#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1llw s GLY 2 N 0.00 1.59 0.12 0.00 0.00 0.49 -4.91 107.32 104.61 1llw s GLY 2 Ca 0.00 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.83 1llw s GLY 2 CO 0.00 -0.39 -0.02 0.14 0.00 0.00 0.00 173.10 172.84 1llw s VAL 3 N -0.09 0.52 0.00 1.40 1.01 -1.26 0.76 120.40 122.74 1llw s VAL 3 Ca -0.01 -1.93 0.00 0.00 0.00 0.00 0.00 61.98 60.04 1llw s VAL 3 Cb -0.14 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1llw s VAL 3 CO 0.03 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 175.04 1llw n GLY 4 N -0.09 1.32 3.30 4.51 0.00 -0.98 -0.70 105.19 112.55 1llw n GLY 4 Ca -0.10 -0.50 -0.18 0.00 0.00 0.00 0.00 46.02 45.24 1llw n GLY 4 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1llw s PHE 5 N -2.00 1.55 -0.07 1.61 -0.12 -0.39 -1.58 117.98 116.98 1llw s PHE 5 Ca 0.00 -0.59 0.02 0.00 -0.05 0.00 0.00 56.93 56.32 1llw s PHE 5 Cb 0.00 -0.76 0.01 0.00 -0.63 0.00 0.00 43.02 41.64 1llw s PHE 5 CO 0.00 0.24 -0.14 0.42 -0.05 0.00 0.00 175.22 175.69 1llw s ILE 6 N -2.65 1.26 0.04 -4.49 1.01 -0.29 -1.06 121.20 115.01 1llw s ILE 6 Ca 0.16 -0.54 0.07 0.00 0.00 0.00 0.00 60.65 60.34 1llw s ILE 6 Cb -0.02 -1.14 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 1llw s ILE 6 CO 0.04 0.38 -0.19 0.00 0.00 0.00 0.00 174.94 175.18 1llw s ALA 7 N 0.67 1.59 -0.16 9.38 0.00 -1.08 -1.26 121.76 130.90 1llw s ALA 7 Ca -0.14 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 50.83 1llw s ALA 7 Cb -0.16 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.70 1llw s ALA 7 CO 0.04 0.35 -0.10 -0.80 0.00 0.00 0.00 175.76 175.24 1llw s ASN 8 N -1.15 2.87 -0.26 0.00 -0.87 0.44 -2.65 114.94 113.31 1llw s ASN 8 Ca 0.06 -0.63 -0.13 0.00 -1.57 0.00 0.00 52.86 50.59 1llw s ASN 8 Cb -0.08 -1.09 -0.14 0.00 -0.02 0.00 0.00 41.25 39.92 1llw s ASN 8 CO 0.02 -0.12 -0.24 0.18 -2.57 0.00 0.00 177.10 174.36 1llw n LEU 9 N 4.79 2.07 -1.89 0.60 4.77 -1.26 -4.59 117.00 121.49 1llw n LEU 9 Ca -0.14 0.30 -0.22 0.00 -0.03 0.00 0.00 56.01 55.92 1llw n LEU 9 Cb 0.48 -0.86 0.09 0.00 -2.33 0.00 0.00 43.42 40.81 1llw n LEU 9 CO 0.19 0.58 0.75 -1.14 -1.33 0.00 0.00 177.39 176.44 1llw n ARG 10 N -4.16 2.78 -2.91 3.23 3.00 -1.26 -4.78 116.66 112.57 1llw n ARG 10 Ca -0.50 -3.59 -0.09 0.00 -0.00 0.00 0.00 57.85 53.67 1llw n ARG 10 Cb 0.87 -2.15 -0.03 0.00 0.00 0.00 0.00 32.46 31.15 1llw n ARG 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1llw n GLY 11 N -0.91 3.71 3.40 5.14 0.00 -1.26 -5.12 105.19 110.15 1llw n GLY 11 Ca 0.47 -1.91 -0.21 0.00 0.00 0.00 0.00 46.02 44.37 1llw n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llw s LYS 12 N -2.58 1.47 -0.93 1.61 -0.14 -1.26 -5.02 119.74 112.90 1llw s LYS 12 Ca 0.10 -1.68 -0.18 0.00 -1.36 0.00 0.00 55.97 52.86 1llw s LYS 12 Cb 0.01 -1.34 -0.26 0.00 -1.68 0.00 0.00 37.83 34.56 1llw s LYS 12 CO 0.07 0.21 2.33 -0.35 -0.76 0.00 0.00 175.35 176.85 1llw n PRO 13 N -0.49 0.17 -1.70 -1.68 -0.04 -1.26 -4.93 135.00 125.08 1llw n PRO 13 Ca -0.07 -0.16 -0.30 0.00 -0.04 0.00 0.00 63.50 62.94 1llw n PRO 13 Cb 0.61 -1.77 0.22 0.00 -0.04 0.00 0.00 33.50 32.52 1llw n PRO 13 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1llw n ASP 14 N 9.68 -0.45 -0.00 3.54 3.85 -1.26 -4.37 116.55 127.54 1llw n ASP 14 Ca 0.62 -1.41 0.10 0.00 -0.71 0.00 0.00 54.79 53.39 1llw n ASP 14 Cb 0.20 -1.02 -0.12 0.00 -1.35 0.00 0.00 41.12 38.83 1llw n ASP 14 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.20 177.76 1llw n HIS 15 N -4.11 0.00 -0.07 2.11 -0.00 -1.26 -2.65 115.22 109.24 1llw n HIS 15 Ca 0.16 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.75 1llw n HIS 15 Cb 0.58 -0.02 -0.06 0.00 -0.00 0.00 0.00 29.99 30.49 1llw n HIS 15 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.34 177.49 1llw h THR 16 N 0.00 1.32 -0.81 3.57 2.02 -1.95 -1.48 112.91 115.58 1llw h THR 16 Ca 0.00 -1.46 0.09 0.00 0.77 0.00 0.00 66.41 65.80 1llw h THR 16 Cb 0.52 1.75 -0.11 0.00 -1.74 0.00 0.00 68.15 68.57 1llw h THR 16 CO 0.00 0.45 -0.54 0.25 0.37 0.00 0.00 175.52 176.05 1llw h LEU 17 N 0.26 -1.95 -0.33 2.58 7.12 -1.89 0.61 115.31 121.72 1llw h LEU 17 Ca 0.03 0.30 0.06 0.00 0.13 0.00 0.00 57.88 58.40 1llw h LEU 17 Cb 0.84 0.86 -0.06 0.00 -0.53 0.00 0.00 40.66 41.77 1llw h LEU 17 CO 0.07 -0.29 -0.05 0.58 -0.13 0.00 0.00 178.44 178.61 1llw h VAL 18 N -0.12 0.70 -0.98 1.05 2.07 -1.68 0.39 116.25 117.68 1llw h VAL 18 Ca 0.16 -0.01 0.13 0.00 0.82 0.00 0.00 66.70 67.80 1llw h VAL 18 Cb 0.49 0.66 -0.09 0.00 -1.52 0.00 0.00 31.29 30.84 1llw h VAL 18 CO -0.83 0.01 0.60 -0.33 0.02 0.00 0.00 177.57 177.03 1llw h GLU 19 N 0.03 0.89 -0.31 1.57 5.08 -0.19 -2.49 114.58 119.15 1llw h GLU 19 Ca 0.16 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 1llw h GLU 19 Cb 0.23 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1llw h GLU 19 CO -0.31 0.59 -0.19 1.96 -1.00 0.00 0.00 179.01 180.05 1llw h GLN 20 N 0.91 0.58 0.03 2.33 4.20 0.43 -1.67 115.11 121.92 1llw h GLN 20 Ca 0.50 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 59.00 1llw h GLN 20 Cb 0.55 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1llw h GLN 20 CO -0.29 0.74 -0.01 0.00 -0.67 0.00 0.00 178.83 178.60 1llw h ALA 21 N 1.28 -0.04 0.18 3.87 0.00 -0.51 -2.25 119.26 121.79 1llw h ALA 21 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1llw h ALA 21 Cb 0.62 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1llw h ALA 21 CO 0.04 -0.42 -0.08 -0.07 0.00 0.00 0.00 179.25 178.72 1llw h LEU 22 N -0.23 -0.20 -0.94 0.00 3.38 -1.09 0.39 115.31 116.62 1llw h LEU 22 Ca -0.00 -0.02 0.27 0.00 0.09 0.00 0.00 57.88 58.21 1llw h LEU 22 Cb 0.22 0.05 -0.16 0.00 0.09 0.00 0.00 40.66 40.86 1llw h LEU 22 CO 0.01 -0.11 0.16 0.50 0.09 0.00 0.00 178.44 179.09 1llw h LYS 23 N -0.27 0.08 -0.09 1.13 1.63 -1.33 -0.38 116.57 117.34 1llw h LYS 23 Ca -0.02 -0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.70 1llw h LYS 23 Cb 0.21 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.82 1llw h LYS 23 CO 0.04 0.05 -0.20 0.00 -3.45 0.00 0.00 179.45 175.89 1llw h ALA 24 N 1.90 0.15 -1.03 5.00 0.00 -0.45 -1.21 119.26 123.61 1llw h ALA 24 Ca 0.60 -0.38 0.26 0.00 0.00 0.00 0.00 54.91 55.39 1llw h ALA 24 Cb 1.29 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.95 1llw h ALA 24 CO -0.79 0.10 0.65 -0.07 0.00 0.00 0.00 179.25 179.13 1llw h LEU 25 N -0.16 0.52 -0.24 0.00 3.38 -0.34 0.28 115.31 118.75 1llw h LEU 25 Ca 0.00 0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1llw h LEU 25 Cb 0.80 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.50 1llw h LEU 25 CO 0.04 0.10 -0.19 1.23 0.09 0.00 0.00 178.44 179.71 1llw h GLY 26 N 0.46 -0.06 -0.17 0.83 0.00 0.16 -1.00 103.07 103.28 1llw h GLY 26 Ca 0.60 0.24 0.00 0.00 0.00 0.00 0.00 47.33 48.18 1llw h GLY 26 CO -0.34 -0.18 0.00 0.00 0.00 0.00 0.00 176.54 176.02 1llw n MET 28 N -0.41 1.19 -0.18 0.00 2.00 -0.38 -4.70 117.12 114.64 1llw n MET 28 Ca 0.00 -0.88 -0.09 0.00 0.00 0.00 0.00 57.70 56.72 1llw n MET 28 Cb 0.04 -1.48 -0.05 0.00 0.00 0.00 0.00 33.22 31.73 1llw n MET 28 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1llw h GLU 29 N 2.16 -0.26 0.00 0.03 4.57 -1.39 0.47 114.58 120.15 1llw h GLU 29 Ca 0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1llw h GLU 29 Cb 0.67 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1llw h GLU 29 CO 0.00 -0.17 0.00 -2.39 -1.18 0.00 0.00 179.01 175.27 1llw n HIS 30 N -5.40 0.00 0.26 0.92 1.44 -1.26 -0.74 115.22 110.44 1llw n HIS 30 Ca 0.00 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 1llw n HIS 30 Cb 0.35 -0.08 0.22 0.00 0.12 0.00 0.00 29.99 30.60 1llw n HIS 30 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1llw n ARG 31 N -1.07 2.54 -4.35 -1.40 1.74 0.16 -4.97 116.66 109.31 1llw n ARG 31 Ca 0.00 -2.33 -0.19 0.00 -0.77 0.00 0.00 57.85 54.56 1llw n ARG 31 Cb 0.00 -1.52 -0.09 0.00 -1.02 0.00 0.00 32.46 29.83 1llw n ARG 31 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1llw s GLY 32 N -1.46 2.07 0.42 -0.13 0.00 0.08 -0.87 107.32 107.44 1llw s GLY 32 Ca 0.40 -1.74 0.07 0.00 0.00 0.00 0.00 44.72 43.44 1llw s GLY 32 CO 0.32 -1.61 0.14 -0.32 0.00 0.00 0.00 173.10 171.63 1llw s GLY 33 N -3.39 2.41 0.18 0.20 0.00 -0.64 -4.84 107.32 101.24 1llw s GLY 33 Ca 0.35 -2.03 0.06 0.00 0.00 0.00 0.00 44.72 43.10 1llw s GLY 33 CO 0.17 -1.97 -0.11 0.00 0.00 0.00 0.00 173.10 171.18 1llw n SER 35 N -0.29 0.00 0.09 0.00 7.64 -0.89 -4.83 113.62 115.34 1llw n SER 35 Ca -0.09 -0.73 0.02 0.00 1.01 0.00 0.00 58.87 59.08 1llw n SER 35 Cb 0.61 0.00 0.38 0.00 -1.01 0.00 0.00 64.21 64.18 1llw n SER 35 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1llw h ALA 36 N -0.87 1.50 -1.54 -0.43 0.00 -1.85 -0.65 119.26 115.42 1llw h ALA 36 Ca 0.00 -0.19 0.49 0.00 0.00 0.00 0.00 54.91 55.21 1llw h ALA 36 Cb 0.00 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 17.58 1llw h ALA 36 CO 0.00 0.36 1.05 -0.25 0.00 0.00 0.00 179.25 180.41 1llw n ASP 37 N -4.29 0.11 -3.91 0.00 8.00 -1.26 -4.88 116.55 110.31 1llw n ASP 37 Ca -0.00 1.13 -0.26 0.00 0.71 0.00 0.00 54.79 56.36 1llw n ASP 37 Cb 0.25 -0.56 -0.01 0.00 -0.02 0.00 0.00 41.12 40.78 1llw n ASP 37 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1llw n ASN 38 N -4.22 -0.96 0.07 -2.24 3.02 -0.25 -4.80 115.26 105.88 1llw n ASN 38 Ca 0.39 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.94 1llw n ASN 38 Cb 1.65 -3.10 0.00 0.00 -0.61 0.00 0.00 39.78 37.72 1llw n ASN 38 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1llw n ASP 39 N -2.94 -1.26 -4.75 6.41 -0.08 -1.26 -4.99 116.55 107.68 1llw n ASP 39 Ca -0.28 0.29 -0.37 0.00 -1.51 0.00 0.00 54.79 52.92 1llw n ASP 39 Cb 0.67 1.48 0.04 0.00 2.34 0.00 0.00 41.12 45.65 1llw n ASP 39 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1llw s SER 40 N -2.00 5.25 0.24 1.67 0.01 -1.26 -4.19 113.70 113.43 1llw s SER 40 Ca 0.00 2.55 -0.02 0.00 1.31 0.00 0.00 55.95 59.78 1llw s SER 40 Cb 0.00 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.57 1llw s SER 40 CO 0.00 -1.56 0.46 -0.83 0.41 0.00 0.00 173.24 171.72 1llw s GLY 41 N -1.31 1.81 0.00 3.44 0.00 -1.19 -2.09 107.32 107.98 1llw s GLY 41 Ca 0.74 -0.71 0.14 0.00 0.00 0.00 0.00 44.72 44.89 1llw s GLY 41 CO 0.39 -0.64 1.33 1.22 0.00 0.00 0.00 173.10 175.40 1llw n ASP 42 N -0.80 0.00 0.00 1.64 9.92 -0.73 -4.07 116.55 122.51 1llw n ASP 42 Ca -0.03 -0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 1llw n ASP 42 Cb 0.54 -0.20 0.00 0.00 -0.64 0.00 0.00 41.12 40.82 1llw n ASP 42 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1llw n GLY 43 N -0.14 4.63 3.01 0.44 0.00 -1.26 -4.66 105.19 107.22 1llw n GLY 43 Ca 0.08 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 1llw n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 44 N -0.70 0.26 0.28 4.61 0.00 0.16 -0.46 121.76 125.90 1llw s ALA 44 Ca 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 51.96 51.15 1llw s ALA 44 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.27 1llw s ALA 44 CO 0.00 -0.16 0.50 0.20 0.00 0.00 0.00 175.76 176.30 1llw s GLY 45 N -1.67 0.73 -0.29 0.00 0.00 -0.55 -1.53 107.32 104.01 1llw s GLY 45 Ca -0.12 -1.01 -0.14 0.00 0.00 0.00 0.00 44.72 43.45 1llw s GLY 45 CO -0.02 -0.68 0.69 0.54 0.00 0.00 0.00 173.10 173.63 1llw s VAL 46 N -3.67 -0.28 -0.15 1.40 0.11 -0.26 -2.94 120.40 114.61 1llw s VAL 46 Ca 0.24 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.16 1llw s VAL 46 Cb -0.01 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.79 1llw s VAL 46 CO 0.12 0.00 0.26 -0.32 -3.33 0.00 0.00 175.10 171.82 1llw s MET 47 N 1.99 4.11 0.19 1.54 1.75 0.17 -0.38 119.30 128.67 1llw s MET 47 Ca -0.09 0.05 -0.01 0.00 -1.25 0.00 0.00 55.69 54.38 1llw s MET 47 Cb -0.07 -3.37 -0.04 0.00 2.84 0.00 0.00 34.83 34.19 1llw s MET 47 CO -0.20 0.36 0.13 0.95 -0.65 0.00 0.00 175.02 175.62 1llw s THR 48 N 0.10 0.01 0.80 10.11 -4.23 -0.21 -0.97 115.64 121.26 1llw s THR 48 Ca 0.16 -1.96 -0.11 0.00 -1.18 0.00 0.00 61.69 58.59 1llw s THR 48 Cb -0.13 -2.43 0.08 0.00 1.34 0.00 0.00 72.50 71.36 1llw s THR 48 CO 0.04 -0.06 1.11 0.00 -0.54 0.00 0.00 174.62 175.17 1llw s ALA 49 N -4.14 2.04 0.03 3.99 0.00 -1.26 0.13 121.76 122.55 1llw s ALA 49 Ca 0.36 0.41 -0.32 0.00 0.00 0.00 0.00 51.96 52.41 1llw s ALA 49 Cb 0.07 -3.34 -0.11 0.00 0.00 0.00 0.00 23.12 19.74 1llw s ALA 49 CO 0.10 -2.03 1.86 -0.89 0.00 0.00 0.00 175.76 174.81 1llw n ILE 50 N -3.62 0.52 -1.73 0.00 5.41 -1.18 -4.61 119.36 114.14 1llw n ILE 50 Ca 0.10 -0.09 -0.41 0.00 1.00 0.00 0.00 62.75 63.34 1llw n ILE 50 Cb 0.53 -2.02 -0.00 0.00 -0.71 0.00 0.00 39.64 37.43 1llw n ILE 50 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1llw n PRO 51 N 6.29 3.14 0.25 0.38 -0.04 -1.26 -4.74 135.00 139.02 1llw n PRO 51 Ca 0.20 -2.66 0.12 0.00 -0.04 0.00 0.00 63.50 61.12 1llw n PRO 51 Cb 0.34 -3.14 0.76 0.00 -0.04 0.00 0.00 33.50 31.42 1llw n PRO 51 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 1llw h ARG 52 N 5.76 0.00 0.45 0.54 0.11 -1.87 0.11 114.38 119.48 1llw h ARG 52 Ca 0.61 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.67 1llw h ARG 52 Cb 0.57 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.64 1llw h ARG 52 CO 1.83 0.00 -0.32 1.49 0.10 0.00 0.00 179.97 183.07 1llw h GLU 53 N 0.00 -0.71 -0.79 0.08 4.81 -1.85 -2.83 114.58 113.29 1llw h GLU 53 Ca 0.02 0.05 0.11 0.00 -0.13 0.00 0.00 59.36 59.41 1llw h GLU 53 Cb 0.10 0.16 -0.06 0.00 0.63 0.00 0.00 28.75 29.59 1llw h GLU 53 CO -0.00 -0.48 0.52 1.25 -0.73 0.00 0.00 179.01 179.57 1llw h LEU 54 N -0.74 0.61 -0.12 1.64 5.85 -0.65 0.17 115.31 122.07 1llw h LEU 54 Ca -0.06 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1llw h LEU 54 Cb 0.61 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1llw h LEU 54 CO 0.03 0.35 0.00 0.18 -0.34 0.00 0.00 178.44 178.66 1llw n LEU 55 N -4.51 0.20 0.01 2.25 4.77 -1.04 -3.23 117.00 115.45 1llw n LEU 55 Ca 0.14 0.54 0.06 0.00 -0.03 0.00 0.00 56.01 56.71 1llw n LEU 55 Cb 0.38 -0.49 0.46 0.00 -2.33 0.00 0.00 43.42 41.43 1llw n LEU 55 CO 0.32 -0.22 1.16 0.00 -1.33 0.00 0.00 177.39 177.32 1llw h ALA 56 N 2.61 1.79 0.00 -1.18 0.00 -0.38 -1.43 119.26 120.67 1llw h ALA 56 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1llw h ALA 56 Cb 0.40 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1llw h ALA 56 CO 0.00 0.16 -0.17 -0.56 0.00 0.00 0.00 179.25 178.69 1llw h GLN 57 N 0.48 0.00 0.39 0.00 3.07 -1.71 -2.29 115.11 115.04 1llw h GLN 57 Ca 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.88 1llw h GLN 57 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.62 1llw h GLN 57 CO -0.04 0.17 -0.20 2.35 0.09 0.00 0.00 178.83 181.20 1llw h TRP 58 N 0.00 -0.52 -0.84 0.06 7.01 -1.48 -1.23 115.95 118.95 1llw h TRP 58 Ca -0.00 -0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.09 1llw h TRP 58 Cb 0.62 0.17 -0.08 0.00 -2.10 0.00 0.00 29.16 27.78 1llw h TRP 58 CO 0.00 -0.31 0.48 0.74 -2.79 0.00 0.00 178.44 176.56 1llw h PHE 59 N -0.53 0.87 0.07 2.65 -1.00 -1.61 -1.94 116.94 115.45 1llw h PHE 59 Ca -0.05 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.78 1llw h PHE 59 Cb 0.41 -0.27 -0.04 0.00 3.61 0.00 0.00 35.95 39.67 1llw h PHE 59 CO 0.11 0.35 -0.25 -0.97 -1.61 0.00 0.00 178.31 175.93 1llw h ASN 60 N 0.80 -0.73 0.59 2.17 -1.24 -1.43 0.56 115.58 116.31 1llw h ASN 60 Ca 0.41 0.09 -0.04 0.00 0.71 0.00 0.00 56.30 57.47 1llw h ASN 60 Cb 0.40 0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.73 1llw h ASN 60 CO -0.26 -0.33 -0.19 0.74 -1.29 0.00 0.00 177.43 176.10 1llw h THR 61 N -0.43 0.62 -0.13 -3.57 2.02 -0.48 0.80 112.91 111.74 1llw h THR 61 Ca 0.04 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.37 1llw h THR 61 Cb 0.48 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 1llw h THR 61 CO -0.18 0.19 0.00 0.54 0.37 0.00 0.00 175.52 176.44 1llw n ARG 62 N -3.57 2.05 -3.59 6.66 1.74 -0.65 -4.95 116.66 114.36 1llw n ARG 62 Ca -0.01 -1.56 -0.22 0.00 -0.77 0.00 0.00 57.85 55.29 1llw n ARG 62 Cb 0.33 -1.46 0.07 0.00 -1.02 0.00 0.00 32.46 30.38 1llw n ARG 62 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1llw n ASN 63 N 0.83 -4.20 -4.59 0.55 5.15 0.32 -5.03 115.26 108.30 1llw n ASN 63 Ca 0.17 -0.62 -0.31 0.00 -0.60 0.00 0.00 54.58 53.22 1llw n ASN 63 Cb 0.48 -4.83 -0.10 0.00 -0.53 0.00 0.00 39.78 34.79 1llw n ASN 63 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1llw s LEU 64 N -6.92 3.11 -0.10 1.20 1.02 0.17 -5.00 118.68 112.15 1llw s LEU 64 Ca 0.34 -0.28 -0.29 0.00 0.02 0.00 0.00 54.13 53.91 1llw s LEU 64 Cb -0.15 -1.86 -0.05 0.00 0.02 0.00 0.00 46.19 44.15 1llw s LEU 64 CO 0.75 0.22 1.66 -2.84 0.02 0.00 0.00 176.35 176.16 1llw s PRO 65 N -1.91 4.05 0.08 1.29 0.02 -1.26 -4.46 135.00 132.81 1llw s PRO 65 Ca 0.20 2.05 -0.30 0.00 0.02 0.00 0.00 61.00 62.97 1llw s PRO 65 Cb -0.11 -4.01 -0.06 0.00 0.02 0.00 0.00 34.50 30.34 1llw s PRO 65 CO 0.12 -0.99 1.13 1.41 -0.33 0.00 0.00 177.00 178.33 1llw s MET 66 N 4.26 4.50 0.67 5.54 1.75 -1.26 -5.03 119.30 129.74 1llw s MET 66 Ca 0.74 1.69 -0.12 0.00 -1.25 0.00 0.00 55.69 56.75 1llw s MET 66 Cb -0.31 -3.35 -0.00 0.00 2.84 0.00 0.00 34.83 34.01 1llw s MET 66 CO 0.29 -0.12 1.06 -2.14 -0.65 0.00 0.00 175.02 173.46 1llw s PRO 67 N 0.63 3.03 0.96 4.11 0.02 -1.26 -5.02 135.00 137.47 1llw s PRO 67 Ca 0.55 1.02 -0.20 0.00 0.02 0.00 0.00 61.00 62.39 1llw s PRO 67 Cb -0.28 -2.00 -0.16 0.00 0.02 0.00 0.00 34.50 32.08 1llw s PRO 67 CO 0.31 -1.03 -1.02 -0.25 -0.33 0.00 0.00 177.00 174.67 1llw n ASP 68 N -2.85 -4.86 0.00 2.53 9.92 -1.26 -4.65 116.55 115.38 1llw n ASP 68 Ca 0.08 0.12 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 1llw n ASP 68 Cb 0.53 -0.65 0.00 0.00 -0.64 0.00 0.00 41.12 40.36 1llw n ASP 68 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1llw n GLY 69 N 3.37 -2.86 0.00 0.44 0.00 -1.26 -2.73 105.19 102.15 1llw n GLY 69 Ca -0.02 0.53 0.01 0.00 0.00 0.00 0.00 46.02 46.54 1llw n GLY 69 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1llw n ASP 70 N -0.73 0.00 0.00 1.61 8.00 -1.26 -2.20 116.55 121.98 1llw n ASP 70 Ca 0.00 -0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1llw n ASP 70 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1llw n ASP 70 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1llw n ARG 71 N -0.95 1.49 0.00 -1.24 0.63 -1.10 -1.63 116.66 113.85 1llw n ARG 71 Ca 0.01 -1.10 0.00 0.00 -0.92 0.00 0.00 57.85 55.84 1llw n ARG 71 Cb 0.01 -0.97 0.00 0.00 0.45 0.00 0.00 32.46 31.94 1llw n ARG 71 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1llw n LEU 72 N -0.30 0.18 -0.09 6.15 7.94 -0.93 -4.43 117.00 125.51 1llw n LEU 72 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1llw n LEU 72 Cb 0.17 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.12 1llw n LEU 72 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 1llw n GLY 73 N 2.94 -2.33 2.75 -3.96 0.00 -1.25 -4.27 105.19 99.08 1llw n GLY 73 Ca 0.00 -1.02 -0.20 0.00 0.00 0.00 0.00 46.02 44.80 1llw n GLY 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1llw s VAL 74 N -0.61 0.14 -0.29 1.61 1.01 0.22 -2.29 120.40 120.19 1llw s VAL 74 Ca 0.00 0.22 -0.15 0.00 0.00 0.00 0.00 61.98 62.05 1llw s VAL 74 Cb 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 36.04 1llw s VAL 74 CO 0.00 0.19 0.38 -0.83 0.00 0.00 0.00 175.10 174.84 1llw s GLY 75 N 1.74 1.88 -0.44 4.51 0.00 0.41 -2.32 107.32 113.11 1llw s GLY 75 Ca 0.00 -0.94 -0.18 0.00 0.00 0.00 0.00 44.72 43.61 1llw s GLY 75 CO -0.03 1.00 0.48 -0.29 0.00 0.00 0.00 173.10 174.25 1llw s MET 76 N 2.08 3.10 -0.07 2.90 1.75 0.14 0.03 119.30 129.24 1llw s MET 76 Ca 0.14 -0.80 0.03 0.00 -1.25 0.00 0.00 55.69 53.82 1llw s MET 76 Cb -0.16 -4.00 0.01 0.00 2.84 0.00 0.00 34.83 33.52 1llw s MET 76 CO 0.11 -0.93 -0.16 0.08 -0.65 0.00 0.00 175.02 173.47 1llw s VAL 77 N 2.22 1.39 0.02 10.11 1.01 -0.03 -0.12 120.40 135.00 1llw s VAL 77 Ca 0.13 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.21 1llw s VAL 77 Cb -0.18 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 1llw s VAL 77 CO 0.13 0.41 0.79 -0.36 0.00 0.00 0.00 175.10 176.07 1llw s PHE 78 N 0.45 3.69 0.03 5.22 2.99 -0.29 -1.07 117.98 129.00 1llw s PHE 78 Ca -0.13 1.47 -0.07 0.00 0.00 0.00 0.00 56.93 58.21 1llw s PHE 78 Cb -0.15 -2.87 -0.01 0.00 0.00 0.00 0.00 43.02 39.99 1llw s PHE 78 CO 0.04 0.19 0.12 -0.51 -0.00 0.00 0.00 175.22 175.07 1llw s LEU 79 N 0.28 1.67 0.44 -0.37 1.43 0.93 -1.90 118.68 121.16 1llw s LEU 79 Ca 0.41 -0.43 -0.23 0.00 -1.03 0.00 0.00 54.13 52.85 1llw s LEU 79 Cb -0.20 0.68 -0.11 0.00 0.03 0.00 0.00 46.19 46.59 1llw s LEU 79 CO 0.23 -0.48 0.86 -2.65 0.23 0.00 0.00 176.35 174.53 1llw n PRO 80 N 0.91 1.05 0.10 1.29 -0.02 -0.16 -0.31 135.00 137.87 1llw n PRO 80 Ca -0.20 0.38 -0.23 0.00 -2.02 0.00 0.00 63.50 61.44 1llw n PRO 80 Cb 0.58 -1.88 -0.15 0.00 -0.02 0.00 0.00 33.50 32.03 1llw n PRO 80 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1llw h GLN 81 N 1.20 0.43 -6.26 -0.52 1.08 -1.88 -3.37 115.11 105.79 1llw h GLN 81 Ca -0.43 -0.73 -0.63 0.00 -1.45 0.00 0.00 58.65 55.40 1llw h GLN 81 Cb 1.36 0.27 0.02 0.00 -0.05 0.00 0.00 27.48 29.08 1llw h GLN 81 CO 0.55 1.35 1.09 -1.91 -0.95 0.00 0.00 178.83 178.95 1llw n GLU 82 N -3.91 2.07 -0.26 1.46 0.00 -1.26 -4.80 120.64 113.94 1llw n GLU 82 Ca -0.16 0.76 0.01 0.00 0.00 0.00 0.00 57.16 57.77 1llw n GLU 82 Cb 0.97 -2.59 0.08 0.00 0.00 0.00 0.00 31.44 29.90 1llw n GLU 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 1llw h PRO 83 N 9.07 -0.01 -0.33 5.31 0.11 -1.99 0.13 132.00 144.29 1llw h PRO 83 Ca -0.48 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 1llw h PRO 83 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1llw h PRO 83 CO 0.95 -0.01 -0.25 0.66 -0.21 0.00 0.00 178.00 179.14 1llw h SER 84 N -0.02 0.66 -0.27 -2.05 4.64 -1.97 0.05 113.55 114.59 1llw h SER 84 Ca 0.35 -0.24 -0.13 0.00 -0.47 0.00 0.00 61.79 61.31 1llw h SER 84 Cb 0.56 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1llw h SER 84 CO -0.78 0.89 -0.28 0.00 -0.87 0.00 0.00 176.83 175.79 1llw h ALA 85 N 1.16 0.81 -0.58 5.18 0.00 -1.76 -2.05 119.26 122.03 1llw h ALA 85 Ca 0.08 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 54.64 1llw h ALA 85 Cb 0.73 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1llw h ALA 85 CO 0.06 0.64 0.30 -0.09 0.00 0.00 0.00 179.25 180.16 1llw h ARG 86 N 0.66 0.56 -0.10 0.00 2.43 0.11 -0.47 114.38 117.57 1llw h ARG 86 Ca 0.08 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1llw h ARG 86 Cb 0.81 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1llw h ARG 86 CO 0.07 0.37 0.01 0.93 -1.51 0.00 0.00 179.97 179.84 1llw h GLU 87 N 0.57 0.17 -0.86 0.20 4.39 -1.11 0.38 114.58 118.32 1llw h GLU 87 Ca 0.26 -0.05 0.22 0.00 0.34 0.00 0.00 59.36 60.13 1llw h GLU 87 Cb 0.16 -0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 28.66 1llw h GLU 87 CO -0.17 0.39 0.27 0.28 -1.16 0.00 0.00 179.01 178.61 1llw h VAL 88 N -0.08 0.39 0.48 3.13 2.07 -1.05 0.20 116.25 121.39 1llw h VAL 88 Ca 0.03 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1llw h VAL 88 Cb 0.31 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1llw h VAL 88 CO 0.00 0.05 -0.23 0.00 0.02 0.00 0.00 177.57 177.41 1llw h ALA 89 N 1.73 -0.64 0.00 1.67 0.00 -0.69 -2.83 119.26 118.50 1llw h ALA 89 Ca 0.53 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1llw h ALA 89 Cb 1.03 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1llw h ALA 89 CO -0.59 -0.76 -0.16 -0.09 0.00 0.00 0.00 179.25 177.65 1llw h ARG 90 N -0.85 0.00 -0.23 0.00 2.43 0.39 -1.64 114.38 114.48 1llw h ARG 90 Ca -0.07 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 58.97 1llw h ARG 90 Cb 0.58 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1llw h ARG 90 CO 0.11 0.16 -0.42 0.00 -1.51 0.00 0.00 179.97 178.31 1llw h ALA 91 N 1.84 0.85 -0.11 2.80 0.00 -0.53 -2.98 119.26 121.12 1llw h ALA 91 Ca -0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1llw h ALA 91 Cb 0.35 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1llw h ALA 91 CO 0.02 0.65 0.00 -0.92 0.00 0.00 0.00 179.25 179.00 1llw h TYR 92 N 0.45 0.22 -0.78 0.00 3.20 -1.07 0.48 116.97 119.47 1llw h TYR 92 Ca 0.04 -0.04 0.15 0.00 3.14 0.00 0.00 58.73 62.02 1llw h TYR 92 Cb 0.92 -0.06 -0.10 0.00 1.54 0.00 0.00 36.73 39.03 1llw h TYR 92 CO 0.04 0.43 0.33 0.28 -1.64 0.00 0.00 178.16 177.59 1llw h VAL 93 N -0.06 0.66 0.04 1.81 2.07 -1.37 -1.03 116.25 118.37 1llw h VAL 93 Ca 0.03 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 1llw h VAL 93 Cb 0.34 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1llw h VAL 93 CO 0.01 0.09 -0.02 -0.33 0.02 0.00 0.00 177.57 177.33 1llw h GLU 94 N 0.47 -0.05 -0.98 1.57 5.08 -1.37 0.50 114.58 119.80 1llw h GLU 94 Ca 0.43 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.92 1llw h GLU 94 Cb 0.66 0.01 -0.14 0.00 0.50 0.00 0.00 28.75 29.78 1llw h GLU 94 CO -0.41 0.39 -0.47 -1.91 -1.00 0.00 0.00 179.01 175.61 1llw n GLU 95 N -4.90 -0.32 0.17 2.33 2.13 0.17 0.76 120.64 120.98 1llw n GLU 95 Ca -0.08 1.50 0.06 0.00 0.66 0.00 0.00 57.16 59.29 1llw n GLU 95 Cb 0.24 -2.22 0.12 0.00 0.27 0.00 0.00 31.44 29.84 1llw n GLU 95 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1llw h VAL 96 N 0.00 0.64 -0.04 6.31 -1.51 -0.72 -1.78 116.25 119.16 1llw h VAL 96 Ca 0.26 -1.81 -0.14 0.00 -1.23 0.00 0.00 66.70 63.78 1llw h VAL 96 Cb 0.51 2.24 -0.01 0.00 -2.13 0.00 0.00 31.29 31.90 1llw h VAL 96 CO -0.95 0.35 -0.63 0.58 -1.23 0.00 0.00 177.57 175.69 1llw h VAL 97 N 0.00 1.42 0.00 7.19 2.07 0.24 -2.41 116.25 124.76 1llw h VAL 97 Ca -0.00 -2.09 -0.08 0.00 0.82 0.00 0.00 66.70 65.35 1llw h VAL 97 Cb 1.22 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 1llw h VAL 97 CO 0.05 0.61 -0.38 -0.09 0.02 0.00 0.00 177.57 177.78 1llw h ARG 98 N 0.10 0.00 0.00 1.57 2.43 0.78 -3.25 114.38 116.01 1llw h ARG 98 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1llw h ARG 98 Cb 1.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1llw h ARG 98 CO 0.09 0.38 -0.32 1.25 -1.51 0.00 0.00 179.97 179.86 1llw h LEU 99 N 0.00 0.00 -9.55 3.80 5.85 -0.80 -3.33 115.31 111.27 1llw h LEU 99 Ca -0.00 -0.04 -0.57 0.00 0.84 0.00 0.00 57.88 58.10 1llw h LEU 99 Cb 0.69 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.67 1llw h LEU 99 CO 0.05 0.02 -0.02 -1.61 -0.34 0.00 0.00 178.44 176.54 1llw s GLU 100 N -3.20 4.30 0.00 1.25 0.41 -1.21 -4.94 118.70 115.30 1llw s GLU 100 Ca 0.06 0.73 0.00 0.00 -0.41 0.00 0.00 54.97 55.35 1llw s GLU 100 Cb 0.09 -3.33 0.00 0.00 -1.78 0.00 0.00 34.13 29.12 1llw s GLU 100 CO 0.68 0.41 0.00 0.36 -0.49 0.00 0.00 175.26 176.22 1llw n LYS 101 N 2.58 0.00 -2.60 1.61 2.85 -1.25 -4.72 118.16 116.63 1llw n LYS 101 Ca -0.07 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 56.97 1llw n LYS 101 Cb 0.51 -1.44 0.06 0.00 -0.65 0.00 0.00 35.03 33.51 1llw n LYS 101 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1llw s LEU 102 N 0.00 3.16 -0.01 -5.58 1.02 -1.23 -4.37 118.68 111.67 1llw s LEU 102 Ca 0.00 -0.09 0.02 0.00 0.02 0.00 0.00 54.13 54.08 1llw s LEU 102 Cb 0.00 -2.63 -0.00 0.00 0.02 0.00 0.00 46.19 43.58 1llw s LEU 102 CO 0.00 -1.37 -0.07 -0.89 0.02 0.00 0.00 176.35 174.04 1llw s THR 103 N -2.90 0.57 -0.09 5.49 2.01 0.22 -4.23 115.64 116.70 1llw s THR 103 Ca 0.60 -0.29 -0.14 0.00 0.31 0.00 0.00 61.69 62.17 1llw s THR 103 Cb -0.09 -0.49 -0.05 0.00 0.01 0.00 0.00 72.50 71.88 1llw s THR 103 CO 0.40 0.17 0.33 -0.69 -0.69 0.00 0.00 174.62 174.14 1llw s VAL 104 N -0.08 5.22 -0.06 3.82 1.01 -1.26 -1.05 120.40 127.99 1llw s VAL 104 Ca 0.02 0.65 0.13 0.00 0.00 0.00 0.00 61.98 62.78 1llw s VAL 104 Cb -0.04 -3.65 -0.22 0.00 0.00 0.00 0.00 36.38 32.48 1llw s VAL 104 CO -0.00 0.49 0.67 0.18 0.00 0.00 0.00 175.10 176.44 1llw n LEU 105 N 2.68 0.85 0.00 3.92 4.77 0.93 -4.98 117.00 125.18 1llw n LEU 105 Ca -0.13 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1llw n LEU 105 Cb 0.52 0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 1llw n LEU 105 CO 0.38 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 1llw n GLY 106 N 1.54 0.61 2.86 -0.72 0.00 -1.20 -5.02 105.19 103.25 1llw n GLY 106 Ca -0.16 -1.51 -0.14 0.00 0.00 0.00 0.00 46.02 44.21 1llw n GLY 106 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1llw s TRP 107 N -4.00 0.16 -0.26 1.61 0.52 -1.26 -1.11 118.94 114.61 1llw s TRP 107 Ca 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 56.10 56.03 1llw s TRP 107 Cb 0.00 -0.18 -0.04 0.00 -1.15 0.00 0.00 33.47 32.10 1llw s TRP 107 CO 0.00 -0.04 0.12 0.50 0.02 0.00 0.00 176.95 177.55 1llw s ARG 108 N 0.36 3.81 -0.01 4.98 3.52 0.14 -4.95 118.95 126.79 1llw s ARG 108 Ca -0.03 -0.40 -0.30 0.00 -0.13 0.00 0.00 55.73 54.87 1llw s ARG 108 Cb -0.05 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.83 1llw s ARG 108 CO -0.01 -0.14 1.41 -1.21 -0.81 0.00 0.00 175.30 174.54 1llw s GLU 109 N 1.57 4.27 -0.42 5.12 2.02 -1.26 0.01 118.70 130.00 1llw s GLU 109 Ca 0.06 1.97 -0.24 0.00 0.02 0.00 0.00 54.97 56.78 1llw s GLU 109 Cb -0.15 -3.62 0.02 0.00 0.10 0.00 0.00 34.13 30.48 1llw s GLU 109 CO 0.06 -0.61 0.83 0.08 0.02 0.00 0.00 175.26 175.65 1llw s VAL 110 N 2.60 4.62 0.23 2.63 1.01 -0.94 -4.96 120.40 125.59 1llw s VAL 110 Ca 0.64 0.68 -0.32 0.00 0.00 0.00 0.00 61.98 62.98 1llw s VAL 110 Cb -0.31 -4.32 -0.12 0.00 0.00 0.00 0.00 36.38 31.63 1llw s VAL 110 CO 0.26 -0.66 1.69 -0.81 0.00 0.00 0.00 175.10 175.58 1llw n PRO 111 N 6.76 2.74 -3.80 2.72 -0.04 -1.26 -4.90 135.00 137.22 1llw n PRO 111 Ca 0.04 0.99 -0.12 0.00 -0.04 0.00 0.00 63.50 64.36 1llw n PRO 111 Cb 0.48 -2.82 -0.09 0.00 -0.04 0.00 0.00 33.50 31.04 1llw n PRO 111 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1llw s VAL 112 N 0.91 0.08 -0.34 0.52 -7.23 -1.26 -2.58 120.40 110.49 1llw s VAL 112 Ca 0.73 -0.63 -0.01 0.00 -1.81 0.00 0.00 61.98 60.27 1llw s VAL 112 Cb -0.51 -0.67 0.08 0.00 0.56 0.00 0.00 36.38 35.84 1llw s VAL 112 CO 0.36 -0.35 0.07 0.21 -0.31 0.00 0.00 175.10 175.08 1llw s ASN 113 N -1.58 4.95 0.44 4.85 2.47 -0.39 -4.97 114.94 120.71 1llw s ASN 113 Ca -0.11 -1.72 0.25 0.00 0.42 0.00 0.00 52.86 51.70 1llw s ASN 113 Cb -0.04 -1.72 0.73 0.00 -1.45 0.00 0.00 41.25 38.77 1llw s ASN 113 CO 0.01 -0.37 1.74 0.28 -3.72 0.00 0.00 177.10 175.04 1llw h SER 114 N 7.91 0.00 -0.11 -4.21 0.02 -1.93 -3.18 113.55 112.05 1llw h SER 114 Ca -0.15 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.84 1llw h SER 114 Cb 1.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.58 1llw h SER 114 CO 0.58 0.14 0.38 0.44 -1.14 0.00 0.00 176.83 177.23 1llw h ASP 115 N 0.00 0.00 0.68 3.07 3.32 -1.97 -2.21 116.42 119.31 1llw h ASP 115 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1llw h ASP 115 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1llw h ASP 115 CO 0.02 0.00 -0.62 1.33 -1.72 0.00 0.00 179.24 178.24 1llw n VAL 116 N -3.10 0.20 -2.58 -1.35 0.24 -1.20 -4.91 118.33 105.63 1llw n VAL 116 Ca 0.01 -0.17 -0.33 0.00 -2.04 0.00 0.00 64.34 61.80 1llw n VAL 116 Cb 0.46 0.04 -0.04 0.00 -1.47 0.00 0.00 33.84 32.83 1llw n VAL 116 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1llw s LEU 117 N -3.74 3.82 0.83 1.34 1.43 -0.83 -5.01 118.68 116.52 1llw s LEU 117 Ca 0.08 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.86 1llw s LEU 117 Cb 0.15 -4.54 0.09 0.00 0.03 0.00 0.00 46.19 41.92 1llw s LEU 117 CO 0.72 -0.65 1.09 -0.83 0.23 0.00 0.00 176.35 176.91 1llw s GLY 118 N -2.25 1.65 0.26 -3.19 0.00 -1.26 -4.77 107.32 97.76 1llw s GLY 118 Ca 0.64 0.09 -0.02 0.00 0.00 0.00 0.00 44.72 45.43 1llw s GLY 118 CO 0.20 0.51 1.77 1.19 0.00 0.00 0.00 173.10 176.77 1llw h ILE 119 N -1.33 0.76 -0.13 0.90 2.10 -1.95 -1.03 117.51 116.84 1llw h ILE 119 Ca -0.47 -0.22 -0.13 0.00 1.08 0.00 0.00 64.86 65.12 1llw h ILE 119 Cb 1.26 0.06 0.00 0.00 -1.09 0.00 0.00 36.82 37.05 1llw h ILE 119 CO 0.53 0.12 -0.43 1.56 -1.08 0.00 0.00 178.15 178.85 1llw h GLN 120 N 0.65 0.52 -0.91 2.19 4.20 -1.99 -1.85 115.11 117.91 1llw h GLN 120 Ca 0.45 -0.38 0.15 0.00 0.06 0.00 0.00 58.65 58.92 1llw h GLN 120 Cb 0.60 0.07 -0.09 0.00 0.30 0.00 0.00 27.48 28.35 1llw h GLN 120 CO -0.34 1.01 0.51 0.00 -0.67 0.00 0.00 178.83 179.34 1llw h ALA 121 N 0.51 1.39 0.00 3.87 0.00 -1.78 -1.65 119.26 121.60 1llw h ALA 121 Ca -0.02 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1llw h ALA 121 Cb 1.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1llw h ALA 121 CO 0.09 -0.01 -0.47 -0.22 0.00 0.00 0.00 179.25 178.64 1llw h LYS 122 N 0.74 0.00 0.11 0.00 3.64 -0.85 0.13 116.57 120.34 1llw h LYS 122 Ca 0.49 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.60 1llw h LYS 122 Cb 0.65 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1llw h LYS 122 CO -0.34 0.47 -1.19 -0.91 -2.27 0.00 0.00 179.45 175.22 1llw h ASN 123 N 0.00 0.48 0.03 4.20 2.35 -0.49 -3.27 115.58 118.87 1llw h ASN 123 Ca -0.00 -0.48 -0.15 0.00 -0.55 0.00 0.00 56.30 55.11 1llw h ASN 123 Cb 0.98 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 1llw h ASN 123 CO 0.06 1.35 -0.52 0.78 -1.65 0.00 0.00 177.43 177.45 1llw h ASN 124 N 0.11 0.60 -0.88 5.81 2.35 -1.11 -3.49 115.58 118.97 1llw h ASN 124 Ca -0.13 -0.31 -0.86 0.00 -0.55 0.00 0.00 56.30 54.45 1llw h ASN 124 Cb 1.90 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 40.10 1llw h ASN 124 CO 0.20 1.01 0.77 1.67 -1.65 0.00 0.00 177.43 179.43 1llw n GLN 125 N -3.97 0.02 -1.05 0.81 7.27 0.43 -4.92 117.38 115.97 1llw n GLN 125 Ca -0.03 0.01 -0.29 0.00 0.07 0.00 0.00 57.00 56.76 1llw n GLN 125 Cb 0.59 -1.51 0.17 0.00 2.41 0.00 0.00 30.24 31.90 1llw n GLN 125 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1llw s PRO 126 N 3.39 0.63 -0.13 3.69 0.04 -1.26 -4.80 135.00 136.56 1llw s PRO 126 Ca 1.07 0.78 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 1llw s PRO 126 Cb -1.49 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 1llw s PRO 126 CO 0.80 -2.66 0.39 -1.58 0.04 0.00 0.00 177.00 173.99 1llw s HIS 127 N -2.85 3.50 -0.16 0.56 2.46 0.58 -4.83 115.29 114.55 1llw s HIS 127 Ca 0.65 0.76 0.00 0.00 0.47 0.00 0.00 55.06 56.94 1llw s HIS 127 Cb -0.20 -2.45 -0.00 0.00 -0.13 0.00 0.00 32.58 29.80 1llw s HIS 127 CO 0.58 0.21 -0.15 0.42 -2.47 0.00 0.00 174.74 173.34 1llw s ILE 128 N 0.50 2.72 -0.14 0.89 1.01 -1.26 -0.05 121.20 124.88 1llw s ILE 128 Ca 0.22 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 1llw s ILE 128 Cb -0.14 -2.15 0.04 0.00 0.01 0.00 0.00 42.46 40.21 1llw s ILE 128 CO 0.08 0.51 0.36 -1.61 0.00 0.00 0.00 174.94 174.28 1llw s GLU 129 N 0.80 0.42 -0.21 2.79 2.02 -0.24 -2.21 118.70 122.07 1llw s GLU 129 Ca -0.05 0.51 -0.10 0.00 0.02 0.00 0.00 54.97 55.35 1llw s GLU 129 Cb -0.15 0.19 -0.05 0.00 0.10 0.00 0.00 34.13 34.22 1llw s GLU 129 CO 0.00 -0.06 0.13 -0.65 0.02 0.00 0.00 175.26 174.71 1llw s GLN 130 N 0.25 4.14 -0.01 1.61 -0.21 0.10 -0.85 119.66 124.69 1llw s GLN 130 Ca -0.00 -0.24 -0.19 0.00 0.02 0.00 0.00 55.36 54.94 1llw s GLN 130 Cb -0.03 -3.44 -0.05 0.00 1.00 0.00 0.00 33.01 30.48 1llw s GLN 130 CO -0.00 0.23 0.55 -1.50 -2.12 0.00 0.00 175.29 172.45 1llw s ILE 131 N 0.57 4.94 -0.18 1.08 2.07 0.11 0.24 121.20 130.03 1llw s ILE 131 Ca 0.08 1.16 -0.06 0.00 -1.41 0.00 0.00 60.65 60.41 1llw s ILE 131 Cb -0.12 -3.89 -0.03 0.00 0.13 0.00 0.00 42.46 38.55 1llw s ILE 131 CO 0.00 0.44 0.02 -0.76 -1.91 0.00 0.00 174.94 172.73 1llw s LEU 132 N -0.27 3.54 0.31 8.50 1.43 -0.27 -0.44 118.68 131.48 1llw s LEU 132 Ca 0.29 -0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.39 1llw s LEU 132 Cb -0.18 -1.89 -0.06 0.00 0.03 0.00 0.00 46.19 44.10 1llw s LEU 132 CO 0.16 0.14 0.04 -0.69 0.23 0.00 0.00 176.35 176.23 1llw s VAL 133 N 0.54 1.23 0.24 -1.59 1.01 -0.97 -0.05 120.40 120.81 1llw s VAL 133 Ca 0.01 -2.02 -0.22 0.00 0.00 0.00 0.00 61.98 59.75 1llw s VAL 133 Cb -0.13 -2.70 0.04 0.00 0.00 0.00 0.00 36.38 33.58 1llw s VAL 133 CO 0.02 -0.07 0.74 0.42 0.00 0.00 0.00 175.10 176.21 1llw s THR 134 N -3.28 0.00 -0.20 3.92 -4.23 -0.22 -4.45 115.64 107.19 1llw s THR 134 Ca 0.35 -0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 60.05 1llw s THR 134 Cb 0.08 -1.84 -0.00 0.00 1.34 0.00 0.00 72.50 72.08 1llw s THR 134 CO 0.14 0.00 -0.09 0.00 -0.54 0.00 0.00 174.62 174.14 1llw h PRO 136 N 7.91 0.76 -0.45 0.00 0.11 -1.94 -2.10 132.00 136.28 1llw h PRO 136 Ca -0.41 -0.05 0.13 0.00 0.11 0.00 0.00 66.00 65.79 1llw h PRO 136 Cb 1.16 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 1llw h PRO 136 CO 0.61 0.50 0.44 0.93 -0.21 0.00 0.00 178.00 180.27 1llw h GLU 137 N 0.78 0.00 0.00 1.05 5.08 -1.96 -3.45 114.58 116.08 1llw h GLU 137 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1llw h GLU 137 Cb -0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1llw h GLU 137 CO -0.05 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.37 1llw n GLY 138 N -1.52 1.54 3.58 -3.84 0.00 -0.79 -5.11 105.19 99.06 1llw n GLY 138 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1llw n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw n ALA 140 N -1.27 -0.06 0.00 0.00 0.00 -1.26 -4.69 120.51 113.23 1llw n ALA 140 Ca 0.12 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1llw n ALA 140 Cb 0.44 0.64 0.00 0.00 0.00 0.00 0.00 19.45 20.53 1llw n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llw n GLY 141 N -0.28 0.00 0.12 0.00 0.00 -0.65 -0.84 105.19 103.55 1llw n GLY 141 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1llw n GLY 141 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1llw h ASP 142 N 0.00 0.30 -0.65 1.61 3.32 -1.99 -2.03 116.42 116.98 1llw h ASP 142 Ca 0.00 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 1llw h ASP 142 Cb 0.00 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1llw h ASP 142 CO 0.00 0.44 0.40 -0.08 -1.72 0.00 0.00 179.24 178.29 1llw h GLU 143 N 0.14 0.89 -0.15 3.56 4.57 -1.80 0.12 114.58 121.90 1llw h GLU 143 Ca 0.06 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.10 1llw h GLU 143 Cb 0.26 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1llw h GLU 143 CO 0.00 0.62 -0.18 1.25 -1.18 0.00 0.00 179.01 179.52 1llw h LEU 144 N 0.91 0.41 -0.08 1.64 5.85 -0.40 0.52 115.31 124.16 1llw h LEU 144 Ca 0.24 -0.50 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 1llw h LEU 144 Cb -0.05 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.86 1llw h LEU 144 CO -0.05 0.83 0.02 0.44 -0.34 0.00 0.00 178.44 179.35 1llw h ASP 145 N 0.01 0.11 -0.56 1.25 5.19 -1.40 0.73 116.42 121.75 1llw h ASP 145 Ca 0.02 -0.21 0.11 0.00 -0.62 0.00 0.00 57.03 56.34 1llw h ASP 145 Cb 0.73 -0.03 -0.11 0.00 0.18 0.00 0.00 39.33 40.10 1llw h ASP 145 CO 0.04 0.29 -0.19 -0.09 -3.12 0.00 0.00 179.24 176.17 1llw h ARG 146 N -0.07 -0.06 0.73 3.56 1.12 -0.64 2.29 114.38 121.32 1llw h ARG 146 Ca 0.02 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.86 1llw h ARG 146 Cb 0.22 0.01 0.01 0.00 -0.01 0.00 0.00 29.97 30.20 1llw h ARG 146 CO -0.00 -0.04 -0.35 0.00 -3.11 0.00 0.00 179.97 176.47 1llw h ARG 147 N -0.06 -0.94 -0.62 0.20 2.47 0.40 -1.08 114.38 114.75 1llw h ARG 147 Ca 0.26 0.06 0.09 0.00 -1.26 0.00 0.00 59.98 59.14 1llw h ARG 147 Cb 0.47 0.21 -0.11 0.00 -1.65 0.00 0.00 29.97 28.89 1llw h ARG 147 CO -0.61 -0.62 -0.44 -0.07 0.56 0.00 0.00 179.97 178.79 1llw h LEU 148 N -1.02 -1.52 -0.80 3.04 4.07 0.11 0.16 115.31 119.35 1llw h LEU 148 Ca -0.10 0.25 0.07 0.00 0.08 0.00 0.00 57.88 58.19 1llw h LEU 148 Cb 0.76 0.70 -0.10 0.00 1.08 0.00 0.00 40.66 43.10 1llw h LEU 148 CO 0.16 -0.33 -0.47 0.00 -1.08 0.00 0.00 178.44 176.72 1llw n TYR 149 N -5.40 -0.35 -0.04 1.13 9.36 0.77 0.22 117.16 122.84 1llw n TYR 149 Ca 0.02 1.00 0.23 0.00 3.32 0.00 0.00 57.90 62.47 1llw n TYR 149 Cb 0.35 -0.56 0.72 0.00 -0.63 0.00 0.00 39.34 39.21 1llw n TYR 149 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 1llw h ILE 150 N 0.00 0.58 0.00 2.97 2.04 0.49 -2.11 117.51 121.48 1llw h ILE 150 Ca 0.13 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 1llw h ILE 150 Cb 0.33 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1llw h ILE 150 CO -0.75 0.00 -0.04 0.00 0.00 0.00 0.00 178.15 177.36 1llw h ALA 151 N 1.61 0.01 -0.18 1.87 0.00 0.53 -2.54 119.26 120.55 1llw h ALA 151 Ca 0.30 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1llw h ALA 151 Cb 1.28 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1llw h ALA 151 CO -0.00 0.02 0.29 0.07 0.00 0.00 0.00 179.25 179.64 1llw h ARG 152 N -1.00 0.00 0.13 0.00 0.11 -0.78 0.17 114.38 113.01 1llw h ARG 152 Ca -0.01 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.80 1llw h ARG 152 Cb 0.53 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.64 1llw h ARG 152 CO -0.00 0.00 -1.14 1.03 0.10 0.00 0.00 179.97 179.95 1llw h SER 153 N 0.00 0.79 0.01 0.08 0.87 -1.44 -1.04 113.55 112.81 1llw h SER 153 Ca 0.09 -0.85 -0.00 0.00 -1.23 0.00 0.00 61.79 59.80 1llw h SER 153 Cb 0.67 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1llw h SER 153 CO -0.00 1.56 -0.00 0.40 -0.53 0.00 0.00 176.83 178.25 1llw h ILE 154 N 0.13 1.31 -0.49 2.23 2.04 -0.31 -2.16 117.51 120.26 1llw h ILE 154 Ca -0.18 -0.95 0.14 0.00 1.00 0.00 0.00 64.86 64.87 1llw h ILE 154 Cb 1.84 1.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.86 1llw h ILE 154 CO 0.22 0.25 0.49 0.40 0.00 0.00 0.00 178.15 179.50 1llw h ILE 155 N -0.42 0.40 0.00 -0.67 2.04 -1.08 0.12 117.51 117.90 1llw h ILE 155 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1llw h ILE 155 Cb 0.41 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1llw h ILE 155 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 178.15 179.38 1llw h GLY 156 N 0.00 0.00 2.00 5.37 0.00 -0.51 -2.98 103.07 106.95 1llw h GLY 156 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 1llw h GLY 156 CO -0.00 0.00 -0.18 0.50 0.00 0.00 0.00 176.54 176.86 1llw h LYS 157 N 0.00 0.00 -0.68 4.80 1.79 -0.58 -2.61 116.57 119.29 1llw h LYS 157 Ca 0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 1llw h LYS 157 Cb 0.59 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.15 1llw h LYS 157 CO 0.00 0.18 0.18 1.63 -1.08 0.00 0.00 179.45 180.36 1llw n LYS 158 N -3.86 4.10 -1.49 3.15 5.02 -1.13 -5.05 118.16 118.91 1llw n LYS 158 Ca -0.02 -3.12 -0.47 0.00 -2.02 0.00 0.00 58.31 52.68 1llw n LYS 158 Cb 0.27 -2.23 -0.03 0.00 -0.02 0.00 0.00 35.03 33.02 1llw n LYS 158 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1llw n LEU 159 N 0.08 0.19 -3.79 -0.35 7.94 -0.99 -4.94 117.00 115.14 1llw n LEU 159 Ca 0.37 1.15 -0.10 0.00 -1.11 0.00 0.00 56.01 56.32 1llw n LEU 159 Cb 1.32 -1.10 -0.07 0.00 0.53 0.00 0.00 43.42 44.11 1llw n LEU 159 CO 0.40 -2.19 -0.02 0.00 -1.11 0.00 0.00 177.39 174.46 1llw s ALA 160 N -0.90 -0.45 0.55 1.96 0.00 -0.59 -4.97 121.76 117.37 1llw s ALA 160 Ca 0.64 -0.39 0.25 0.00 0.00 0.00 0.00 51.96 52.46 1llw s ALA 160 Cb -0.85 0.50 1.49 0.00 0.00 0.00 0.00 23.12 24.25 1llw s ALA 160 CO 0.57 -0.52 2.07 1.05 0.00 0.00 0.00 175.76 178.93 1llw h GLU 161 N 2.77 0.00 -0.02 0.00 4.11 -2.01 -1.67 114.58 117.76 1llw h GLU 161 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.09 1llw h GLU 161 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1llw h GLU 161 CO 0.52 0.00 -0.36 -3.47 0.07 0.00 0.00 179.01 175.77 1llw n ASP 162 N -4.15 1.88 -3.25 3.06 2.03 -1.26 -4.52 116.55 110.34 1llw n ASP 162 Ca 0.04 -1.42 -0.05 0.00 0.52 0.00 0.00 54.79 53.88 1llw n ASP 162 Cb 0.38 0.33 -0.04 0.00 -0.72 0.00 0.00 41.12 41.08 1llw n ASP 162 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1llw s PHE 163 N -2.42 -1.30 -0.26 -0.67 5.36 -0.63 -0.98 117.98 117.09 1llw s PHE 163 Ca 0.22 0.43 -0.19 0.00 -0.96 0.00 0.00 56.93 56.43 1llw s PHE 163 Cb 0.19 0.02 0.07 0.00 -0.34 0.00 0.00 43.02 42.96 1llw s PHE 163 CO 0.52 -1.04 0.66 -0.47 -1.46 0.00 0.00 175.22 173.43 1llw s TYR 164 N 2.44 -0.85 -0.33 10.12 5.04 -0.80 -1.55 117.35 131.41 1llw s TYR 164 Ca 0.11 1.89 -0.17 0.00 -2.44 0.00 0.00 57.07 56.47 1llw s TYR 164 Cb -0.11 0.40 -0.01 0.00 0.35 0.00 0.00 41.96 42.59 1llw s TYR 164 CO -0.23 -0.42 0.45 0.08 -1.34 0.00 0.00 175.55 174.08 1llw s VAL 165 N 0.92 5.08 0.38 3.14 1.01 -1.26 -1.13 120.40 128.54 1llw s VAL 165 Ca -0.05 0.29 0.13 0.00 0.00 0.00 0.00 61.98 62.35 1llw s VAL 165 Cb -0.05 -3.88 0.10 0.00 0.00 0.00 0.00 36.38 32.54 1llw s VAL 165 CO -0.08 -0.12 1.84 0.00 0.00 0.00 0.00 175.10 176.73 1llw s SER 167 N -6.94 -0.07 -0.32 0.00 1.04 -1.20 -4.20 113.70 102.01 1llw s SER 167 Ca -0.03 0.12 0.02 0.00 0.48 0.00 0.00 55.95 56.54 1llw s SER 167 Cb 0.15 0.12 0.16 0.00 0.10 0.00 0.00 66.02 66.54 1llw s SER 167 CO 0.72 -0.03 0.39 0.12 0.98 0.00 0.00 173.24 175.42 1llw s PHE 168 N -0.26 -0.75 0.22 5.02 2.19 -1.25 0.28 117.98 123.42 1llw s PHE 168 Ca 0.07 -0.11 -0.15 0.00 0.33 0.00 0.00 56.93 57.07 1llw s PHE 168 Cb -0.04 -0.25 0.01 0.00 -1.31 0.00 0.00 43.02 41.43 1llw s PHE 168 CO -0.13 -0.98 0.50 -1.54 1.83 0.00 0.00 175.22 174.90 1llw s SER 169 N 2.13 -0.16 0.00 6.13 1.04 -0.98 -4.34 113.70 117.52 1llw s SER 169 Ca 0.12 -0.70 0.17 0.00 0.48 0.00 0.00 55.95 56.03 1llw s SER 169 Cb -0.13 0.58 0.48 0.00 0.10 0.00 0.00 66.02 67.06 1llw s SER 169 CO -0.21 -1.10 1.40 0.00 0.98 0.00 0.00 173.24 174.31 1llw n ARG 171 N 0.97 0.00 -4.22 0.00 1.74 -1.26 -4.43 116.66 109.46 1llw n ARG 171 Ca 0.17 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 57.08 1llw n ARG 171 Cb 0.44 -0.66 -0.11 0.00 -1.02 0.00 0.00 32.46 31.11 1llw n ARG 171 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1llw s THR 172 N -1.48 1.22 -0.02 0.55 -1.32 -1.26 -3.12 115.64 110.20 1llw s THR 172 Ca 0.00 -1.67 -0.02 0.00 -1.21 0.00 0.00 61.69 58.78 1llw s THR 172 Cb 0.00 -1.46 0.00 0.00 -1.51 0.00 0.00 72.50 69.54 1llw s THR 172 CO 0.00 -0.44 0.07 -0.51 -2.21 0.00 0.00 174.62 171.53 1llw s ILE 173 N -2.16 0.01 -0.15 5.08 2.07 0.36 -4.34 121.20 122.07 1llw s ILE 173 Ca 0.07 -0.08 -0.01 0.00 -1.41 0.00 0.00 60.65 59.22 1llw s ILE 173 Cb -0.05 -0.13 -0.01 0.00 0.13 0.00 0.00 42.46 42.40 1llw s ILE 173 CO 0.02 -0.05 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.20 1llw s VAL 174 N -0.11 3.10 -0.27 4.00 1.01 -1.26 -1.04 120.40 125.82 1llw s VAL 174 Ca -0.02 -0.63 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 1llw s VAL 174 Cb -0.01 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 34.06 1llw s VAL 174 CO 0.00 0.51 -0.00 -0.31 0.00 0.00 0.00 175.10 175.30 1llw s TYR 175 N 0.58 3.13 0.11 5.22 1.51 0.49 -4.82 117.35 123.58 1llw s TYR 175 Ca -0.07 -1.42 -0.12 0.00 -1.01 0.00 0.00 57.07 54.45 1llw s TYR 175 Cb -0.15 -2.13 0.01 0.00 -0.11 0.00 0.00 41.96 39.57 1llw s TYR 175 CO 0.03 -0.69 0.29 -1.59 -1.11 0.00 0.00 175.55 172.48 1llw s LYS 176 N 1.37 0.98 -0.06 -0.62 -2.85 -1.26 -1.10 119.74 116.20 1llw s LYS 176 Ca 0.00 -0.88 -0.31 0.00 -1.00 0.00 0.00 55.97 53.78 1llw s LYS 176 Cb -0.17 0.40 0.12 0.00 -2.06 0.00 0.00 37.83 36.12 1llw s LYS 176 CO -0.02 -0.35 1.36 0.20 0.10 0.00 0.00 175.35 176.64 1llw s GLY 177 N -2.85 -0.37 -1.24 0.59 0.00 -0.58 -5.02 107.32 97.84 1llw s GLY 177 Ca 0.06 0.61 -0.09 0.00 0.00 0.00 0.00 44.72 45.29 1llw s GLY 177 CO -0.10 2.09 1.78 1.03 0.00 0.00 0.00 173.10 177.90 1llw n MET 178 N -0.64 3.73 -4.20 2.90 2.81 -1.26 -0.67 117.12 119.80 1llw n MET 178 Ca -0.05 -3.71 -0.16 0.00 -1.81 0.00 0.00 57.70 51.97 1llw n MET 178 Cb 0.62 -2.87 -0.11 0.00 -0.71 0.00 0.00 33.22 30.15 1llw n MET 178 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1llw s VAL 179 N -0.03 1.11 0.64 2.03 -7.23 -1.26 -3.19 120.40 112.48 1llw s VAL 179 Ca 0.38 -1.62 -0.16 0.00 -1.81 0.00 0.00 61.98 58.78 1llw s VAL 179 Cb 0.08 -1.38 -0.01 0.00 0.56 0.00 0.00 36.38 35.63 1llw s VAL 179 CO 0.02 -0.45 1.12 -0.13 -0.31 0.00 0.00 175.10 175.34 1llw s ARG 180 N -2.58 2.88 0.06 4.82 0.52 -1.26 -3.22 118.95 120.17 1llw s ARG 180 Ca 0.06 1.44 -0.34 0.00 -0.52 0.00 0.00 55.73 56.36 1llw s ARG 180 Cb -0.05 -1.96 -0.19 0.00 0.52 0.00 0.00 34.95 33.27 1llw s ARG 180 CO 0.02 -1.19 1.54 0.66 0.02 0.00 0.00 175.30 176.34 1llw h SER 181 N 0.23 -0.94 0.06 0.23 4.64 -1.90 -0.13 113.55 115.73 1llw h SER 181 Ca -0.47 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1llw h SER 181 Cb 1.25 0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1llw h SER 181 CO 0.54 -0.65 0.00 0.00 -0.87 0.00 0.00 176.83 175.86 1llw n ILE 182 N -5.55 0.27 0.18 0.95 0.00 -1.26 -0.67 119.36 113.27 1llw n ILE 182 Ca -0.15 0.07 0.12 0.00 0.00 0.00 0.00 62.75 62.79 1llw n ILE 182 Cb 0.44 -0.92 0.04 0.00 0.00 0.00 0.00 39.64 39.20 1llw n ILE 182 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1llw h ILE 183 N 0.00 0.00 -0.43 9.51 5.03 -1.38 -3.39 117.51 126.84 1llw h ILE 183 Ca 0.00 -0.93 0.09 0.00 -0.12 0.00 0.00 64.86 63.89 1llw h ILE 183 Cb 0.03 1.50 -0.08 0.00 -3.03 0.00 0.00 36.82 35.24 1llw h ILE 183 CO 0.00 0.00 -0.11 0.25 -0.68 0.00 0.00 178.15 177.61 1llw h LEU 184 N 0.00 -0.41 -2.06 1.44 5.85 -0.80 0.58 115.31 119.90 1llw h LEU 184 Ca 0.00 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1llw h LEU 184 Cb 0.97 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 1llw h LEU 184 CO 0.00 -0.15 -0.07 1.23 -0.34 0.00 0.00 178.44 179.11 1llw h GLY 185 N -0.01 0.00 1.99 3.75 0.00 -1.76 -2.06 103.07 104.98 1llw h GLY 185 Ca 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.33 1llw h GLY 185 CO -0.45 0.00 -0.97 0.83 0.00 0.00 0.00 176.54 175.95 1llw h GLU 186 N 0.00 0.00 0.27 4.80 4.39 -0.12 -3.36 114.58 120.56 1llw h GLU 186 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1llw h GLU 186 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1llw h GLU 186 CO 0.01 0.96 -0.13 0.35 -1.16 0.00 0.00 179.01 179.04 1llw h PHE 187 N 0.00 -0.33 -3.31 4.33 3.57 -0.85 -3.40 116.94 116.94 1llw h PHE 187 Ca -0.01 -0.01 -0.54 0.00 3.53 0.00 0.00 57.97 60.94 1llw h PHE 187 Cb 1.75 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 40.58 1llw h PHE 187 CO 0.00 -0.21 0.45 0.71 -2.23 0.00 0.00 178.31 177.04 1llw s TYR 188 N -2.73 3.56 -0.20 0.41 1.51 -0.79 -1.26 117.35 117.85 1llw s TYR 188 Ca -0.05 1.53 0.08 0.00 -1.01 0.00 0.00 57.07 57.62 1llw s TYR 188 Cb 0.01 -3.25 -0.21 0.00 -0.11 0.00 0.00 41.96 38.39 1llw s TYR 188 CO 0.16 -0.54 0.02 1.28 -1.11 0.00 0.00 175.55 175.35 1llw n LEU 189 N 3.94 1.62 -0.16 -1.29 4.77 -1.07 -3.57 117.00 121.25 1llw n LEU 189 Ca 0.07 -0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.14 1llw n LEU 189 Cb 0.49 -0.30 0.18 0.00 -2.33 0.00 0.00 43.42 41.46 1llw n LEU 189 CO 0.53 0.72 0.42 0.47 -1.33 0.00 0.00 177.39 178.20 1llw n ASP 190 N -3.07 0.01 0.08 -1.43 8.00 -1.26 -0.82 116.55 118.06 1llw n ASP 190 Ca -0.37 0.82 0.13 0.00 0.71 0.00 0.00 54.79 56.08 1llw n ASP 190 Cb 1.07 -0.33 0.46 0.00 -0.02 0.00 0.00 41.12 42.30 1llw n ASP 190 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1llw n LEU 191 N -4.42 0.60 -1.14 0.64 4.32 -1.23 -1.86 117.00 113.91 1llw n LEU 191 Ca 0.13 0.57 0.09 0.00 -0.02 0.00 0.00 56.01 56.78 1llw n LEU 191 Cb 0.44 -0.40 0.27 0.00 -1.62 0.00 0.00 43.42 42.12 1llw n LEU 191 CO -0.03 -0.20 0.73 0.29 -1.22 0.00 0.00 177.39 176.96 1llw n LYS 192 N -2.08 3.05 -3.69 3.23 5.02 0.00 -4.77 118.16 118.92 1llw n LYS 192 Ca 0.05 -2.53 -0.37 0.00 -2.02 0.00 0.00 58.31 53.44 1llw n LYS 192 Cb 0.37 -1.57 -0.12 0.00 -0.02 0.00 0.00 35.03 33.69 1llw n LYS 192 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1llw s ASN 193 N -1.05 5.56 0.00 4.39 3.84 -0.78 -4.99 114.94 121.92 1llw s ASN 193 Ca 0.40 -0.10 0.06 0.00 0.21 0.00 0.00 52.86 53.44 1llw s ASN 193 Cb 0.24 -2.02 0.33 0.00 -0.55 0.00 0.00 41.25 39.26 1llw s ASN 193 CO 0.23 -0.03 1.02 -2.65 -2.79 0.00 0.00 177.10 172.88 1llw n PRO 194 N 4.91 0.11 0.05 0.43 -0.02 -1.26 0.69 135.00 139.91 1llw n PRO 194 Ca -0.15 0.18 0.13 0.00 -2.02 0.00 0.00 63.50 61.65 1llw n PRO 194 Cb 0.52 -1.50 0.49 0.00 -0.02 0.00 0.00 33.50 32.99 1llw n PRO 194 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1llw n GLY 195 N -0.72 -1.58 3.62 -1.23 0.00 -1.26 -4.74 105.19 99.28 1llw n GLY 195 Ca 0.03 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1llw n GLY 195 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1llw s TYR 196 N -3.05 2.50 -0.02 1.61 5.04 0.22 -2.93 117.35 120.72 1llw s TYR 196 Ca 0.12 0.75 -0.05 0.00 -2.44 0.00 0.00 57.07 55.45 1llw s TYR 196 Cb 0.16 -4.09 0.00 0.00 0.35 0.00 0.00 41.96 38.38 1llw s TYR 196 CO 0.57 -1.95 0.11 0.95 -1.34 0.00 0.00 175.55 173.89 1llw s THR 197 N 4.94 0.05 -0.18 4.34 -4.23 -1.26 -4.08 115.64 115.22 1llw s THR 197 Ca 0.60 -0.42 -0.22 0.00 -1.18 0.00 0.00 61.69 60.46 1llw s THR 197 Cb -0.16 -0.31 0.06 0.00 1.34 0.00 0.00 72.50 73.43 1llw s THR 197 CO 0.28 -0.23 0.60 -0.55 -0.54 0.00 0.00 174.62 174.18 1llw s SER 198 N -0.77 -0.61 0.47 3.99 0.15 -1.09 -4.34 113.70 111.51 1llw s SER 198 Ca -0.09 1.06 0.32 0.00 0.70 0.00 0.00 55.95 57.94 1llw s SER 198 Cb -0.05 1.05 1.51 0.00 -1.71 0.00 0.00 66.02 66.82 1llw s SER 198 CO 0.01 -0.30 1.96 -0.55 1.20 0.00 0.00 173.24 175.56 1llw h ASN 199 N 4.71 0.00 -0.00 5.45 -1.07 -1.89 -3.39 115.58 119.39 1llw h ASN 199 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.09 1llw h ASN 199 Cb 1.16 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.41 1llw h ASN 199 CO 0.19 0.00 0.00 2.22 0.07 0.00 0.00 177.43 179.91 1llw n PHE 200 N -2.75 -0.00 -3.28 4.14 1.16 -1.26 0.17 117.46 115.64 1llw n PHE 200 Ca -0.00 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.61 1llw n PHE 200 Cb 0.18 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.01 1llw n PHE 200 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1llw s ALA 201 N -1.37 -3.14 -0.18 1.98 0.00 -0.39 -4.61 121.76 114.05 1llw s ALA 201 Ca 0.00 1.84 -0.05 0.00 0.00 0.00 0.00 51.96 53.75 1llw s ALA 201 Cb 0.00 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 1llw s ALA 201 CO 0.00 -0.86 0.01 0.08 0.00 0.00 0.00 175.76 174.99 1llw s VAL 202 N 1.90 4.22 0.13 0.00 1.01 -0.14 -1.14 120.40 126.39 1llw s VAL 202 Ca -0.01 -0.23 0.10 0.00 0.00 0.00 0.00 61.98 61.84 1llw s VAL 202 Cb -0.01 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 1llw s VAL 202 CO -0.15 0.46 -0.25 -0.72 0.00 0.00 0.00 175.10 174.43 1llw s TYR 203 N 0.55 2.20 -0.06 5.22 -0.85 -0.62 0.42 117.35 124.22 1llw s TYR 203 Ca -0.00 -0.39 -0.06 0.00 -0.52 0.00 0.00 57.07 56.10 1llw s TYR 203 Cb -0.14 -1.19 0.02 0.00 0.38 0.00 0.00 41.96 41.03 1llw s TYR 203 CO 0.02 0.33 0.18 -1.58 -1.52 0.00 0.00 175.55 172.97 1llw s HIS 204 N -1.14 -0.18 -0.09 -3.49 2.46 -1.15 -2.31 115.29 109.39 1llw s HIS 204 Ca 0.13 0.45 0.03 0.00 0.47 0.00 0.00 55.06 56.13 1llw s HIS 204 Cb -0.10 0.06 0.01 0.00 -0.13 0.00 0.00 32.58 32.42 1llw s HIS 204 CO 0.06 -0.11 -0.17 0.50 -2.47 0.00 0.00 174.74 172.56 1llw s ARG 205 N 0.00 2.25 0.06 2.88 6.06 0.23 -1.47 118.95 128.97 1llw s ARG 205 Ca -0.01 -0.60 -0.07 0.00 -2.50 0.00 0.00 55.73 52.56 1llw s ARG 205 Cb -0.02 -1.81 -0.05 0.00 0.06 0.00 0.00 34.95 33.13 1llw s ARG 205 CO 0.00 0.05 0.33 0.50 -2.50 0.00 0.00 175.30 173.68 1llw s ARG 206 N 0.66 3.64 -0.31 5.12 3.52 0.39 -0.38 118.95 131.59 1llw s ARG 206 Ca -0.14 -0.02 0.01 0.00 -0.13 0.00 0.00 55.73 55.46 1llw s ARG 206 Cb -0.16 -3.00 0.10 0.00 -1.56 0.00 0.00 34.95 30.33 1llw s ARG 206 CO 0.04 0.58 0.06 0.12 -0.81 0.00 0.00 175.30 175.29 1llw s PHE 207 N -1.42 2.65 0.42 5.12 5.99 -1.26 -1.62 117.98 127.85 1llw s PHE 207 Ca 0.33 -2.27 -0.02 0.00 0.00 0.00 0.00 56.93 54.96 1llw s PHE 207 Cb -0.13 -2.21 -0.03 0.00 0.00 0.00 0.00 43.02 40.64 1llw s PHE 207 CO 0.19 -0.90 0.67 -1.54 -0.00 0.00 0.00 175.22 173.64 1llw s SER 208 N 1.29 6.20 -0.28 6.13 1.04 -1.26 -4.80 113.70 122.02 1llw s SER 208 Ca 0.09 0.62 0.05 0.00 0.48 0.00 0.00 55.95 57.18 1llw s SER 208 Cb -0.18 -2.04 0.51 0.00 0.10 0.00 0.00 66.02 64.40 1llw s SER 208 CO -0.16 -0.48 1.58 0.35 0.98 0.00 0.00 173.24 175.51 1llw n THR 209 N -2.03 2.41 -2.64 2.02 -2.24 -1.26 -4.81 114.28 105.72 1llw n THR 209 Ca -0.02 -1.26 0.00 0.00 -2.27 0.00 0.00 64.05 60.50 1llw n THR 209 Cb 0.56 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1llw n THR 209 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1llw n ASN 210 N -0.37 0.00 -0.06 3.42 0.23 -1.26 -4.50 115.26 112.72 1llw n ASN 210 Ca 0.36 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.41 1llw n ASN 210 Cb 1.23 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.93 1llw n ASN 210 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 1llw n THR 211 N 0.00 0.02 -3.72 5.53 5.66 -1.26 -4.75 114.28 115.76 1llw n THR 211 Ca 0.00 -0.02 -0.30 0.00 -3.05 0.00 0.00 64.05 60.68 1llw n THR 211 Cb 0.00 0.93 -0.14 0.00 -1.55 0.00 0.00 70.33 69.56 1llw n THR 211 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 1llw s MET 212 N -0.02 0.90 0.24 1.09 -1.94 -1.26 -2.93 119.30 115.37 1llw s MET 212 Ca 0.00 -1.38 -0.30 0.00 -1.71 0.00 0.00 55.69 52.30 1llw s MET 212 Cb 0.00 -2.10 -0.09 0.00 2.01 0.00 0.00 34.83 34.65 1llw s MET 212 CO 0.00 -1.05 1.23 -1.25 -0.01 0.00 0.00 175.02 173.94 1llw s PRO 213 N 1.20 4.47 -0.15 2.03 0.04 -1.26 -5.05 135.00 136.29 1llw s PRO 213 Ca 0.12 1.97 0.01 0.00 0.04 0.00 0.00 61.00 63.15 1llw s PRO 213 Cb -0.20 -3.18 -0.00 0.00 0.04 0.00 0.00 34.50 31.16 1llw s PRO 213 CO -0.16 -0.08 -0.16 0.15 0.04 0.00 0.00 177.00 176.78 1llw s LYS 214 N -0.77 3.19 0.27 4.56 -0.14 -1.26 -4.98 119.74 120.61 1llw s LYS 214 Ca 0.51 -0.77 0.01 0.00 -1.36 0.00 0.00 55.97 54.36 1llw s LYS 214 Cb -0.35 -2.58 0.61 0.00 -1.68 0.00 0.00 37.83 33.83 1llw s LYS 214 CO 0.41 0.03 1.72 -1.49 -0.76 0.00 0.00 175.35 175.26 1llw h TRP 215 N 7.24 0.63 -0.04 3.18 4.06 -1.91 -0.34 115.95 128.76 1llw h TRP 215 Ca -0.31 0.04 0.01 0.00 2.06 0.00 0.00 58.89 60.69 1llw h TRP 215 Cb 1.19 -0.15 -0.00 0.00 -1.00 0.00 0.00 29.16 29.21 1llw h TRP 215 CO 0.50 0.03 0.11 -1.35 -3.56 0.00 0.00 178.44 174.17 1llw h PRO 216 N 0.46 0.00 -0.01 0.49 0.11 -1.91 -2.75 132.00 128.39 1llw h PRO 216 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 1llw h PRO 216 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1llw h PRO 216 CO -0.47 0.00 -0.18 1.28 -0.21 0.00 0.00 178.00 178.43 1llw n LEU 217 N -3.34 0.92 -4.41 2.35 4.77 -0.14 -4.85 117.00 112.30 1llw n LEU 217 Ca -0.02 -0.22 -0.29 0.00 -0.03 0.00 0.00 56.01 55.46 1llw n LEU 217 Cb 0.19 -0.12 0.27 0.00 -2.33 0.00 0.00 43.42 41.44 1llw n LEU 217 CO 0.22 0.17 0.46 0.00 -1.33 0.00 0.00 177.39 176.91 1llw n ALA 218 N -0.63 -3.52 -2.81 -1.18 0.00 -1.04 -4.98 120.51 106.35 1llw n ALA 218 Ca 0.14 -1.38 -0.11 0.00 0.00 0.00 0.00 53.44 52.09 1llw n ALA 218 Cb 0.33 -1.91 0.06 0.00 0.00 0.00 0.00 19.45 17.92 1llw n ALA 218 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1llw n GLN 219 N -5.20 0.97 -3.63 0.00 7.27 -1.26 -4.74 117.38 110.78 1llw n GLN 219 Ca 0.04 -2.15 -0.36 0.00 0.07 0.00 0.00 57.00 54.59 1llw n GLN 219 Cb 0.55 -1.20 -0.09 0.00 2.41 0.00 0.00 30.24 31.91 1llw n GLN 219 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1llw s PRO 220 N -0.11 4.11 0.00 3.69 0.05 -1.26 -4.34 135.00 137.14 1llw s PRO 220 Ca 0.27 -0.19 0.00 0.00 0.05 0.00 0.00 61.00 61.12 1llw s PRO 220 Cb 0.29 -3.52 0.00 0.00 0.05 0.00 0.00 34.50 31.32 1llw s PRO 220 CO -0.09 0.10 0.00 -1.33 0.05 0.00 0.00 177.00 175.73 1llw n MET 221 N 4.16 3.07 0.19 4.56 2.81 0.27 -4.79 117.12 127.39 1llw n MET 221 Ca -0.14 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.84 1llw n MET 221 Cb 0.52 0.00 0.12 0.00 -0.71 0.00 0.00 33.22 33.15 1llw n MET 221 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1llw h ARG 222 N 0.00 0.00 0.00 0.03 -0.00 -1.95 -3.40 114.38 109.06 1llw h ARG 222 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1llw h ARG 222 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 1llw h ARG 222 CO 0.00 0.12 -0.17 -0.11 0.00 0.00 0.00 179.97 179.81 1llw n LEU 223 N -3.10 0.39 -4.05 3.04 7.94 -1.26 -4.93 117.00 115.02 1llw n LEU 223 Ca 0.03 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.86 1llw n LEU 223 Cb 0.58 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.44 1llw n LEU 223 CO 0.36 0.06 -0.33 -1.48 -1.11 0.00 0.00 177.39 174.90 1llw s LEU 224 N -2.90 2.33 -0.13 -1.96 2.34 -1.26 -0.71 118.68 116.39 1llw s LEU 224 Ca 0.00 -0.90 -0.03 0.00 0.06 0.00 0.00 54.13 53.26 1llw s LEU 224 Cb 0.00 0.29 -0.03 0.00 -0.56 0.00 0.00 46.19 45.89 1llw s LEU 224 CO 0.00 -0.58 -0.04 -0.83 -1.06 0.00 0.00 176.35 173.84 1llw s GLY 225 N -2.75 1.74 -0.14 -3.48 0.00 0.94 -0.56 107.32 103.06 1llw s GLY 225 Ca 0.04 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 43.94 1llw s GLY 225 CO -0.09 -0.23 -0.16 -1.58 0.00 0.00 0.00 173.10 171.04 1llw s HIS 226 N 0.01 2.75 -0.28 1.90 2.46 -1.26 -1.23 115.29 119.63 1llw s HIS 226 Ca 0.01 -1.00 -0.02 0.00 0.47 0.00 0.00 55.06 54.51 1llw s HIS 226 Cb -0.13 -1.86 0.04 0.00 -0.13 0.00 0.00 32.58 30.50 1llw s HIS 226 CO 0.03 -0.44 -0.01 1.21 -2.47 0.00 0.00 174.74 173.06 1llw s ASN 227 N 0.69 4.73 0.00 9.88 2.47 -0.76 -5.02 114.94 126.94 1llw s ASN 227 Ca -0.08 -1.09 0.00 0.00 0.42 0.00 0.00 52.86 52.11 1llw s ASN 227 Cb -0.16 -1.71 0.00 0.00 -1.45 0.00 0.00 41.25 37.93 1llw s ASN 227 CO 0.02 -0.21 0.00 0.61 -3.72 0.00 0.00 177.10 173.79 1llw n GLY 228 N 4.66 -0.09 3.58 1.21 0.00 -1.26 -1.15 105.19 112.14 1llw n GLY 228 Ca -0.14 -1.02 -0.04 0.00 0.00 0.00 0.00 46.02 44.82 1llw n GLY 228 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1llw s GLU 229 N -2.00 0.57 -0.05 1.61 0.41 -0.16 -4.95 118.70 114.13 1llw s GLU 229 Ca 0.00 1.33 -0.30 0.00 -0.41 0.00 0.00 54.97 55.59 1llw s GLU 229 Cb 0.00 0.62 -0.03 0.00 -1.78 0.00 0.00 34.13 32.94 1llw s GLU 229 CO 0.00 -0.19 1.12 0.42 -0.49 0.00 0.00 175.26 176.12 1llw s ILE 230 N 2.55 4.43 -2.11 -1.63 1.09 -1.25 -3.17 121.20 121.11 1llw s ILE 230 Ca -0.06 1.74 0.22 0.00 -1.10 0.00 0.00 60.65 61.44 1llw s ILE 230 Cb -0.10 -4.12 0.50 0.00 -1.06 0.00 0.00 42.46 37.67 1llw s ILE 230 CO -0.18 0.03 1.43 -0.46 -0.10 0.00 0.00 174.94 175.66 1llw n ASN 231 N 4.84 3.60 -0.04 3.58 0.23 0.52 -4.11 115.26 123.87 1llw n ASN 231 Ca 0.10 -1.98 0.03 0.00 -0.53 0.00 0.00 54.58 52.19 1llw n ASN 231 Cb 0.47 -0.34 0.04 0.00 -2.08 0.00 0.00 39.78 37.87 1llw n ASN 231 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1llw n THR 232 N 1.46 1.10 0.00 5.53 -2.24 -1.26 -4.95 114.28 113.93 1llw n THR 232 Ca 0.21 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 1llw n THR 232 Cb 0.59 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1llw n THR 232 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1llw n LEU 233 N -0.68 0.00 -0.30 3.22 7.94 -1.26 -1.01 117.00 124.92 1llw n LEU 233 Ca 0.04 0.25 0.17 0.00 -1.11 0.00 0.00 56.01 55.36 1llw n LEU 233 Cb 0.39 -0.09 0.32 0.00 0.53 0.00 0.00 43.42 44.58 1llw n LEU 233 CO 0.00 -0.09 0.76 -0.11 -1.11 0.00 0.00 177.39 176.85 1llw n LEU 234 N -1.53 -0.00 0.26 -1.96 -0.00 -1.26 -1.06 117.00 111.44 1llw n LEU 234 Ca 0.00 1.50 -0.10 0.00 -0.00 0.00 0.00 56.01 57.40 1llw n LEU 234 Cb 0.00 -0.59 -0.05 0.00 -0.00 0.00 0.00 43.42 42.78 1llw n LEU 234 CO 0.00 -1.56 0.34 1.23 -0.00 0.00 0.00 177.39 177.40 1llw h GLY 235 N 0.00 -0.71 -0.82 -3.96 0.00 -1.34 -1.40 103.07 94.84 1llw h GLY 235 Ca 0.59 0.26 0.13 0.00 0.00 0.00 0.00 47.33 48.31 1llw h GLY 235 CO -0.80 -0.26 -0.42 3.43 0.00 0.00 0.00 176.54 178.50 1llw h ASN 236 N -0.97 -1.50 -0.84 0.19 2.35 -1.17 0.18 115.58 113.82 1llw h ASN 236 Ca -0.07 0.29 0.09 0.00 -0.55 0.00 0.00 56.30 56.06 1llw h ASN 236 Cb 0.52 0.74 -0.06 0.00 0.05 0.00 0.00 38.32 39.58 1llw h ASN 236 CO 0.11 -0.29 0.54 0.40 -1.65 0.00 0.00 177.43 176.55 1llw h ILE 237 N -0.07 0.97 -0.42 2.81 2.04 -1.11 0.29 117.51 122.03 1llw h ILE 237 Ca 0.28 -0.28 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1llw h ILE 237 Cb 0.56 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1llw h ILE 237 CO -0.88 0.15 -0.09 0.78 0.00 0.00 0.00 178.15 178.11 1llw h ASN 238 N 0.82 0.80 0.00 1.72 4.21 0.40 -0.21 115.58 123.32 1llw h ASN 238 Ca 0.38 -0.36 0.00 0.00 1.21 0.00 0.00 56.30 57.53 1llw h ASN 238 Cb 0.39 -0.22 0.00 0.00 -1.12 0.00 0.00 38.32 37.37 1llw h ASN 238 CO -0.15 0.97 0.00 0.79 -1.29 0.00 0.00 177.43 177.75 1llw n TRP 239 N -4.32 0.00 -0.09 1.19 7.02 0.17 -1.29 117.44 120.11 1llw n TRP 239 Ca -0.01 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.34 1llw n TRP 239 Cb 0.36 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.17 1llw n TRP 239 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 1llw n MET 240 N -0.71 0.46 -0.30 -0.99 2.81 0.03 -4.15 117.12 114.28 1llw n MET 240 Ca 0.10 0.11 0.07 0.00 -1.81 0.00 0.00 57.70 56.17 1llw n MET 240 Cb 0.04 -1.36 0.29 0.00 -0.71 0.00 0.00 33.22 31.48 1llw n MET 240 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1llw h ALA 241 N -0.05 1.62 -0.26 3.04 0.00 -0.88 -0.26 119.26 122.47 1llw h ALA 241 Ca -0.42 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 1llw h ALA 241 Cb 1.63 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1llw h ALA 241 CO -0.08 0.19 -0.30 0.00 0.00 0.00 0.00 179.25 179.06 1llw h ALA 242 N 1.55 1.00 0.00 0.00 0.00 -1.43 -2.89 119.26 117.49 1llw h ALA 242 Ca 0.43 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1llw h ALA 242 Cb 0.42 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1llw h ALA 242 CO -0.19 0.60 0.00 0.54 0.00 0.00 0.00 179.25 180.20 1llw n ARG 243 N -4.09 0.11 -0.03 0.00 1.74 -0.13 -4.26 116.66 110.01 1llw n ARG 243 Ca -0.01 0.58 -0.17 0.00 -0.77 0.00 0.00 57.85 57.49 1llw n ARG 243 Cb 0.45 -1.84 -0.07 0.00 -1.02 0.00 0.00 32.46 29.97 1llw n ARG 243 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1llw h GLU 244 N 0.00 0.74 -0.40 5.56 5.08 -1.28 -3.09 114.58 121.19 1llw h GLU 244 Ca 0.00 -0.58 -0.11 0.00 -1.00 0.00 0.00 59.36 57.67 1llw h GLU 244 Cb 0.04 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1llw h GLU 244 CO 0.00 1.19 -0.18 0.87 -1.00 0.00 0.00 179.01 179.89 1llw h LYS 245 N 0.46 0.83 -1.32 2.33 1.57 -1.80 -3.34 116.57 115.30 1llw h LYS 245 Ca -0.04 -0.36 -0.33 0.00 -1.87 0.00 0.00 60.65 58.06 1llw h LYS 245 Cb 1.29 -0.03 -0.16 0.00 0.08 0.00 0.00 32.23 33.42 1llw h LYS 245 CO 0.14 0.99 0.42 0.39 -0.57 0.00 0.00 179.45 180.83 1llw n GLU 246 N -4.24 1.81 -2.65 3.15 1.02 -1.17 -4.94 120.64 113.63 1llw n GLU 246 Ca -0.01 -1.67 -0.41 0.00 -0.02 0.00 0.00 57.16 55.05 1llw n GLU 246 Cb 0.42 -1.66 -0.05 0.00 -0.02 0.00 0.00 31.44 30.14 1llw n GLU 246 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1llw s LEU 247 N -1.92 4.56 -0.03 -4.62 1.43 -1.24 -4.93 118.68 111.93 1llw s LEU 247 Ca 0.33 2.00 -0.01 0.00 -1.03 0.00 0.00 54.13 55.42 1llw s LEU 247 Cb 0.26 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.91 1llw s LEU 247 CO 0.01 -0.03 0.05 -1.61 0.23 0.00 0.00 176.35 175.01 1llw s GLU 248 N -0.76 -0.03 0.13 1.70 2.02 -1.26 -4.93 118.70 115.57 1llw s GLU 248 Ca 0.45 0.24 -0.08 0.00 0.02 0.00 0.00 54.97 55.60 1llw s GLU 248 Cb -0.27 -0.27 -0.01 0.00 0.10 0.00 0.00 34.13 33.68 1llw s GLU 248 CO 0.34 -0.19 0.23 0.08 0.02 0.00 0.00 175.26 175.73 1llw s VAL 249 N 1.24 0.10 -0.59 2.63 1.01 -1.26 -4.53 120.40 119.00 1llw s VAL 249 Ca -0.07 -1.38 -0.38 0.00 0.00 0.00 0.00 61.98 60.14 1llw s VAL 249 Cb -0.13 -1.70 -0.18 0.00 0.00 0.00 0.00 36.38 34.38 1llw s VAL 249 CO -0.03 -0.44 2.30 -1.54 0.00 0.00 0.00 175.10 175.38 1llw n SER 250 N -0.15 0.99 0.00 3.32 3.41 -1.26 -2.23 113.62 117.70 1llw n SER 250 Ca -0.10 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1llw n SER 250 Cb 0.63 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 1llw n SER 250 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1llw n GLY 251 N 7.00 0.00 3.61 5.00 0.00 -1.26 -4.88 105.19 114.66 1llw n GLY 251 Ca 0.54 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.13 1llw n GLY 251 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1llw s TRP 252 N -0.63 1.17 0.45 1.61 0.52 -0.95 -4.96 118.94 116.14 1llw s TRP 252 Ca 0.00 0.41 -0.22 0.00 0.02 0.00 0.00 56.10 56.31 1llw s TRP 252 Cb 0.00 -3.97 -0.09 0.00 -1.15 0.00 0.00 33.47 28.26 1llw s TRP 252 CO 0.00 -4.30 1.04 0.99 0.02 0.00 0.00 176.95 174.69 1llw s THR 253 N 7.84 3.80 0.57 2.01 2.01 -1.26 -4.45 115.64 126.16 1llw s THR 253 Ca 0.99 1.23 0.33 0.00 0.31 0.00 0.00 61.69 64.55 1llw s THR 253 Cb -0.34 -3.56 0.33 0.00 0.01 0.00 0.00 72.50 68.94 1llw s THR 253 CO 0.36 -0.14 2.01 0.50 -0.69 0.00 0.00 174.62 176.66 1llw h LYS 254 N 1.98 0.00 0.05 4.92 3.64 -1.93 0.27 116.57 125.50 1llw h LYS 254 Ca -0.49 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 58.60 1llw h LYS 254 Cb 1.22 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 1llw h LYS 254 CO 0.61 0.00 -1.54 0.00 -2.27 0.00 0.00 179.45 176.25 1llw h ALA 255 N 1.59 0.51 0.08 5.00 0.00 -1.98 -2.85 119.26 121.61 1llw h ALA 255 Ca 0.00 -1.24 -0.22 0.00 0.00 0.00 0.00 54.91 53.45 1llw h ALA 255 Cb 0.40 0.32 0.02 0.00 0.00 0.00 0.00 17.79 18.53 1llw h ALA 255 CO 0.00 1.36 -0.91 0.93 0.00 0.00 0.00 179.25 180.63 1llw h GLU 256 N 0.03 0.48 0.56 0.00 5.08 -1.12 -2.97 114.58 116.63 1llw h GLU 256 Ca -0.23 -0.62 -0.02 0.00 -1.00 0.00 0.00 59.36 57.49 1llw h GLU 256 Cb 1.97 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 31.40 1llw h GLU 256 CO 0.11 1.25 -0.49 -0.07 -1.00 0.00 0.00 179.01 178.81 1llw h LEU 257 N -0.01 -1.33 -1.38 1.33 3.38 -0.80 -1.38 115.31 115.12 1llw h LEU 257 Ca -0.14 0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1llw h LEU 257 Cb 1.63 0.43 -0.01 0.00 0.09 0.00 0.00 40.66 42.80 1llw h LEU 257 CO 0.18 -0.67 0.61 -0.08 0.09 0.00 0.00 178.44 178.57 1llw h GLU 258 N -1.03 0.00 -0.05 1.13 4.81 -1.59 -0.56 114.58 117.29 1llw h GLU 258 Ca -0.07 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.96 1llw h GLU 258 Cb 0.88 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.25 1llw h GLU 258 CO -0.02 0.00 -0.80 0.00 -0.73 0.00 0.00 179.01 177.46 1llw h ALA 259 N 0.94 0.54 0.00 2.92 0.00 -1.08 -2.73 119.26 119.85 1llw h ALA 259 Ca 0.08 -0.65 -0.37 0.00 0.00 0.00 0.00 54.91 53.98 1llw h ALA 259 Cb 1.31 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1llw h ALA 259 CO -0.00 0.80 1.81 1.28 0.00 0.00 0.00 179.25 183.14 1llw n LEU 260 N -3.79 5.71 0.50 0.00 4.77 -0.22 -4.65 117.00 119.32 1llw n LEU 260 Ca -0.05 -3.20 -0.19 0.00 -0.03 0.00 0.00 56.01 52.54 1llw n LEU 260 Cb 0.75 -1.24 -0.09 0.00 -2.33 0.00 0.00 43.42 40.51 1llw n LEU 260 CO 0.49 1.29 0.54 0.74 -1.33 0.00 0.00 177.39 179.12 1llw h THR 261 N 2.80 0.00 -3.08 -5.08 2.02 -1.68 -3.05 112.91 104.85 1llw h THR 261 Ca 0.46 0.00 -0.74 0.00 0.77 0.00 0.00 66.41 66.90 1llw h THR 261 Cb 0.62 0.00 -0.23 0.00 -1.74 0.00 0.00 68.15 66.81 1llw h THR 261 CO 1.06 0.00 -0.14 -2.16 0.37 0.00 0.00 175.52 174.65 1llw s PRO 262 N -5.78 3.01 0.00 6.66 0.04 -1.26 -4.90 135.00 132.77 1llw s PRO 262 Ca -0.19 -1.54 0.24 0.00 0.04 0.00 0.00 61.00 59.56 1llw s PRO 262 Cb 0.02 -4.26 1.29 0.00 0.04 0.00 0.00 34.50 31.59 1llw s PRO 262 CO 0.56 -1.34 1.85 0.44 0.04 0.00 0.00 177.00 178.55 1llw n ILE 263 N 5.33 0.03 -3.65 0.56 -5.35 -1.15 -4.82 119.36 110.31 1llw n ILE 263 Ca -0.12 -0.08 -0.12 0.00 -0.27 0.00 0.00 62.75 62.15 1llw n ILE 263 Cb 0.41 -0.16 -0.08 0.00 -1.74 0.00 0.00 39.64 38.08 1llw n ILE 263 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1llw s VAL 264 N -1.97 -0.00 -0.23 7.28 0.11 -1.26 -4.49 120.40 119.85 1llw s VAL 264 Ca 0.36 0.01 -0.13 0.00 -2.93 0.00 0.00 61.98 59.29 1llw s VAL 264 Cb 0.17 -0.91 0.07 0.00 -1.53 0.00 0.00 36.38 34.19 1llw s VAL 264 CO 0.28 0.00 0.55 0.21 -3.33 0.00 0.00 175.10 172.82 1llw s ASN 265 N 0.66 -0.73 0.18 3.54 3.84 -1.26 -4.88 114.94 116.29 1llw s ASN 265 Ca -0.03 1.21 0.18 0.00 0.21 0.00 0.00 52.86 54.44 1llw s ASN 265 Cb -0.05 1.10 0.83 0.00 -0.55 0.00 0.00 41.25 42.58 1llw s ASN 265 CO -0.04 -0.22 1.56 0.00 -2.79 0.00 0.00 177.10 175.62 1llw n GLN 266 N 4.32 0.12 0.24 0.43 10.64 -1.26 -2.52 117.38 129.35 1llw n GLN 266 Ca -0.21 0.44 0.13 0.00 -1.83 0.00 0.00 57.00 55.53 1llw n GLN 266 Cb 0.57 -1.77 0.46 0.00 -0.86 0.00 0.00 30.24 28.64 1llw n GLN 266 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1llw h ALA 267 N 2.23 0.98 -1.92 2.61 0.00 -2.05 -3.45 119.26 117.65 1llw h ALA 267 Ca 0.00 -0.08 -0.44 0.00 0.00 0.00 0.00 54.91 54.38 1llw h ALA 267 Cb 0.22 -0.01 0.05 0.00 0.00 0.00 0.00 17.79 18.05 1llw h ALA 267 CO 0.00 0.12 0.00 -0.80 0.00 0.00 0.00 179.25 178.57 1llw s ASN 268 N -6.00 5.24 0.48 0.00 0.01 -1.05 -5.08 114.94 108.55 1llw s ASN 268 Ca 0.03 0.08 -0.21 0.00 -0.71 0.00 0.00 52.86 52.04 1llw s ASN 268 Cb 0.08 -0.95 -0.08 0.00 0.41 0.00 0.00 41.25 40.72 1llw s ASN 268 CO 0.61 -1.18 1.08 -0.94 -1.51 0.00 0.00 177.10 175.16 1llw s SER 269 N -4.43 6.23 0.25 -1.22 1.04 -1.26 -4.80 113.70 109.51 1llw s SER 269 Ca 0.57 2.08 0.10 0.00 0.48 0.00 0.00 55.95 59.18 1llw s SER 269 Cb -0.10 -2.58 0.83 0.00 0.10 0.00 0.00 66.02 64.27 1llw s SER 269 CO 0.39 -0.87 1.14 -0.90 0.98 0.00 0.00 173.24 173.98 1llw n ASP 270 N -0.81 0.14 0.14 7.02 5.68 -1.26 -1.66 116.55 125.79 1llw n ASP 270 Ca 0.09 1.21 -0.05 0.00 -0.50 0.00 0.00 54.79 55.53 1llw n ASP 270 Cb 0.51 -0.54 -0.03 0.00 -1.14 0.00 0.00 41.12 39.93 1llw n ASP 270 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1llw h SER 271 N 0.00 -0.30 0.00 -1.12 0.02 -1.96 0.92 113.55 111.11 1llw h SER 271 Ca 0.55 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.51 1llw h SER 271 Cb 1.37 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.99 1llw h SER 271 CO -0.60 -0.19 0.00 0.00 -1.14 0.00 0.00 176.83 174.91 1llw n TYR 272 N -3.10 0.00 -0.17 3.45 9.36 -0.88 0.61 117.16 126.43 1llw n TYR 272 Ca -0.04 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.28 1llw n TYR 272 Cb 0.14 -0.45 0.19 0.00 -0.63 0.00 0.00 39.34 38.59 1llw n TYR 272 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1llw n ASN 273 N -2.75 0.01 -0.05 2.98 3.02 -0.66 -0.77 115.26 117.03 1llw n ASN 273 Ca 0.00 0.86 -0.15 0.00 -0.03 0.00 0.00 54.58 55.25 1llw n ASN 273 Cb 0.00 -0.34 -0.06 0.00 -0.61 0.00 0.00 39.78 38.76 1llw n ASN 273 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1llw h LEU 274 N 0.00 0.79 0.00 3.41 6.46 0.65 -1.90 115.31 124.71 1llw h LEU 274 Ca 0.34 -0.58 0.00 0.00 -0.12 0.00 0.00 57.88 57.52 1llw h LEU 274 Cb 0.77 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.48 1llw h LEU 274 CO -0.45 1.22 0.00 -0.67 -0.62 0.00 0.00 178.44 177.92 1llw n ASP 275 N -4.14 0.00 -0.10 1.25 4.64 0.05 -0.27 116.55 117.98 1llw n ASP 275 Ca -0.06 0.95 -0.02 0.00 -1.38 0.00 0.00 54.79 54.28 1llw n ASP 275 Cb 0.60 -0.45 -0.02 0.00 -1.04 0.00 0.00 41.12 40.22 1llw n ASP 275 CO 0.00 0.00 0.00 -0.24 -0.82 0.00 0.00 177.20 176.14 1llw n SER 276 N -1.85 -0.23 -0.07 1.67 2.88 -0.71 0.82 113.62 116.13 1llw n SER 276 Ca 0.00 0.43 -0.12 0.00 -1.33 0.00 0.00 58.87 57.86 1llw n SER 276 Cb 0.00 -0.07 -0.05 0.00 -0.75 0.00 0.00 64.21 63.34 1llw n SER 276 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1llw h ALA 277 N 0.18 0.28 -0.09 -1.46 0.00 -0.77 -0.87 119.26 116.53 1llw h ALA 277 Ca 0.05 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1llw h ALA 277 Cb 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1llw h ALA 277 CO -0.23 0.01 -0.27 1.25 0.00 0.00 0.00 179.25 180.01 1llw h LEU 278 N 0.12 0.16 -0.54 0.00 5.85 0.27 -2.09 115.31 119.08 1llw h LEU 278 Ca 0.06 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.79 1llw h LEU 278 Cb 0.42 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 1llw h LEU 278 CO 0.01 0.44 0.25 -0.33 -0.34 0.00 0.00 178.44 178.47 1llw h GLU 279 N 0.15 0.46 -0.63 1.25 4.39 0.18 -1.68 114.58 118.71 1llw h GLU 279 Ca 0.02 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 1llw h GLU 279 Cb 0.57 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 1llw h GLU 279 CO 0.04 0.31 0.15 1.25 -1.16 0.00 0.00 179.01 179.59 1llw h LEU 280 N 0.48 0.93 -1.50 1.33 5.85 -0.65 0.17 115.31 121.92 1llw h LEU 280 Ca 0.25 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1llw h LEU 280 Cb 0.20 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1llw h LEU 280 CO -0.20 0.90 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.62 1llw h LEU 281 N 0.94 0.17 0.00 2.25 3.38 -1.19 -2.85 115.31 118.01 1llw h LEU 281 Ca 0.20 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1llw h LEU 281 Cb 0.34 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1llw h LEU 281 CO 0.00 0.31 -0.12 0.58 0.09 0.00 0.00 178.44 179.30 1llw h VAL 282 N 0.18 0.00 0.00 1.22 2.07 0.20 -2.79 116.25 117.13 1llw h VAL 282 Ca 0.04 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1llw h VAL 282 Cb 0.32 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1llw h VAL 282 CO 0.02 0.00 0.97 0.03 0.02 0.00 0.00 177.57 178.61 1llw h ARG 283 N -0.53 0.00 -0.66 1.57 2.47 -1.30 0.58 114.38 116.51 1llw h ARG 283 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1llw h ARG 283 Cb 0.12 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.44 1llw h ARG 283 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 179.97 180.78 1llw n THR 284 N -2.48 1.91 0.00 2.04 -2.24 -1.08 -4.95 114.28 107.48 1llw n THR 284 Ca -0.00 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 1llw n THR 284 Cb 0.97 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.28 1llw n THR 284 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1llw n GLY 285 N 1.12 1.45 3.68 3.38 0.00 0.20 -4.99 105.19 110.03 1llw n GLY 285 Ca 0.26 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.03 1llw n GLY 285 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1llw s ARG 286 N -0.07 2.44 0.34 1.61 0.52 -1.05 -5.06 118.95 117.67 1llw s ARG 286 Ca 0.00 -1.17 -0.20 0.00 -0.52 0.00 0.00 55.73 53.85 1llw s ARG 286 Cb 0.00 -2.34 -0.10 0.00 0.52 0.00 0.00 34.95 33.04 1llw s ARG 286 CO 0.00 0.43 0.84 -1.54 0.02 0.00 0.00 175.30 175.05 1llw s SER 287 N -3.19 6.98 0.53 0.23 1.04 -1.26 -4.25 113.70 113.78 1llw s SER 287 Ca 0.29 1.54 0.27 0.00 0.48 0.00 0.00 55.95 58.53 1llw s SER 287 Cb -0.09 -2.47 1.41 0.00 0.10 0.00 0.00 66.02 64.97 1llw s SER 287 CO 0.20 -0.19 1.95 1.55 0.98 0.00 0.00 173.24 177.73 1llw h PRO 288 N 2.51 0.03 -0.03 4.02 0.13 -1.94 0.51 132.00 137.23 1llw h PRO 288 Ca -0.48 -0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1llw h PRO 288 Cb 1.18 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1llw h PRO 288 CO 0.64 0.02 -0.09 -0.07 -0.23 0.00 0.00 178.00 178.26 1llw h LEU 289 N 0.03 -0.27 -0.51 1.56 3.38 -1.97 -0.47 115.31 117.06 1llw h LEU 289 Ca 0.33 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.31 1llw h LEU 289 Cb 1.26 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 1llw h LEU 289 CO -0.01 -0.13 0.20 -0.08 0.09 0.00 0.00 178.44 178.50 1llw h GLU 290 N -0.14 0.76 -0.84 1.13 4.81 -0.38 -2.83 114.58 117.08 1llw h GLU 290 Ca 0.05 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1llw h GLU 290 Cb 0.21 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 1llw h GLU 290 CO -0.12 0.68 0.44 0.00 -0.73 0.00 0.00 179.01 179.28 1llw h ALA 291 N 1.05 1.19 -0.48 2.92 0.00 -1.08 0.15 119.26 123.01 1llw h ALA 291 Ca 0.17 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1llw h ALA 291 Cb 0.20 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1llw h ALA 291 CO -0.01 0.64 0.23 0.00 0.00 0.00 0.00 179.25 180.10 1llw h ALA 292 N 1.30 0.60 -0.14 0.00 0.00 -1.03 -1.98 119.26 118.01 1llw h ALA 292 Ca 0.29 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.26 1llw h ALA 292 Cb 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1llw h ALA 292 CO -0.04 -0.13 -0.01 0.52 0.00 0.00 0.00 179.25 179.58 1llw h MET 293 N 0.45 0.03 -0.57 0.00 2.07 -0.48 1.57 114.93 117.99 1llw h MET 293 Ca 0.21 -0.00 0.09 0.00 -2.07 0.00 0.00 59.70 57.93 1llw h MET 293 Cb 0.15 -0.01 -0.07 0.00 -1.87 0.00 0.00 31.60 29.80 1llw h MET 293 CO -0.17 0.02 0.18 0.82 1.07 0.00 0.00 176.91 178.83 1llw h ILE 294 N 0.03 0.75 0.00 -1.22 5.03 -1.17 -2.89 117.51 118.04 1llw h ILE 294 Ca 0.06 -0.12 -0.05 0.00 -0.12 0.00 0.00 64.86 64.64 1llw h ILE 294 Cb 0.09 0.38 -0.01 0.00 -3.03 0.00 0.00 36.82 34.25 1llw h ILE 294 CO -0.12 0.06 -0.86 -0.07 -0.68 0.00 0.00 178.15 176.48 1llw h LEU 295 N 0.34 0.00 -5.38 1.44 3.38 -0.49 -3.40 115.31 111.20 1llw h LEU 295 Ca 0.29 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.86 1llw h LEU 295 Cb 0.37 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 40.74 1llw h LEU 295 CO -0.32 0.18 -1.12 0.52 0.09 0.00 0.00 178.44 177.79 1llw n VAL 296 N -2.86 0.46 -1.72 1.22 0.31 0.53 -1.85 118.33 114.43 1llw n VAL 296 Ca -0.01 -3.48 -0.40 0.00 -0.01 0.00 0.00 64.34 60.43 1llw n VAL 296 Cb 0.63 0.37 0.02 0.00 -0.91 0.00 0.00 33.84 33.95 1llw n VAL 296 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1llw n PRO 297 N 0.05 1.85 -0.55 5.55 -0.04 -1.09 -4.47 135.00 136.30 1llw n PRO 297 Ca 0.14 0.66 -0.28 0.00 -0.04 0.00 0.00 63.50 63.98 1llw n PRO 297 Cb 0.76 -2.46 0.25 0.00 -0.04 0.00 0.00 33.50 32.01 1llw n PRO 297 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1llw s GLU 298 N -2.46 -0.83 -0.74 0.54 2.02 -1.26 -4.27 118.70 111.70 1llw s GLU 298 Ca 0.65 0.90 -0.25 0.00 0.02 0.00 0.00 54.97 56.28 1llw s GLU 298 Cb -0.47 -1.56 0.05 0.00 0.10 0.00 0.00 34.13 32.25 1llw s GLU 298 CO 0.55 -3.68 1.19 0.00 0.02 0.00 0.00 175.26 173.34 1llw s ALA 299 N -2.47 2.87 0.06 5.21 0.00 -1.26 -4.88 121.76 121.30 1llw s ALA 299 Ca 0.68 -1.61 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 1llw s ALA 299 Cb -0.25 -4.15 -0.23 0.00 0.00 0.00 0.00 23.12 18.49 1llw s ALA 299 CO 0.64 -3.15 1.18 0.10 0.00 0.00 0.00 175.76 174.53 1llw h TYR 300 N 9.84 0.95 -2.97 0.00 -0.00 -1.95 -3.45 116.97 119.39 1llw h TYR 300 Ca -0.24 -0.51 -0.58 0.00 0.00 0.00 0.00 58.73 57.41 1llw h TYR 300 Cb 1.05 -0.11 0.10 0.00 0.00 0.00 0.00 36.73 37.77 1llw h TYR 300 CO 1.09 1.34 0.51 1.63 -0.00 0.00 0.00 178.16 182.73 1llw n LYS 301 N -3.95 2.00 -3.18 0.10 5.02 -1.26 -2.37 118.16 114.52 1llw n LYS 301 Ca -0.11 0.71 -0.14 0.00 -2.02 0.00 0.00 58.31 56.75 1llw n LYS 301 Cb 0.82 -2.29 0.07 0.00 -0.02 0.00 0.00 35.03 33.61 1llw n LYS 301 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1llw n ASN 302 N 1.36 -3.22 -3.78 4.39 3.02 -1.26 -4.90 115.26 110.87 1llw n ASN 302 Ca 0.08 -0.56 -0.28 0.00 -0.03 0.00 0.00 54.58 53.78 1llw n ASN 302 Cb 0.34 -4.56 -0.12 0.00 -0.61 0.00 0.00 39.78 34.83 1llw n ASN 302 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1llw s GLN 303 N -4.90 1.86 0.19 3.52 2.00 -1.00 -4.94 119.66 116.40 1llw s GLN 303 Ca 0.12 -2.73 0.06 0.00 -2.00 0.00 0.00 55.36 50.81 1llw s GLN 303 Cb -0.02 -2.82 0.59 0.00 0.80 0.00 0.00 33.01 31.56 1llw s GLN 303 CO 0.64 -1.25 0.90 -2.30 -0.50 0.00 0.00 175.29 172.78 1llw n PRO 304 N 2.64 -0.04 0.20 1.67 -0.02 -1.26 0.26 135.00 138.45 1llw n PRO 304 Ca 0.17 0.83 0.13 0.00 -2.02 0.00 0.00 63.50 62.61 1llw n PRO 304 Cb 0.37 -1.39 0.71 0.00 -0.02 0.00 0.00 33.50 33.16 1llw n PRO 304 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1llw h ALA 305 N 1.15 1.02 -0.61 3.55 0.00 -1.97 -1.47 119.26 120.93 1llw h ALA 305 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1llw h ALA 305 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1llw h ALA 305 CO -0.50 -0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.01 1llw n LEU 306 N -2.42 5.07 -0.33 0.00 4.77 0.72 -4.57 117.00 120.24 1llw n LEU 306 Ca -0.02 -2.63 0.05 0.00 -0.03 0.00 0.00 56.01 53.38 1llw n LEU 306 Cb 0.07 -0.61 0.23 0.00 -2.33 0.00 0.00 43.42 40.78 1llw n LEU 306 CO 0.11 0.75 1.25 0.11 -1.33 0.00 0.00 177.39 178.28 1llw h LYS 307 N 3.97 1.02 -0.57 3.23 1.57 -1.40 -2.43 116.57 121.96 1llw h LYS 307 Ca 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1llw h LYS 307 Cb 1.63 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1llw h LYS 307 CO 0.32 0.67 0.00 -0.25 -0.57 0.00 0.00 179.45 179.62 1llw n ASP 308 N -4.51 4.82 -1.08 0.86 8.00 -1.26 -4.62 116.55 118.76 1llw n ASP 308 Ca 0.15 -2.61 0.05 0.00 0.71 0.00 0.00 54.79 53.09 1llw n ASP 308 Cb 0.23 -0.58 0.09 0.00 -0.02 0.00 0.00 41.12 40.84 1llw n ASP 308 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1llw n TYR 309 N 0.79 0.00 0.22 1.24 4.02 -0.91 -4.90 117.16 117.62 1llw n TYR 309 Ca 0.25 -0.86 0.04 0.00 -0.01 0.00 0.00 57.90 57.33 1llw n TYR 309 Cb 0.94 -0.18 0.20 0.00 -0.02 0.00 0.00 39.34 40.28 1llw n TYR 309 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1llw n PRO 310 N -0.18 0.03 0.20 -0.72 -0.04 -1.25 -0.04 135.00 133.00 1llw n PRO 310 Ca 0.11 0.42 -0.15 0.00 -0.04 0.00 0.00 63.50 63.84 1llw n PRO 310 Cb 0.94 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 32.76 1llw n PRO 310 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1llw h GLU 311 N 0.00 -0.55 -0.78 0.54 5.08 -1.93 -2.72 114.58 114.21 1llw h GLU 311 Ca 0.00 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1llw h GLU 311 Cb 0.11 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1llw h GLU 311 CO 0.00 -0.37 0.51 0.97 -1.00 0.00 0.00 179.01 179.13 1llw h ILE 312 N -0.57 1.14 0.00 3.13 -0.00 -0.77 0.24 117.51 120.68 1llw h ILE 312 Ca -0.02 -0.34 -0.01 0.00 -0.00 0.00 0.00 64.86 64.49 1llw h ILE 312 Cb 0.50 0.07 -0.00 0.00 -0.00 0.00 0.00 36.82 37.40 1llw h ILE 312 CO -0.01 0.18 -0.05 0.28 -0.00 0.00 0.00 178.15 178.55 1llw h SER 313 N 0.98 0.00 0.41 2.19 0.02 -1.58 -2.59 113.55 112.98 1llw h SER 313 Ca 0.31 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.95 1llw h SER 313 Cb 0.01 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 1llw h SER 313 CO -0.08 0.05 -1.77 0.44 -1.14 0.00 0.00 176.83 174.32 1llw h ASP 314 N 0.00 0.11 0.08 3.07 3.32 -0.23 -2.74 116.42 120.04 1llw h ASP 314 Ca -0.00 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 56.76 1llw h ASP 314 Cb 0.20 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1llw h ASP 314 CO 0.01 1.22 -0.14 -0.26 -1.72 0.00 0.00 179.24 178.35 1llw h PHE 315 N 0.02 0.13 0.02 4.55 -1.00 -0.96 0.13 116.94 119.83 1llw h PHE 315 Ca -0.31 -0.01 -0.21 0.00 2.81 0.00 0.00 57.97 60.24 1llw h PHE 315 Cb 2.02 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 41.53 1llw h PHE 315 CO 0.02 0.27 -0.94 0.45 -1.61 0.00 0.00 178.31 176.50 1llw h HIS 316 N 0.12 0.36 -0.66 -0.55 3.86 -1.59 0.48 115.15 117.18 1llw h HIS 316 Ca 0.03 -0.21 -0.04 0.00 -1.16 0.00 0.00 60.37 58.99 1llw h HIS 316 Cb 0.33 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 28.73 1llw h HIS 316 CO 0.00 1.05 0.26 0.22 0.86 0.00 0.00 177.93 180.32 1llw h ASP 317 N 0.12 0.92 0.40 2.45 1.82 -1.10 1.23 116.42 122.25 1llw h ASP 317 Ca -0.06 -0.17 -0.02 0.00 -0.39 0.00 0.00 57.03 56.39 1llw h ASP 317 Cb 1.59 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 41.37 1llw h ASP 317 CO 0.15 0.84 -0.19 0.22 -1.61 0.00 0.00 179.24 178.65 1llw h TYR 318 N 0.94 -0.49 0.00 0.28 3.20 -0.75 -3.34 116.97 116.81 1llw h TYR 318 Ca 0.22 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 1llw h TYR 318 Cb 0.21 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 1llw h TYR 318 CO 0.01 -0.31 -0.12 1.88 -1.64 0.00 0.00 178.16 177.99 1llw h TYR 319 N -0.71 0.00 -0.67 -3.82 -1.99 0.38 0.55 116.97 110.71 1llw h TYR 319 Ca -0.05 0.00 0.16 0.00 2.00 0.00 0.00 58.73 60.84 1llw h TYR 319 Cb 0.41 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.10 1llw h TYR 319 CO 0.07 0.12 0.46 1.03 -0.00 0.00 0.00 178.16 179.84 1llw h SER 320 N 0.00 0.16 0.72 3.88 0.87 0.14 0.43 113.55 119.76 1llw h SER 320 Ca -0.00 0.01 -0.26 0.00 -1.23 0.00 0.00 61.79 60.31 1llw h SER 320 Cb 0.27 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 1llw h SER 320 CO 0.02 0.08 -1.33 1.23 -0.53 0.00 0.00 176.83 176.29 1llw h GLY 321 N 0.17 0.06 0.00 5.77 0.00 -1.00 -3.39 103.07 104.68 1llw h GLY 321 Ca 0.32 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.47 1llw h GLY 321 CO -0.05 0.15 -0.19 1.41 0.00 0.00 0.00 176.54 177.86 1llw h LEU 322 N 0.02 0.00 -7.85 3.11 4.07 -1.08 -3.47 115.31 110.11 1llw h LEU 322 Ca -0.15 -0.21 -0.63 0.00 0.08 0.00 0.00 57.88 56.98 1llw h LEU 322 Cb 1.90 0.00 -0.37 0.00 1.08 0.00 0.00 40.66 43.27 1llw h LEU 322 CO 0.12 0.70 -0.82 -1.58 -1.08 0.00 0.00 178.44 175.79 1llw s GLN 323 N -1.86 2.21 0.41 1.13 2.00 0.14 -4.98 119.66 118.70 1llw s GLN 323 Ca -0.08 -0.85 -0.23 0.00 -2.00 0.00 0.00 55.36 52.20 1llw s GLN 323 Cb 0.00 -2.44 -0.10 0.00 0.80 0.00 0.00 33.01 31.28 1llw s GLN 323 CO 0.20 -0.39 1.00 -1.83 -0.50 0.00 0.00 175.29 173.77 1llw s GLU 324 N 1.37 4.22 0.57 1.67 4.04 -1.26 -4.52 118.70 124.78 1llw s GLU 324 Ca -0.00 1.33 -0.20 0.00 0.04 0.00 0.00 54.97 56.14 1llw s GLU 324 Cb -0.16 -2.42 -0.04 0.00 0.02 0.00 0.00 34.13 31.53 1llw s GLU 324 CO -0.09 -0.06 1.24 -2.14 -1.84 0.00 0.00 175.26 172.37 1llw s PRO 325 N -2.72 3.07 -0.93 -4.83 0.02 -1.26 -4.93 135.00 123.42 1llw s PRO 325 Ca 0.59 1.93 -0.22 0.00 0.02 0.00 0.00 61.00 63.31 1llw s PRO 325 Cb -0.17 -2.05 0.07 0.00 0.02 0.00 0.00 34.50 32.37 1llw s PRO 325 CO 0.21 -1.15 1.30 -1.58 -0.33 0.00 0.00 177.00 175.45 1llw s TRP 326 N -1.50 2.65 0.30 6.54 0.52 -0.77 -4.71 118.94 121.97 1llw s TRP 326 Ca 0.75 -0.84 -0.03 0.00 0.02 0.00 0.00 56.10 56.00 1llw s TRP 326 Cb -0.33 -4.55 0.07 0.00 -1.15 0.00 0.00 33.47 27.50 1llw s TRP 326 CO 0.37 -1.82 0.41 -3.47 0.02 0.00 0.00 176.95 172.46 1llw n ASP 327 N 8.28 0.29 0.00 2.95 2.03 -1.26 -4.86 116.55 123.97 1llw n ASP 327 Ca 0.23 -1.30 0.00 0.00 0.52 0.00 0.00 54.79 54.24 1llw n ASP 327 Cb 0.50 -0.29 0.00 0.00 -0.72 0.00 0.00 41.12 40.60 1llw n ASP 327 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1llw n GLY 328 N 2.07 -0.08 3.75 0.27 0.00 -1.25 -0.36 105.19 109.59 1llw n GLY 328 Ca 0.06 -1.78 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 1llw n GLY 328 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1llw s PRO 329 N -2.03 1.80 0.00 1.61 0.02 -1.19 -4.79 135.00 130.43 1llw s PRO 329 Ca 0.00 0.98 0.00 0.00 0.02 0.00 0.00 61.00 62.00 1llw s PRO 329 Cb 0.00 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1llw s PRO 329 CO 0.00 -1.91 0.00 0.00 -0.33 0.00 0.00 177.00 174.76 1llw n ALA 330 N -3.68 0.00 -2.86 -1.55 0.00 -1.25 -0.98 120.51 110.19 1llw n ALA 330 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.15 1llw n ALA 330 Cb 0.54 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.87 1llw n ALA 330 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1llw s LEU 331 N 0.00 3.79 -0.14 0.00 2.96 -0.30 0.12 118.68 125.10 1llw s LEU 331 Ca 0.00 -0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 53.67 1llw s LEU 331 Cb 0.00 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 1llw s LEU 331 CO 0.00 -0.08 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.15 1llw s LEU 332 N 1.66 3.22 -0.03 -0.68 1.43 0.03 -1.82 118.68 122.49 1llw s LEU 332 Ca 0.06 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.07 1llw s LEU 332 Cb -0.16 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.31 1llw s LEU 332 CO 0.07 0.21 -0.06 -0.69 0.23 0.00 0.00 176.35 176.10 1llw s VAL 333 N 0.12 0.59 -0.13 -1.59 1.01 -0.36 -2.04 120.40 117.99 1llw s VAL 333 Ca -0.01 -0.22 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 1llw s VAL 333 Cb -0.14 -0.56 0.05 0.00 0.00 0.00 0.00 36.38 35.73 1llw s VAL 333 CO 0.03 0.21 0.48 0.72 0.00 0.00 0.00 175.10 176.53 1llw s PHE 334 N 0.43 -0.48 0.03 5.22 -0.12 0.04 -0.04 117.98 123.07 1llw s PHE 334 Ca -0.06 1.06 0.01 0.00 -0.05 0.00 0.00 56.93 57.90 1llw s PHE 334 Cb -0.10 0.20 -0.02 0.00 -0.63 0.00 0.00 43.02 42.47 1llw s PHE 334 CO 0.00 -0.34 -0.06 0.45 -0.05 0.00 0.00 175.22 175.23 1llw s SER 335 N -0.29 0.62 -0.03 1.98 0.15 0.12 -1.89 113.70 114.37 1llw s SER 335 Ca -0.04 -0.49 0.21 0.00 0.70 0.00 0.00 55.95 56.32 1llw s SER 335 Cb -0.03 0.05 -0.26 0.00 -1.71 0.00 0.00 66.02 64.06 1llw s SER 335 CO 0.03 -0.21 0.50 -0.67 1.20 0.00 0.00 173.24 174.09 1llw n ASP 336 N 1.65 0.18 0.00 5.45 2.03 -0.97 -4.64 116.55 120.25 1llw n ASP 336 Ca -0.22 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.16 1llw n ASP 336 Cb 0.55 1.45 0.00 0.00 -0.72 0.00 0.00 41.12 42.40 1llw n ASP 336 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1llw n GLY 337 N 1.36 2.48 0.12 0.27 0.00 -1.26 -4.75 105.19 103.41 1llw n GLY 337 Ca -0.10 -0.34 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 1llw n GLY 337 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1llw h LYS 338 N 0.00 0.31 -5.72 1.61 1.57 -1.94 -3.47 116.57 108.92 1llw h LYS 338 Ca 0.00 -0.53 -0.54 0.00 -1.87 0.00 0.00 60.65 57.71 1llw h LYS 338 Cb 0.00 0.20 -0.28 0.00 0.08 0.00 0.00 32.23 32.23 1llw h LYS 338 CO 0.00 1.26 -0.83 0.42 -0.57 0.00 0.00 179.45 179.73 1llw s ILE 339 N -2.48 1.41 -0.06 1.86 1.01 -1.26 -2.65 121.20 119.03 1llw s ILE 339 Ca -0.16 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.61 1llw s ILE 339 Cb 0.03 -1.21 0.02 0.00 0.01 0.00 0.00 42.46 41.31 1llw s ILE 339 CO 0.82 0.29 -0.10 0.54 0.00 0.00 0.00 174.94 176.48 1llw s VAL 340 N -0.58 0.98 0.11 2.92 0.11 -0.86 -2.29 120.40 120.80 1llw s VAL 340 Ca 0.06 -0.38 -0.06 0.00 -2.93 0.00 0.00 61.98 58.67 1llw s VAL 340 Cb -0.07 -0.92 0.02 0.00 -1.53 0.00 0.00 36.38 33.88 1llw s VAL 340 CO 0.00 0.32 0.32 0.61 -3.33 0.00 0.00 175.10 173.02 1llw n GLY 341 N 3.95 1.40 3.49 6.54 0.00 -0.79 -1.97 105.19 117.81 1llw n GLY 341 Ca -0.23 -1.06 -0.17 0.00 0.00 0.00 0.00 46.02 44.56 1llw n GLY 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 342 N -1.38 -1.67 0.12 4.61 0.00 -0.99 -0.78 121.76 121.68 1llw s ALA 342 Ca 0.07 1.22 -0.25 0.00 0.00 0.00 0.00 51.96 53.00 1llw s ALA 342 Cb -0.01 -0.01 0.08 0.00 0.00 0.00 0.00 23.12 23.18 1llw s ALA 342 CO 0.03 -0.36 1.07 0.20 0.00 0.00 0.00 175.76 176.70 1llw s GLY 343 N -1.18 -0.16 0.25 0.00 0.00 -0.87 -0.63 107.32 104.73 1llw s GLY 343 Ca -0.11 0.10 0.08 0.00 0.00 0.00 0.00 44.72 44.79 1llw s GLY 343 CO 0.09 1.04 0.08 1.08 0.00 0.00 0.00 173.10 175.39 1llw s LEU 344 N -3.13 3.48 0.99 0.66 1.43 -1.15 -0.79 118.68 120.16 1llw s LEU 344 Ca 0.16 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 52.68 1llw s LEU 344 Cb -0.00 -2.01 0.07 0.00 0.03 0.00 0.00 46.19 44.27 1llw s LEU 344 CO 0.02 -0.01 0.42 -0.90 0.23 0.00 0.00 176.35 176.11 1llw n ASP 345 N -0.95 -1.91 0.13 2.29 5.75 0.12 -4.06 116.55 117.91 1llw n ASP 345 Ca -0.07 0.23 0.06 0.00 -0.01 0.00 0.00 54.79 55.00 1llw n ASP 345 Cb 0.58 -1.19 0.30 0.00 -1.03 0.00 0.00 41.12 39.79 1llw n ASP 345 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1llw n ARG 346 N -2.13 0.08 -0.00 0.11 1.85 -1.26 -2.46 116.66 112.85 1llw n ARG 346 Ca 0.06 0.52 0.05 0.00 -1.00 0.00 0.00 57.85 57.48 1llw n ARG 346 Cb 0.55 -1.99 -0.07 0.00 -1.05 0.00 0.00 32.46 29.90 1llw n ARG 346 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1llw n ASN 347 N -1.91 1.22 -1.55 2.89 3.02 -1.26 -4.36 115.26 113.31 1llw n ASN 347 Ca -0.01 -0.48 -0.06 0.00 -0.03 0.00 0.00 54.58 54.01 1llw n ASN 347 Cb 0.26 1.18 0.02 0.00 -0.61 0.00 0.00 39.78 40.64 1llw n ASN 347 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1llw n GLY 348 N 1.48 0.35 0.03 7.41 0.00 -1.03 -4.73 105.19 108.69 1llw n GLY 348 Ca 0.01 -0.36 0.14 0.00 0.00 0.00 0.00 46.02 45.81 1llw n GLY 348 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llw n LEU 349 N -1.83 0.16 -4.29 0.99 4.77 -1.26 -4.74 117.00 110.79 1llw n LEU 349 Ca -0.05 0.25 -0.26 0.00 -0.03 0.00 0.00 56.01 55.92 1llw n LEU 349 Cb 0.53 -0.31 -0.13 0.00 -2.33 0.00 0.00 43.42 41.18 1llw n LEU 349 CO 0.17 0.03 -0.53 -0.13 -1.33 0.00 0.00 177.39 175.60 1llw s ARG 350 N -2.69 1.33 0.40 3.23 1.81 -1.26 -4.82 118.95 116.95 1llw s ARG 350 Ca 0.23 -1.10 -0.25 0.00 -1.72 0.00 0.00 55.73 52.89 1llw s ARG 350 Cb 0.20 -1.57 -0.08 0.00 -0.45 0.00 0.00 34.95 33.04 1llw s ARG 350 CO 0.50 0.38 1.19 -1.25 -0.68 0.00 0.00 175.30 175.44 1llw s PRO 351 N -1.58 4.02 -0.27 3.54 0.04 -1.26 -4.89 135.00 134.60 1llw s PRO 351 Ca 0.08 1.88 -0.00 0.00 0.04 0.00 0.00 61.00 63.00 1llw s PRO 351 Cb -0.10 -2.67 0.14 0.00 0.04 0.00 0.00 34.50 31.92 1llw s PRO 351 CO 0.03 -0.36 0.38 0.00 0.04 0.00 0.00 177.00 177.09 1llw s ALA 352 N -1.40 -1.04 -0.25 8.56 0.00 -1.26 -4.30 121.76 122.07 1llw s ALA 352 Ca 0.57 0.45 -0.09 0.00 0.00 0.00 0.00 51.96 52.90 1llw s ALA 352 Cb -0.31 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 1llw s ALA 352 CO 0.40 -1.52 0.12 1.03 0.00 0.00 0.00 175.76 175.78 1llw s ARG 353 N 2.52 3.84 0.37 0.00 1.81 -0.62 -0.83 118.95 126.04 1llw s ARG 353 Ca 0.11 -0.38 0.08 0.00 -1.72 0.00 0.00 55.73 53.82 1llw s ARG 353 Cb -0.14 -3.44 -0.05 0.00 -0.45 0.00 0.00 34.95 30.87 1llw s ARG 353 CO -0.24 -0.09 0.11 1.52 -0.68 0.00 0.00 175.30 175.92 1llw s TYR 354 N 1.41 2.61 -0.12 -0.53 -0.85 -0.93 -2.30 117.35 116.63 1llw s TYR 354 Ca 0.06 -0.49 -0.09 0.00 -0.52 0.00 0.00 57.07 56.03 1llw s TYR 354 Cb -0.15 -1.72 0.04 0.00 0.38 0.00 0.00 41.96 40.51 1llw s TYR 354 CO 0.06 0.33 0.31 0.00 -1.52 0.00 0.00 175.55 174.73 1llw s ILE 356 N 0.58 0.48 0.40 0.00 1.01 -0.57 -0.94 121.20 122.16 1llw s ILE 356 Ca -0.03 -0.25 0.08 0.00 0.00 0.00 0.00 60.65 60.44 1llw s ILE 356 Cb -0.05 -0.41 -0.03 0.00 0.01 0.00 0.00 42.46 41.99 1llw s ILE 356 CO -0.03 0.14 0.33 0.42 0.00 0.00 0.00 174.94 175.79 1llw s THR 357 N -0.10 2.72 0.57 2.92 -4.23 -0.55 -0.22 115.64 116.75 1llw s THR 357 Ca 0.02 -1.41 0.28 0.00 -1.18 0.00 0.00 61.69 59.40 1llw s THR 357 Cb -0.03 -3.02 0.40 0.00 1.34 0.00 0.00 72.50 71.19 1llw s THR 357 CO -0.00 -0.03 1.94 0.11 -0.54 0.00 0.00 174.62 176.10 1llw h LYS 358 N 1.13 0.00 -0.71 3.99 1.57 -1.71 0.13 116.57 120.97 1llw h LYS 358 Ca -0.42 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.10 1llw h LYS 358 Cb 1.26 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.42 1llw h LYS 358 CO 0.59 0.00 0.29 -0.25 -0.57 0.00 0.00 179.45 179.51 1llw n ASP 359 N -3.95 4.24 -3.83 0.86 8.00 -1.26 -4.91 116.55 115.70 1llw n ASP 359 Ca 0.09 -3.36 -0.30 0.00 0.71 0.00 0.00 54.79 51.94 1llw n ASP 359 Cb 0.66 -0.74 0.02 0.00 -0.02 0.00 0.00 41.12 41.05 1llw n ASP 359 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1llw n ASP 360 N -0.52 -4.70 -4.63 -2.24 9.92 0.46 -4.23 116.55 110.59 1llw n ASP 360 Ca 0.43 -0.72 -0.42 0.00 -0.53 0.00 0.00 54.79 53.54 1llw n ASP 360 Cb 1.37 -3.77 -0.04 0.00 -0.64 0.00 0.00 41.12 38.04 1llw n ASP 360 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1llw s TYR 361 N -3.25 3.27 0.17 1.24 6.04 -1.26 -4.13 117.35 119.43 1llw s TYR 361 Ca 0.63 1.05 0.07 0.00 0.04 0.00 0.00 57.07 58.86 1llw s TYR 361 Cb -0.32 -3.16 -0.04 0.00 -1.04 0.00 0.00 41.96 37.41 1llw s TYR 361 CO 0.77 -0.48 0.03 -1.50 -1.54 0.00 0.00 175.55 172.84 1llw s ILE 362 N 2.95 3.91 -0.29 3.14 2.07 -1.08 -1.48 121.20 130.41 1llw s ILE 362 Ca 0.35 -1.34 -0.01 0.00 -1.41 0.00 0.00 60.65 58.24 1llw s ILE 362 Cb -0.15 -2.98 0.13 0.00 0.13 0.00 0.00 42.46 39.60 1llw s ILE 362 CO 0.09 -0.11 0.28 -0.69 -1.91 0.00 0.00 174.94 172.60 1llw s VAL 363 N -1.74 -0.37 0.26 4.00 1.01 -0.12 -2.63 120.40 120.81 1llw s VAL 363 Ca 0.28 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.78 1llw s VAL 363 Cb -0.09 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 1llw s VAL 363 CO 0.20 -0.50 0.36 -0.22 0.00 0.00 0.00 175.10 174.94 1llw s LEU 364 N 2.30 4.21 0.00 3.92 2.96 -0.23 -1.30 118.68 130.54 1llw s LEU 364 Ca 0.10 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 54.00 1llw s LEU 364 Cb -0.14 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.76 1llw s LEU 364 CO -0.32 -0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.19 1llw n GLY 365 N -1.43 3.01 0.51 7.98 0.00 -0.97 -1.26 105.19 113.03 1llw n GLY 365 Ca -0.07 -0.62 0.33 0.00 0.00 0.00 0.00 46.02 45.65 1llw n GLY 365 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1llw h SER 366 N 0.00 0.00 -4.00 1.61 0.02 -1.10 -1.65 113.55 108.43 1llw h SER 366 Ca 0.00 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.62 1llw h SER 366 Cb 0.00 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 62.26 1llw h SER 366 CO 0.00 0.00 -0.76 -1.61 -1.14 0.00 0.00 176.83 173.32 1llw s GLU 367 N -4.87 0.47 0.04 3.45 2.02 -1.26 -4.42 118.70 114.13 1llw s GLU 367 Ca -0.05 -0.26 -0.27 0.00 0.02 0.00 0.00 54.97 54.41 1llw s GLU 367 Cb 0.21 -0.43 -0.15 0.00 0.10 0.00 0.00 34.13 33.86 1llw s GLU 367 CO 0.75 0.12 1.41 0.00 0.02 0.00 0.00 175.26 177.55 1llw h ALA 368 N 5.86 -1.24 0.00 5.21 0.00 -1.88 -3.35 119.26 123.86 1llw h ALA 368 Ca -0.29 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 1llw h ALA 368 Cb 1.19 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1llw h ALA 368 CO 0.49 -1.18 -0.12 0.41 0.00 0.00 0.00 179.25 178.85 1llw n GLY 369 N -1.48 2.55 0.16 0.00 0.00 -1.26 -4.63 105.19 100.53 1llw n GLY 369 Ca -0.12 -0.43 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 1llw n GLY 369 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1llw n VAL 370 N 1.92 1.47 -3.43 1.61 3.14 -1.26 -4.74 118.33 117.04 1llw n VAL 370 Ca 0.15 0.04 -0.38 0.00 -2.96 0.00 0.00 64.34 61.20 1llw n VAL 370 Cb 0.61 -2.20 -0.06 0.00 -1.06 0.00 0.00 33.84 31.13 1llw n VAL 370 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1llw s VAL 371 N -2.77 5.17 -0.64 1.55 1.01 -1.26 -4.54 120.40 118.92 1llw s VAL 371 Ca -0.29 0.81 -0.12 0.00 0.00 0.00 0.00 61.98 62.38 1llw s VAL 371 Cb 0.06 -3.73 0.16 0.00 0.00 0.00 0.00 36.38 32.87 1llw s VAL 371 CO 0.42 0.43 0.55 1.51 0.00 0.00 0.00 175.10 178.00 1llw s ASP 372 N 0.02 6.16 0.54 3.32 1.47 -1.26 -5.03 116.67 121.89 1llw s ASP 372 Ca 0.23 -2.28 -0.06 0.00 1.18 0.00 0.00 52.55 51.62 1llw s ASP 372 Cb -0.15 -2.12 -0.02 0.00 -0.34 0.00 0.00 42.92 40.29 1llw s ASP 372 CO 0.10 -0.66 0.86 -0.76 0.68 0.00 0.00 175.17 175.39 1llw s LEU 373 N 0.82 3.44 -0.86 2.11 1.43 -1.26 -4.95 118.68 119.40 1llw s LEU 373 Ca 0.11 0.93 -0.22 0.00 -1.03 0.00 0.00 54.13 53.91 1llw s LEU 373 Cb -0.21 -3.85 0.07 0.00 0.03 0.00 0.00 46.19 42.24 1llw s LEU 373 CO -0.03 -0.78 1.22 -2.16 0.23 0.00 0.00 176.35 174.83 1llw s PRO 374 N -4.89 3.41 0.11 1.29 0.04 -1.26 -4.89 135.00 128.81 1llw s PRO 374 Ca 0.51 -1.07 -0.03 0.00 0.04 0.00 0.00 61.00 60.44 1llw s PRO 374 Cb -0.10 -4.77 0.18 0.00 0.04 0.00 0.00 34.50 29.84 1llw s PRO 374 CO 0.46 -1.99 0.62 0.39 0.04 0.00 0.00 177.00 176.52 1llw n GLU 375 N 8.07 -0.04 -0.47 4.56 4.71 -1.26 -0.43 120.64 135.78 1llw n GLU 375 Ca 0.17 0.62 0.42 0.00 -0.01 0.00 0.00 57.16 58.35 1llw n GLU 375 Cb 0.49 -0.92 0.76 0.00 -1.01 0.00 0.00 31.44 30.76 1llw n GLU 375 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1llw h VAL 376 N 0.00 0.25 -0.45 2.62 2.07 -1.91 -1.96 116.25 116.87 1llw h VAL 376 Ca 0.19 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.70 1llw h VAL 376 Cb 0.29 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1llw h VAL 376 CO -0.41 0.00 0.00 -0.90 0.02 0.00 0.00 177.57 176.29 1llw n ASP 377 N -4.14 3.93 -4.70 0.57 5.68 0.43 -4.20 116.55 114.11 1llw n ASP 377 Ca 0.33 -2.46 -0.42 0.00 -0.50 0.00 0.00 54.79 51.74 1llw n ASP 377 Cb 1.53 -0.46 -0.03 0.00 -1.14 0.00 0.00 41.12 41.02 1llw n ASP 377 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1llw s ILE 378 N -1.83 3.71 -0.21 2.12 1.01 -0.74 -1.86 121.20 123.39 1llw s ILE 378 Ca 0.40 1.14 0.02 0.00 0.00 0.00 0.00 60.65 62.21 1llw s ILE 378 Cb 0.26 -3.73 -0.20 0.00 0.01 0.00 0.00 42.46 38.80 1llw s ILE 378 CO 0.18 0.03 -0.03 0.52 0.00 0.00 0.00 174.94 175.63 1llw n VAL 379 N 4.42 1.55 -3.80 2.92 0.31 0.69 -4.39 118.33 120.04 1llw n VAL 379 Ca 0.12 -0.63 -0.12 0.00 -0.01 0.00 0.00 64.34 63.70 1llw n VAL 379 Cb 0.44 -1.37 -0.11 0.00 -0.91 0.00 0.00 33.84 31.89 1llw n VAL 379 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1llw s GLU 380 N -2.53 0.35 -0.26 5.55 2.12 -1.13 -4.88 118.70 117.93 1llw s GLU 380 Ca -0.28 0.16 -0.00 0.00 0.36 0.00 0.00 54.97 55.21 1llw s GLU 380 Cb 0.08 0.16 0.07 0.00 0.26 0.00 0.00 34.13 34.71 1llw s GLU 380 CO 0.67 -0.06 0.01 0.15 -0.54 0.00 0.00 175.26 175.49 1llw s LYS 381 N -0.27 1.18 0.00 4.30 1.02 -1.26 -1.51 119.74 123.20 1llw s LYS 381 Ca -0.04 -0.99 0.00 0.00 0.02 0.00 0.00 55.97 54.96 1llw s LYS 381 Cb -0.03 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 34.88 1llw s LYS 381 CO 0.01 -0.74 0.00 0.41 -0.92 0.00 0.00 175.35 174.11 1llw n GLY 382 N 4.75 5.55 3.56 -3.33 0.00 -0.93 -1.08 105.19 113.71 1llw n GLY 382 Ca -0.07 -1.66 -0.06 0.00 0.00 0.00 0.00 46.02 44.23 1llw n GLY 382 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1llw s ARG 383 N 1.80 0.51 -0.46 1.61 1.70 -1.26 -2.18 118.95 120.67 1llw s ARG 383 Ca 0.00 -0.18 -0.19 0.00 -0.47 0.00 0.00 55.73 54.89 1llw s ARG 383 Cb 0.00 0.24 0.04 0.00 -0.57 0.00 0.00 34.95 34.65 1llw s ARG 383 CO 0.00 -0.22 0.58 -0.51 -1.08 0.00 0.00 175.30 174.06 1llw s LEU 384 N -2.24 4.77 1.00 -1.89 1.43 -0.01 -4.93 118.68 116.80 1llw s LEU 384 Ca 0.07 -0.64 -0.11 0.00 -1.03 0.00 0.00 54.13 52.42 1llw s LEU 384 Cb -0.01 -2.53 0.19 0.00 0.03 0.00 0.00 46.19 43.87 1llw s LEU 384 CO -0.06 -0.76 1.09 0.00 0.23 0.00 0.00 176.35 176.85 1llw s ALA 385 N 2.55 0.81 -0.11 4.21 0.00 -1.26 -4.77 121.76 123.18 1llw s ALA 385 Ca 0.17 0.21 -0.34 0.00 0.00 0.00 0.00 51.96 52.00 1llw s ALA 385 Cb -0.17 -3.33 -0.11 0.00 0.00 0.00 0.00 23.12 19.51 1llw s ALA 385 CO 0.15 -3.05 1.93 -2.30 0.00 0.00 0.00 175.76 172.49 1llw n PRO 386 N -4.40 2.11 -0.38 0.00 -0.02 -1.26 -1.27 135.00 129.78 1llw n PRO 386 Ca 0.08 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1llw n PRO 386 Cb 0.53 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1llw n PRO 386 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1llw n GLY 387 N 4.66 0.70 3.75 -1.23 0.00 -1.14 -4.81 105.19 107.12 1llw n GLY 387 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 1llw n GLY 387 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1llw s GLN 388 N -0.61 4.77 0.26 1.61 -0.21 -0.39 -4.63 119.66 120.45 1llw s GLN 388 Ca 0.00 1.61 0.08 0.00 0.02 0.00 0.00 55.36 57.08 1llw s GLN 388 Cb 0.00 -3.24 -0.04 0.00 1.00 0.00 0.00 33.01 30.73 1llw s GLN 388 CO 0.00 0.40 0.09 -1.64 -2.12 0.00 0.00 175.29 172.01 1llw s MET 389 N -1.28 2.58 -0.18 2.91 -1.94 -1.26 -2.92 119.30 117.22 1llw s MET 389 Ca 0.42 -1.25 -0.15 0.00 -1.71 0.00 0.00 55.69 53.01 1llw s MET 389 Cb -0.28 -2.35 0.05 0.00 2.01 0.00 0.00 34.83 34.26 1llw s MET 389 CO 0.36 0.38 0.46 -1.50 -0.01 0.00 0.00 175.02 174.71 1llw s ILE 390 N -2.23 -0.00 0.12 2.53 2.07 0.19 -2.52 121.20 121.36 1llw s ILE 390 Ca 0.32 0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.59 1llw s ILE 390 Cb -0.07 -0.65 -0.01 0.00 0.13 0.00 0.00 42.46 41.86 1llw s ILE 390 CO 0.22 0.01 0.12 0.00 -1.91 0.00 0.00 174.94 173.38 1llw n ALA 391 N 3.07 0.12 -3.28 1.50 0.00 -0.78 -2.35 120.51 118.79 1llw n ALA 391 Ca -0.15 -0.63 -0.13 0.00 0.00 0.00 0.00 53.44 52.53 1llw n ALA 391 Cb 0.57 0.51 -0.10 0.00 0.00 0.00 0.00 19.45 20.43 1llw n ALA 391 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1llw s VAL 392 N -2.50 0.01 -0.07 0.00 1.01 -0.83 -1.25 120.40 116.78 1llw s VAL 392 Ca 0.12 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1llw s VAL 392 Cb 0.00 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.81 1llw s VAL 392 CO 0.09 -0.06 -0.12 -0.62 0.00 0.00 0.00 175.10 174.39 1llw s ASP 393 N -0.22 1.78 0.53 3.32 -1.08 -0.77 -2.02 116.67 118.19 1llw s ASP 393 Ca -0.04 -0.30 0.46 0.00 -0.52 0.00 0.00 52.55 52.15 1llw s ASP 393 Cb -0.03 -0.82 1.68 0.00 -1.46 0.00 0.00 42.92 42.29 1llw s ASP 393 CO 0.02 0.02 1.57 -0.07 0.52 0.00 0.00 175.17 177.24 1llw h LEU 394 N 7.04 0.05 -2.12 -1.34 3.38 -1.82 -0.84 115.31 119.66 1llw h LEU 394 Ca -0.31 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1llw h LEU 394 Cb 1.18 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1llw h LEU 394 CO 0.47 -0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.93 1llw n ALA 395 N -2.82 1.76 -1.95 1.53 0.00 -1.26 -4.79 120.51 112.98 1llw n ALA 395 Ca 0.44 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.69 1llw n ALA 395 Cb 1.91 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 20.25 1llw n ALA 395 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1llw n GLU 396 N 0.95 -1.60 -4.98 0.00 1.02 -0.34 -4.99 120.64 110.69 1llw n GLU 396 Ca 0.00 1.03 -0.29 0.00 -0.02 0.00 0.00 57.16 57.88 1llw n GLU 396 Cb 0.12 -5.52 -0.17 0.00 -0.02 0.00 0.00 31.44 25.85 1llw n GLU 396 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1llw s GLN 397 N -4.28 2.40 0.85 3.49 -0.21 -1.06 -4.87 119.66 115.98 1llw s GLN 397 Ca 0.00 -0.71 -0.12 0.00 0.02 0.00 0.00 55.36 54.56 1llw s GLN 397 Cb 0.00 -1.91 0.10 0.00 1.00 0.00 0.00 33.01 32.20 1llw s GLN 397 CO 0.00 0.17 1.10 -1.59 -2.12 0.00 0.00 175.29 172.85 1llw s LYS 398 N 0.33 1.64 -0.41 2.91 0.00 -1.26 -1.85 119.74 121.10 1llw s LYS 398 Ca -0.14 0.59 0.05 0.00 0.00 0.00 0.00 55.97 56.47 1llw s LYS 398 Cb -0.16 -1.87 0.17 0.00 0.00 0.00 0.00 37.83 35.97 1llw s LYS 398 CO 0.06 -1.92 0.46 0.42 0.00 0.00 0.00 175.35 174.37 1llw s ILE 399 N -3.13 -0.43 0.77 3.79 1.01 -0.38 -4.88 121.20 117.94 1llw s ILE 399 Ca 0.62 -1.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.05 1llw s ILE 399 Cb -0.15 -0.55 0.06 0.00 0.01 0.00 0.00 42.46 41.82 1llw s ILE 399 CO 0.55 -0.51 1.10 -0.76 0.00 0.00 0.00 174.94 175.32 1llw s LEU 400 N 1.18 3.08 0.53 2.97 1.43 -1.26 -1.87 118.68 124.74 1llw s LEU 400 Ca 0.21 1.90 0.31 0.00 -1.03 0.00 0.00 54.13 55.52 1llw s LEU 400 Cb -0.09 -4.53 1.46 0.00 0.03 0.00 0.00 46.19 43.06 1llw s LEU 400 CO -0.06 -2.08 1.88 0.07 0.23 0.00 0.00 176.35 176.40 1llw h LYS 401 N -0.98 0.02 0.83 1.70 2.10 -1.90 -2.93 116.57 115.41 1llw h LYS 401 Ca -0.44 -0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.17 1llw h LYS 401 Cb 1.24 -0.01 0.01 0.00 -0.90 0.00 0.00 32.23 32.57 1llw h LYS 401 CO 0.51 0.02 -0.40 -0.91 -2.00 0.00 0.00 179.45 176.67 1llw h ASN 402 N 0.03 -0.94 0.00 7.07 4.21 -1.89 -2.28 115.58 121.77 1llw h ASN 402 Ca 0.44 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.98 1llw h ASN 402 Cb 1.70 0.24 0.00 0.00 -1.12 0.00 0.00 38.32 39.14 1llw h ASN 402 CO -0.02 -0.65 0.00 -1.22 -1.29 0.00 0.00 177.43 174.26 1llw n TYR 403 N -5.15 0.00 0.00 1.19 4.02 -1.11 -1.76 117.16 114.36 1llw n TYR 403 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.75 1llw n TYR 403 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.76 1llw n TYR 403 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1llw n GLN 404 N 0.00 0.00 -0.12 -0.72 1.13 -1.26 0.25 117.38 116.66 1llw n GLN 404 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 1llw n GLN 404 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.32 1llw n GLN 404 CO 0.00 0.00 0.00 -0.84 -1.44 0.00 0.00 177.06 174.78 1llw h ILE 405 N 0.00 1.28 -0.90 5.09 -0.00 -1.17 -2.18 117.51 119.63 1llw h ILE 405 Ca 0.00 -1.46 0.10 0.00 -0.00 0.00 0.00 64.86 63.50 1llw h ILE 405 Cb 0.00 1.41 -0.08 0.00 -0.00 0.00 0.00 36.82 38.15 1llw h ILE 405 CO 0.00 0.48 0.54 0.11 -0.00 0.00 0.00 178.15 179.28 1llw h LYS 406 N 0.64 0.86 -0.33 0.16 1.57 0.42 0.37 116.57 120.26 1llw h LYS 406 Ca 0.07 -0.05 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 1llw h LYS 406 Cb 0.87 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1llw h LYS 406 CO 0.08 0.57 0.26 1.96 -0.57 0.00 0.00 179.45 181.75 1llw h GLN 407 N 0.89 0.00 -0.04 3.15 4.20 -0.58 1.23 115.11 123.96 1llw h GLN 407 Ca 0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.15 1llw h GLN 407 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1llw h GLN 407 CO -0.25 0.00 0.00 0.94 -0.67 0.00 0.00 178.83 178.85 1llw n GLN 408 N -4.20 1.15 0.10 1.46 0.00 -1.08 -3.90 117.38 110.91 1llw n GLN 408 Ca 0.05 -1.43 -0.07 0.00 -0.00 0.00 0.00 57.00 55.56 1llw n GLN 408 Cb 0.43 -1.29 -0.04 0.00 0.00 0.00 0.00 30.24 29.35 1llw n GLN 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1llw h ALA 409 N 2.93 -0.87 -0.92 1.69 0.00 0.23 -3.35 119.26 118.96 1llw h ALA 409 Ca 0.00 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 54.98 1llw h ALA 409 Cb 0.63 0.46 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 1llw h ALA 409 CO 0.00 -0.89 -0.37 0.00 0.00 0.00 0.00 179.25 177.99 1llw n ALA 410 N -2.48 -0.14 -1.80 0.00 0.00 0.37 -4.72 120.51 111.74 1llw n ALA 410 Ca -0.04 0.91 -0.11 0.00 0.00 0.00 0.00 53.44 54.20 1llw n ALA 410 Cb 0.17 -0.40 0.09 0.00 0.00 0.00 0.00 19.45 19.31 1llw n ALA 410 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1llw n GLN 411 N -5.35 -0.32 -2.74 0.00 7.27 -1.25 -4.41 117.38 110.57 1llw n GLN 411 Ca 0.09 -1.13 -0.04 0.00 0.07 0.00 0.00 57.00 55.99 1llw n GLN 411 Cb 0.36 -0.55 -0.01 0.00 2.41 0.00 0.00 30.24 32.45 1llw n GLN 411 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1llw n LYS 412 N -2.22 -0.99 0.00 3.69 5.02 -1.26 -4.72 118.16 117.68 1llw n LYS 412 Ca 0.08 0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.30 1llw n LYS 412 Cb 0.29 -0.47 0.07 0.00 -0.02 0.00 0.00 35.03 34.90 1llw n LYS 412 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 1llw h TYR 413 N 0.64 0.67 0.00 2.13 -0.00 -1.85 -3.41 116.97 115.15 1llw h TYR 413 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 58.73 58.42 1llw h TYR 413 Cb 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 36.73 36.78 1llw h TYR 413 CO 0.07 0.94 0.03 -2.30 -0.00 0.00 0.00 178.16 176.89 1llw n PRO 414 N -3.98 0.00 0.00 0.10 -0.02 -1.26 -4.29 135.00 125.55 1llw n PRO 414 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1llw n PRO 414 Cb 0.58 -0.14 0.00 0.00 -0.02 0.00 0.00 33.50 33.92 1llw n PRO 414 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1llw n TYR 415 N -0.06 0.00 0.19 6.00 0.18 -1.26 0.68 117.16 122.88 1llw n TYR 415 Ca 0.00 0.00 0.10 0.00 1.88 0.00 0.00 57.90 59.88 1llw n TYR 415 Cb 0.03 0.00 0.12 0.00 -0.38 0.00 0.00 39.34 39.10 1llw n TYR 415 CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 1llw h GLY 416 N 0.00 0.00 1.37 -7.48 0.00 -1.85 -3.07 103.07 92.04 1llw h GLY 416 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1llw h GLY 416 CO 0.00 0.00 -0.27 -2.09 0.00 0.00 0.00 176.54 174.18 1llw h GLU 417 N 0.00 0.72 0.00 4.80 4.81 0.24 -3.01 114.58 122.13 1llw h GLU 417 Ca -0.01 -0.31 -0.07 0.00 -0.13 0.00 0.00 59.36 58.85 1llw h GLU 417 Cb 1.08 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1llw h GLU 417 CO 0.01 0.91 -1.92 -2.67 -0.73 0.00 0.00 179.01 174.61 1llw n TRP 418 N -4.09 0.17 -0.01 0.92 4.27 3.19 -3.40 117.44 118.49 1llw n TRP 418 Ca -0.00 0.05 -0.12 0.00 -3.89 0.00 0.00 57.50 53.54 1llw n TRP 418 Cb 0.45 -0.67 -0.07 0.00 -1.36 0.00 0.00 31.31 29.66 1llw n TRP 418 CO 0.00 0.00 0.00 0.82 -2.29 0.00 0.00 177.69 176.22 1llw h ILE 419 N 0.00 1.16 -0.40 -1.67 2.04 -1.49 -1.14 117.51 116.01 1llw h ILE 419 Ca -0.10 -0.49 0.06 0.00 1.00 0.00 0.00 64.86 65.33 1llw h ILE 419 Cb 1.25 1.33 -0.09 0.00 -0.74 0.00 0.00 36.82 38.58 1llw h ILE 419 CO 0.01 0.14 -0.50 0.11 0.00 0.00 0.00 178.15 177.91 1llw h LYS 420 N -0.04 -0.36 0.00 2.37 1.57 -1.71 -2.73 116.57 115.67 1llw h LYS 420 Ca 0.03 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1llw h LYS 420 Cb 0.20 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1llw h LYS 420 CO -0.00 -0.24 0.00 -0.89 -0.57 0.00 0.00 179.45 177.75 1llw n ILE 421 N -5.40 0.55 0.00 1.86 5.41 -0.57 -5.13 119.36 116.08 1llw n ILE 421 Ca -0.02 0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.87 1llw n ILE 421 Cb 0.35 -1.03 0.00 0.00 -0.71 0.00 0.00 39.64 38.25 1llw n ILE 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1llw n GLN 422 N -1.18 0.00 0.00 0.38 10.64 -0.54 -5.05 117.38 121.64 1llw n GLN 422 Ca 0.04 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.21 1llw n GLN 422 Cb 0.04 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.42 1llw n GLN 422 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1llw n ASP 439 N 0.00 0.00 -1.46 2.61 9.92 -1.26 -5.10 116.55 121.25 1llw n ASP 439 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1llw n ASP 439 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1llw n ASP 439 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1llw n ALA 440 N 0.00 0.00 -2.91 2.24 0.00 -1.26 -5.05 120.51 113.54 1llw n ALA 440 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1llw n ALA 440 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1llw n ALA 440 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1llw n GLN 441 N 0.00 2.21 0.08 0.00 3.00 -1.26 -4.71 117.38 116.70 1llw n GLN 441 Ca 0.00 -4.07 0.08 0.00 -0.01 0.00 0.00 57.00 53.00 1llw n GLN 441 Cb 0.00 -1.92 -0.03 0.00 0.00 0.00 0.00 30.24 28.30 1llw n GLN 441 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1llw n THR 442 N -0.08 0.78 -0.32 5.09 -1.04 -1.26 -3.52 114.28 113.93 1llw n THR 442 Ca 0.27 -0.59 0.09 0.00 -2.04 0.00 0.00 64.05 61.78 1llw n THR 442 Cb 0.59 -0.45 0.26 0.00 -1.82 0.00 0.00 70.33 68.90 1llw n THR 442 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1llw h VAL 443 N 0.00 0.72 0.00 12.58 2.07 -1.98 1.36 116.25 131.00 1llw h VAL 443 Ca -0.05 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1llw h VAL 443 Cb 1.17 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1llw h VAL 443 CO 0.01 0.12 0.02 -0.11 0.02 0.00 0.00 177.57 177.63 1llw n LEU 444 N -4.84 0.23 0.00 2.57 -0.00 -1.23 -1.96 117.00 111.78 1llw n LEU 444 Ca 0.19 0.60 0.00 0.00 -0.00 0.00 0.00 56.01 56.80 1llw n LEU 444 Cb 0.48 -0.62 0.00 0.00 -0.00 0.00 0.00 43.42 43.28 1llw n LEU 444 CO 0.21 -0.68 -0.16 0.00 -0.00 0.00 0.00 177.39 176.76 1llw n GLN 445 N -1.81 3.35 -0.08 1.96 6.02 0.39 -4.03 117.38 123.19 1llw n GLN 445 Ca -0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.96 1llw n GLN 445 Cb 0.03 -0.66 -0.02 0.00 1.02 0.00 0.00 30.24 30.61 1llw n GLN 445 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1llw h GLN 446 N 0.00 -0.02 -0.80 -1.09 1.08 0.64 0.28 115.11 115.20 1llw h GLN 446 Ca 0.00 0.00 0.26 0.00 -1.45 0.00 0.00 58.65 57.46 1llw h GLN 446 Cb 0.08 0.00 -0.15 0.00 -0.05 0.00 0.00 27.48 27.37 1llw h GLN 446 CO 0.00 -0.01 0.15 1.04 -0.95 0.00 0.00 178.83 179.05 1llw n GLN 447 N -3.45 -0.06 -0.11 1.46 6.02 -0.83 -0.21 117.38 120.21 1llw n GLN 447 Ca 0.00 1.17 -0.11 0.00 -0.01 0.00 0.00 57.00 58.05 1llw n GLN 447 Cb 0.06 -1.94 -0.03 0.00 1.02 0.00 0.00 30.24 29.35 1llw n GLN 447 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1llw h ALA 448 N 1.61 0.44 0.09 -1.58 0.00 -1.32 0.06 119.26 118.55 1llw h ALA 448 Ca 0.55 -0.27 -0.30 0.00 0.00 0.00 0.00 54.91 54.89 1llw h ALA 448 Cb 1.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1llw h ALA 448 CO -0.71 0.24 -1.54 0.00 0.00 0.00 0.00 179.25 177.24 1llw h ALA 449 N 0.81 0.36 0.00 0.00 0.00 0.14 -1.46 119.26 119.12 1llw h ALA 449 Ca 0.08 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1llw h ALA 449 Cb 0.53 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1llw h ALA 449 CO 0.03 1.23 0.00 0.74 0.00 0.00 0.00 179.25 181.24 1llw h PHE 450 N 0.05 0.00 0.00 0.00 -1.00 -1.16 -3.36 116.94 111.48 1llw h PHE 450 Ca -0.24 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.54 1llw h PHE 450 Cb 2.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.56 1llw h PHE 450 CO 0.05 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.16 1llw n GLY 451 N -0.99 0.63 3.26 -1.45 0.00 -0.55 -4.83 105.19 101.27 1llw n GLY 451 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1llw n GLY 451 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1llw n TYR 452 N -1.24 -1.88 -3.52 1.61 4.02 -0.01 -4.97 117.16 111.17 1llw n TYR 452 Ca 0.00 0.21 -0.14 0.00 -0.01 0.00 0.00 57.90 57.96 1llw n TYR 452 Cb 0.00 -1.61 -0.04 0.00 -0.02 0.00 0.00 39.34 37.67 1llw n TYR 452 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1llw s THR 453 N -2.24 0.02 0.26 -0.72 2.01 -1.26 -4.62 115.64 109.08 1llw s THR 453 Ca 0.52 -0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.37 1llw s THR 453 Cb -0.14 -0.99 0.23 0.00 0.01 0.00 0.00 72.50 71.61 1llw s THR 453 CO 0.69 -0.07 1.76 0.00 -0.69 0.00 0.00 174.62 176.30 1llw h ALA 454 N 2.59 1.21 0.00 7.40 0.00 -1.06 0.45 119.26 129.84 1llw h ALA 454 Ca -0.31 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1llw h ALA 454 Cb 1.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1llw h ALA 454 CO 0.40 -0.09 -0.46 0.93 0.00 0.00 0.00 179.25 180.03 1llw h GLU 455 N 0.61 0.00 -0.36 0.00 5.08 -1.88 -2.29 114.58 115.74 1llw h GLU 455 Ca 0.44 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.74 1llw h GLU 455 Cb 0.60 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1llw h GLU 455 CO -0.35 0.46 0.01 -0.44 -1.00 0.00 0.00 179.01 177.68 1llw h ASP 456 N 0.00 0.62 0.13 1.42 3.32 -0.50 0.82 116.42 122.24 1llw h ASP 456 Ca -0.00 -0.30 -0.22 0.00 0.02 0.00 0.00 57.03 56.52 1llw h ASP 456 Cb 0.87 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 40.26 1llw h ASP 456 CO 0.06 0.78 -1.02 1.62 -1.72 0.00 0.00 179.24 178.96 1llw h VAL 457 N 0.45 1.35 0.13 -1.35 3.04 -1.48 -0.49 116.25 117.91 1llw h VAL 457 Ca 0.10 -2.50 -0.01 0.00 -1.01 0.00 0.00 66.70 63.29 1llw h VAL 457 Cb 0.45 3.04 0.00 0.00 -2.01 0.00 0.00 31.29 32.77 1llw h VAL 457 CO 0.02 0.71 -0.06 -0.33 -1.01 0.00 0.00 177.57 176.90 1llw h GLU 458 N -0.35 -0.16 0.00 4.17 5.08 -1.52 0.45 114.58 122.25 1llw h GLU 458 Ca -0.20 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1llw h GLU 458 Cb 1.69 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.97 1llw h GLU 458 CO 0.12 0.11 -0.72 -1.33 -1.00 0.00 0.00 179.01 176.20 1llw n MET 459 N -5.04 0.01 0.03 2.33 2.81 0.28 -4.24 117.12 113.29 1llw n MET 459 Ca -0.09 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 1llw n MET 459 Cb 0.19 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1llw n MET 459 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1llw n VAL 460 N -1.52 0.33 -0.10 2.03 0.31 -1.11 -4.71 118.33 113.55 1llw n VAL 460 Ca 0.05 0.11 -0.09 0.00 -0.01 0.00 0.00 64.34 64.40 1llw n VAL 460 Cb 0.34 -0.93 -0.01 0.00 -0.91 0.00 0.00 33.84 32.32 1llw n VAL 460 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1llw h VAL 461 N 0.00 1.12 0.29 2.52 2.07 -1.00 -2.05 116.25 119.21 1llw h VAL 461 Ca 0.00 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1llw h VAL 461 Cb 0.00 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1llw h VAL 461 CO 0.00 0.12 -0.29 0.58 0.02 0.00 0.00 177.57 178.00 1llw h VAL 462 N 0.44 0.00 -0.95 2.57 2.07 -0.30 0.23 116.25 120.30 1llw h VAL 462 Ca 0.12 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.87 1llw h VAL 462 Cb 0.02 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.67 1llw h VAL 462 CO -0.02 0.00 0.51 -0.65 0.02 0.00 0.00 177.57 177.42 1llw h PRO 463 N -0.59 0.51 -0.13 1.57 0.11 -1.72 0.36 132.00 132.11 1llw h PRO 463 Ca -0.04 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 1llw h PRO 463 Cb 0.51 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1llw h PRO 463 CO -0.03 0.34 0.07 0.52 -0.21 0.00 0.00 178.00 178.68 1llw h MET 464 N 0.52 0.17 0.00 1.05 2.86 -0.73 -0.90 114.93 117.91 1llw h MET 464 Ca 0.60 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 58.17 1llw h MET 464 Cb 1.11 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 1llw h MET 464 CO -0.48 0.19 -0.22 0.00 1.06 0.00 0.00 176.91 177.46 1llw h ALA 465 N 0.98 1.32 0.02 6.32 0.00 0.11 0.80 119.26 128.82 1llw h ALA 465 Ca 0.04 -0.20 -0.35 0.00 0.00 0.00 0.00 54.91 54.41 1llw h ALA 465 Cb 0.06 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1llw h ALA 465 CO -0.01 0.27 -2.11 -1.13 0.00 0.00 0.00 179.25 176.27 1llw n SER 466 N -3.82 0.98 -0.00 0.00 3.41 0.11 -4.33 113.62 109.96 1llw n SER 466 Ca -0.02 0.15 0.02 0.00 -0.26 0.00 0.00 58.87 58.76 1llw n SER 466 Cb 0.31 0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 1llw n SER 466 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1llw n GLN 467 N -3.06 0.43 -0.26 4.33 6.02 -0.38 -4.96 117.38 119.50 1llw n GLN 467 Ca -0.30 -0.03 0.00 0.00 -0.01 0.00 0.00 57.00 56.66 1llw n GLN 467 Cb 1.08 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 31.24 1llw n GLN 467 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1llw n GLY 468 N 2.33 0.86 2.96 1.08 0.00 0.27 -5.03 105.19 107.66 1llw n GLY 468 Ca -0.01 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 1llw n GLY 468 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llw s LYS 469 N -0.68 0.13 0.66 1.61 1.02 -1.26 -3.95 119.74 117.27 1llw s LYS 469 Ca 0.00 0.40 -0.17 0.00 0.02 0.00 0.00 55.97 56.22 1llw s LYS 469 Cb 0.00 -0.15 -0.02 0.00 -0.52 0.00 0.00 37.83 37.14 1llw s LYS 469 CO 0.00 -0.16 0.96 -0.85 -0.92 0.00 0.00 175.35 174.38 1llw n GLU 470 N 4.14 0.70 -2.01 1.68 0.28 -1.26 -4.13 120.64 120.03 1llw n GLU 470 Ca -0.25 0.29 -0.37 0.00 -0.16 0.00 0.00 57.16 56.67 1llw n GLU 470 Cb 0.52 -2.19 0.03 0.00 1.43 0.00 0.00 31.44 31.23 1llw n GLU 470 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1llw s PRO 471 N -3.05 3.19 0.48 3.44 0.04 -1.26 -4.95 135.00 132.89 1llw s PRO 471 Ca 0.75 1.92 -0.08 0.00 0.04 0.00 0.00 61.00 63.63 1llw s PRO 471 Cb -0.38 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.00 1llw s PRO 471 CO 0.48 -1.06 0.82 0.99 0.04 0.00 0.00 177.00 178.27 1llw s THR 472 N -1.51 4.84 0.01 1.26 2.01 -1.26 -3.23 115.64 117.76 1llw s THR 472 Ca 0.73 0.42 -0.00 0.00 0.31 0.00 0.00 61.69 63.15 1llw s THR 472 Cb -0.32 -3.83 0.00 0.00 0.01 0.00 0.00 72.50 68.36 1llw s THR 472 CO 0.37 -0.80 0.01 0.33 -0.69 0.00 0.00 174.62 173.84 1llw n PHE 473 N -2.05 -0.79 -4.06 4.92 7.35 0.74 -4.80 117.46 118.77 1llw n PHE 473 Ca 0.02 -0.03 -0.10 0.00 -0.76 0.00 0.00 57.45 56.57 1llw n PHE 473 Cb 0.55 0.01 -0.06 0.00 0.35 0.00 0.00 39.48 40.32 1llw n PHE 473 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1llw n MET 475 N -0.37 -2.07 -2.33 0.00 2.81 0.13 -4.92 117.12 110.36 1llw n MET 475 Ca -0.00 1.49 -0.27 0.00 -1.81 0.00 0.00 57.70 57.11 1llw n MET 475 Cb 0.63 -2.60 0.04 0.00 -0.71 0.00 0.00 33.22 30.57 1llw n MET 475 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1llw s GLY 476 N -5.62 1.61 -0.90 3.03 0.00 -1.24 -4.50 107.32 99.70 1llw s GLY 476 Ca 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 44.72 43.80 1llw s GLY 476 CO 0.00 -0.37 1.99 -0.35 0.00 0.00 0.00 173.10 174.37 1llw s ASP 477 N -4.32 5.01 0.59 1.64 2.15 -1.23 -4.81 116.67 115.70 1llw s ASP 477 Ca 0.55 -0.63 0.36 0.00 0.43 0.00 0.00 52.55 53.26 1llw s ASP 477 Cb -0.11 -2.56 1.84 0.00 -0.30 0.00 0.00 42.92 41.79 1llw s ASP 477 CO 0.46 -2.87 2.18 -0.78 -0.17 0.00 0.00 175.17 173.99 1llw h ASP 478 N 11.39 0.00 -2.86 -0.34 1.82 -1.92 -3.44 116.42 121.07 1llw h ASP 478 Ca 0.09 0.00 -0.48 0.00 -0.39 0.00 0.00 57.03 56.25 1llw h ASP 478 Cb 1.00 0.00 0.01 0.00 0.68 0.00 0.00 39.33 41.02 1llw h ASP 478 CO 1.19 0.04 -0.18 0.42 -1.61 0.00 0.00 179.24 179.09 1llw s THR 479 N -4.08 5.10 0.88 2.25 -4.23 -1.26 -2.29 115.64 112.01 1llw s THR 479 Ca -0.03 -0.39 -0.10 0.00 -1.18 0.00 0.00 61.69 59.99 1llw s THR 479 Cb 0.12 -3.84 0.12 0.00 1.34 0.00 0.00 72.50 70.24 1llw s THR 479 CO 0.50 -0.53 1.13 -2.84 -0.54 0.00 0.00 174.62 172.35 1llw s PRO 480 N -4.21 1.31 0.10 3.99 0.02 -1.26 -4.95 135.00 130.01 1llw s PRO 480 Ca 0.40 1.46 -0.31 0.00 0.02 0.00 0.00 61.00 62.57 1llw s PRO 480 Cb -0.10 -1.77 -0.08 0.00 0.02 0.00 0.00 34.50 32.58 1llw s PRO 480 CO 0.35 -2.40 1.41 -0.51 -0.33 0.00 0.00 177.00 175.53 1llw s LEU 481 N -6.44 4.36 0.00 -5.54 1.43 -1.10 -4.74 118.68 106.65 1llw s LEU 481 Ca 0.65 2.33 0.00 0.00 -1.03 0.00 0.00 54.13 56.08 1llw s LEU 481 Cb -0.21 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.42 1llw s LEU 481 CO 0.57 -0.68 0.00 0.00 0.23 0.00 0.00 176.35 176.47 1llw n ALA 482 N 4.19 0.00 0.09 4.21 0.00 -1.26 0.96 120.51 128.70 1llw n ALA 482 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.42 1llw n ALA 482 Cb 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.73 1llw n ALA 482 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1llw h VAL 483 N 0.00 1.51 -0.00 0.00 3.04 -1.89 -3.23 116.25 115.68 1llw h VAL 483 Ca 0.00 -3.11 0.00 0.00 -1.01 0.00 0.00 66.70 62.58 1llw h VAL 483 Cb 0.00 2.91 0.00 0.00 -2.01 0.00 0.00 31.29 32.19 1llw h VAL 483 CO 0.00 0.90 -0.51 0.18 -1.01 0.00 0.00 177.57 177.13 1llw n LEU 484 N -3.49 0.71 -4.77 3.16 4.77 0.27 -4.58 117.00 113.08 1llw n LEU 484 Ca -0.07 -0.14 -0.30 0.00 -0.03 0.00 0.00 56.01 55.47 1llw n LEU 484 Cb 1.01 -0.19 0.11 0.00 -2.33 0.00 0.00 43.42 42.02 1llw n LEU 484 CO 0.52 0.16 0.69 -0.55 -1.33 0.00 0.00 177.39 176.89 1llw s SER 485 N -2.88 4.09 -0.00 -1.43 0.15 -0.72 -4.76 113.70 108.14 1llw s SER 485 Ca 0.14 1.41 0.20 0.00 0.70 0.00 0.00 55.95 58.40 1llw s SER 485 Cb 0.18 -2.13 -0.22 0.00 -1.71 0.00 0.00 66.02 62.14 1llw s SER 485 CO 0.68 -2.24 0.86 1.41 1.20 0.00 0.00 173.24 175.15 1llw n HIS 486 N -3.62 0.00 -3.60 3.44 8.25 -1.26 -4.56 115.22 113.87 1llw n HIS 486 Ca 0.07 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.21 1llw n HIS 486 Cb 0.56 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.61 1llw n HIS 486 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1llw s LYS 487 N -2.94 3.69 0.55 -0.41 -0.14 -1.26 -5.02 119.74 114.21 1llw s LYS 487 Ca 0.07 0.05 -0.21 0.00 -1.36 0.00 0.00 55.97 54.53 1llw s LYS 487 Cb 0.15 -2.86 -0.06 0.00 -1.68 0.00 0.00 37.83 33.39 1llw s LYS 487 CO 0.84 0.47 1.11 -0.35 -0.76 0.00 0.00 175.35 176.66 1llw n PRO 488 N 0.29 1.26 -3.89 -1.68 -0.04 -1.26 -5.00 135.00 124.67 1llw n PRO 488 Ca -0.04 0.47 -0.10 0.00 -0.04 0.00 0.00 63.50 63.80 1llw n PRO 488 Cb 0.52 -2.28 -0.09 0.00 -0.04 0.00 0.00 33.50 31.61 1llw n PRO 488 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1llw s ARG 489 N -2.66 0.66 0.47 0.54 1.81 -1.26 -5.13 118.95 113.38 1llw s ARG 489 Ca 0.72 -0.75 -0.16 0.00 -1.72 0.00 0.00 55.73 53.82 1llw s ARG 489 Cb -0.44 0.27 -0.08 0.00 -0.45 0.00 0.00 34.95 34.24 1llw s ARG 489 CO 0.50 -0.18 0.93 -0.51 -0.68 0.00 0.00 175.30 175.35 1llw s LEU 490 N -2.23 3.75 0.45 2.53 1.43 -1.26 -4.91 118.68 118.44 1llw s LEU 490 Ca -0.03 1.50 0.16 0.00 -1.03 0.00 0.00 54.13 54.73 1llw s LEU 490 Cb -0.00 -4.41 1.11 0.00 0.03 0.00 0.00 46.19 42.93 1llw s LEU 490 CO -0.05 -0.49 1.98 0.25 0.23 0.00 0.00 176.35 178.27 1llw h LEU 491 N 1.25 0.29 -2.07 1.79 5.85 -2.00 -0.41 115.31 120.00 1llw h LEU 491 Ca -0.47 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.31 1llw h LEU 491 Cb 1.18 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1llw h LEU 491 CO 0.62 0.17 0.34 1.88 -0.34 0.00 0.00 178.44 181.10 1llw h TYR 492 N 0.32 0.00 -0.10 1.25 -1.99 -1.96 -2.45 116.97 112.03 1llw h TYR 492 Ca 0.28 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.01 1llw h TYR 492 Cb 0.67 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.40 1llw h TYR 492 CO -0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 178.16 177.91 1llw n ASP 493 N -3.34 0.94 -0.01 3.88 8.00 -0.16 -2.82 116.55 123.04 1llw n ASP 493 Ca 0.02 -1.64 0.10 0.00 0.71 0.00 0.00 54.79 53.98 1llw n ASP 493 Cb 0.44 -0.07 -0.15 0.00 -0.02 0.00 0.00 41.12 41.33 1llw n ASP 493 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1llw n TYR 494 N -0.14 0.00 -3.34 1.24 4.02 -0.92 -4.50 117.16 113.52 1llw n TYR 494 Ca 0.14 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.62 1llw n TYR 494 Cb 0.20 -0.41 -0.09 0.00 -0.02 0.00 0.00 39.34 39.02 1llw n TYR 494 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1llw s PHE 495 N -3.31 3.20 -0.15 -0.72 0.40 -1.13 -0.71 117.98 115.56 1llw s PHE 495 Ca -0.06 0.04 -0.13 0.00 -0.60 0.00 0.00 56.93 56.18 1llw s PHE 495 Cb 0.12 -2.76 -0.05 0.00 0.51 0.00 0.00 43.02 40.85 1llw s PHE 495 CO 0.80 -0.47 0.27 0.15 0.70 0.00 0.00 175.22 176.67 1llw s LYS 496 N 2.15 4.16 0.41 0.44 -0.14 -0.55 -4.90 119.74 121.31 1llw s LYS 496 Ca 0.14 0.07 -0.25 0.00 -1.36 0.00 0.00 55.97 54.56 1llw s LYS 496 Cb -0.16 -3.39 -0.10 0.00 -1.68 0.00 0.00 37.83 32.49 1llw s LYS 496 CO 0.12 0.32 1.19 1.04 -0.76 0.00 0.00 175.35 177.26 1llw n GLN 497 N 3.32 1.75 -3.64 1.68 6.02 0.26 -0.62 117.38 126.14 1llw n GLN 497 Ca -0.13 0.62 -0.20 0.00 -0.01 0.00 0.00 57.00 57.28 1llw n GLN 497 Cb 0.52 -2.26 -0.02 0.00 1.02 0.00 0.00 30.24 29.51 1llw n GLN 497 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1llw s ARG 498 N -2.10 2.93 0.21 -1.09 0.52 -1.01 -3.11 118.95 115.29 1llw s ARG 498 Ca 0.61 -1.15 -0.23 0.00 -0.52 0.00 0.00 55.73 54.44 1llw s ARG 498 Cb -0.54 -2.65 0.05 0.00 0.52 0.00 0.00 34.95 32.33 1llw s ARG 498 CO 0.58 0.08 0.71 -0.59 0.02 0.00 0.00 175.30 176.10 1llw s PHE 499 N -2.24 -0.32 -0.11 -0.53 -0.12 -1.26 -4.63 117.98 108.76 1llw s PHE 499 Ca 0.43 -0.01 -0.19 0.00 -0.05 0.00 0.00 56.93 57.11 1llw s PHE 499 Cb -0.08 0.64 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 1llw s PHE 499 CO 0.29 -1.01 0.50 0.00 -0.05 0.00 0.00 175.22 174.95 1llw s ALA 500 N -3.74 3.46 0.00 1.99 0.00 0.30 -4.88 121.76 118.89 1llw s ALA 500 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 51.88 1llw s ALA 500 Cb -0.03 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1llw s ALA 500 CO -0.02 -0.02 0.00 1.04 0.00 0.00 0.00 175.76 176.77 1llw n GLN 501 N 3.70 0.00 -0.03 0.00 6.02 -1.24 -4.56 117.38 121.27 1llw n GLN 501 Ca -0.06 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 56.96 1llw n GLN 501 Cb 0.52 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.64 1llw n GLN 501 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1llw n VAL 502 N -0.03 0.40 0.07 5.09 0.31 -1.26 -4.36 118.33 118.55 1llw n VAL 502 Ca 0.00 -0.51 0.10 0.00 -0.01 0.00 0.00 64.34 63.92 1llw n VAL 502 Cb 0.00 -0.14 -0.05 0.00 -0.91 0.00 0.00 33.84 32.75 1llw n VAL 502 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1llw n THR 503 N -2.29 0.52 -3.78 2.52 5.66 -1.26 -3.45 114.28 112.20 1llw n THR 503 Ca -0.12 -0.55 -0.10 0.00 -3.05 0.00 0.00 64.05 60.24 1llw n THR 503 Cb 0.66 -0.29 -0.05 0.00 -1.55 0.00 0.00 70.33 69.11 1llw n THR 503 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1llw s ASN 504 N -5.19 -0.17 0.29 1.09 4.22 -1.26 -4.49 114.94 109.42 1llw s ASN 504 Ca -0.03 -0.55 0.03 0.00 -2.14 0.00 0.00 52.86 50.17 1llw s ASN 504 Cb 0.10 0.52 -0.03 0.00 1.28 0.00 0.00 41.25 43.12 1llw s ASN 504 CO 0.82 -0.97 0.44 -2.16 -2.04 0.00 0.00 177.10 173.19 1llw s PRO 505 N -3.88 3.46 0.70 3.55 0.04 -1.26 -3.73 135.00 133.87 1llw s PRO 505 Ca 0.10 -0.57 -0.11 0.00 0.04 0.00 0.00 61.00 60.46 1llw s PRO 505 Cb 0.01 -2.79 0.01 0.00 0.04 0.00 0.00 34.50 31.76 1llw s PRO 505 CO -0.04 0.31 1.07 -1.25 0.04 0.00 0.00 177.00 177.13 1llw s PRO 506 N -4.11 2.94 0.10 0.56 0.05 -1.26 -3.45 135.00 129.83 1llw s PRO 506 Ca 0.37 0.72 0.08 0.00 0.05 0.00 0.00 61.00 62.22 1llw s PRO 506 Cb -0.09 -2.01 -0.04 0.00 0.05 0.00 0.00 34.50 32.41 1llw s PRO 506 CO 0.32 -1.04 -0.15 0.96 0.05 0.00 0.00 177.00 177.14 1llw s ILE 507 N -3.18 3.02 -0.39 0.56 -4.36 -0.77 -4.11 121.20 111.97 1llw s ILE 507 Ca 0.58 -1.39 -0.29 0.00 -0.26 0.00 0.00 60.65 59.29 1llw s ILE 507 Cb -0.13 -2.38 0.01 0.00 1.25 0.00 0.00 42.46 41.21 1llw s ILE 507 CO 0.54 0.13 1.35 -0.62 0.24 0.00 0.00 174.94 176.58 1llw s ASP 508 N -2.09 6.45 0.01 4.36 -1.08 -1.26 -4.67 116.67 118.39 1llw s ASP 508 Ca 0.19 0.88 0.27 0.00 -0.52 0.00 0.00 52.55 53.37 1llw s ASP 508 Cb -0.11 -2.54 0.92 0.00 -1.46 0.00 0.00 42.92 39.73 1llw s ASP 508 CO 0.11 -1.32 1.71 -0.81 0.52 0.00 0.00 175.17 175.37 1llw n PRO 509 N 7.86 0.01 -0.11 4.34 -0.04 -1.26 -1.54 135.00 144.26 1llw n PRO 509 Ca 0.16 0.01 -0.22 0.00 -0.04 0.00 0.00 63.50 63.40 1llw n PRO 509 Cb 0.48 -1.51 -0.07 0.00 -0.04 0.00 0.00 33.50 32.35 1llw n PRO 509 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1llw n LEU 510 N -1.53 1.71 0.00 1.53 4.32 -1.26 -3.37 117.00 118.40 1llw n LEU 510 Ca 0.06 0.29 0.05 0.00 -0.02 0.00 0.00 56.01 56.39 1llw n LEU 510 Cb 0.34 -0.70 0.27 0.00 -1.62 0.00 0.00 43.42 41.72 1llw n LEU 510 CO 0.30 0.32 0.50 0.54 -1.22 0.00 0.00 177.39 177.83 1llw n ARG 511 N -4.12 0.28 -1.49 3.23 3.00 -1.25 -2.94 116.66 113.37 1llw n ARG 511 Ca -0.40 0.01 -0.03 0.00 -0.01 0.00 0.00 57.85 57.42 1llw n ARG 511 Cb 0.75 -1.50 -0.01 0.00 0.00 0.00 0.00 32.46 31.70 1llw n ARG 511 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1llw n GLU 512 N -1.01 0.32 0.26 5.56 1.02 -0.59 -4.81 120.64 121.38 1llw n GLU 512 Ca 0.07 -1.42 0.12 0.00 -0.02 0.00 0.00 57.16 55.91 1llw n GLU 512 Cb 0.03 0.24 0.78 0.00 -0.02 0.00 0.00 31.44 32.47 1llw n GLU 512 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1llw h ASN 513 N 0.55 0.00 0.12 1.62 -1.24 -1.54 -3.16 115.58 111.93 1llw h ASN 513 Ca -0.45 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.56 1llw h ASN 513 Cb 1.50 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.55 1llw h ASN 513 CO -0.15 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 175.99 1llw n LEU 514 N -4.17 0.37 -0.35 0.34 -0.00 -1.26 0.49 117.00 112.42 1llw n LEU 514 Ca -0.02 0.66 0.10 0.00 -0.00 0.00 0.00 56.01 56.74 1llw n LEU 514 Cb 0.13 -0.68 -0.03 0.00 -0.00 0.00 0.00 43.42 42.84 1llw n LEU 514 CO 0.31 -0.73 0.21 0.52 -0.00 0.00 0.00 177.39 177.70 1llw n VAL 515 N -1.98 0.00 -2.95 1.47 0.31 -1.19 -4.81 118.33 109.18 1llw n VAL 515 Ca -0.00 -0.23 -0.21 0.00 -0.01 0.00 0.00 64.34 63.89 1llw n VAL 515 Cb 0.06 1.18 0.08 0.00 -0.91 0.00 0.00 33.84 34.25 1llw n VAL 515 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1llw s MET 516 N -2.39 2.08 -0.25 5.55 -1.94 0.18 -4.84 119.30 117.69 1llw s MET 516 Ca 0.14 -1.62 -0.28 0.00 -1.71 0.00 0.00 55.69 52.22 1llw s MET 516 Cb 0.16 -2.57 0.17 0.00 2.01 0.00 0.00 34.83 34.60 1llw s MET 516 CO 0.57 -1.08 1.24 0.45 -0.01 0.00 0.00 175.02 176.19 1llw s SER 517 N -4.74 -0.18 -0.06 3.03 0.15 -0.34 -4.96 113.70 106.61 1llw s SER 517 Ca 0.64 0.24 0.13 0.00 0.70 0.00 0.00 55.95 57.66 1llw s SER 517 Cb -0.05 0.20 0.40 0.00 -1.71 0.00 0.00 66.02 64.86 1llw s SER 517 CO 0.41 -0.13 1.33 0.18 1.20 0.00 0.00 173.24 176.22 1llw n LEU 518 N 0.93 3.32 -4.25 3.45 4.32 -1.26 -2.35 117.00 121.16 1llw n LEU 518 Ca -0.06 -2.32 -0.35 0.00 -0.02 0.00 0.00 56.01 53.25 1llw n LEU 518 Cb 0.58 -0.35 0.07 0.00 -1.62 0.00 0.00 43.42 42.10 1llw n LEU 518 CO 0.08 0.72 -0.60 0.00 -1.22 0.00 0.00 177.39 176.37 1llw n ALA 519 N 0.26 -3.58 -3.15 -1.18 0.00 -1.23 -3.59 120.51 108.04 1llw n ALA 519 Ca 0.15 -0.51 0.05 0.00 0.00 0.00 0.00 53.44 53.13 1llw n ALA 519 Cb 0.59 -1.51 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 1llw n ALA 519 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1llw s MET 520 N -2.57 0.36 -0.27 0.00 -1.94 -1.06 -4.30 119.30 109.52 1llw s MET 520 Ca 0.52 0.57 -0.26 0.00 -1.71 0.00 0.00 55.69 54.80 1llw s MET 520 Cb -0.25 0.31 0.00 0.00 2.01 0.00 0.00 34.83 36.90 1llw s MET 520 CO 0.72 -0.45 0.93 -0.06 -0.01 0.00 0.00 175.02 176.14 1llw s PHE 521 N 2.91 3.27 -0.71 -0.03 0.40 -1.26 -2.92 117.98 119.63 1llw s PHE 521 Ca 0.11 1.18 0.25 0.00 -0.60 0.00 0.00 56.93 57.88 1llw s PHE 521 Cb -0.11 -3.27 0.60 0.00 0.51 0.00 0.00 43.02 40.76 1llw s PHE 521 CO -0.18 -0.52 1.56 1.28 0.70 0.00 0.00 175.22 178.06 1llw n LEU 522 N 6.30 0.72 -4.67 -0.37 4.77 -1.26 -4.86 117.00 117.62 1llw n LEU 522 Ca 0.08 0.39 -0.29 0.00 -0.03 0.00 0.00 56.01 56.16 1llw n LEU 522 Cb 0.47 -0.26 0.17 0.00 -2.33 0.00 0.00 43.42 41.47 1llw n LEU 522 CO 0.51 -0.10 0.64 -0.83 -1.33 0.00 0.00 177.39 176.28 1llw s GLY 523 N -3.56 1.59 0.19 -0.72 0.00 -1.26 -4.41 107.32 99.14 1llw s GLY 523 Ca 0.09 -0.16 -0.30 0.00 0.00 0.00 0.00 44.72 44.35 1llw s GLY 523 CO 0.65 0.40 1.04 -1.59 0.00 0.00 0.00 173.10 173.60 1llw s LYS 524 N -4.88 4.67 0.30 2.90 -2.85 -1.26 -4.65 119.74 113.96 1llw s LYS 524 Ca 0.65 1.63 -0.28 0.00 -1.00 0.00 0.00 55.97 56.96 1llw s LYS 524 Cb -0.19 -3.29 -0.09 0.00 -2.06 0.00 0.00 37.83 32.19 1llw s LYS 524 CO 0.58 0.20 1.05 1.03 0.10 0.00 0.00 175.35 178.31 1llw s ARG 525 N -0.55 4.58 0.00 1.78 0.52 -1.22 -5.05 118.95 119.01 1llw s ARG 525 Ca 0.47 1.66 0.00 0.00 -0.52 0.00 0.00 55.73 57.34 1llw s ARG 525 Cb -0.28 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.13 1llw s ARG 525 CO 0.34 0.20 0.00 0.41 0.02 0.00 0.00 175.30 176.27 1llw n GLY 526 N 1.05 0.79 3.64 -3.53 0.00 -1.26 -4.81 105.19 101.06 1llw n GLY 526 Ca 0.00 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 1llw n GLY 526 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1llw s ASN 527 N -0.93 6.92 0.29 1.61 0.01 -1.26 -4.94 114.94 116.64 1llw s ASN 527 Ca 0.00 1.05 -0.01 0.00 -0.71 0.00 0.00 52.86 53.19 1llw s ASN 527 Cb 0.00 -2.52 0.44 0.00 0.41 0.00 0.00 41.25 39.58 1llw s ASN 527 CO 0.00 -0.81 1.89 0.25 -1.51 0.00 0.00 177.10 176.93 1llw h LEU 528 N 9.89 0.83 -0.49 0.60 5.85 -1.95 -3.14 115.31 126.90 1llw h LEU 528 Ca -0.21 -0.09 -0.16 0.00 0.84 0.00 0.00 57.88 58.26 1llw h LEU 528 Cb 1.07 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 1llw h LEU 528 CO 1.00 0.71 -0.48 -0.07 -0.34 0.00 0.00 178.44 179.26 1llw h LEU 529 N 0.91 0.75 -7.70 2.25 3.38 -1.92 -3.40 115.31 109.59 1llw h LEU 529 Ca 0.22 -0.38 -0.77 0.00 0.09 0.00 0.00 57.88 57.05 1llw h LEU 529 Cb 0.11 -0.21 -0.29 0.00 0.09 0.00 0.00 40.66 40.36 1llw h LEU 529 CO -0.03 1.11 0.08 -1.61 0.09 0.00 0.00 178.44 178.08 1llw s GLU 530 N -4.16 3.53 -0.79 1.13 0.41 -1.19 -5.03 118.70 112.61 1llw s GLU 530 Ca -0.09 -2.69 -0.25 0.00 -0.41 0.00 0.00 54.97 51.53 1llw s GLU 530 Cb 0.11 -4.31 -0.08 0.00 -1.78 0.00 0.00 34.13 28.08 1llw s GLU 530 CO 0.85 -1.26 2.14 -2.14 -0.49 0.00 0.00 175.26 174.37 1llw s PRO 531 N -0.27 2.18 -0.07 0.39 0.02 -1.26 -4.79 135.00 131.19 1llw s PRO 531 Ca 0.21 0.24 -0.00 0.00 0.02 0.00 0.00 61.00 61.47 1llw s PRO 531 Cb -0.11 -4.84 -0.03 0.00 0.02 0.00 0.00 34.50 29.53 1llw s PRO 531 CO -0.08 -3.69 -0.02 0.15 -0.33 0.00 0.00 177.00 173.03 1llw s LYS 532 N 7.80 2.87 0.64 5.54 1.02 -1.26 -4.95 119.74 131.41 1llw s LYS 532 Ca 0.80 -0.48 0.25 0.00 0.02 0.00 0.00 55.97 56.56 1llw s LYS 532 Cb -0.10 -2.71 1.27 0.00 -0.52 0.00 0.00 37.83 35.77 1llw s LYS 532 CO 0.07 0.68 1.72 0.00 -0.92 0.00 0.00 175.35 176.90 1llw h ALA 533 N 5.09 1.79 -1.42 5.17 0.00 -1.92 -3.51 119.26 124.47 1llw h ALA 533 Ca -0.50 -0.01 -0.76 0.00 0.00 0.00 0.00 54.91 53.64 1llw h ALA 533 Cb 1.18 0.01 -0.19 0.00 0.00 0.00 0.00 17.79 18.80 1llw h ALA 533 CO 0.54 -0.65 1.53 -1.91 0.00 0.00 0.00 179.25 178.76 1llw n GLU 534 N -3.07 3.64 -3.64 0.00 0.00 -1.26 -4.96 120.64 111.35 1llw n GLU 534 Ca 0.03 -3.83 -0.04 0.00 0.00 0.00 0.00 57.16 53.32 1llw n GLU 534 Cb 0.64 -2.88 -0.06 0.00 0.00 0.00 0.00 31.44 29.14 1llw n GLU 534 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 1llw s LYS 540 N 0.26 0.14 -0.28 5.31 2.20 -1.26 -5.09 119.74 121.01 1llw s LYS 540 Ca 0.39 0.11 -0.03 0.00 -0.36 0.00 0.00 55.97 56.07 1llw s LYS 540 Cb 0.03 0.07 0.10 0.00 -1.51 0.00 0.00 37.83 36.52 1llw s LYS 540 CO 0.01 -0.03 0.12 -1.17 -0.36 0.00 0.00 175.35 173.92 1llw s LEU 541 N -0.37 1.00 0.55 5.43 2.96 -1.15 -4.89 118.68 122.21 1llw s LEU 541 Ca 0.07 -1.32 0.42 0.00 -0.22 0.00 0.00 54.13 53.07 1llw s LEU 541 Cb -0.03 -0.49 1.62 0.00 0.50 0.00 0.00 46.19 47.79 1llw s LEU 541 CO -0.11 -0.42 1.72 -0.09 -1.32 0.00 0.00 176.35 176.13 1llw h ARG 542 N 8.32 0.00 -3.82 1.98 9.65 -1.88 -2.80 114.38 125.83 1llw h ARG 542 Ca -0.18 -0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 58.60 1llw h ARG 542 Cb 1.02 -0.00 -0.15 0.00 -1.39 0.00 0.00 29.97 29.45 1llw h ARG 542 CO 0.44 0.00 -0.42 0.45 2.80 0.00 0.00 179.97 183.23 1llw s SER 543 N -4.72 0.16 0.47 -3.80 0.15 -1.26 -3.50 113.70 101.21 1llw s SER 543 Ca -0.05 -0.65 0.17 0.00 0.70 0.00 0.00 55.95 56.12 1llw s SER 543 Cb 0.24 0.31 1.13 0.00 -1.71 0.00 0.00 66.02 65.99 1llw s SER 543 CO 0.84 -0.67 2.04 1.55 1.20 0.00 0.00 173.24 178.19 1llw h PRO 544 N 2.97 0.00 -5.97 5.44 0.13 -1.78 -3.41 132.00 129.38 1llw h PRO 544 Ca -0.34 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.20 1llw h PRO 544 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 1llw h PRO 544 CO 0.56 0.14 0.57 -1.17 -0.23 0.00 0.00 178.00 177.87 1llw s LEU 545 N -8.53 4.04 -0.18 1.56 0.20 -1.26 0.46 118.68 114.98 1llw s LEU 545 Ca -0.04 0.84 -0.00 0.00 0.69 0.00 0.00 54.13 55.62 1llw s LEU 545 Cb 0.16 -3.26 0.00 0.00 -0.43 0.00 0.00 46.19 42.66 1llw s LEU 545 CO 0.67 -0.70 -0.14 0.68 -0.29 0.00 0.00 176.35 176.57 1llw s VAL 546 N 3.20 2.68 0.60 1.68 -7.23 0.24 -4.93 120.40 116.64 1llw s VAL 546 Ca 0.37 -0.75 -0.14 0.00 -1.81 0.00 0.00 61.98 59.65 1llw s VAL 546 Cb -0.14 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1llw s VAL 546 CO 0.13 0.50 1.04 0.54 -0.31 0.00 0.00 175.10 177.00 1llw s ASN 547 N 1.07 5.95 0.26 4.85 2.20 -1.26 -4.03 114.94 123.98 1llw s ASN 547 Ca -0.00 1.66 0.09 0.00 -0.94 0.00 0.00 52.86 53.66 1llw s ASN 547 Cb -0.14 -2.51 0.81 0.00 -2.00 0.00 0.00 41.25 37.40 1llw s ASN 547 CO -0.04 -1.05 1.21 -0.62 -2.94 0.00 0.00 177.10 173.66 1llw n GLU 548 N -2.27 -0.05 -0.03 3.55 -0.58 -1.26 0.65 120.64 120.65 1llw n GLU 548 Ca 0.08 1.11 -0.09 0.00 -0.42 0.00 0.00 57.16 57.84 1llw n GLU 548 Cb 0.53 -1.86 -0.03 0.00 -0.57 0.00 0.00 31.44 29.51 1llw n GLU 548 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1llw h VAL 549 N 0.00 0.68 -0.03 2.62 2.07 -1.99 -1.48 116.25 118.13 1llw h VAL 549 Ca 0.56 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.99 1llw h VAL 549 Cb 1.33 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1llw h VAL 549 CO -0.66 0.00 -0.39 -0.33 0.02 0.00 0.00 177.57 176.21 1llw h GLU 550 N -0.09 0.05 0.78 1.57 5.08 -0.13 0.27 114.58 122.11 1llw h GLU 550 Ca 0.10 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1llw h GLU 550 Cb 0.24 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1llw h GLU 550 CO -0.24 0.44 -0.37 1.25 -1.00 0.00 0.00 179.01 179.09 1llw h LEU 551 N 0.05 -0.88 -0.50 1.33 5.85 -0.61 0.40 115.31 120.95 1llw h LEU 551 Ca 0.00 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.84 1llw h LEU 551 Cb 0.71 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.87 1llw h LEU 551 CO 0.05 -0.60 -0.19 -0.61 -0.34 0.00 0.00 178.44 176.76 1llw h GLN 552 N -1.10 -0.07 0.12 1.25 4.15 -1.26 0.32 115.11 118.53 1llw h GLN 552 Ca -0.11 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.33 1llw h GLN 552 Cb 0.81 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.47 1llw h GLN 552 CO 0.17 -0.05 -0.53 0.00 -1.93 0.00 0.00 178.83 176.50 1llw h ALA 553 N 1.32 -1.00 -0.20 3.38 0.00 0.04 0.13 119.26 122.93 1llw h ALA 553 Ca 0.24 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1llw h ALA 553 Cb 0.44 0.90 -0.07 0.00 0.00 0.00 0.00 17.79 19.06 1llw h ALA 553 CO -0.55 -1.13 -0.26 0.82 0.00 0.00 0.00 179.25 178.12 1llw h ILE 554 N -0.76 0.37 0.00 0.00 5.03 -0.04 0.24 117.51 122.34 1llw h ILE 554 Ca -0.01 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.73 1llw h ILE 554 Cb 0.76 0.37 0.00 0.00 -3.03 0.00 0.00 36.82 34.92 1llw h ILE 554 CO -0.29 0.00 0.03 0.29 -0.68 0.00 0.00 178.15 177.50 1llw n LYS 555 N -5.38 0.00 0.00 2.37 5.02 0.11 -2.92 118.16 117.36 1llw n LYS 555 Ca -0.02 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1llw n LYS 555 Cb 0.30 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 1llw n LYS 555 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1llw n THR 556 N -1.05 0.00 -0.17 -0.18 -1.04 0.81 -4.86 114.28 107.80 1llw n THR 556 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1llw n THR 556 Cb 0.03 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.20 1llw n THR 556 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1llw n GLY 557 N 2.84 0.07 0.46 3.41 0.00 -0.94 -4.49 105.19 106.55 1llw n GLY 557 Ca 0.00 -0.20 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 1llw n GLY 557 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1llw h GLN 558 N 0.00 -0.82 -5.86 1.61 7.50 -1.92 -3.43 115.11 112.20 1llw h GLN 558 Ca 0.00 0.06 -0.50 0.00 0.50 0.00 0.00 58.65 58.70 1llw h GLN 558 Cb 0.00 0.19 -0.21 0.00 0.05 0.00 0.00 27.48 27.50 1llw h GLN 558 CO 0.00 -0.54 -0.81 -1.17 -1.50 0.00 0.00 178.83 174.81 1llw s LEU 559 N -9.74 2.30 0.52 1.46 0.20 -1.26 -5.15 118.68 107.01 1llw s LEU 559 Ca -0.16 -0.68 -0.12 0.00 0.69 0.00 0.00 54.13 53.86 1llw s LEU 559 Cb 0.05 -0.75 -0.10 0.00 -0.43 0.00 0.00 46.19 44.96 1llw s LEU 559 CO 0.56 0.00 -0.32 0.00 -0.29 0.00 0.00 176.35 176.30 1llw n GLN 560 N 1.09 0.00 -2.85 1.98 1.13 -1.26 -4.77 117.38 112.70 1llw n GLN 560 Ca -0.20 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.77 1llw n GLN 560 Cb 0.54 -0.69 0.01 0.00 0.11 0.00 0.00 30.24 30.21 1llw n GLN 560 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1llw n VAL 561 N -1.38 -0.17 -0.92 5.09 0.31 -1.26 -4.10 118.33 115.90 1llw n VAL 561 Ca 0.02 -1.61 -0.43 0.00 -0.01 0.00 0.00 64.34 62.31 1llw n VAL 561 Cb 0.35 0.70 -0.08 0.00 -0.91 0.00 0.00 33.84 33.90 1llw n VAL 561 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1llw n ALA 562 N 2.40 0.05 -1.78 3.52 0.00 -1.23 -4.47 120.51 119.00 1llw n ALA 562 Ca 0.16 0.16 -0.41 0.00 0.00 0.00 0.00 53.44 53.35 1llw n ALA 562 Cb 0.57 -1.47 -0.01 0.00 0.00 0.00 0.00 19.45 18.55 1llw n ALA 562 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1llw s GLU 563 N 4.06 4.13 -0.19 0.00 2.02 -1.25 -2.82 118.70 124.65 1llw s GLU 563 Ca 0.84 2.55 0.00 0.00 0.02 0.00 0.00 54.97 58.38 1llw s GLU 563 Cb -1.06 -2.99 0.04 0.00 0.10 0.00 0.00 34.13 30.22 1llw s GLU 563 CO 0.48 -0.54 -0.07 0.08 0.02 0.00 0.00 175.26 175.23 1llw s VAL 564 N -0.83 1.35 -0.75 2.63 1.01 -1.01 -4.99 120.40 117.80 1llw s VAL 564 Ca 0.55 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 61.39 1llw s VAL 564 Cb -0.46 -1.50 -0.16 0.00 0.00 0.00 0.00 36.38 34.26 1llw s VAL 564 CO 0.59 0.12 2.53 -0.24 0.00 0.00 0.00 175.10 178.10 1llw n SER 565 N 4.78 1.12 0.25 3.32 2.88 -1.26 -3.49 113.62 121.21 1llw n SER 565 Ca -0.13 0.02 0.17 0.00 -1.33 0.00 0.00 58.87 57.59 1llw n SER 565 Cb 0.47 -1.16 0.87 0.00 -0.75 0.00 0.00 64.21 63.65 1llw n SER 565 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1llw h THR 566 N 7.77 0.00 -4.33 2.46 2.02 -1.24 -3.44 112.91 116.15 1llw h THR 566 Ca -0.13 -0.05 -0.50 0.00 0.77 0.00 0.00 66.41 66.50 1llw h THR 566 Cb 1.30 0.81 0.05 0.00 -1.74 0.00 0.00 68.15 68.58 1llw h THR 566 CO 1.27 0.00 0.41 -0.76 0.37 0.00 0.00 175.52 176.81 1llw s LEU 567 N -5.35 3.30 -0.22 2.58 1.43 -1.25 -1.04 118.68 118.13 1llw s LEU 567 Ca -0.03 1.46 -0.15 0.00 -1.03 0.00 0.00 54.13 54.38 1llw s LEU 567 Cb 0.10 -4.48 0.06 0.00 0.03 0.00 0.00 46.19 41.90 1llw s LEU 567 CO 0.33 -0.84 0.55 -0.72 0.23 0.00 0.00 176.35 175.90 1llw s TYR 568 N -3.07 -0.77 0.91 0.29 -0.85 -1.13 -4.89 117.35 107.84 1llw s TYR 568 Ca 0.56 1.65 -0.11 0.00 -0.52 0.00 0.00 57.07 58.65 1llw s TYR 568 Cb -0.11 0.37 0.14 0.00 0.38 0.00 0.00 41.96 42.75 1llw s TYR 568 CO 0.50 -0.39 1.11 -0.51 -1.52 0.00 0.00 175.55 174.74 1llw s ASP 569 N 1.13 3.11 0.30 -0.18 1.01 -1.26 -2.61 116.67 118.17 1llw s ASP 569 Ca -0.07 1.94 -0.19 0.00 0.71 0.00 0.00 52.55 54.95 1llw s ASP 569 Cb -0.06 -2.48 -0.09 0.00 1.01 0.00 0.00 42.92 41.30 1llw s ASP 569 CO -0.11 -2.94 0.79 -0.22 0.21 0.00 0.00 175.17 172.90 1llw s LEU 570 N -6.48 4.17 -0.08 1.23 0.20 -1.18 -4.67 118.68 111.87 1llw s LEU 570 Ca 0.65 1.45 -0.02 0.00 0.69 0.00 0.00 54.13 56.90 1llw s LEU 570 Cb -0.21 -3.97 0.01 0.00 -0.43 0.00 0.00 46.19 41.58 1llw s LEU 570 CO 0.58 -0.13 0.03 0.47 -0.29 0.00 0.00 176.35 177.01 1llw n ASP 571 N 0.07 -6.35 0.00 3.68 8.00 -1.26 -4.73 116.55 115.96 1llw n ASP 571 Ca 0.02 0.87 0.00 0.00 0.71 0.00 0.00 54.79 56.39 1llw n ASP 571 Cb 0.52 -2.77 0.00 0.00 -0.02 0.00 0.00 41.12 38.86 1llw n ASP 571 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1llw n GLY 572 N 1.57 0.34 3.48 0.44 0.00 -1.26 -4.83 105.19 104.92 1llw n GLY 572 Ca -0.06 0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1llw n GLY 572 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1llw s VAL 573 N 0.00 4.56 0.10 1.61 1.01 -1.26 -5.00 120.40 121.42 1llw s VAL 573 Ca 0.00 -1.46 -0.31 0.00 0.00 0.00 0.00 61.98 60.20 1llw s VAL 573 Cb 0.00 -4.85 -0.13 0.00 0.00 0.00 0.00 36.38 31.40 1llw s VAL 573 CO 0.00 -1.62 1.51 -1.13 0.00 0.00 0.00 175.10 173.86 1llw h ASN 574 N 8.93 -1.53 -2.42 3.32 -1.24 -1.88 -3.44 115.58 117.33 1llw h ASN 574 Ca 0.18 0.17 -0.58 0.00 0.71 0.00 0.00 56.30 56.78 1llw h ASN 574 Cb 1.01 0.58 -0.11 0.00 0.73 0.00 0.00 38.32 40.53 1llw h ASN 574 CO 1.19 -0.48 -0.67 -0.94 -1.29 0.00 0.00 177.43 175.24 1llw s SER 575 N -4.57 4.40 0.28 1.15 1.04 -1.26 -4.52 113.70 110.23 1llw s SER 575 Ca -0.15 -0.65 0.02 0.00 0.48 0.00 0.00 55.95 55.65 1llw s SER 575 Cb 0.06 -0.78 0.66 0.00 0.10 0.00 0.00 66.02 66.06 1llw s SER 575 CO 0.56 0.03 1.71 0.25 0.98 0.00 0.00 173.24 176.77 1llw h LEU 576 N 2.19 0.32 -0.75 2.42 5.85 -1.92 -1.98 115.31 121.44 1llw h LEU 576 Ca -0.45 0.14 0.16 0.00 0.84 0.00 0.00 57.88 58.58 1llw h LEU 576 Cb 1.24 0.12 -0.14 0.00 0.37 0.00 0.00 40.66 42.25 1llw h LEU 576 CO 0.59 0.03 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.57 1llw h GLU 577 N 0.42 0.05 0.45 1.25 4.81 -1.96 -2.34 114.58 117.26 1llw h GLU 577 Ca 0.52 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.73 1llw h GLU 577 Cb 0.94 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.32 1llw h GLU 577 CO -0.50 0.04 -0.22 -0.44 -0.73 0.00 0.00 179.01 177.16 1llw h ASP 578 N 0.06 -0.51 -0.04 1.04 3.32 -1.77 -1.15 116.42 117.37 1llw h ASP 578 Ca 0.39 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.45 1llw h ASP 578 Cb 0.66 0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 1llw h ASP 578 CO -0.71 -0.34 0.06 0.00 -1.72 0.00 0.00 179.24 176.53 1llw h ALA 579 N -0.09 1.40 0.37 3.45 0.00 -1.43 0.88 119.26 123.85 1llw h ALA 579 Ca -0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1llw h ALA 579 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1llw h ALA 579 CO 0.10 -0.08 -0.18 1.25 0.00 0.00 0.00 179.25 180.34 1llw h LEU 580 N 0.00 -0.42 -0.96 0.00 5.85 -1.06 -1.54 115.31 117.18 1llw h LEU 580 Ca 0.02 0.01 0.24 0.00 0.84 0.00 0.00 57.88 58.99 1llw h LEU 580 Cb 0.14 0.11 -0.18 0.00 0.37 0.00 0.00 40.66 41.10 1llw h LEU 580 CO -0.00 -0.08 -0.07 0.41 -0.34 0.00 0.00 178.44 178.37 1llw n THR 581 N -4.60 -0.40 0.24 1.05 -1.04 0.11 0.02 114.28 109.65 1llw n THR 581 Ca -0.06 2.13 0.12 0.00 -2.04 0.00 0.00 64.05 64.20 1llw n THR 581 Cb 0.20 -3.06 0.18 0.00 -1.82 0.00 0.00 70.33 65.83 1llw n THR 581 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1llw h ASN 582 N 0.00 0.00 -0.05 8.00 2.35 0.52 -2.06 115.58 124.34 1llw h ASN 582 Ca 0.54 -0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.14 1llw h ASN 582 Cb 1.03 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.41 1llw h ASN 582 CO -0.93 0.00 -0.56 0.25 -1.65 0.00 0.00 177.43 174.54 1llw h LEU 583 N 0.00 0.58 -0.12 1.61 6.46 0.67 0.29 115.31 124.81 1llw h LEU 583 Ca 0.00 -0.70 -0.02 0.00 -0.12 0.00 0.00 57.88 57.04 1llw h LEU 583 Cb 0.98 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 40.73 1llw h LEU 583 CO 0.00 1.19 0.00 0.58 -0.62 0.00 0.00 178.44 179.59 1llw h VAL 584 N 0.01 1.25 -0.66 1.05 2.07 -1.35 1.32 116.25 119.94 1llw h VAL 584 Ca -0.06 -0.81 0.02 0.00 0.82 0.00 0.00 66.70 66.67 1llw h VAL 584 Cb 1.23 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.53 1llw h VAL 584 CO 0.11 0.23 0.43 0.11 0.02 0.00 0.00 177.57 178.47 1llw h LYS 585 N -0.06 0.83 -0.28 1.57 1.57 -1.39 1.58 116.57 120.38 1llw h LYS 585 Ca 0.03 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1llw h LYS 585 Cb 0.36 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1llw h LYS 585 CO 0.01 0.55 0.16 1.15 -0.57 0.00 0.00 179.45 180.74 1llw h THR 586 N 0.86 1.12 0.40 -0.16 2.02 -0.06 0.20 112.91 117.28 1llw h THR 586 Ca 0.25 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1llw h THR 586 Cb -0.05 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1llw h THR 586 CO -0.08 0.12 -0.25 0.00 0.37 0.00 0.00 175.52 175.69 1llw h ALA 587 N 1.04 -1.08 -0.95 6.16 0.00 0.26 -0.16 119.26 124.53 1llw h ALA 587 Ca 0.10 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1llw h ALA 587 Cb 0.06 0.36 -0.13 0.00 0.00 0.00 0.00 17.79 18.08 1llw h ALA 587 CO -0.02 -1.06 -0.49 -0.89 0.00 0.00 0.00 179.25 176.79 1llw n ILE 588 N -3.86 -0.59 -0.24 0.00 5.41 0.53 -0.59 119.36 120.01 1llw n ILE 588 Ca -0.07 2.27 0.01 0.00 1.00 0.00 0.00 62.75 65.96 1llw n ILE 588 Cb 0.25 -2.87 0.14 0.00 -0.71 0.00 0.00 39.64 36.45 1llw n ILE 588 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1llw h ALA 589 N 0.76 0.97 -0.22 -1.39 0.00 -0.52 -2.61 119.26 116.25 1llw h ALA 589 Ca 0.21 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 1llw h ALA 589 Cb 0.45 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1llw h ALA 589 CO -0.91 -0.05 -0.41 1.15 0.00 0.00 0.00 179.25 179.03 1llw h THR 590 N 0.59 1.30 -0.27 0.00 2.02 0.11 -2.55 112.91 114.11 1llw h THR 590 Ca 0.35 -1.57 -0.15 0.00 0.77 0.00 0.00 66.41 65.80 1llw h THR 590 Cb 0.37 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 1llw h THR 590 CO -0.27 0.49 -0.45 0.58 0.37 0.00 0.00 175.52 176.25 1llw h VAL 591 N 0.42 1.29 -0.90 3.16 2.07 -0.99 -2.20 116.25 119.10 1llw h VAL 591 Ca 0.04 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 65.92 1llw h VAL 591 Cb 0.90 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 1llw h VAL 591 CO 0.08 0.52 0.57 1.56 0.02 0.00 0.00 177.57 180.32 1llw h GLN 592 N 0.56 1.21 -0.92 1.57 4.20 -1.39 -2.90 115.11 117.45 1llw h GLN 592 Ca 0.04 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1llw h GLN 592 Cb 0.99 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.51 1llw h GLN 592 CO 0.09 0.83 0.00 0.00 -0.67 0.00 0.00 178.83 179.08 1llw n ALA 593 N -2.37 2.38 -0.15 3.87 0.00 -0.96 -4.80 120.51 118.48 1llw n ALA 593 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1llw n ALA 593 Cb 0.04 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1llw n ALA 593 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llw n GLY 594 N 0.06 0.79 3.71 0.00 0.00 -1.09 -5.04 105.19 103.61 1llw n GLY 594 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1llw n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 595 N -2.45 3.88 -0.96 4.61 0.00 -0.87 -4.89 121.76 121.09 1llw s ALA 595 Ca 0.00 1.55 0.10 0.00 0.00 0.00 0.00 51.96 53.60 1llw s ALA 595 Cb 0.00 -3.72 0.01 0.00 0.00 0.00 0.00 23.12 19.42 1llw s ALA 595 CO 0.00 -1.02 0.66 0.39 0.00 0.00 0.00 175.76 175.79 1llw n GLU 596 N 4.55 1.75 -3.71 0.00 1.02 -1.26 -4.35 120.64 118.64 1llw n GLU 596 Ca 0.17 -0.70 -0.15 0.00 -0.02 0.00 0.00 57.16 56.45 1llw n GLU 596 Cb 0.36 -1.10 -0.15 0.00 -0.02 0.00 0.00 31.44 30.53 1llw n GLU 596 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1llw s ILE 597 N -1.22 -0.15 -0.53 -3.67 1.01 -1.26 -1.08 121.20 114.30 1llw s ILE 597 Ca 0.09 0.27 -0.07 0.00 0.00 0.00 0.00 60.65 60.94 1llw s ILE 597 Cb 0.08 -0.26 0.14 0.00 0.01 0.00 0.00 42.46 42.43 1llw s ILE 597 CO 0.22 0.11 0.39 -0.76 0.00 0.00 0.00 174.94 174.90 1llw s LEU 598 N 1.72 5.64 -0.40 2.97 1.02 -1.26 -3.55 118.68 124.82 1llw s LEU 598 Ca -0.03 -2.23 -0.29 0.00 0.02 0.00 0.00 54.13 51.60 1llw s LEU 598 Cb -0.12 -1.97 0.01 0.00 0.02 0.00 0.00 46.19 44.13 1llw s LEU 598 CO -0.06 -0.58 1.46 -0.69 0.02 0.00 0.00 176.35 176.50 1llw s VAL 599 N 0.87 3.85 -0.58 -1.59 1.01 -1.13 -3.59 120.40 119.24 1llw s VAL 599 Ca 0.10 0.87 -0.21 0.00 0.00 0.00 0.00 61.98 62.73 1llw s VAL 599 Cb -0.23 -4.14 0.07 0.00 0.00 0.00 0.00 36.38 32.08 1llw s VAL 599 CO -0.03 -0.72 0.82 -0.76 0.00 0.00 0.00 175.10 174.42 1llw s LEU 600 N 5.60 4.66 -0.15 3.92 1.02 -0.70 -2.42 118.68 130.63 1llw s LEU 600 Ca 0.63 -0.90 -0.10 0.00 0.02 0.00 0.00 54.13 53.78 1llw s LEU 600 Cb -0.15 -2.50 -0.05 0.00 0.02 0.00 0.00 46.19 43.52 1llw s LEU 600 CO 0.33 -1.19 0.18 -0.89 0.02 0.00 0.00 176.35 174.80 1llw s THR 601 N 3.40 5.40 -2.03 5.49 2.01 -1.23 -2.33 115.64 126.36 1llw s THR 601 Ca 0.20 0.30 0.10 0.00 0.31 0.00 0.00 61.69 62.60 1llw s THR 601 Cb -0.18 -3.49 0.26 0.00 0.01 0.00 0.00 72.50 69.11 1llw s THR 601 CO 0.12 0.51 1.25 -0.90 -0.69 0.00 0.00 174.62 174.92 1llw n ASP 602 N 2.79 1.33 -2.71 3.53 5.75 -1.22 -0.68 116.55 125.33 1llw n ASP 602 Ca -0.17 -1.94 -0.22 0.00 -0.01 0.00 0.00 54.79 52.46 1llw n ASP 602 Cb 0.53 -0.15 -0.01 0.00 -1.03 0.00 0.00 41.12 40.46 1llw n ASP 602 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1llw n ARG 603 N 0.20 2.57 -2.68 0.11 1.85 -1.26 -4.73 116.66 112.71 1llw n ARG 603 Ca 0.10 -4.17 -0.40 0.00 -1.00 0.00 0.00 57.85 52.37 1llw n ARG 603 Cb 0.22 -1.95 -0.05 0.00 -1.05 0.00 0.00 32.46 29.62 1llw n ARG 603 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 1llw s PRO 604 N -3.30 4.76 -1.19 2.89 0.02 -1.26 -3.02 135.00 133.90 1llw s PRO 604 Ca 0.43 1.54 0.00 0.00 0.02 0.00 0.00 61.00 62.99 1llw s PRO 604 Cb 0.38 -3.29 0.00 0.00 0.02 0.00 0.00 34.50 31.60 1llw s PRO 604 CO -0.11 0.35 0.00 0.09 -0.33 0.00 0.00 177.00 176.99 1llw n ASN 605 N 1.91 -3.57 0.00 2.53 3.02 -1.26 -3.42 115.26 114.48 1llw n ASN 605 Ca -0.00 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 1llw n ASN 605 Cb 0.47 -3.20 0.00 0.00 -0.61 0.00 0.00 39.78 36.44 1llw n ASN 605 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1llw n GLY 606 N -0.50 0.31 3.58 7.41 0.00 -1.17 -5.09 105.19 109.73 1llw n GLY 606 Ca -0.13 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 1llw n GLY 606 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 607 N -2.00 -1.61 -0.42 4.61 0.00 -1.22 -5.11 121.76 116.02 1llw s ALA 607 Ca 0.00 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.41 1llw s ALA 607 Cb 0.00 0.70 0.13 0.00 0.00 0.00 0.00 23.12 23.95 1llw s ALA 607 CO 0.00 -0.84 0.21 0.42 0.00 0.00 0.00 175.76 175.55 1llw s ILE 608 N -3.51 1.35 0.98 0.00 1.01 -1.26 -4.53 121.20 115.23 1llw s ILE 608 Ca 0.06 -2.39 -0.16 0.00 0.00 0.00 0.00 60.65 58.16 1llw s ILE 608 Cb -0.02 -1.95 0.22 0.00 0.01 0.00 0.00 42.46 40.72 1llw s ILE 608 CO -0.06 -0.86 1.33 -0.76 0.00 0.00 0.00 174.94 174.60 1llw s LEU 609 N 0.54 2.77 0.18 2.97 1.43 -1.26 -4.93 118.68 120.37 1llw s LEU 609 Ca 0.16 0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 53.32 1llw s LEU 609 Cb -0.24 -2.07 0.06 0.00 0.03 0.00 0.00 46.19 43.97 1llw s LEU 609 CO -0.03 -2.84 1.49 0.74 0.23 0.00 0.00 176.35 175.94 1llw h THR 610 N -1.68 1.30 0.00 5.49 2.02 -1.98 -3.27 112.91 114.79 1llw h THR 610 Ca -0.43 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.02 1llw h THR 610 Cb 1.22 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1llw h THR 610 CO 0.32 0.55 -0.89 -0.62 0.37 0.00 0.00 175.52 175.26 1llw n GLU 611 N -3.99 0.35 -0.40 6.66 4.71 -1.26 -3.86 120.64 122.85 1llw n GLU 611 Ca -0.03 0.05 -0.11 0.00 -0.01 0.00 0.00 57.16 57.05 1llw n GLU 611 Cb 0.59 -1.67 -0.01 0.00 -1.01 0.00 0.00 31.44 29.34 1llw n GLU 611 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1llw n ASN 612 N -2.15 2.65 -3.02 1.62 3.02 -1.23 -3.13 115.26 113.00 1llw n ASN 612 Ca 0.02 -2.15 -0.10 0.00 -0.03 0.00 0.00 54.58 52.32 1llw n ASN 612 Cb 0.46 -0.80 -0.01 0.00 -0.61 0.00 0.00 39.78 38.82 1llw n ASN 612 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1llw n GLN 613 N 4.41 0.96 0.00 3.52 -0.06 -1.07 -4.62 117.38 120.52 1llw n GLN 613 Ca 0.24 -0.90 0.00 0.00 -2.00 0.00 0.00 57.00 54.34 1llw n GLN 613 Cb 0.09 -2.17 0.00 0.00 -4.06 0.00 0.00 30.24 24.10 1llw n GLN 613 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1llw n SER 614 N 4.47 0.00 -4.34 1.69 3.41 -1.26 -4.71 113.62 112.88 1llw n SER 614 Ca 0.21 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.59 1llw n SER 614 Cb 0.08 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.91 1llw n SER 614 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1llw s PHE 615 N -0.91 1.87 -0.31 7.33 2.99 -1.26 -2.86 117.98 124.84 1llw s PHE 615 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 56.93 56.19 1llw s PHE 615 Cb 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 43.02 42.09 1llw s PHE 615 CO 0.00 0.34 1.12 0.42 -0.00 0.00 0.00 175.22 177.10 1llw s ILE 616 N -1.93 4.43 0.25 0.64 1.09 -0.21 -4.96 121.20 120.51 1llw s ILE 616 Ca 0.15 1.65 -0.31 0.00 -1.10 0.00 0.00 60.65 61.04 1llw s ILE 616 Cb -0.06 -4.36 -0.13 0.00 -1.06 0.00 0.00 42.46 36.85 1llw s ILE 616 CO 0.07 -0.47 1.45 -2.65 -0.10 0.00 0.00 174.94 173.23 1llw n PRO 617 N 6.95 2.18 0.12 2.79 -0.02 -1.26 -4.79 135.00 140.97 1llw n PRO 617 Ca 0.13 0.78 0.01 0.00 -2.02 0.00 0.00 63.50 62.39 1llw n PRO 617 Cb 0.47 -2.46 0.32 0.00 -0.02 0.00 0.00 33.50 31.81 1llw n PRO 617 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1llw h PRO 618 N 4.37 0.19 -0.23 0.52 0.11 -1.98 0.84 132.00 135.81 1llw h PRO 618 Ca -0.45 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 1llw h PRO 618 Cb 1.26 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1llw h PRO 618 CO 0.77 0.46 0.06 1.25 -0.21 0.00 0.00 178.00 180.33 1llw h LEU 619 N 0.17 0.35 -0.77 2.35 5.85 -1.92 -0.06 115.31 121.28 1llw h LEU 619 Ca 0.03 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.60 1llw h LEU 619 Cb 0.60 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.47 1llw h LEU 619 CO 0.04 0.48 0.45 0.25 -0.34 0.00 0.00 178.44 179.32 1llw h LEU 620 N 0.20 0.66 0.29 2.25 5.85 -1.68 -2.06 115.31 120.83 1llw h LEU 620 Ca 0.07 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1llw h LEU 620 Cb 0.26 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1llw h LEU 620 CO -0.00 0.41 -0.14 0.00 -0.34 0.00 0.00 178.44 178.37 1llw h ALA 621 N 1.40 -0.39 0.00 1.25 0.00 -0.70 -1.27 119.26 119.55 1llw h ALA 621 Ca 0.35 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1llw h ALA 621 Cb 0.25 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1llw h ALA 621 CO -0.21 -0.52 -0.02 0.28 0.00 0.00 0.00 179.25 178.79 1llw h VAL 622 N -0.80 0.19 -0.00 0.00 2.07 -1.02 0.99 116.25 117.67 1llw h VAL 622 Ca -0.04 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1llw h VAL 622 Cb 0.51 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1llw h VAL 622 CO 0.07 0.02 -0.01 1.23 0.02 0.00 0.00 177.57 178.90 1llw h GLY 623 N 0.49 0.01 0.65 2.17 0.00 -1.32 -3.01 103.07 102.05 1llw h GLY 623 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1llw h GLY 623 CO 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 176.54 176.53 1llw h ALA 624 N 0.34 0.07 -0.29 3.60 0.00 0.35 0.33 119.26 123.66 1llw h ALA 624 Ca -0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1llw h ALA 624 Cb 0.67 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1llw h ALA 624 CO 0.00 -0.20 -0.17 -0.39 0.00 0.00 0.00 179.25 178.49 1llw h VAL 625 N -0.28 1.25 -0.33 0.00 -1.51 -1.21 0.18 116.25 114.34 1llw h VAL 625 Ca 0.01 -1.13 -0.03 0.00 -1.23 0.00 0.00 66.70 64.32 1llw h VAL 625 Cb 0.44 1.22 -0.01 0.00 -2.13 0.00 0.00 31.29 30.81 1llw h VAL 625 CO 0.01 0.37 0.09 -0.74 -1.23 0.00 0.00 177.57 176.06 1llw h HIS 626 N 0.47 0.55 0.00 5.19 -0.00 -1.29 0.14 115.15 120.20 1llw h HIS 626 Ca 0.08 -0.06 -0.09 0.00 -0.00 0.00 0.00 60.37 60.30 1llw h HIS 626 Cb 0.57 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 27.81 1llw h HIS 626 CO 0.02 0.56 -0.49 0.45 -0.00 0.00 0.00 177.93 178.47 1llw h HIS 627 N 0.38 0.00 0.19 5.26 3.86 0.01 -2.85 115.15 122.00 1llw h HIS 627 Ca 0.10 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.98 1llw h HIS 627 Cb 0.28 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.77 1llw h HIS 627 CO 0.01 0.41 -1.57 0.45 0.86 0.00 0.00 177.93 178.10 1llw h HIS 628 N 0.00 0.74 -0.04 2.45 3.86 -0.64 -1.39 115.15 120.12 1llw h HIS 628 Ca -0.01 -0.54 0.03 0.00 -1.16 0.00 0.00 60.37 58.69 1llw h HIS 628 Cb 1.33 -0.03 -0.06 0.00 1.06 0.00 0.00 27.41 29.71 1llw h HIS 628 CO 0.00 1.54 -0.42 -0.07 0.86 0.00 0.00 177.93 179.84 1llw h LEU 629 N 0.11 -1.28 -0.67 2.43 4.07 -1.10 -2.08 115.31 116.80 1llw h LEU 629 Ca -0.27 0.16 0.14 0.00 0.08 0.00 0.00 57.88 57.99 1llw h LEU 629 Cb 2.10 0.51 -0.12 0.00 1.08 0.00 0.00 40.66 44.22 1llw h LEU 629 CO 0.21 -0.45 -0.09 0.40 -1.08 0.00 0.00 178.44 177.43 1llw h ILE 630 N -0.55 0.37 0.00 1.22 2.04 -1.49 1.44 117.51 120.55 1llw h ILE 630 Ca 0.06 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1llw h ILE 630 Cb 0.64 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 1llw h ILE 630 CO -0.34 0.01 0.00 0.54 0.00 0.00 0.00 178.15 178.36 1llw n ARG 631 N -5.39 0.09 0.00 2.37 1.74 -0.53 -2.29 116.66 112.65 1llw n ARG 631 Ca 0.10 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 1llw n ARG 631 Cb 0.37 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 1llw n ARG 631 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1llw n ALA 632 N -1.11 2.19 -0.26 7.54 0.00 0.49 -4.97 120.51 124.38 1llw n ALA 632 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1llw n ALA 632 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1llw n ALA 632 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llw n GLY 633 N 0.45 0.79 0.02 0.00 0.00 -0.79 -4.92 105.19 100.74 1llw n GLY 633 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1llw n GLY 633 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llw n LEU 634 N 0.00 0.00 -0.59 0.99 4.77 -1.06 -4.57 117.00 116.53 1llw n LEU 634 Ca 0.00 0.00 0.47 0.00 -0.03 0.00 0.00 56.01 56.45 1llw n LEU 634 Cb 0.00 0.07 0.78 0.00 -2.33 0.00 0.00 43.42 41.94 1llw n LEU 634 CO 0.00 0.07 1.42 -0.09 -1.33 0.00 0.00 177.39 177.45 1llw h ARG 635 N 0.00 0.01 0.00 3.23 9.65 -1.85 1.31 114.38 126.73 1llw h ARG 635 Ca -0.07 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 1llw h ARG 635 Cb 0.95 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.53 1llw h ARG 635 CO 0.00 0.01 0.00 1.28 2.80 0.00 0.00 179.97 184.06 1llw n LEU 636 N -4.12 0.00 -0.09 3.80 4.32 -1.26 -4.27 117.00 115.37 1llw n LEU 636 Ca 0.40 0.42 -0.17 0.00 -0.02 0.00 0.00 56.01 56.64 1llw n LEU 636 Cb 1.78 -0.42 -0.11 0.00 -1.62 0.00 0.00 43.42 43.05 1llw n LEU 636 CO 0.39 -0.19 -0.20 0.11 -1.22 0.00 0.00 177.39 176.29 1llw h LYS 637 N 0.00 0.00 -6.79 3.23 1.79 0.14 -3.23 116.57 111.71 1llw h LYS 637 Ca 0.00 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 57.98 1llw h LYS 637 Cb 0.24 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.93 1llw h LYS 637 CO 0.00 0.90 -0.03 0.00 -1.08 0.00 0.00 179.45 179.24 1llw s ALA 638 N -2.35 4.47 -0.05 3.86 0.00 -1.26 -4.29 121.76 122.15 1llw s ALA 638 Ca -0.24 -2.11 -0.04 0.00 0.00 0.00 0.00 51.96 49.57 1llw s ALA 638 Cb 0.03 -1.57 0.02 0.00 0.00 0.00 0.00 23.12 21.59 1llw s ALA 638 CO 0.58 -1.10 0.13 -1.54 0.00 0.00 0.00 175.76 173.83 1llw s SER 639 N -4.73 -0.13 -0.08 0.00 1.04 -0.24 -4.76 113.70 104.81 1llw s SER 639 Ca 0.64 0.27 -0.18 0.00 0.48 0.00 0.00 55.95 57.16 1llw s SER 639 Cb -0.05 0.24 -0.05 0.00 0.10 0.00 0.00 66.02 66.26 1llw s SER 639 CO 0.41 -0.08 0.50 -0.76 0.98 0.00 0.00 173.24 174.29 1llw s LEU 640 N 0.45 4.33 -0.21 2.42 1.02 -1.26 -4.09 118.68 121.33 1llw s LEU 640 Ca -0.03 0.92 -0.08 0.00 0.02 0.00 0.00 54.13 54.96 1llw s LEU 640 Cb -0.05 -2.74 -0.04 0.00 0.02 0.00 0.00 46.19 43.38 1llw s LEU 640 CO -0.02 0.05 0.09 -0.63 0.02 0.00 0.00 176.35 175.86 1llw s ILE 641 N 0.27 4.81 -0.42 -0.59 1.01 -1.24 0.16 121.20 125.21 1llw s ILE 641 Ca 0.27 -0.02 -0.15 0.00 0.00 0.00 0.00 60.65 60.76 1llw s ILE 641 Cb -0.16 -3.20 0.03 0.00 0.01 0.00 0.00 42.46 39.14 1llw s ILE 641 CO 0.12 0.41 0.32 0.54 0.00 0.00 0.00 174.94 176.33 1llw s VAL 642 N 0.80 5.22 -0.86 2.92 0.11 -0.48 -1.71 120.40 126.41 1llw s VAL 642 Ca 0.05 -0.77 -0.11 0.00 -2.93 0.00 0.00 61.98 58.21 1llw s VAL 642 Cb -0.13 -3.96 0.22 0.00 -1.53 0.00 0.00 36.38 30.98 1llw s VAL 642 CO 0.02 -0.37 0.79 -0.62 -3.33 0.00 0.00 175.10 171.59 1llw s ASP 643 N 1.90 6.66 0.05 3.54 2.15 -0.98 -2.14 116.67 127.85 1llw s ASP 643 Ca 0.05 -2.91 0.04 0.00 0.43 0.00 0.00 52.55 50.16 1llw s ASP 643 Cb -0.20 -2.16 -0.02 0.00 -0.30 0.00 0.00 42.92 40.23 1llw s ASP 643 CO 0.09 -0.48 -0.13 0.28 -0.17 0.00 0.00 175.17 174.76 1llw s THR 644 N -0.18 0.97 0.07 1.71 -1.32 -0.95 -3.45 115.64 112.49 1llw s THR 644 Ca 0.20 -1.13 -0.18 0.00 -1.21 0.00 0.00 61.69 59.38 1llw s THR 644 Cb -0.11 -0.93 -0.11 0.00 -1.51 0.00 0.00 72.50 69.84 1llw s THR 644 CO -0.08 -0.17 1.41 0.00 -2.21 0.00 0.00 174.62 173.56 1llw h ALA 645 N 4.59 0.33 0.00 11.08 0.00 -1.90 -2.55 119.26 130.80 1llw h ALA 645 Ca -0.39 -0.34 -0.33 0.00 0.00 0.00 0.00 54.91 53.86 1llw h ALA 645 Cb 1.19 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.92 1llw h ALA 645 CO 0.42 0.24 2.30 0.94 0.00 0.00 0.00 179.25 183.14 1llw n GLN 646 N -4.45 1.66 -3.33 0.00 7.27 -1.26 -3.71 117.38 113.56 1llw n GLN 646 Ca -0.05 -1.31 0.02 0.00 0.07 0.00 0.00 57.00 55.74 1llw n GLN 646 Cb 0.38 -2.40 -0.02 0.00 2.41 0.00 0.00 30.24 30.61 1llw n GLN 646 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1llw n TRP 648 N 5.37 -0.01 -1.61 0.00 2.14 -1.26 -4.33 117.44 117.74 1llw n TRP 648 Ca -0.06 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.09 1llw n TRP 648 Cb 0.51 0.14 0.01 0.00 -0.81 0.00 0.00 31.31 31.16 1llw n TRP 648 CO 0.00 0.00 0.00 0.43 2.07 0.00 0.00 177.69 180.19 1llw n SER 649 N -1.78 1.33 -0.21 -0.67 7.64 -1.26 -4.93 113.62 113.74 1llw n SER 649 Ca 0.00 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1llw n SER 649 Cb 0.00 -1.35 0.11 0.00 -1.01 0.00 0.00 64.21 61.96 1llw n SER 649 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1llw h THR 650 N 1.63 0.75 -0.29 0.44 2.02 -1.94 -1.66 112.91 113.86 1llw h THR 650 Ca -0.44 -0.14 -0.10 0.00 0.77 0.00 0.00 66.41 66.50 1llw h THR 650 Cb 1.34 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1llw h THR 650 CO 0.57 0.07 -0.24 -0.74 0.37 0.00 0.00 175.52 175.55 1llw h HIS 651 N 0.40 0.62 -0.08 3.16 -0.00 -1.94 -2.86 115.15 114.45 1llw h HIS 651 Ca 0.31 -0.13 0.03 0.00 -0.00 0.00 0.00 60.37 60.58 1llw h HIS 651 Cb 0.40 -0.15 -0.03 0.00 -0.00 0.00 0.00 27.41 27.63 1llw h HIS 651 CO -0.18 0.75 -0.08 0.45 -0.00 0.00 0.00 177.93 178.87 1llw h HIS 652 N 0.49 -0.21 -0.93 5.26 -0.00 -1.71 0.00 115.15 118.06 1llw h HIS 652 Ca 0.07 0.01 0.08 0.00 -0.00 0.00 0.00 60.37 60.53 1llw h HIS 652 Cb 0.68 0.10 -0.06 0.00 -0.00 0.00 0.00 27.41 28.13 1llw h HIS 652 CO 0.03 -0.13 0.60 0.74 -0.00 0.00 0.00 177.93 179.17 1llw h PHE 653 N -0.11 1.06 -0.15 2.45 0.04 -1.11 -1.98 116.94 117.14 1llw h PHE 653 Ca 0.06 0.03 -0.21 0.00 2.80 0.00 0.00 57.97 60.65 1llw h PHE 653 Cb 0.19 -0.35 0.00 0.00 2.20 0.00 0.00 35.95 38.00 1llw h PHE 653 CO -0.19 0.53 -0.72 0.00 -0.60 0.00 0.00 178.31 177.32 1llw h ALA 654 N 1.51 0.43 -0.19 2.45 0.00 -1.16 -1.19 119.26 121.12 1llw h ALA 654 Ca 0.41 -0.59 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1llw h ALA 654 Cb 0.27 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1llw h ALA 654 CO -0.17 0.70 -0.20 0.00 0.00 0.00 0.00 179.25 179.58 1llw h LEU 656 N -0.22 -0.98 -0.60 0.00 4.07 -1.01 0.70 115.31 117.26 1llw h LEU 656 Ca 0.12 0.08 0.02 0.00 0.08 0.00 0.00 57.88 58.18 1llw h LEU 656 Cb 0.40 0.33 -0.03 0.00 1.08 0.00 0.00 40.66 42.44 1llw h LEU 656 CO -0.32 -0.51 0.38 0.58 -1.08 0.00 0.00 178.44 177.50 1llw h VAL 657 N -0.75 1.12 -0.29 1.22 2.07 -1.27 0.34 116.25 118.68 1llw h VAL 657 Ca -0.03 -0.26 0.07 0.00 0.82 0.00 0.00 66.70 67.30 1llw h VAL 657 Cb 0.68 0.28 -0.07 0.00 -1.52 0.00 0.00 31.29 30.65 1llw h VAL 657 CO -0.06 0.14 -0.17 1.23 0.02 0.00 0.00 177.57 178.73 1llw h GLY 658 N 0.77 0.04 -3.47 2.17 0.00 -0.09 0.73 103.07 103.22 1llw h GLY 658 Ca 0.23 0.21 -0.39 0.00 0.00 0.00 0.00 47.33 47.38 1llw h GLY 658 CO -0.07 -0.17 0.50 -1.72 0.00 0.00 0.00 176.54 175.08 1llw n TYR 659 N -5.34 2.17 0.00 5.60 4.02 0.17 -4.31 117.16 119.47 1llw n TYR 659 Ca 0.00 -1.72 0.00 0.00 -0.01 0.00 0.00 57.90 56.17 1llw n TYR 659 Cb 0.25 -0.86 0.00 0.00 -0.02 0.00 0.00 39.34 38.71 1llw n TYR 659 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1llw n GLY 660 N -0.51 1.31 3.75 2.72 0.00 0.25 -3.71 105.19 109.00 1llw n GLY 660 Ca 0.42 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.03 1llw n GLY 660 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 661 N -0.81 3.66 -0.51 4.61 0.00 0.11 -4.63 121.76 124.19 1llw s ALA 661 Ca 0.00 1.45 0.24 0.00 0.00 0.00 0.00 51.96 53.65 1llw s ALA 661 Cb 0.00 -3.59 0.37 0.00 0.00 0.00 0.00 23.12 19.90 1llw s ALA 661 CO 0.00 -0.87 1.45 0.77 0.00 0.00 0.00 175.76 177.11 1llw h SER 662 N 4.60 0.00 -5.97 0.00 0.02 0.12 -3.38 113.55 108.94 1llw h SER 662 Ca -0.47 -0.05 0.40 0.00 -0.84 0.00 0.00 61.79 60.82 1llw h SER 662 Cb 1.22 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.64 1llw h SER 662 CO 0.76 0.03 0.99 0.00 -1.14 0.00 0.00 176.83 177.46 1llw s ALA 663 N -3.21 -2.59 -0.19 3.77 0.00 -0.98 -4.76 121.76 113.81 1llw s ALA 663 Ca 0.06 0.67 -0.13 0.00 0.00 0.00 0.00 51.96 52.56 1llw s ALA 663 Cb 0.10 0.48 0.06 0.00 0.00 0.00 0.00 23.12 23.76 1llw s ALA 663 CO 0.69 -1.10 0.47 0.42 0.00 0.00 0.00 175.76 176.24 1llw s ILE 664 N -2.04 -0.01 -0.44 0.00 1.01 0.17 -1.38 121.20 118.52 1llw s ILE 664 Ca 0.21 0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.91 1llw s ILE 664 Cb 0.05 -0.68 0.12 0.00 0.01 0.00 0.00 42.46 41.96 1llw s ILE 664 CO -0.05 0.02 0.20 0.00 0.00 0.00 0.00 174.94 175.10 1llw n PRO 666 N 3.98 3.23 -0.11 0.00 -0.04 -1.25 -2.24 135.00 138.55 1llw n PRO 666 Ca 0.03 -3.22 -0.10 0.00 -0.04 0.00 0.00 63.50 60.17 1llw n PRO 666 Cb 0.39 -3.20 -0.02 0.00 -0.04 0.00 0.00 33.50 30.63 1llw n PRO 666 CO 0.00 0.00 0.00 0.10 -0.04 0.00 0.00 175.50 175.56 1llw h TYR 667 N 6.49 0.54 -0.11 0.54 -0.00 -1.73 0.19 116.97 122.89 1llw h TYR 667 Ca 0.45 -0.05 -0.03 0.00 0.00 0.00 0.00 58.73 59.11 1llw h TYR 667 Cb 0.73 -0.16 -0.00 0.00 0.00 0.00 0.00 36.73 37.30 1llw h TYR 667 CO 1.34 0.51 -0.05 1.25 -0.00 0.00 0.00 178.16 181.20 1llw h LEU 668 N 0.41 0.24 -0.46 0.10 6.46 -1.76 0.18 115.31 120.47 1llw h LEU 668 Ca 0.11 -0.41 0.08 0.00 -0.12 0.00 0.00 57.88 57.54 1llw h LEU 668 Cb 0.21 -0.07 -0.10 0.00 -0.73 0.00 0.00 40.66 39.98 1llw h LEU 668 CO -0.01 0.59 -0.42 0.00 -0.62 0.00 0.00 178.44 177.99 1llw h ALA 669 N 0.65 -0.36 -0.88 1.25 0.00 -1.51 0.26 119.26 118.67 1llw h ALA 669 Ca 0.03 0.08 0.14 0.00 0.00 0.00 0.00 54.91 55.16 1llw h ALA 669 Cb 0.50 0.89 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 1llw h ALA 669 CO 0.02 -0.83 0.57 -0.07 0.00 0.00 0.00 179.25 178.93 1llw h LEU 670 N -0.28 0.67 -1.30 0.00 3.38 -0.38 1.01 115.31 118.40 1llw h LEU 670 Ca 0.16 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1llw h LEU 670 Cb 0.57 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1llw h LEU 670 CO -0.61 0.35 0.22 -0.08 0.09 0.00 0.00 178.44 178.41 1llw h GLU 671 N 0.72 0.70 -0.01 1.13 4.57 0.25 -3.10 114.58 118.83 1llw h GLU 671 Ca 0.44 -0.09 -0.19 0.00 -1.18 0.00 0.00 59.36 58.34 1llw h GLU 671 Cb 0.67 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.11 1llw h GLU 671 CO -0.20 0.56 -0.82 0.77 -1.18 0.00 0.00 179.01 178.14 1llw h SER 672 N 0.70 0.27 0.13 1.04 0.02 0.42 -0.03 113.55 116.10 1llw h SER 672 Ca 0.17 -0.20 0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1llw h SER 672 Cb 0.10 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1llw h SER 672 CO -0.02 0.97 -0.40 0.58 -1.14 0.00 0.00 176.83 176.83 1llw h VAL 673 N 0.13 0.00 -0.49 2.27 2.07 -1.47 -1.25 116.25 117.50 1llw h VAL 673 Ca -0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1llw h VAL 673 Cb 1.42 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.13 1llw h VAL 673 CO 0.13 0.00 -0.29 0.54 0.02 0.00 0.00 177.57 177.97 1llw n ARG 674 N -4.72 -0.22 -0.10 1.57 1.74 -0.55 -1.14 116.66 113.24 1llw n ARG 674 Ca -0.07 1.23 -0.05 0.00 -0.77 0.00 0.00 57.85 58.18 1llw n ARG 674 Cb 0.32 -1.82 0.02 0.00 -1.02 0.00 0.00 32.46 29.95 1llw n ARG 674 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1llw h GLN 675 N 0.00 0.08 0.38 5.56 1.08 -1.06 0.50 115.11 121.65 1llw h GLN 675 Ca 0.08 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1llw h GLN 675 Cb 0.20 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 1llw h GLN 675 CO -0.46 0.05 -0.43 2.35 -0.95 0.00 0.00 178.83 179.40 1llw h TRP 676 N 0.08 -1.17 0.55 2.96 7.01 0.13 -2.92 115.95 122.59 1llw h TRP 676 Ca 0.18 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.17 1llw h TRP 676 Cb 0.25 0.46 -0.02 0.00 -2.10 0.00 0.00 29.16 27.75 1llw h TRP 676 CO -0.26 -0.57 -0.50 2.35 -2.79 0.00 0.00 178.44 176.67 1llw h TRP 677 N -0.84 -1.36 0.00 2.65 7.01 -1.05 -3.24 115.95 119.11 1llw h TRP 677 Ca -0.03 0.01 -0.40 0.00 2.11 0.00 0.00 58.89 60.57 1llw h TRP 677 Cb 0.76 0.52 0.02 0.00 -2.10 0.00 0.00 29.16 28.35 1llw h TRP 677 CO -0.25 -0.67 2.68 -0.11 -2.79 0.00 0.00 178.44 177.30 1llw n LEU 678 N -5.48 5.35 -3.80 0.65 -0.00 0.18 -3.87 117.00 110.02 1llw n LEU 678 Ca -0.12 -3.05 -0.12 0.00 -0.00 0.00 0.00 56.01 52.71 1llw n LEU 678 Cb 0.46 -1.14 -0.10 0.00 -0.00 0.00 0.00 43.42 42.64 1llw n LEU 678 CO 0.27 0.80 -0.07 -0.62 -0.00 0.00 0.00 177.39 177.77 1llw s ASP 679 N 3.23 -0.14 0.08 1.96 -1.08 -1.13 -4.68 116.67 114.91 1llw s ASP 679 Ca 0.43 0.12 -0.30 0.00 -0.52 0.00 0.00 52.55 52.29 1llw s ASP 679 Cb 0.11 0.34 -0.15 0.00 -1.46 0.00 0.00 42.92 41.76 1llw s ASP 679 CO -0.04 -0.31 1.65 1.05 0.52 0.00 0.00 175.17 178.04 1llw h GLU 680 N 4.58 -0.61 -0.88 4.34 -0.00 -1.89 -1.79 114.58 118.33 1llw h GLU 680 Ca -0.29 0.04 0.12 0.00 -0.00 0.00 0.00 59.36 59.23 1llw h GLU 680 Cb 1.19 0.14 -0.13 0.00 -0.00 0.00 0.00 28.75 29.94 1llw h GLU 680 CO 0.38 -0.41 -0.46 0.87 -0.00 0.00 0.00 179.01 179.40 1llw h LYS 681 N -0.63 -0.06 0.36 1.06 1.57 -1.94 -1.05 116.57 115.88 1llw h LYS 681 Ca -0.04 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1llw h LYS 681 Cb 0.53 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1llw h LYS 681 CO 0.04 -0.04 -0.17 1.15 -0.57 0.00 0.00 179.45 179.85 1llw h THR 682 N -0.06 0.00 -1.67 -0.16 2.02 -1.78 -2.49 112.91 108.77 1llw h THR 682 Ca 0.25 -0.09 0.52 0.00 0.77 0.00 0.00 66.41 67.86 1llw h THR 682 Cb 0.53 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.83 1llw h THR 682 CO -0.89 0.00 1.14 1.56 0.37 0.00 0.00 175.52 177.70 1llw h GLN 683 N -0.58 0.00 0.27 6.66 4.20 -1.18 -0.68 115.11 123.80 1llw h GLN 683 Ca -0.05 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1llw h GLN 683 Cb 0.37 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1llw h GLN 683 CO 0.08 0.00 -0.13 -0.22 -0.67 0.00 0.00 178.83 177.89 1llw h LYS 684 N 0.00 -0.35 -1.20 1.46 3.64 -0.98 -2.11 116.57 117.03 1llw h LYS 684 Ca 0.91 0.02 0.34 0.00 -1.27 0.00 0.00 60.65 60.66 1llw h LYS 684 Cb 3.29 0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 35.12 1llw h LYS 684 CO -0.25 -0.23 0.83 -0.07 -2.27 0.00 0.00 179.45 177.45 1llw h LEU 685 N -0.51 0.17 -1.22 5.20 3.38 -0.79 0.69 115.31 122.23 1llw h LEU 685 Ca -0.04 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1llw h LEU 685 Cb 0.28 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1llw h LEU 685 CO 0.06 0.01 -0.34 0.24 0.09 0.00 0.00 178.44 178.50 1llw h MET 686 N 0.14 0.00 0.00 1.13 2.86 -1.02 -0.71 114.93 117.33 1llw h MET 686 Ca 0.63 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.27 1llw h MET 686 Cb 2.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.81 1llw h MET 686 CO -0.15 0.34 0.00 0.39 1.06 0.00 0.00 176.91 178.55 1llw n GLU 687 N -3.75 0.04 0.00 1.72 1.02 0.24 -3.47 120.64 116.45 1llw n GLU 687 Ca -0.01 0.30 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 1llw n GLU 687 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 1llw n GLU 687 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1llw n ASN 688 N -1.43 0.00 0.00 1.62 6.94 -0.32 -5.08 115.26 116.99 1llw n ASN 688 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.59 1llw n ASN 688 Cb 0.10 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.52 1llw n ASN 688 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1llw n GLY 689 N 0.00 1.32 3.78 4.83 0.00 -0.91 -4.63 105.19 109.58 1llw n GLY 689 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1llw n GLY 689 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1llw s ARG 690 N 0.00 2.34 -0.54 1.61 0.52 -1.00 -4.98 118.95 116.90 1llw s ARG 690 Ca 0.00 1.10 -0.27 0.00 -0.52 0.00 0.00 55.73 56.04 1llw s ARG 690 Cb 0.00 -1.91 -0.01 0.00 0.52 0.00 0.00 34.95 33.55 1llw s ARG 690 CO 0.00 -1.57 1.72 -0.51 0.02 0.00 0.00 175.30 174.96 1llw s LEU 691 N -5.86 3.37 -1.42 2.53 1.43 -1.26 -4.29 118.68 113.17 1llw s LEU 691 Ca 0.61 0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 54.09 1llw s LEU 691 Cb -0.17 -2.90 0.05 0.00 0.03 0.00 0.00 46.19 43.21 1llw s LEU 691 CO 0.56 -2.04 2.12 -0.67 0.23 0.00 0.00 176.35 176.55 1llw n ASP 692 N 11.28 4.12 -2.60 2.29 2.03 -1.23 -4.14 116.55 128.29 1llw n ASP 692 Ca 0.18 -2.86 -0.13 0.00 0.52 0.00 0.00 54.79 52.51 1llw n ASP 692 Cb 0.50 -1.68 0.03 0.00 -0.72 0.00 0.00 41.12 39.25 1llw n ASP 692 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1llw n ARG 693 N 6.59 1.92 -2.93 -0.67 0.63 -1.26 -4.96 116.66 115.98 1llw n ARG 693 Ca 0.51 -3.64 -0.14 0.00 -0.92 0.00 0.00 57.85 53.66 1llw n ARG 693 Cb 0.41 -1.60 0.01 0.00 0.45 0.00 0.00 32.46 31.72 1llw n ARG 693 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1llw n ILE 694 N -0.28 -0.26 -0.77 5.15 2.08 -1.26 -4.92 119.36 119.10 1llw n ILE 694 Ca 0.18 -2.53 -0.32 0.00 0.56 0.00 0.00 62.75 60.64 1llw n ILE 694 Cb 0.79 0.16 0.16 0.00 -0.75 0.00 0.00 39.64 40.00 1llw n ILE 694 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 1llw n ASP 695 N 1.45 0.19 -0.28 4.38 5.75 -1.26 -4.79 116.55 121.98 1llw n ASP 695 Ca 0.14 0.44 -0.04 0.00 -0.01 0.00 0.00 54.79 55.32 1llw n ASP 695 Cb 0.60 -1.45 0.08 0.00 -1.03 0.00 0.00 41.12 39.31 1llw n ASP 695 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1llw h LEU 696 N -1.67 0.85 -1.12 -2.12 5.85 -2.00 -1.18 115.31 113.92 1llw h LEU 696 Ca -0.44 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.37 1llw h LEU 696 Cb 1.28 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 1llw h LEU 696 CO 0.41 0.61 0.80 -0.65 -0.34 0.00 0.00 178.44 179.27 1llw h PRO 697 N 1.01 0.00 0.01 5.25 0.11 -2.00 -1.15 132.00 135.22 1llw h PRO 697 Ca 0.29 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 66.02 1llw h PRO 697 Cb -0.07 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 30.97 1llw h PRO 697 CO -0.08 0.00 -2.41 2.41 -0.21 0.00 0.00 178.00 177.71 1llw n THR 698 N -3.01 1.47 0.00 -1.15 -1.04 -0.46 -2.91 114.28 107.17 1llw n THR 698 Ca 0.07 -0.68 -0.09 0.00 -2.04 0.00 0.00 64.05 61.31 1llw n THR 698 Cb 0.93 -1.10 -0.03 0.00 -1.82 0.00 0.00 70.33 68.31 1llw n THR 698 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1llw h ALA 699 N 0.37 -0.07 0.36 2.41 0.00 -1.03 0.11 119.26 121.42 1llw h ALA 699 Ca -0.56 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1llw h ALA 699 Cb 2.03 0.28 0.00 0.00 0.00 0.00 0.00 17.79 20.10 1llw h ALA 699 CO -0.04 -0.59 -0.18 -0.07 0.00 0.00 0.00 179.25 178.37 1llw h LEU 700 N -0.18 -0.42 -2.05 0.00 3.38 -1.56 -0.01 115.31 114.48 1llw h LEU 700 Ca 0.09 -0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.04 1llw h LEU 700 Cb 0.30 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1llw h LEU 700 CO -0.22 -0.06 0.34 0.50 0.09 0.00 0.00 178.44 179.09 1llw h LYS 701 N -0.81 0.00 -0.34 1.13 3.11 -1.53 0.83 116.57 118.97 1llw h LYS 701 Ca -0.05 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.72 1llw h LYS 701 Cb 0.53 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.75 1llw h LYS 701 CO 0.08 0.00 -0.07 -0.91 -2.81 0.00 0.00 179.45 175.74 1llw h ASN 702 N 0.00 0.65 -0.23 4.20 4.21 -0.71 -2.71 115.58 120.99 1llw h ASN 702 Ca 0.19 -0.36 -0.02 0.00 1.21 0.00 0.00 56.30 57.32 1llw h ASN 702 Cb 0.87 -0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.88 1llw h ASN 702 CO -0.00 0.86 0.06 0.22 -1.29 0.00 0.00 177.43 177.28 1llw h TYR 703 N 0.43 0.38 -0.08 1.19 3.20 0.27 -2.05 116.97 120.31 1llw h TYR 703 Ca 0.09 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1llw h TYR 703 Cb 0.57 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.73 1llw h TYR 703 CO 0.05 0.46 -0.00 -0.09 -1.64 0.00 0.00 178.16 176.94 1llw h ARG 704 N 0.20 0.15 0.00 1.82 2.43 -1.49 -2.72 114.38 114.77 1llw h ARG 704 Ca 0.07 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1llw h ARG 704 Cb 0.27 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1llw h ARG 704 CO 0.00 0.42 0.00 0.37 -1.51 0.00 0.00 179.97 179.25 1llw h GLN 705 N -0.14 0.00 0.00 0.20 4.15 -1.35 0.67 115.11 118.64 1llw h GLN 705 Ca 0.02 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.21 1llw h GLN 705 Cb 0.36 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.01 1llw h GLN 705 CO 0.00 0.00 -1.63 -1.13 -1.93 0.00 0.00 178.83 174.15 1llw n SER 706 N -2.93 0.78 -0.15 -0.69 3.41 -0.78 -3.01 113.62 110.25 1llw n SER 706 Ca -0.02 0.36 -0.12 0.00 -0.26 0.00 0.00 58.87 58.83 1llw n SER 706 Cb 0.11 0.17 -0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1llw n SER 706 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1llw h VAL 707 N 0.00 1.27 -0.21 -3.33 2.07 0.32 -2.76 116.25 113.61 1llw h VAL 707 Ca -0.24 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 65.90 1llw h VAL 707 Cb 1.80 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 1llw h VAL 707 CO 0.06 0.47 0.07 -0.33 0.02 0.00 0.00 177.57 177.86 1llw h GLU 708 N 0.76 0.33 0.00 1.57 5.08 -0.03 -0.29 114.58 122.01 1llw h GLU 708 Ca 0.10 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1llw h GLU 708 Cb 0.79 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 1llw h GLU 708 CO 0.06 0.41 -0.09 0.00 -1.00 0.00 0.00 179.01 178.40 1llw h ALA 709 N 0.90 1.62 0.13 3.43 0.00 -1.60 0.47 119.26 124.20 1llw h ALA 709 Ca 0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1llw h ALA 709 Cb 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1llw h ALA 709 CO -0.00 0.11 -0.06 0.78 0.00 0.00 0.00 179.25 180.07 1llw h GLY 710 N 0.37 -0.18 0.83 0.00 0.00 -1.13 -1.49 103.07 101.47 1llw h GLY 710 Ca -0.00 0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.42 1llw h GLY 710 CO 0.01 -0.06 0.12 1.41 0.00 0.00 0.00 176.54 178.01 1llw h LEU 711 N -0.61 0.16 -0.92 3.11 3.38 -0.74 -0.81 115.31 118.88 1llw h LEU 711 Ca -0.02 0.02 0.18 0.00 0.09 0.00 0.00 57.88 58.15 1llw h LEU 711 Cb 0.47 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.11 1llw h LEU 711 CO 0.03 0.13 0.50 -0.26 0.09 0.00 0.00 178.44 178.93 1llw h PHE 712 N 0.25 0.87 0.67 1.13 0.05 -0.87 -1.46 116.94 117.58 1llw h PHE 712 Ca 0.12 0.04 -0.03 0.00 3.82 0.00 0.00 57.97 61.91 1llw h PHE 712 Cb 0.06 -0.25 0.01 0.00 2.00 0.00 0.00 35.95 37.77 1llw h PHE 712 CO -0.11 0.15 -0.32 -0.22 -0.18 0.00 0.00 178.31 177.63 1llw h LYS 713 N 0.63 -0.87 -0.77 1.51 3.64 -0.43 -0.71 116.57 119.57 1llw h LYS 713 Ca 0.54 0.06 0.18 0.00 -1.27 0.00 0.00 60.65 60.15 1llw h LYS 713 Cb 0.86 0.20 -0.13 0.00 -0.41 0.00 0.00 32.23 32.75 1llw h LYS 713 CO -0.41 -0.58 0.11 0.82 -2.27 0.00 0.00 179.45 177.12 1llw h ILE 714 N -0.95 0.40 -0.49 2.00 2.04 -0.70 0.45 117.51 120.26 1llw h ILE 714 Ca -0.09 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1llw h ILE 714 Cb 0.69 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1llw h ILE 714 CO 0.15 0.03 0.17 -0.07 0.00 0.00 0.00 178.15 178.43 1llw h LEU 715 N 0.18 0.69 -1.92 1.44 3.38 -1.23 -2.34 115.31 115.51 1llw h LEU 715 Ca 0.44 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 1llw h LEU 715 Cb 0.80 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1llw h LEU 715 CO -0.61 0.70 -0.09 0.77 0.09 0.00 0.00 178.44 179.30 1llw h SER 716 N 0.65 0.00 -0.12 -0.43 4.64 0.13 0.39 113.55 118.81 1llw h SER 716 Ca 0.16 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.51 1llw h SER 716 Cb 0.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1llw h SER 716 CO -0.01 0.09 0.22 0.11 -0.87 0.00 0.00 176.83 176.37 1llw h LYS 717 N 0.00 0.00 -0.04 4.77 1.57 -0.18 -1.88 116.57 120.81 1llw h LYS 717 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1llw h LYS 717 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1llw h LYS 717 CO 0.01 0.00 0.00 -0.12 -0.57 0.00 0.00 179.45 178.77 1llw n MET 718 N -3.43 0.58 -1.65 3.15 0.00 0.13 -0.54 117.12 115.35 1llw n MET 718 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 57.70 56.68 1llw n MET 718 Cb 0.32 -1.08 -0.00 0.00 0.00 0.00 0.00 33.22 32.46 1llw n MET 718 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1llw n GLY 719 N 0.09 0.38 3.69 -5.12 0.00 -0.83 -4.64 105.19 98.76 1llw n GLY 719 Ca 0.03 -0.92 -0.38 0.00 0.00 0.00 0.00 46.02 44.74 1llw n GLY 719 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1llw s ILE 720 N -2.04 5.18 0.09 -0.61 1.01 -0.76 -4.52 121.20 119.55 1llw s ILE 720 Ca 0.00 0.83 0.09 0.00 0.00 0.00 0.00 60.65 61.58 1llw s ILE 720 Cb 0.00 -3.78 -0.13 0.00 0.01 0.00 0.00 42.46 38.57 1llw s ILE 720 CO 0.00 0.27 1.37 0.28 0.00 0.00 0.00 174.94 176.85 1llw h SER 721 N 7.12 0.00 -3.18 3.58 0.02 -1.89 -3.35 113.55 115.86 1llw h SER 721 Ca -0.37 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.04 1llw h SER 721 Cb 1.17 0.00 -0.37 0.00 0.14 0.00 0.00 62.40 63.34 1llw h SER 721 CO 0.74 0.84 -0.81 -0.76 -1.14 0.00 0.00 176.83 175.70 1llw s LEU 722 N -6.78 1.26 0.49 5.07 1.43 -1.26 -1.19 118.68 117.70 1llw s LEU 722 Ca 0.01 -0.34 0.41 0.00 -1.03 0.00 0.00 54.13 53.18 1llw s LEU 722 Cb 0.10 -0.89 1.61 0.00 0.03 0.00 0.00 46.19 47.04 1llw s LEU 722 CO 0.79 -0.11 1.56 -0.11 0.23 0.00 0.00 176.35 178.71 1llw n LEU 723 N 4.92 0.11 -0.02 1.79 7.94 -0.99 0.12 117.00 130.88 1llw n LEU 723 Ca -0.13 1.21 -0.10 0.00 -1.11 0.00 0.00 56.01 55.88 1llw n LEU 723 Cb 0.50 -0.60 -0.03 0.00 0.53 0.00 0.00 43.42 43.82 1llw n LEU 723 CO 0.17 -1.27 0.66 0.00 -1.11 0.00 0.00 177.39 175.84 1llw h ALA 724 N 1.32 -0.29 -0.33 1.96 0.00 -1.81 0.33 119.26 120.43 1llw h ALA 724 Ca 0.91 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.82 1llw h ALA 724 Cb 3.28 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 21.64 1llw h ALA 724 CO -0.26 -0.76 0.03 0.77 0.00 0.00 0.00 179.25 179.04 1llw h SER 725 N -0.35 0.55 -0.32 0.00 0.02 0.64 -2.68 113.55 111.41 1llw h SER 725 Ca 0.11 -0.28 0.09 0.00 -0.84 0.00 0.00 61.79 60.87 1llw h SER 725 Cb 0.52 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1llw h SER 725 CO -0.37 0.70 0.31 0.22 -1.14 0.00 0.00 176.83 176.55 1llw h TYR 726 N 0.39 0.00 -0.00 3.45 3.20 -0.59 -3.24 116.97 120.17 1llw h TYR 726 Ca 0.10 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 1llw h TYR 726 Cb 0.40 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1llw h TYR 726 CO 0.03 0.00 -0.02 1.25 -1.64 0.00 0.00 178.16 177.78 1llw h HIS 727 N 0.00 0.02 0.13 -3.82 2.76 0.00 -2.61 115.15 111.63 1llw h HIS 727 Ca 0.15 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1llw h HIS 727 Cb 0.77 -0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.70 1llw h HIS 727 CO 0.00 0.69 -0.35 0.78 -1.30 0.00 0.00 177.93 177.75 1llw h GLY 728 N -0.65 -1.17 -1.20 5.26 0.00 -1.68 -3.37 103.07 100.26 1llw h GLY 728 Ca -0.00 0.59 -0.36 0.00 0.00 0.00 0.00 47.33 47.56 1llw h GLY 728 CO 0.00 -0.34 -0.56 0.00 0.00 0.00 0.00 176.54 175.65 1llw n ALA 729 N -2.74 -3.07 -3.29 3.60 0.00 -0.98 -4.65 120.51 109.38 1llw n ALA 729 Ca -0.06 -1.32 -0.23 0.00 0.00 0.00 0.00 53.44 51.82 1llw n ALA 729 Cb 0.28 -1.35 -0.08 0.00 0.00 0.00 0.00 19.45 18.30 1llw n ALA 729 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1llw n GLN 730 N -2.91 0.24 -2.38 0.00 6.02 -1.26 -4.44 117.38 112.65 1llw n GLN 730 Ca 0.05 -2.99 -0.42 0.00 -0.01 0.00 0.00 57.00 53.63 1llw n GLN 730 Cb 0.52 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 30.15 1llw n GLN 730 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1llw n ILE 731 N 2.84 4.94 -3.70 5.09 5.41 -1.26 -4.77 119.36 127.91 1llw n ILE 731 Ca 0.28 -4.79 -0.11 0.00 1.00 0.00 0.00 62.75 59.13 1llw n ILE 731 Cb 0.49 -2.16 -0.06 0.00 -0.71 0.00 0.00 39.64 37.21 1llw n ILE 731 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1llw s PHE 732 N -1.04 -0.16 -0.08 1.39 0.40 -1.26 -2.42 117.98 114.81 1llw s PHE 732 Ca 0.42 -0.02 0.02 0.00 -0.60 0.00 0.00 56.93 56.75 1llw s PHE 732 Cb 0.12 0.17 0.01 0.00 0.51 0.00 0.00 43.02 43.83 1llw s PHE 732 CO -0.02 -0.59 -0.15 -2.00 0.70 0.00 0.00 175.22 173.17 1llw s GLU 733 N -3.03 2.04 -0.21 0.44 2.12 0.21 -4.62 118.70 115.65 1llw s GLU 733 Ca -0.02 -0.52 -0.15 0.00 0.36 0.00 0.00 54.97 54.64 1llw s GLU 733 Cb 0.01 -1.65 -0.04 0.00 0.26 0.00 0.00 34.13 32.70 1llw s GLU 733 CO -0.06 0.04 0.38 0.00 -0.54 0.00 0.00 175.26 175.07 1llw s ALA 734 N 0.66 3.56 -0.25 6.30 0.00 -0.26 -1.48 121.76 130.30 1llw s ALA 734 Ca -0.14 -0.57 -0.08 0.00 0.00 0.00 0.00 51.96 51.17 1llw s ALA 734 Cb -0.16 -2.61 -0.03 0.00 0.00 0.00 0.00 23.12 20.32 1llw s ALA 734 CO 0.04 -0.31 0.09 0.42 0.00 0.00 0.00 175.76 176.00 1llw s ILE 735 N 1.33 4.49 0.00 0.00 -1.09 0.11 -3.99 121.20 122.04 1llw s ILE 735 Ca 0.18 -0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.49 1llw s ILE 735 Cb -0.15 -3.11 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1llw s ILE 735 CO 0.08 0.33 0.00 0.61 -1.23 0.00 0.00 174.94 174.72 1llw n GLY 736 N 4.91 0.59 3.79 6.18 0.00 -1.26 -4.76 105.19 114.64 1llw n GLY 736 Ca -0.16 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 1llw n GLY 736 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llw s LEU 737 N 0.00 3.94 0.68 0.99 1.43 -1.26 -0.37 118.68 124.09 1llw s LEU 737 Ca 0.00 0.17 -0.11 0.00 -1.03 0.00 0.00 54.13 53.16 1llw s LEU 737 Cb 0.00 -2.29 0.00 0.00 0.03 0.00 0.00 46.19 43.94 1llw s LEU 737 CO 0.00 0.28 1.07 -0.83 0.23 0.00 0.00 176.35 177.10 1llw s GLY 738 N -1.72 1.63 0.15 -3.19 0.00 0.57 -1.62 107.32 103.14 1llw s GLY 738 Ca 0.23 -0.33 -0.17 0.00 0.00 0.00 0.00 44.72 44.45 1llw s GLY 738 CO 0.14 0.02 1.71 0.00 0.00 0.00 0.00 173.10 174.96 1llw h ALA 739 N -0.56 0.30 -0.23 3.20 0.00 -1.85 -0.20 119.26 119.91 1llw h ALA 739 Ca -0.45 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 1llw h ALA 739 Cb 1.24 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1llw h ALA 739 CO 0.63 -0.40 -0.06 0.93 0.00 0.00 0.00 179.25 180.35 1llw h GLU 740 N 0.09 0.44 -0.73 0.00 3.07 -1.93 -1.09 114.58 114.43 1llw h GLU 740 Ca 0.16 -0.17 0.16 0.00 -0.50 0.00 0.00 59.36 59.02 1llw h GLU 740 Cb 0.22 -0.02 -0.12 0.00 -0.84 0.00 0.00 28.75 27.98 1llw h GLU 740 CO -0.27 0.68 0.05 1.25 -1.40 0.00 0.00 179.01 179.32 1llw h LEU 741 N 0.17 -0.24 -0.42 1.33 5.85 -1.79 -0.16 115.31 120.05 1llw h LEU 741 Ca 0.06 0.18 -0.17 0.00 0.84 0.00 0.00 57.88 58.78 1llw h LEU 741 Cb 0.52 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 41.84 1llw h LEU 741 CO 0.02 -0.14 -0.59 0.58 -0.34 0.00 0.00 178.44 177.97 1llw h VAL 742 N 0.14 1.31 -0.37 1.05 2.07 -0.29 -2.59 116.25 117.57 1llw h VAL 742 Ca 0.40 -1.84 -0.13 0.00 0.82 0.00 0.00 66.70 65.95 1llw h VAL 742 Cb 0.71 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1llw h VAL 742 CO -0.61 0.58 -0.28 -0.08 0.02 0.00 0.00 177.57 177.20 1llw h GLU 743 N 0.47 0.78 -0.48 1.57 4.57 -0.87 0.60 114.58 121.22 1llw h GLU 743 Ca -0.00 -0.34 -0.11 0.00 -1.18 0.00 0.00 59.36 57.73 1llw h GLU 743 Cb 1.16 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 1llw h GLU 743 CO 0.12 0.96 -0.14 -0.92 -1.18 0.00 0.00 179.01 177.85 1llw h TYR 744 N 0.67 1.01 0.00 0.92 3.20 -0.89 -3.37 116.97 118.51 1llw h TYR 744 Ca 0.08 -0.21 -0.11 0.00 3.14 0.00 0.00 58.73 61.63 1llw h TYR 744 Cb 0.81 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 1llw h TYR 744 CO 0.04 0.97 -1.40 0.00 -1.64 0.00 0.00 178.16 176.14 1llw n ALA 745 N -2.50 2.26 -3.06 1.82 0.00 -0.99 -4.62 120.51 113.42 1llw n ALA 745 Ca 0.01 -0.29 -0.26 0.00 0.00 0.00 0.00 53.44 52.90 1llw n ALA 745 Cb 0.40 0.38 -0.05 0.00 0.00 0.00 0.00 19.45 20.19 1llw n ALA 745 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1llw n PHE 746 N -3.08 3.29 -1.65 0.00 3.01 0.16 -3.95 117.46 115.25 1llw n PHE 746 Ca -0.13 -3.99 -0.46 0.00 1.01 0.00 0.00 57.45 53.88 1llw n PHE 746 Cb 0.61 -0.49 -0.03 0.00 -0.01 0.00 0.00 39.48 39.57 1llw n PHE 746 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1llw n ALA 747 N 0.07 0.59 -1.34 4.37 0.00 -0.94 -2.83 120.51 120.42 1llw n ALA 747 Ca 0.30 0.42 -0.09 0.00 0.00 0.00 0.00 53.44 54.07 1llw n ALA 747 Cb 0.44 -2.20 -0.04 0.00 0.00 0.00 0.00 19.45 17.65 1llw n ALA 747 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llw n GLY 748 N 2.04 0.98 3.83 0.00 0.00 -1.26 -5.01 105.19 105.77 1llw n GLY 748 Ca 0.12 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 1llw n GLY 748 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1llw s THR 749 N -2.35 5.15 0.27 2.61 2.01 -1.13 -5.07 115.64 117.13 1llw s THR 749 Ca 0.00 0.70 -0.29 0.00 0.31 0.00 0.00 61.69 62.41 1llw s THR 749 Cb 0.00 -3.65 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 1llw s THR 749 CO 0.00 0.56 0.95 0.28 -0.69 0.00 0.00 174.62 175.71 1llw s THR 750 N -0.85 4.09 -0.49 -0.82 -1.32 -1.26 -4.86 115.64 110.13 1llw s THR 750 Ca 0.21 1.99 0.06 0.00 -1.21 0.00 0.00 61.69 62.75 1llw s THR 750 Cb -0.15 -4.22 0.20 0.00 -1.51 0.00 0.00 72.50 66.81 1llw s THR 750 CO 0.11 0.39 0.70 -0.24 -2.21 0.00 0.00 174.62 173.36 1llw n SER 751 N 1.20 -2.81 -0.34 8.08 2.88 -1.26 -1.10 113.62 120.28 1llw n SER 751 Ca -0.01 -2.90 0.06 0.00 -1.33 0.00 0.00 58.87 54.68 1llw n SER 751 Cb 0.48 1.36 0.22 0.00 -0.75 0.00 0.00 64.21 65.51 1llw n SER 751 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1llw n ARG 752 N 2.63 1.43 0.00 -1.46 1.74 -1.26 -3.37 116.66 116.38 1llw n ARG 752 Ca 0.18 -0.66 0.00 0.00 -0.77 0.00 0.00 57.85 56.60 1llw n ARG 752 Cb 0.56 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 1llw n ARG 752 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1llw n VAL 753 N -0.02 0.00 -2.90 1.55 3.14 -1.26 -4.36 118.33 114.48 1llw n VAL 753 Ca 0.10 0.00 -0.00 0.00 -2.96 0.00 0.00 64.34 61.47 1llw n VAL 753 Cb 0.18 -0.37 -0.00 0.00 -1.06 0.00 0.00 33.84 32.59 1llw n VAL 753 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1llw n GLY 754 N 1.62 -2.60 0.00 7.55 0.00 -1.22 0.42 105.19 110.97 1llw n GLY 754 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1llw n GLY 754 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llw n GLY 755 N 1.04 0.13 3.47 -0.02 0.00 -0.64 -3.91 105.19 105.25 1llw n GLY 755 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1llw n GLY 755 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1llw n LEU 756 N -0.87 0.13 0.00 0.99 4.32 0.50 -3.49 117.00 118.58 1llw n LEU 756 Ca 0.00 0.96 -0.19 0.00 -0.02 0.00 0.00 56.01 56.76 1llw n LEU 756 Cb 0.00 -1.13 -0.00 0.00 -1.62 0.00 0.00 43.42 40.67 1llw n LEU 756 CO 0.00 -2.70 0.05 0.41 -1.22 0.00 0.00 177.39 173.92 1llw n THR 757 N -0.67 0.00 -0.06 -5.08 -1.04 -1.26 -0.31 114.28 105.85 1llw n THR 757 Ca 0.12 -1.60 -0.11 0.00 -2.04 0.00 0.00 64.05 60.42 1llw n THR 757 Cb 0.38 -0.14 -0.04 0.00 -1.82 0.00 0.00 70.33 68.70 1llw n THR 757 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1llw h ILE 758 N 0.63 1.18 -0.75 12.58 2.04 -1.97 -1.68 117.51 129.55 1llw h ILE 758 Ca -0.26 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 1llw h ILE 758 Cb 0.93 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 1llw h ILE 758 CO 0.40 0.18 0.43 0.00 0.00 0.00 0.00 178.15 179.16 1llw h ALA 759 N 0.90 0.96 -0.59 1.87 0.00 -1.98 -1.16 119.26 119.28 1llw h ALA 759 Ca 0.07 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1llw h ALA 759 Cb 0.21 -0.30 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 1llw h ALA 759 CO -0.00 0.45 0.12 -0.44 0.00 0.00 0.00 179.25 179.38 1llw h ASP 760 N 1.03 -0.01 -0.67 0.00 3.32 -1.76 0.14 116.42 118.48 1llw h ASP 760 Ca 0.27 0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.38 1llw h ASP 760 Cb 0.00 0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1llw h ASP 760 CO -0.05 0.01 0.24 -0.37 -1.72 0.00 0.00 179.24 177.35 1llw h VAL 761 N 0.25 1.25 -0.87 -1.35 -1.51 -0.96 -2.93 116.25 110.13 1llw h VAL 761 Ca 0.31 -0.81 0.21 0.00 -1.23 0.00 0.00 66.70 65.18 1llw h VAL 761 Cb 0.45 0.51 -0.06 0.00 -2.13 0.00 0.00 31.29 30.06 1llw h VAL 761 CO -0.40 0.32 0.59 0.00 -1.23 0.00 0.00 177.57 176.85 1llw h ALA 762 N 1.10 2.31 -0.01 5.19 0.00 0.51 -2.08 119.26 126.29 1llw h ALA 762 Ca 0.22 0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.91 1llw h ALA 762 Cb 0.25 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1llw h ALA 762 CO -0.01 -0.58 -0.87 0.78 0.00 0.00 0.00 179.25 178.57 1llw h GLY 763 N 0.32 0.67 0.75 0.00 0.00 -1.11 -2.31 103.07 101.40 1llw h GLY 763 Ca 0.45 -1.16 0.02 0.00 0.00 0.00 0.00 47.33 46.63 1llw h GLY 763 CO -0.14 1.03 -0.09 0.83 0.00 0.00 0.00 176.54 178.17 1llw h GLU 764 N 0.22 -0.14 -0.26 4.80 5.08 -1.48 -0.72 114.58 122.09 1llw h GLU 764 Ca -0.11 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.34 1llw h GLU 764 Cb 1.54 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.81 1llw h GLU 764 CO 0.17 -0.09 0.20 -0.39 -1.00 0.00 0.00 179.01 177.90 1llw h VAL 765 N -0.14 0.76 0.00 3.13 -1.51 -1.27 0.22 116.25 117.45 1llw h VAL 765 Ca 0.04 0.00 -0.12 0.00 -1.23 0.00 0.00 66.70 65.39 1llw h VAL 765 Cb 0.19 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 30.19 1llw h VAL 765 CO -0.11 0.00 -0.56 0.24 -1.23 0.00 0.00 177.57 175.92 1llw h MET 766 N 0.00 0.00 -0.14 5.19 2.86 -0.96 -1.33 114.93 120.55 1llw h MET 766 Ca 0.12 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 1llw h MET 766 Cb 0.52 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1llw h MET 766 CO -0.00 0.56 0.03 0.28 1.06 0.00 0.00 176.91 178.84 1llw h VAL 767 N 0.00 1.20 -0.41 -2.22 2.07 0.97 0.74 116.25 118.59 1llw h VAL 767 Ca -0.01 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1llw h VAL 767 Cb 1.13 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1llw h VAL 767 CO 0.07 0.18 0.00 0.49 0.02 0.00 0.00 177.57 178.34 1llw n PHE 768 N -4.84 0.54 0.05 1.57 0.99 -1.11 -3.39 117.46 111.27 1llw n PHE 768 Ca -0.05 -0.27 -0.07 0.00 -0.00 0.00 0.00 57.45 57.06 1llw n PHE 768 Cb 0.16 0.00 -0.12 0.00 -1.00 0.00 0.00 39.48 38.51 1llw n PHE 768 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1llw h HIS 769 N 3.92 0.01 -1.01 1.38 -0.00 -1.22 -3.26 115.15 114.98 1llw h HIS 769 Ca 0.00 -0.01 0.27 0.00 -0.00 0.00 0.00 60.37 60.63 1llw h HIS 769 Cb 0.87 -0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 28.21 1llw h HIS 769 CO 0.27 1.01 0.69 0.78 -0.00 0.00 0.00 177.93 180.67 1llw h GLY 770 N 3.00 0.61 -3.25 5.26 0.00 -0.86 -3.29 103.07 104.55 1llw h GLY 770 Ca -0.04 -0.11 -0.46 0.00 0.00 0.00 0.00 47.33 46.73 1llw h GLY 770 CO 0.13 -0.05 -0.03 1.03 0.00 0.00 0.00 176.54 177.61 1llw n MET 771 N -4.43 2.68 0.00 4.80 2.00 -1.24 -4.27 117.12 116.66 1llw n MET 771 Ca 0.23 -3.54 0.00 0.00 0.00 0.00 0.00 57.70 54.39 1llw n MET 771 Cb 0.94 -2.12 0.00 0.00 0.00 0.00 0.00 33.22 32.04 1llw n MET 771 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1llw n ALA 772 N -0.94 0.31 -0.52 3.04 0.00 -1.24 -4.85 120.51 116.31 1llw n ALA 772 Ca 0.46 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1llw n ALA 772 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.40 1llw n ALA 772 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1llw n PHE 773 N 0.00 -0.05 0.35 0.00 0.99 -1.26 -4.83 117.46 112.66 1llw n PHE 773 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.45 57.59 1llw n PHE 773 Cb 0.33 0.24 0.52 0.00 -1.00 0.00 0.00 39.48 39.57 1llw n PHE 773 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 1llw h PRO 774 N 0.00 0.00 0.00 -1.08 0.13 -1.87 -3.43 132.00 125.75 1llw h PRO 774 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1llw h PRO 774 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1llw h PRO 774 CO 0.00 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.16 1llw n GLU 775 N -2.73 0.00 -0.28 0.86 1.02 -1.26 -5.17 120.64 113.08 1llw n GLU 775 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1llw n GLU 775 Cb 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.75 1llw n GLU 775 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1llw n MET 776 N 0.00 0.00 -3.36 3.49 2.81 -1.26 -5.05 117.12 113.74 1llw n MET 776 Ca 0.00 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.91 1llw n MET 776 Cb 0.00 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 32.46 1llw n MET 776 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1llw s ALA 777 N -1.51 -2.95 0.00 3.04 0.00 -1.26 -4.36 121.76 114.72 1llw s ALA 777 Ca 0.00 1.92 0.00 0.00 0.00 0.00 0.00 51.96 53.88 1llw s ALA 777 Cb 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.99 1llw s ALA 777 CO 0.00 -0.79 0.00 0.36 0.00 0.00 0.00 175.76 175.33 1llw n LYS 778 N 4.29 0.00 -3.71 0.00 2.85 -1.26 -5.08 118.16 115.25 1llw n LYS 778 Ca -0.10 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.04 1llw n LYS 778 Cb 0.55 -0.32 -0.10 0.00 -0.65 0.00 0.00 35.03 34.51 1llw n LYS 778 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1llw s LYS 779 N -1.31 0.46 0.57 -1.58 1.02 -1.26 -5.09 119.74 112.55 1llw s LYS 779 Ca 0.00 0.73 -0.20 0.00 0.02 0.00 0.00 55.97 56.52 1llw s LYS 779 Cb 0.00 0.11 -0.06 0.00 -0.52 0.00 0.00 37.83 37.36 1llw s LYS 779 CO 0.00 -0.11 1.02 1.28 -0.92 0.00 0.00 175.35 176.62 1llw n LEU 780 N 3.61 3.79 -4.75 3.17 4.77 -1.26 -4.86 117.00 121.47 1llw n LEU 780 Ca -0.19 0.86 -0.35 0.00 -0.03 0.00 0.00 56.01 56.30 1llw n LEU 780 Cb 0.56 -1.41 0.05 0.00 -2.33 0.00 0.00 43.42 40.29 1llw n LEU 780 CO 0.09 -1.64 0.80 -0.70 -1.33 0.00 0.00 177.39 174.62 1llw s GLU 781 N -2.68 2.72 -0.30 3.23 2.12 -1.26 -4.14 118.70 118.39 1llw s GLU 781 Ca 0.74 1.70 -0.07 0.00 0.36 0.00 0.00 54.97 57.70 1llw s GLU 781 Cb -0.43 -1.91 0.02 0.00 0.26 0.00 0.00 34.13 32.06 1llw s GLU 781 CO 0.49 -1.37 0.09 1.21 -0.54 0.00 0.00 175.26 175.13 1llw s ASN 782 N -1.93 5.17 -0.08 -1.70 3.84 -1.26 -0.69 114.94 118.29 1llw s ASN 782 Ca 0.74 -0.79 -0.04 0.00 0.21 0.00 0.00 52.86 52.98 1llw s ASN 782 Cb -0.28 -1.88 -0.04 0.00 -0.55 0.00 0.00 41.25 38.51 1llw s ASN 782 CO 0.38 -0.22 0.08 -0.36 -2.79 0.00 0.00 177.10 174.19 1llw s PHE 783 N 1.48 3.38 -1.37 0.43 0.40 -1.26 -4.61 117.98 116.43 1llw s PHE 783 Ca 0.02 0.34 -0.14 0.00 -0.60 0.00 0.00 56.93 56.54 1llw s PHE 783 Cb -0.18 -1.84 0.08 0.00 0.51 0.00 0.00 43.02 41.59 1llw s PHE 783 CO 0.03 0.60 1.98 0.41 0.70 0.00 0.00 175.22 178.94 1llw n GLY 784 N 1.84 3.89 0.10 4.36 0.00 -1.26 -4.67 105.19 109.44 1llw n GLY 784 Ca -0.18 -1.67 -0.18 0.00 0.00 0.00 0.00 46.02 43.99 1llw n GLY 784 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1llw h PHE 785 N 6.48 0.35 0.00 1.61 0.05 -1.94 -3.26 116.94 120.22 1llw h PHE 785 Ca 0.49 -0.25 -0.14 0.00 3.82 0.00 0.00 57.97 61.89 1llw h PHE 785 Cb 0.72 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.64 1llw h PHE 785 CO 1.39 1.22 -0.67 0.28 -0.18 0.00 0.00 178.31 180.35 1llw h VAL 786 N -0.59 1.45 -2.70 -0.55 2.07 -1.99 -3.46 116.25 110.47 1llw h VAL 786 Ca -0.10 -2.33 -0.12 0.00 0.82 0.00 0.00 66.70 64.97 1llw h VAL 786 Cb 1.42 2.27 -0.25 0.00 -1.52 0.00 0.00 31.29 33.21 1llw h VAL 786 CO 0.09 0.66 -0.26 0.21 0.02 0.00 0.00 177.57 178.29 1llw s ASN 787 N -6.79 -0.47 0.08 0.57 3.84 -1.23 -5.07 114.94 105.87 1llw s ASN 787 Ca -0.01 0.86 -0.35 0.00 0.21 0.00 0.00 52.86 53.57 1llw s ASN 787 Cb 0.12 0.81 -0.15 0.00 -0.55 0.00 0.00 41.25 41.48 1llw s ASN 787 CO 0.77 -0.17 1.53 0.00 -2.79 0.00 0.00 177.10 176.44 1llw n TYR 788 N 3.48 1.98 -4.20 0.43 9.36 -1.26 -4.35 117.16 122.60 1llw n TYR 788 Ca -0.18 0.40 -0.17 0.00 3.32 0.00 0.00 57.90 61.27 1llw n TYR 788 Cb 0.56 -2.47 -0.12 0.00 -0.63 0.00 0.00 39.34 36.68 1llw n TYR 788 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1llw s ARG 789 N 1.26 0.74 0.00 2.98 0.52 -1.26 -5.01 118.95 118.18 1llw s ARG 789 Ca 0.84 -0.76 0.00 0.00 -0.52 0.00 0.00 55.73 55.29 1llw s ARG 789 Cb -0.81 -0.68 0.00 0.00 0.52 0.00 0.00 34.95 33.98 1llw s ARG 789 CO 0.45 0.16 0.83 -2.30 0.02 0.00 0.00 175.30 174.45 1llw n PRO 790 N 1.70 0.00 0.18 3.54 -0.02 -1.26 -3.51 135.00 135.63 1llw n PRO 790 Ca -0.20 0.83 0.18 0.00 -2.02 0.00 0.00 63.50 62.29 1llw n PRO 790 Cb 0.55 -1.31 0.81 0.00 -0.02 0.00 0.00 33.50 33.53 1llw n PRO 790 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1llw h GLY 791 N 0.00 0.00 0.00 -1.23 0.00 -1.98 -3.47 103.07 96.39 1llw h GLY 791 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1llw h GLY 791 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1llw n GLY 792 N -1.41 4.72 3.62 4.60 0.00 -1.23 -4.92 105.19 110.56 1llw n GLY 792 Ca 0.03 -2.06 -0.38 0.00 0.00 0.00 0.00 46.02 43.61 1llw n GLY 792 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1llw n GLU 793 N -0.07 0.97 -0.60 1.61 4.07 -1.26 -4.67 120.64 120.69 1llw n GLU 793 Ca 0.00 0.37 -0.29 0.00 -0.06 0.00 0.00 57.16 57.18 1llw n GLU 793 Cb 0.00 -2.17 0.26 0.00 -0.06 0.00 0.00 31.44 29.47 1llw n GLU 793 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 1llw s TYR 794 N -1.49 0.84 -0.30 4.31 5.04 -1.26 -4.61 117.35 119.88 1llw s TYR 794 Ca 0.74 0.93 -0.10 0.00 -2.44 0.00 0.00 57.07 56.20 1llw s TYR 794 Cb -0.43 -3.08 0.13 0.00 0.35 0.00 0.00 41.96 38.93 1llw s TYR 794 CO 0.48 -4.12 0.65 -1.01 -1.34 0.00 0.00 175.55 170.21 1llw s HIS 795 N -2.49 -1.34 0.51 4.97 3.76 -1.26 -4.55 115.29 114.89 1llw s HIS 795 Ca 0.68 2.33 0.22 0.00 -0.15 0.00 0.00 55.06 58.14 1llw s HIS 795 Cb -0.20 0.80 1.31 0.00 1.11 0.00 0.00 32.58 35.60 1llw s HIS 795 CO 0.62 -0.66 2.00 0.52 -0.85 0.00 0.00 174.74 176.37 1llw h MET 796 N 7.96 0.08 -5.78 1.40 2.86 -1.86 -3.38 114.93 116.21 1llw h MET 796 Ca -0.18 -0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 56.88 1llw h MET 796 Cb 1.10 -0.02 -0.29 0.00 0.06 0.00 0.00 31.60 32.45 1llw h MET 796 CO 0.10 0.05 -0.84 -0.80 1.06 0.00 0.00 176.91 176.48 1llw s ASN 797 N -6.29 2.19 0.04 1.22 0.01 -1.26 -5.02 114.94 105.82 1llw s ASN 797 Ca -0.06 -0.34 -0.11 0.00 -0.71 0.00 0.00 52.86 51.64 1llw s ASN 797 Cb 0.19 -0.26 0.01 0.00 0.41 0.00 0.00 41.25 41.61 1llw s ASN 797 CO 0.73 0.23 0.24 -0.94 -1.51 0.00 0.00 177.10 175.85 1llw s SER 798 N -0.42 -0.03 0.36 -1.22 1.04 -1.26 -4.90 113.70 107.26 1llw s SER 798 Ca 0.07 -0.30 0.07 0.00 0.48 0.00 0.00 55.95 56.28 1llw s SER 798 Cb -0.07 0.32 0.67 0.00 0.10 0.00 0.00 66.02 67.04 1llw s SER 798 CO -0.01 -0.58 1.86 -0.65 0.98 0.00 0.00 173.24 174.85 1llw h PRO 799 N 3.37 0.32 0.14 4.02 0.11 -1.93 -1.25 132.00 136.77 1llw h PRO 799 Ca -0.32 -0.08 -0.23 0.00 0.11 0.00 0.00 66.00 65.48 1llw h PRO 799 Cb 1.19 -0.04 0.02 0.00 0.11 0.00 0.00 31.00 32.29 1llw h PRO 799 CO 0.47 0.47 -0.97 1.05 -0.21 0.00 0.00 178.00 178.81 1llw h GLU 800 N 0.30 0.41 -0.88 1.05 9.09 -2.00 -1.81 114.58 120.75 1llw h GLU 800 Ca 0.06 -0.63 0.21 0.00 0.05 0.00 0.00 59.36 59.05 1llw h GLU 800 Cb 0.44 0.22 -0.16 0.00 -1.65 0.00 0.00 28.75 27.61 1llw h GLU 800 CO 0.03 1.28 -0.03 1.98 0.05 0.00 0.00 179.01 182.32 1llw h MET 801 N -0.13 0.05 0.07 1.06 -1.53 -1.93 -2.98 114.93 109.53 1llw h MET 801 Ca -0.16 -0.00 -0.29 0.00 -3.44 0.00 0.00 59.70 55.80 1llw h MET 801 Cb 1.73 -0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 32.75 1llw h MET 801 CO 0.18 0.03 -1.55 0.66 0.14 0.00 0.00 176.91 176.38 1llw h SER 802 N 0.05 0.22 -0.83 1.39 4.64 -1.19 -2.70 113.55 115.14 1llw h SER 802 Ca 0.49 -0.35 0.18 0.00 -0.47 0.00 0.00 61.79 61.64 1llw h SER 802 Cb 0.90 -0.07 -0.15 0.00 -0.31 0.00 0.00 62.40 62.77 1llw h SER 802 CO -0.82 1.29 -0.13 0.11 -0.87 0.00 0.00 176.83 176.41 1llw h LYS 803 N 0.04 0.02 0.04 4.77 1.57 -1.28 0.08 116.57 121.80 1llw h LYS 803 Ca -0.24 -0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.28 1llw h LYS 803 Cb 1.98 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 34.30 1llw h LYS 803 CO 0.13 0.02 -1.06 0.66 -0.57 0.00 0.00 179.45 178.62 1llw h SER 804 N 0.02 0.72 -0.95 0.86 4.64 -1.54 -2.02 113.55 115.29 1llw h SER 804 Ca 0.42 -0.60 0.06 0.00 -0.47 0.00 0.00 61.79 61.19 1llw h SER 804 Cb 0.70 -0.22 -0.06 0.00 -0.31 0.00 0.00 62.40 62.51 1llw h SER 804 CO -0.81 1.41 0.62 0.25 -0.87 0.00 0.00 176.83 177.43 1llw h LEU 805 N 0.28 0.98 -0.52 5.97 5.85 -1.13 -0.23 115.31 126.51 1llw h LEU 805 Ca -0.12 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 1llw h LEU 805 Cb 1.72 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.52 1llw h LEU 805 CO 0.20 0.64 0.07 -0.74 -0.34 0.00 0.00 178.44 178.27 1llw h HIS 806 N 1.12 0.92 0.00 1.25 2.76 -0.86 -2.67 115.15 117.67 1llw h HIS 806 Ca 0.40 -0.14 -0.10 0.00 -2.20 0.00 0.00 60.37 58.33 1llw h HIS 806 Cb 0.13 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 28.83 1llw h HIS 806 CO -0.00 0.84 -0.50 0.87 -1.30 0.00 0.00 177.93 177.84 1llw h LYS 807 N 0.74 0.00 0.55 5.26 1.57 -0.60 -0.96 116.57 123.14 1llw h LYS 807 Ca 0.15 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1llw h LYS 807 Cb 0.42 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1llw h LYS 807 CO 0.01 0.50 -0.48 0.00 -0.57 0.00 0.00 179.45 178.91 1llw h ALA 808 N 1.50 -1.12 -0.21 3.86 0.00 -0.77 -2.98 119.26 119.55 1llw h ALA 808 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1llw h ALA 808 Cb 0.98 0.67 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1llw h ALA 808 CO 0.06 -1.16 -0.06 0.28 0.00 0.00 0.00 179.25 178.37 1llw h VAL 809 N -1.02 1.17 -0.75 0.00 2.07 -1.14 -1.86 116.25 114.71 1llw h VAL 809 Ca -0.07 -0.69 0.16 0.00 0.82 0.00 0.00 66.70 66.93 1llw h VAL 809 Cb 0.87 1.08 -0.11 0.00 -1.52 0.00 0.00 31.29 31.61 1llw h VAL 809 CO -0.03 0.22 0.23 0.00 0.02 0.00 0.00 177.57 178.02 1llw h ALA 810 N 1.64 1.02 0.20 1.67 0.00 -1.14 -3.32 119.26 119.33 1llw h ALA 810 Ca 0.07 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1llw h ALA 810 Cb 0.30 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1llw h ALA 810 CO 0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 179.25 178.87 1llw h ALA 811 N 1.60 -0.46 0.00 0.00 0.00 -1.18 -3.49 119.26 115.73 1llw h ALA 811 Ca 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1llw h ALA 811 Cb 0.71 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1llw h ALA 811 CO -0.48 -0.44 0.00 0.98 0.00 0.00 0.00 179.25 179.31 1llw n TYR 812 N -3.58 0.00 0.00 0.00 9.36 -1.19 -5.15 117.16 116.59 1llw n TYR 812 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 1llw n TYR 812 Cb 0.11 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.82 1llw n TYR 812 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 1llw n TYR 824 N 0.00 -0.84 0.20 2.98 -0.00 -1.26 -5.07 117.16 113.17 1llw n TYR 824 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.90 57.98 1llw n TYR 824 Cb 0.00 0.17 0.33 0.00 -0.00 0.00 0.00 39.34 39.84 1llw n TYR 824 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.86 176.42 1llw h ASP 825 N 0.00 0.00 0.12 2.98 3.32 -2.00 -3.33 116.42 117.51 1llw h ASP 825 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1llw h ASP 825 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1llw h ASP 825 CO 0.00 0.27 -0.05 0.45 -1.72 0.00 0.00 179.24 178.19 1llw h HIS 826 N 0.00 0.00 -0.26 4.55 3.86 -1.97 0.24 115.15 121.57 1llw h HIS 826 Ca -0.00 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.06 1llw h HIS 826 Cb 0.92 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.39 1llw h HIS 826 CO 0.00 0.05 -0.41 1.88 0.86 0.00 0.00 177.93 180.31 1llw h TYR 827 N 0.00 0.92 -0.61 2.45 -1.99 -1.86 1.53 116.97 117.41 1llw h TYR 827 Ca -0.00 -0.31 0.11 0.00 2.00 0.00 0.00 58.73 60.53 1llw h TYR 827 Cb 0.13 -0.18 -0.12 0.00 2.00 0.00 0.00 36.73 38.56 1llw h TYR 827 CO 0.00 1.10 -0.27 1.49 -0.00 0.00 0.00 178.16 180.47 1llw h GLU 828 N 0.48 -0.10 0.00 4.88 4.81 -0.77 4.86 114.58 128.74 1llw h GLU 828 Ca 0.02 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1llw h GLU 828 Cb 1.01 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1llw h GLU 828 CO 0.09 -0.07 0.00 1.28 -0.73 0.00 0.00 179.01 179.59 1llw n LEU 829 N -5.44 0.00 -0.04 1.64 4.77 -0.42 -0.48 117.00 117.02 1llw n LEU 829 Ca 0.06 0.78 -0.13 0.00 -0.03 0.00 0.00 56.01 56.68 1llw n LEU 829 Cb 0.35 -0.28 -0.07 0.00 -2.33 0.00 0.00 43.42 41.09 1llw n LEU 829 CO 0.02 -0.28 0.55 0.22 -1.33 0.00 0.00 177.39 176.57 1llw h TYR 830 N 0.00 -1.41 -0.77 -1.77 3.20 0.25 0.36 116.97 116.83 1llw h TYR 830 Ca 0.00 0.06 0.17 0.00 3.14 0.00 0.00 58.73 62.11 1llw h TYR 830 Cb 0.00 0.65 -0.12 0.00 1.54 0.00 0.00 36.73 38.80 1llw h TYR 830 CO 0.11 -0.50 0.20 0.00 -1.64 0.00 0.00 178.16 176.33 1llw h ARG 831 N -0.48 0.27 -0.02 1.82 3.08 0.96 -2.12 114.38 117.88 1llw h ARG 831 Ca 0.07 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.13 1llw h ARG 831 Cb 0.64 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 1llw h ARG 831 CO -0.47 0.18 -0.15 0.37 -1.07 0.00 0.00 179.97 178.83 1llw h GLN 832 N 0.27 -0.22 -1.09 0.04 4.15 0.23 -0.66 115.11 117.84 1llw h GLN 832 Ca 0.45 0.02 0.30 0.00 0.77 0.00 0.00 58.65 60.18 1llw h GLN 832 Cb 0.79 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 28.46 1llw h GLN 832 CO -0.54 -0.15 0.74 1.88 -1.93 0.00 0.00 178.83 178.84 1llw h TYR 833 N -0.23 0.31 0.00 3.99 -1.99 -0.33 0.89 116.97 119.61 1llw h TYR 833 Ca 0.06 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1llw h TYR 833 Cb 0.31 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 38.95 1llw h TYR 833 CO -0.21 0.02 0.00 -0.07 -0.00 0.00 0.00 178.16 177.90 1llw h LEU 834 N 0.18 0.00 0.12 3.88 4.07 -0.85 -2.96 115.31 119.76 1llw h LEU 834 Ca 0.57 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 58.23 1llw h LEU 834 Cb 1.85 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.59 1llw h LEU 834 CO -0.15 0.00 -1.48 0.11 -1.08 0.00 0.00 178.44 175.85 1llw h LYS 835 N 0.00 0.26 0.00 1.13 1.57 0.16 -3.37 116.57 116.32 1llw h LYS 835 Ca 0.00 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1llw h LYS 835 Cb 0.86 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.34 1llw h LYS 835 CO 0.00 1.14 0.00 -0.44 -0.57 0.00 0.00 179.45 179.58 1llw h ASP 836 N 0.07 0.00 -3.86 0.86 5.19 -0.92 -3.45 116.42 114.31 1llw h ASP 836 Ca -0.22 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 55.69 1llw h ASP 836 Cb 2.01 0.00 0.02 0.00 0.18 0.00 0.00 39.33 41.54 1llw h ASP 836 CO 0.17 0.00 0.46 0.00 -3.12 0.00 0.00 179.24 176.75 1llw s ARG 837 N -3.66 4.48 0.90 3.56 1.70 -1.24 -5.05 118.95 119.65 1llw s ARG 837 Ca -0.00 1.73 -0.12 0.00 -0.47 0.00 0.00 55.73 56.86 1llw s ARG 837 Cb 0.09 -2.99 0.13 0.00 -0.57 0.00 0.00 34.95 31.62 1llw s ARG 837 CO 0.38 0.09 1.11 -1.25 -1.08 0.00 0.00 175.30 174.55 1llw s PRO 838 N -1.77 1.23 0.00 3.89 0.04 -1.26 -4.96 135.00 132.17 1llw s PRO 838 Ca 0.49 0.49 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1llw s PRO 838 Cb -0.29 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1llw s PRO 838 CO 0.37 -2.18 0.00 0.28 0.04 0.00 0.00 177.00 175.52 1llw n VAL 839 N -3.79 0.00 0.00 -0.36 0.31 -1.26 -4.88 118.33 108.35 1llw n VAL 839 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1llw n VAL 839 Cb 0.58 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.51 1llw n VAL 839 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1llw n THR 840 N 0.00 0.00 -4.57 2.52 -1.04 -1.26 -4.67 114.28 105.27 1llw n THR 840 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.74 1llw n THR 840 Cb 0.00 -0.40 -0.08 0.00 -1.82 0.00 0.00 70.33 68.03 1llw n THR 840 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1llw s ALA 841 N -1.57 3.17 0.20 2.41 0.00 -1.26 -2.72 121.76 121.99 1llw s ALA 841 Ca 0.00 -1.09 -0.03 0.00 0.00 0.00 0.00 51.96 50.84 1llw s ALA 841 Cb 0.00 0.59 0.13 0.00 0.00 0.00 0.00 23.12 23.84 1llw s ALA 841 CO 0.00 -0.27 1.53 -0.07 0.00 0.00 0.00 175.76 176.96 1llw h LEU 842 N 1.70 0.64 -2.32 0.00 3.38 -2.02 -2.24 115.31 114.45 1llw h LEU 842 Ca -0.37 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.31 1llw h LEU 842 Cb 1.28 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 1llw h LEU 842 CO 0.61 1.02 0.21 0.08 0.09 0.00 0.00 178.44 180.45 1llw h ARG 843 N 0.47 0.00 0.00 1.13 0.11 -1.97 0.91 114.38 115.03 1llw h ARG 843 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1llw h ARG 843 Cb 1.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.10 1llw h ARG 843 CO 0.09 0.00 0.00 -0.44 0.10 0.00 0.00 179.97 179.72 1llw h ASP 844 N 0.00 0.00 0.97 0.08 3.32 -1.81 -1.24 116.42 117.73 1llw h ASP 844 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1llw h ASP 844 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1llw h ASP 844 CO -0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 1llw n LEU 845 N -2.75 0.00 -4.88 1.55 4.77 0.31 -4.90 117.00 111.10 1llw n LEU 845 Ca 0.01 0.50 -0.21 0.00 -0.03 0.00 0.00 56.01 56.28 1llw n LEU 845 Cb 0.27 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 1llw n LEU 845 CO 0.24 -0.01 -0.01 -0.76 -1.33 0.00 0.00 177.39 175.52 1llw s LEU 846 N -2.99 3.42 0.11 2.23 1.43 -0.47 0.01 118.68 122.43 1llw s LEU 846 Ca 0.14 -0.71 -0.26 0.00 -1.03 0.00 0.00 54.13 52.27 1llw s LEU 846 Cb 0.19 -2.09 0.08 0.00 0.03 0.00 0.00 46.19 44.39 1llw s LEU 846 CO 0.51 -0.62 1.05 -0.62 0.23 0.00 0.00 176.35 176.90 1llw s ASP 847 N -4.12 -0.13 -0.09 2.29 2.15 -0.95 -4.72 116.67 111.09 1llw s ASP 847 Ca 0.47 -0.36 -0.05 0.00 0.43 0.00 0.00 52.55 53.05 1llw s ASP 847 Cb -0.04 0.41 -0.04 0.00 -0.30 0.00 0.00 42.92 42.95 1llw s ASP 847 CO 0.28 -0.76 0.11 -0.36 -0.17 0.00 0.00 175.17 174.26 1llw s PHE 848 N -3.00 3.47 -0.58 -5.34 2.99 -1.26 -1.71 117.98 112.55 1llw s PHE 848 Ca 0.13 0.41 0.06 0.00 0.00 0.00 0.00 56.93 57.54 1llw s PHE 848 Cb 0.00 -1.88 0.23 0.00 0.00 0.00 0.00 43.02 41.37 1llw s PHE 848 CO 0.01 0.65 0.64 -1.71 -0.00 0.00 0.00 175.22 174.81 1llw n ASN 849 N 1.88 2.64 -4.63 1.36 5.15 0.15 -4.89 115.26 116.91 1llw n ASN 849 Ca -0.18 -3.19 -0.43 0.00 -0.60 0.00 0.00 54.58 50.18 1llw n ASN 849 Cb 0.54 -0.67 -0.01 0.00 -0.53 0.00 0.00 39.78 39.12 1llw n ASN 849 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1llw n ALA 850 N 1.24 0.41 -0.47 5.20 0.00 -1.26 -4.70 120.51 120.93 1llw n ALA 850 Ca 0.27 0.35 0.06 0.00 0.00 0.00 0.00 53.44 54.12 1llw n ALA 850 Cb 0.43 -2.12 0.16 0.00 0.00 0.00 0.00 19.45 17.93 1llw n ALA 850 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1llw n ASP 851 N 0.92 3.05 -3.65 0.00 5.75 -1.26 -5.01 116.55 116.35 1llw n ASP 851 Ca 0.08 -2.40 -0.13 0.00 -0.01 0.00 0.00 54.79 52.33 1llw n ASP 851 Cb 0.35 -0.31 -0.06 0.00 -1.03 0.00 0.00 41.12 40.06 1llw n ASP 851 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1llw s GLN 852 N -1.71 0.92 0.43 0.11 -0.21 -1.26 -5.14 119.66 112.80 1llw s GLN 852 Ca 0.26 -0.30 -0.25 0.00 0.02 0.00 0.00 55.36 55.10 1llw s GLN 852 Cb 0.18 0.41 -0.08 0.00 1.00 0.00 0.00 33.01 34.53 1llw s GLN 852 CO 0.10 -0.31 1.26 -2.14 -2.12 0.00 0.00 175.29 172.08 1llw s PRO 853 N -2.30 3.86 0.78 2.91 0.02 -1.26 -4.65 135.00 134.36 1llw s PRO 853 Ca -0.06 2.05 -0.16 0.00 0.02 0.00 0.00 61.00 62.85 1llw s PRO 853 Cb -0.01 -2.64 -0.05 0.00 0.02 0.00 0.00 34.50 31.82 1llw s PRO 853 CO -0.01 -0.54 0.25 0.00 -0.33 0.00 0.00 177.00 176.36 1llw n ALA 854 N -0.10 -2.45 -3.10 -1.55 0.00 -1.26 -4.55 120.51 107.50 1llw n ALA 854 Ca 0.05 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1llw n ALA 854 Cb 0.45 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1llw n ALA 854 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1llw n ILE 855 N -2.53 0.00 -4.45 0.00 5.41 -0.39 -4.96 119.36 112.44 1llw n ILE 855 Ca 0.07 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.49 1llw n ILE 855 Cb 0.51 0.00 -0.15 0.00 -0.71 0.00 0.00 39.64 39.29 1llw n ILE 855 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1llw s SER 856 N -0.82 3.56 0.55 4.38 0.15 -1.26 -4.82 113.70 115.43 1llw s SER 856 Ca 0.00 -0.51 0.43 0.00 0.70 0.00 0.00 55.95 56.57 1llw s SER 856 Cb 0.00 -1.55 1.63 0.00 -1.71 0.00 0.00 66.02 64.39 1llw s SER 856 CO 0.00 0.07 1.70 -0.07 1.20 0.00 0.00 173.24 176.14 1llw h LEU 857 N 7.44 0.01 -0.21 3.45 3.38 -1.95 1.13 115.31 128.56 1llw h LEU 857 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1llw h LEU 857 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1llw h LEU 857 CO 0.58 -0.00 0.00 -0.62 0.09 0.00 0.00 178.44 178.48 1llw n GLU 858 N -4.09 0.17 0.02 1.13 1.02 -1.26 -2.97 120.64 114.66 1llw n GLU 858 Ca 0.34 0.25 -0.22 0.00 -0.02 0.00 0.00 57.16 57.51 1llw n GLU 858 Cb 1.59 -1.75 -0.14 0.00 -0.02 0.00 0.00 31.44 31.12 1llw n GLU 858 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1llw h GLU 859 N 0.00 0.29 -6.38 3.49 5.08 0.91 -3.47 114.58 114.50 1llw h GLU 859 Ca 0.00 -0.49 -0.60 0.00 -1.00 0.00 0.00 59.36 57.27 1llw h GLU 859 Cb 0.54 0.18 0.16 0.00 0.50 0.00 0.00 28.75 30.13 1llw h GLU 859 CO 0.00 1.24 -0.43 0.28 -1.00 0.00 0.00 179.01 179.10 1llw n VAL 860 N -3.52 1.83 -1.67 3.13 0.31 -1.16 -4.82 118.33 112.44 1llw n VAL 860 Ca -0.31 -0.50 -0.34 0.00 -0.01 0.00 0.00 64.34 63.18 1llw n VAL 860 Cb 1.05 -0.58 0.06 0.00 -0.91 0.00 0.00 33.84 33.46 1llw n VAL 860 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1llw s GLU 861 N -1.73 2.53 0.95 5.55 -1.05 0.19 -4.96 118.70 120.19 1llw s GLU 861 Ca 0.65 1.66 -0.11 0.00 -0.15 0.00 0.00 54.97 57.01 1llw s GLU 861 Cb -0.54 -1.89 0.16 0.00 -0.44 0.00 0.00 34.13 31.42 1llw s GLU 861 CO 0.57 -1.51 1.09 -1.54 0.95 0.00 0.00 175.26 174.82 1llw s SER 862 N -2.10 2.82 0.41 0.83 1.04 -1.26 -4.90 113.70 110.54 1llw s SER 862 Ca 0.73 1.69 0.09 0.00 0.48 0.00 0.00 55.95 58.94 1llw s SER 862 Cb -0.27 -2.32 0.88 0.00 0.10 0.00 0.00 66.02 64.41 1llw s SER 862 CO 0.41 -3.08 2.01 0.58 0.98 0.00 0.00 173.24 174.14 1llw h VAL 863 N -1.85 1.12 0.00 5.02 2.07 -1.94 -2.79 116.25 117.88 1llw h VAL 863 Ca -0.50 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 66.55 1llw h VAL 863 Cb 1.29 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1llw h VAL 863 CO 0.50 0.15 -0.23 -0.33 0.02 0.00 0.00 177.57 177.68 1llw h GLU 864 N 0.33 0.00 -0.01 1.57 5.08 -1.95 -2.62 114.58 116.98 1llw h GLU 864 Ca 0.08 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.30 1llw h GLU 864 Cb 0.14 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.40 1llw h GLU 864 CO -0.00 0.23 -0.53 1.03 -1.00 0.00 0.00 179.01 178.74 1llw h SER 865 N 0.00 0.47 -0.33 1.42 0.87 -1.85 -3.22 113.55 110.92 1llw h SER 865 Ca -0.00 -0.76 -0.02 0.00 -1.23 0.00 0.00 61.79 59.78 1llw h SER 865 Cb 0.45 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1llw h SER 865 CO 0.03 1.17 0.12 0.40 -0.53 0.00 0.00 176.83 178.02 1llw h ILE 866 N -0.17 1.19 -0.94 2.23 2.04 -1.56 -3.12 117.51 117.18 1llw h ILE 866 Ca -0.06 -0.61 0.17 0.00 1.00 0.00 0.00 64.86 65.36 1llw h ILE 866 Cb 1.24 0.98 -0.08 0.00 -0.74 0.00 0.00 36.82 38.22 1llw h ILE 866 CO 0.10 0.21 0.60 0.58 0.00 0.00 0.00 178.15 179.65 1llw h VAL 867 N 0.38 0.76 0.00 1.67 2.07 -1.54 1.02 116.25 120.61 1llw h VAL 867 Ca 0.11 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1llw h VAL 867 Cb 0.21 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1llw h VAL 867 CO -0.01 0.12 0.00 0.29 0.02 0.00 0.00 177.57 177.99 1llw n LYS 868 N -4.61 0.05 0.00 1.57 5.02 -1.18 -0.10 118.16 118.92 1llw n LYS 868 Ca 0.20 0.51 0.14 0.00 -2.02 0.00 0.00 58.31 57.14 1llw n LYS 868 Cb 0.55 -1.65 0.54 0.00 -0.02 0.00 0.00 35.03 34.45 1llw n LYS 868 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1llw n ARG 869 N -1.76 1.45 -3.50 1.97 1.74 0.35 -4.75 116.66 112.16 1llw n ARG 869 Ca 0.00 -0.78 -0.30 0.00 -0.77 0.00 0.00 57.85 56.00 1llw n ARG 869 Cb 0.04 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 29.96 1llw n ARG 869 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1llw s PHE 870 N -2.09 3.47 -0.04 -1.55 2.99 0.86 -1.64 117.98 119.98 1llw s PHE 870 Ca 0.36 0.61 -0.02 0.00 0.00 0.00 0.00 56.93 57.89 1llw s PHE 870 Cb 0.21 -2.07 0.03 0.00 0.00 0.00 0.00 43.02 41.19 1llw s PHE 870 CO 0.37 0.30 0.09 0.00 -0.00 0.00 0.00 175.22 175.98 1llw h THR 872 N 6.01 1.34 -0.49 0.00 1.03 -1.48 0.36 112.91 119.67 1llw h THR 872 Ca -0.42 -2.14 0.00 0.00 -0.01 0.00 0.00 66.41 63.84 1llw h THR 872 Cb 1.14 2.13 0.00 0.00 -1.07 0.00 0.00 68.15 70.35 1llw h THR 872 CO 0.45 0.65 -0.09 0.61 -0.01 0.00 0.00 175.52 177.14 1llw n GLY 873 N 0.69 -3.52 3.58 2.99 0.00 -1.26 -3.72 105.19 103.95 1llw n GLY 873 Ca -0.06 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1llw n GLY 873 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1llw s GLY 874 N -0.97 1.28 -0.08 -0.02 0.00 -1.26 -4.65 107.32 101.61 1llw s GLY 874 Ca 0.00 -0.68 0.01 0.00 0.00 0.00 0.00 44.72 44.06 1llw s GLY 874 CO 0.00 2.37 -0.12 1.06 0.00 0.00 0.00 173.10 176.41 1llw s MET 875 N 4.48 2.89 0.28 2.90 -1.94 -1.25 -4.46 119.30 122.21 1llw s MET 875 Ca 0.44 -0.65 -0.29 0.00 -1.71 0.00 0.00 55.69 53.47 1llw s MET 875 Cb -0.08 -2.53 -0.10 0.00 2.01 0.00 0.00 34.83 34.13 1llw s MET 875 CO 0.28 0.48 1.22 -1.54 -0.01 0.00 0.00 175.02 175.46 1llw s SER 876 N -0.35 6.99 0.23 3.03 1.04 -1.26 -2.77 113.70 120.62 1llw s SER 876 Ca 0.04 2.46 -0.06 0.00 0.48 0.00 0.00 55.95 58.87 1llw s SER 876 Cb -0.13 -2.63 0.39 0.00 0.10 0.00 0.00 66.02 63.76 1llw s SER 876 CO 0.02 -0.38 1.72 0.25 0.98 0.00 0.00 173.24 175.83 1llw h LEU 877 N 3.96 0.16 -0.99 2.42 5.85 -1.84 0.55 115.31 125.42 1llw h LEU 877 Ca -0.47 0.11 0.14 0.00 0.84 0.00 0.00 57.88 58.50 1llw h LEU 877 Cb 1.22 0.12 -0.15 0.00 0.37 0.00 0.00 40.66 42.22 1llw h LEU 877 CO 0.68 0.06 -0.44 0.61 -0.34 0.00 0.00 178.44 179.02 1llw n GLY 878 N -1.32 -2.18 0.16 3.75 0.00 -1.26 -3.84 105.19 100.50 1llw n GLY 878 Ca 0.12 1.13 -0.17 0.00 0.00 0.00 0.00 46.02 47.10 1llw n GLY 878 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw h ALA 879 N 1.14 0.15 -2.30 4.61 0.00 -1.28 -3.43 119.26 118.15 1llw h ALA 879 Ca 0.30 -0.55 -0.49 0.00 0.00 0.00 0.00 54.91 54.17 1llw h ALA 879 Cb 0.54 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.37 1llw h ALA 879 CO -0.97 0.40 0.01 -0.51 0.00 0.00 0.00 179.25 178.19 1llw s LEU 880 N -8.45 3.78 0.64 0.00 1.43 -0.72 -4.23 118.68 111.14 1llw s LEU 880 Ca -0.13 0.82 -0.12 0.00 -1.03 0.00 0.00 54.13 53.67 1llw s LEU 880 Cb 0.05 -3.73 -0.02 0.00 0.03 0.00 0.00 46.19 42.52 1llw s LEU 880 CO 0.84 -0.45 1.04 -0.94 0.23 0.00 0.00 176.35 177.07 1llw s SER 881 N -3.88 5.79 0.37 2.29 1.04 0.62 -4.71 113.70 115.21 1llw s SER 881 Ca 0.46 1.60 0.11 0.00 0.48 0.00 0.00 55.95 58.60 1llw s SER 881 Cb -0.10 -2.50 0.71 0.00 0.10 0.00 0.00 66.02 64.24 1llw s SER 881 CO 0.40 -1.16 1.84 0.08 0.98 0.00 0.00 173.24 175.37 1llw h ARG 882 N -0.24 0.07 -0.33 4.02 0.11 -1.85 -1.41 114.38 114.75 1llw h ARG 882 Ca -0.45 -0.03 0.06 0.00 0.10 0.00 0.00 59.98 59.67 1llw h ARG 882 Cb 1.20 -0.01 -0.08 0.00 1.11 0.00 0.00 29.97 32.20 1llw h ARG 882 CO 0.59 0.39 -0.42 0.93 0.10 0.00 0.00 179.97 181.56 1llw h GLU 883 N 0.06 -0.36 -0.36 0.08 3.07 -1.92 0.11 114.58 115.26 1llw h GLU 883 Ca 0.01 0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 58.78 1llw h GLU 883 Cb 0.61 0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.59 1llw h GLU 883 CO 0.04 -0.24 -0.25 0.00 -1.40 0.00 0.00 179.01 177.17 1llw h ALA 884 N 0.35 0.89 -0.10 3.43 0.00 -1.63 -2.70 119.26 119.51 1llw h ALA 884 Ca 0.12 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1llw h ALA 884 Cb 0.59 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1llw h ALA 884 CO -0.52 0.63 -0.15 1.25 0.00 0.00 0.00 179.25 180.45 1llw h HIS 885 N 0.63 0.34 -0.22 0.00 6.17 -0.98 -2.10 115.15 118.99 1llw h HIS 885 Ca 0.08 -0.11 -0.12 0.00 0.71 0.00 0.00 60.37 60.93 1llw h HIS 885 Cb 0.75 -0.07 -0.00 0.00 2.52 0.00 0.00 27.41 30.61 1llw h HIS 885 CO 0.04 0.74 -0.33 0.93 0.71 0.00 0.00 177.93 180.02 1llw h GLU 886 N -0.16 0.62 -0.28 5.26 5.08 -0.85 -2.33 114.58 121.91 1llw h GLU 886 Ca 0.01 -0.36 0.04 0.00 -1.00 0.00 0.00 59.36 58.05 1llw h GLU 886 Cb 0.71 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.92 1llw h GLU 886 CO 0.03 0.97 -0.53 1.15 -1.00 0.00 0.00 179.01 179.64 1llw h THR 887 N 0.31 0.02 -0.92 1.13 2.02 -1.53 0.27 112.91 114.21 1llw h THR 887 Ca 0.02 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.40 1llw h THR 887 Cb 0.91 0.02 -0.11 0.00 -1.74 0.00 0.00 68.15 67.23 1llw h THR 887 CO 0.08 0.00 0.48 -0.07 0.37 0.00 0.00 175.52 176.38 1llw h LEU 888 N -0.47 0.54 -0.65 2.58 3.38 -1.04 -1.08 115.31 118.56 1llw h LEU 888 Ca 0.06 0.12 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 1llw h LEU 888 Cb 0.63 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1llw h LEU 888 CO -0.52 0.14 -0.30 0.00 0.09 0.00 0.00 178.44 177.86 1llw h ALA 889 N 1.65 0.84 -0.18 1.53 0.00 -0.65 0.56 119.26 123.01 1llw h ALA 889 Ca 0.54 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 1llw h ALA 889 Cb 0.92 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1llw h ALA 889 CO -0.44 0.64 -0.35 0.82 0.00 0.00 0.00 179.25 179.92 1llw h ILE 890 N 0.62 1.29 0.01 0.00 2.04 0.68 -0.33 117.51 121.83 1llw h ILE 890 Ca 0.07 -1.43 -0.20 0.00 1.00 0.00 0.00 64.86 64.30 1llw h ILE 890 Cb 0.81 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 1llw h ILE 890 CO 0.07 0.44 -0.92 0.00 0.00 0.00 0.00 178.15 177.74 1llw h ALA 891 N 1.31 0.47 0.14 1.87 0.00 -0.81 -1.74 119.26 120.49 1llw h ALA 891 Ca 0.04 -0.76 -0.28 0.00 0.00 0.00 0.00 54.91 53.91 1llw h ALA 891 Cb 0.77 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1llw h ALA 891 CO 0.06 0.96 -1.25 0.52 0.00 0.00 0.00 179.25 179.55 1llw h MET 892 N 0.08 0.36 -0.10 0.00 2.86 -0.69 -2.73 114.93 114.72 1llw h MET 892 Ca -0.05 -0.57 -0.04 0.00 -2.06 0.00 0.00 59.70 56.99 1llw h MET 892 Cb 1.57 0.20 -0.01 0.00 0.06 0.00 0.00 31.60 33.43 1llw h MET 892 CO 0.14 1.26 -0.13 -0.91 1.06 0.00 0.00 176.91 178.32 1llw h ASN 893 N 0.12 0.14 0.19 1.22 2.35 -1.05 -0.95 115.58 117.59 1llw h ASN 893 Ca -0.15 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.56 1llw h ASN 893 Cb 1.96 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 40.29 1llw h ASN 893 CO 0.21 0.29 -0.09 0.03 -1.65 0.00 0.00 177.43 176.22 1llw h ARG 894 N 0.14 -0.24 0.00 0.81 3.08 -1.04 -3.06 114.38 114.07 1llw h ARG 894 Ca 0.03 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1llw h ARG 894 Cb 0.33 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1llw h ARG 894 CO 0.02 0.04 0.00 1.28 -1.07 0.00 0.00 179.97 180.24 1llw n LEU 895 N -5.08 0.42 -0.64 3.04 4.77 -1.05 -4.84 117.00 113.62 1llw n LEU 895 Ca -0.09 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1llw n LEU 895 Cb 0.21 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1llw n LEU 895 CO 0.32 -0.43 0.00 0.61 -1.33 0.00 0.00 177.39 176.56 1llw n GLY 896 N 0.05 0.76 0.00 -0.72 0.00 -1.14 -4.52 105.19 99.63 1llw n GLY 896 Ca 0.03 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1llw n GLY 896 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw n ALA 897 N -1.78 0.00 -2.71 4.61 0.00 -0.37 -4.27 120.51 115.98 1llw n ALA 897 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1llw n ALA 897 Cb 0.46 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.80 1llw n ALA 897 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1llw s LYS 898 N 1.45 0.58 0.16 0.00 1.02 -1.18 -4.47 119.74 117.30 1llw s LYS 898 Ca 0.00 -0.87 0.04 0.00 0.02 0.00 0.00 55.97 55.16 1llw s LYS 898 Cb 0.00 -0.23 -0.05 0.00 -0.52 0.00 0.00 37.83 37.03 1llw s LYS 898 CO 0.00 0.03 -0.09 0.45 -0.92 0.00 0.00 175.35 174.82 1llw s SER 899 N -1.90 1.84 -0.01 2.83 0.15 -1.26 -1.55 113.70 113.80 1llw s SER 899 Ca -0.06 -1.05 0.01 0.00 0.70 0.00 0.00 55.95 55.56 1llw s SER 899 Cb -0.06 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 1llw s SER 899 CO -0.01 -0.35 -0.03 0.21 1.20 0.00 0.00 173.24 174.25 1llw s ASN 900 N -3.20 0.46 -0.89 5.45 3.84 -1.26 -2.06 114.94 117.28 1llw s ASN 900 Ca 0.19 -0.07 -0.16 0.00 0.21 0.00 0.00 52.86 53.04 1llw s ASN 900 Cb 0.03 -0.08 0.19 0.00 -0.55 0.00 0.00 41.25 40.83 1llw s ASN 900 CO 0.02 0.03 0.94 -0.94 -2.79 0.00 0.00 177.10 174.37 1llw s SER 901 N 0.05 6.74 0.05 -4.21 1.04 -0.80 -3.80 113.70 112.77 1llw s SER 901 Ca -0.00 -2.48 -0.10 0.00 0.48 0.00 0.00 55.95 53.85 1llw s SER 901 Cb -0.03 -2.29 -0.02 0.00 0.10 0.00 0.00 66.02 63.78 1llw s SER 901 CO -0.00 -0.76 0.72 0.61 0.98 0.00 0.00 173.24 174.78 1llw n GLY 902 N 4.53 -1.55 0.00 7.32 0.00 -1.11 -3.72 105.19 110.65 1llw n GLY 902 Ca 0.19 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1llw n GLY 902 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1llw n GLU 903 N -3.77 0.00 -0.91 1.61 1.02 -1.26 -4.58 120.64 112.75 1llw n GLU 903 Ca 0.01 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.19 1llw n GLU 903 Cb 0.08 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.59 1llw n GLU 903 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1llw n GLY 904 N 0.00 2.54 3.97 0.62 0.00 -1.26 -4.33 105.19 106.72 1llw n GLY 904 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1llw n GLY 904 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llw n GLY 905 N -0.27 -2.20 3.12 -0.02 0.00 -1.26 -4.56 105.19 100.00 1llw n GLY 905 Ca 0.10 -1.61 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 1llw n GLY 905 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1llw s GLU 906 N -0.26 0.28 -0.11 1.61 2.12 -1.26 -4.70 118.70 116.38 1llw s GLU 906 Ca 0.00 0.36 -0.29 0.00 0.36 0.00 0.00 54.97 55.39 1llw s GLU 906 Cb 0.00 0.12 -0.05 0.00 0.26 0.00 0.00 34.13 34.46 1llw s GLU 906 CO 0.00 -0.04 1.68 0.34 -0.54 0.00 0.00 175.26 176.70 1llw s ASP 907 N 0.21 6.50 0.40 -1.70 3.68 -1.26 -4.94 116.67 119.57 1llw s ASP 907 Ca -0.01 2.03 0.24 0.00 2.13 0.00 0.00 52.55 56.95 1llw s ASP 907 Cb -0.02 -2.53 1.30 0.00 -1.45 0.00 0.00 42.92 40.22 1llw s ASP 907 CO -0.00 -1.09 1.65 0.58 0.13 0.00 0.00 175.17 176.43 1llw h VAL 908 N 5.84 0.20 0.00 1.11 2.07 -2.02 -0.30 116.25 123.16 1llw h VAL 908 Ca -0.38 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1llw h VAL 908 Cb 1.17 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1llw h VAL 908 CO 0.97 0.03 0.43 0.58 0.02 0.00 0.00 177.57 179.60 1llw h VAL 909 N 0.17 0.00 0.00 2.57 2.07 -1.99 -0.54 116.25 118.53 1llw h VAL 909 Ca 0.77 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.29 1llw h VAL 909 Cb 2.20 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1llw h VAL 909 CO -0.48 0.00 -0.65 0.03 0.02 0.00 0.00 177.57 176.49 1llw h ARG 910 N 0.00 0.00 -0.97 1.57 3.08 -1.40 -3.32 114.38 113.35 1llw h ARG 910 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1llw h ARG 910 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1llw h ARG 910 CO 0.00 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.56 1llw n TYR 911 N -2.58 0.00 -3.79 3.04 0.53 -0.21 -2.93 117.16 111.22 1llw n TYR 911 Ca 0.02 -0.16 -0.21 0.00 -1.02 0.00 0.00 57.90 56.53 1llw n TYR 911 Cb 0.51 -0.13 -0.17 0.00 -1.03 0.00 0.00 39.34 38.51 1llw n TYR 911 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 1llw s LEU 912 N 0.00 0.63 0.48 7.72 1.43 -1.25 -5.05 118.68 122.64 1llw s LEU 912 Ca 0.00 -0.02 -0.23 0.00 -1.03 0.00 0.00 54.13 52.84 1llw s LEU 912 Cb 0.00 -0.30 -0.07 0.00 0.03 0.00 0.00 46.19 45.85 1llw s LEU 912 CO 0.00 -0.18 1.28 -0.89 0.23 0.00 0.00 176.35 176.79 1llw s THR 913 N 1.76 2.57 -0.11 5.49 2.01 -1.26 -4.71 115.64 121.39 1llw s THR 913 Ca 0.01 0.44 -0.25 0.00 0.31 0.00 0.00 61.69 62.20 1llw s THR 913 Cb -0.13 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 1llw s THR 913 CO -0.04 0.01 0.79 -0.76 -0.69 0.00 0.00 174.62 173.94 1llw s LEU 914 N -3.09 4.26 -0.12 4.42 1.43 -0.74 -4.97 118.68 119.86 1llw s LEU 914 Ca 0.65 1.23 -0.16 0.00 -1.03 0.00 0.00 54.13 54.82 1llw s LEU 914 Cb -0.36 -3.20 -0.26 0.00 0.03 0.00 0.00 46.19 42.40 1llw s LEU 914 CO 0.43 -0.26 0.50 0.44 0.23 0.00 0.00 176.35 177.69 1llw h ASP 915 N 7.03 0.31 -0.04 2.29 5.19 -1.92 -3.40 116.42 125.87 1llw h ASP 915 Ca -0.36 -0.82 0.00 0.00 -0.62 0.00 0.00 57.03 55.23 1llw h ASP 915 Cb 1.17 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.58 1llw h ASP 915 CO 0.79 1.59 0.00 -0.90 -3.12 0.00 0.00 179.24 177.60 1llw n ASP 916 N -3.99 0.32 -4.71 6.45 5.75 -1.26 -4.91 116.55 114.20 1llw n ASP 916 Ca -0.26 -1.70 -0.42 0.00 -0.01 0.00 0.00 54.79 52.40 1llw n ASP 916 Cb 0.86 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.89 1llw n ASP 916 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1llw s VAL 917 N -1.94 2.44 0.56 2.12 1.01 -1.26 -4.66 120.40 118.67 1llw s VAL 917 Ca 0.18 0.27 0.06 0.00 0.00 0.00 0.00 61.98 62.49 1llw s VAL 917 Cb 0.09 -3.18 0.05 0.00 0.00 0.00 0.00 36.38 33.34 1llw s VAL 917 CO 0.14 0.02 0.44 1.51 0.00 0.00 0.00 175.10 177.21 1llw s ASP 918 N 1.38 4.65 0.26 3.32 1.47 -0.66 -4.87 116.67 122.22 1llw s ASP 918 Ca 0.73 -1.24 -0.03 0.00 1.18 0.00 0.00 52.55 53.19 1llw s ASP 918 Cb -0.46 0.48 0.53 0.00 -0.34 0.00 0.00 42.92 43.13 1llw s ASP 918 CO 0.32 -1.16 1.68 0.77 0.68 0.00 0.00 175.17 177.46 1llw h SER 919 N 0.67 0.04 0.53 2.11 4.64 -1.94 -0.52 113.55 119.09 1llw h SER 919 Ca -0.36 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1llw h SER 919 Cb 1.30 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1llw h SER 919 CO 0.55 -0.05 0.00 -0.33 -0.87 0.00 0.00 176.83 176.13 1llw h GLU 920 N 0.28 0.00 0.00 4.77 4.39 -1.98 -3.46 114.58 118.58 1llw h GLU 920 Ca 0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.15 1llw h GLU 920 Cb 0.81 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1llw h GLU 920 CO -0.54 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 177.72 1llw n GLY 921 N -0.50 1.07 3.51 -3.84 0.00 -0.20 -4.75 105.19 100.48 1llw n GLY 921 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1llw n GLY 921 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1llw s ASN 922 N -2.00 3.74 -0.03 1.61 0.01 -1.25 -1.46 114.94 115.56 1llw s ASN 922 Ca 0.00 -1.02 -0.01 0.00 -0.71 0.00 0.00 52.86 51.12 1llw s ASN 922 Cb 0.00 -0.37 0.03 0.00 0.41 0.00 0.00 41.25 41.32 1llw s ASN 922 CO 0.00 -0.02 0.04 -0.55 -1.51 0.00 0.00 177.10 175.06 1llw s SER 923 N -3.55 0.43 0.66 -1.22 0.15 -1.26 -1.65 113.70 107.25 1llw s SER 923 Ca 0.31 0.05 0.44 0.00 0.70 0.00 0.00 55.95 57.44 1llw s SER 923 Cb -0.04 -0.10 2.35 0.00 -1.71 0.00 0.00 66.02 66.53 1llw s SER 923 CO 0.16 -0.17 2.35 -0.65 1.20 0.00 0.00 173.24 176.13 1llw h PRO 924 N 7.66 0.00 -0.19 5.44 0.11 -1.95 -1.42 132.00 141.65 1llw h PRO 924 Ca -0.35 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.66 1llw h PRO 924 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1llw h PRO 924 CO 0.38 0.00 -0.28 1.15 -0.21 0.00 0.00 178.00 179.03 1llw h THR 925 N 0.00 1.34 -2.63 -1.15 2.02 -1.95 -3.37 112.91 107.17 1llw h THR 925 Ca -0.00 -1.50 -0.60 0.00 0.77 0.00 0.00 66.41 65.08 1llw h THR 925 Cb 0.04 1.85 -0.41 0.00 -1.74 0.00 0.00 68.15 67.89 1llw h THR 925 CO 0.00 0.46 -0.72 0.18 0.37 0.00 0.00 175.52 175.81 1llw n LEU 926 N -4.37 2.11 0.23 2.58 4.77 -0.92 -4.98 117.00 116.43 1llw n LEU 926 Ca -0.06 -5.02 0.07 0.00 -0.03 0.00 0.00 56.01 50.97 1llw n LEU 926 Cb 0.46 -0.31 0.55 0.00 -2.33 0.00 0.00 43.42 41.80 1llw n LEU 926 CO 0.43 1.87 0.91 -0.65 -1.33 0.00 0.00 177.39 178.62 1llw h PRO 927 N 5.05 0.00 0.00 3.23 0.11 -1.44 -2.68 132.00 136.26 1llw h PRO 927 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1llw h PRO 927 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1llw h PRO 927 CO 0.64 0.18 0.00 -2.39 -0.21 0.00 0.00 178.00 176.22 1llw n HIS 928 N -4.14 0.32 -2.43 0.65 1.44 -1.26 -4.82 115.22 104.99 1llw n HIS 928 Ca -0.02 0.11 -0.26 0.00 -2.01 0.00 0.00 57.72 55.53 1llw n HIS 928 Cb 0.25 -0.67 0.03 0.00 0.12 0.00 0.00 29.99 29.72 1llw n HIS 928 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1llw s LEU 929 N -3.55 3.23 0.03 2.39 1.43 -1.01 -4.96 118.68 116.25 1llw s LEU 929 Ca 0.10 0.64 0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1llw s LEU 929 Cb 0.14 -3.46 -0.02 0.00 0.03 0.00 0.00 46.19 42.87 1llw s LEU 929 CO 0.45 -1.08 -0.07 -1.00 0.23 0.00 0.00 176.35 174.87 1llw s HIS 930 N -2.98 0.64 -0.76 0.29 3.76 -1.26 -4.77 115.29 110.22 1llw s HIS 930 Ca 0.54 -0.42 -0.02 0.00 -0.15 0.00 0.00 55.06 55.01 1llw s HIS 930 Cb -0.10 -0.39 0.00 0.00 1.11 0.00 0.00 32.58 33.20 1llw s HIS 930 CO 0.44 -0.07 0.29 0.41 -0.85 0.00 0.00 174.74 174.97 1llw n GLY 931 N 1.74 0.10 3.83 -2.22 0.00 -0.89 -4.29 105.19 103.45 1llw n GLY 931 Ca -0.21 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.12 1llw n GLY 931 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llw s LEU 932 N -3.48 4.30 0.35 0.99 1.43 -0.53 -4.65 118.68 117.09 1llw s LEU 932 Ca 0.15 1.28 0.07 0.00 -1.03 0.00 0.00 54.13 54.60 1llw s LEU 932 Cb -0.06 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.58 1llw s LEU 932 CO 0.18 0.02 0.36 -1.10 0.23 0.00 0.00 176.35 176.04 1llw s GLN 933 N -2.13 2.77 0.33 1.70 -0.21 -1.26 -4.67 119.66 116.19 1llw s GLN 933 Ca 0.43 -1.28 0.11 0.00 0.02 0.00 0.00 55.36 54.64 1llw s GLN 933 Cb -0.15 -2.54 0.57 0.00 1.00 0.00 0.00 33.01 31.89 1llw s GLN 933 CO 0.20 0.02 1.75 -0.97 -2.12 0.00 0.00 175.29 174.16 1llw h ASN 934 N 1.10 0.06 -0.19 5.90 -0.73 -1.89 -2.05 115.58 117.78 1llw h ASN 934 Ca -0.44 -0.02 0.00 0.00 1.87 0.00 0.00 56.30 57.70 1llw h ASN 934 Cb 1.26 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.83 1llw h ASN 934 CO 0.56 0.49 0.00 0.61 -0.37 0.00 0.00 177.43 178.73 1llw n GLY 935 N -0.23 -0.04 3.71 1.57 0.00 -1.26 -4.34 105.19 104.60 1llw n GLY 935 Ca -0.02 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 1llw n GLY 935 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1llw s ASP 936 N -1.14 3.79 -0.07 1.61 1.01 -0.77 -4.66 116.67 116.44 1llw s ASP 936 Ca 0.18 2.22 -0.03 0.00 0.71 0.00 0.00 52.55 55.63 1llw s ASP 936 Cb 0.10 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.49 1llw s ASP 936 CO 0.13 -2.53 0.16 0.28 0.21 0.00 0.00 175.17 173.43 1llw s THR 937 N -2.35 -0.04 -1.39 -1.27 -1.32 -1.26 -1.79 115.64 106.21 1llw s THR 937 Ca 0.70 0.16 0.15 0.00 -1.21 0.00 0.00 61.69 61.48 1llw s THR 937 Cb -0.25 -0.26 0.54 0.00 -1.51 0.00 0.00 72.50 71.02 1llw s THR 937 CO 0.51 0.06 1.42 0.00 -2.21 0.00 0.00 174.62 174.41 1llw n ALA 938 N 4.10 2.86 -2.69 11.08 0.00 -1.26 -3.75 120.51 130.84 1llw n ALA 938 Ca -0.25 -1.16 -0.42 0.00 0.00 0.00 0.00 53.44 51.61 1llw n ALA 938 Cb 0.53 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 1llw n ALA 938 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1llw s ASN 939 N -0.84 7.16 0.15 0.00 2.47 -1.15 -4.78 114.94 117.96 1llw s ASN 939 Ca 0.39 1.42 -0.31 0.00 0.42 0.00 0.00 52.86 54.77 1llw s ASN 939 Cb 0.24 -2.51 -0.10 0.00 -1.45 0.00 0.00 41.25 37.43 1llw s ASN 939 CO 0.20 -0.33 1.69 -0.44 -3.72 0.00 0.00 177.10 174.50 1llw s SER 940 N 1.04 6.48 0.20 -4.21 0.01 -1.26 -4.91 113.70 111.05 1llw s SER 940 Ca 0.45 2.71 -0.08 0.00 1.31 0.00 0.00 55.95 60.34 1llw s SER 940 Cb -0.18 -2.58 0.13 0.00 0.21 0.00 0.00 66.02 63.59 1llw s SER 940 CO 0.19 -0.92 1.73 0.00 0.41 0.00 0.00 173.24 174.65 1llw h ALA 941 N 7.44 0.96 -3.15 1.44 0.00 -1.89 -3.41 119.26 120.64 1llw h ALA 941 Ca -0.43 -0.23 -0.62 0.00 0.00 0.00 0.00 54.91 53.62 1llw h ALA 941 Cb 1.21 -0.28 -0.16 0.00 0.00 0.00 0.00 17.79 18.55 1llw h ALA 941 CO 0.94 0.65 -0.54 0.42 0.00 0.00 0.00 179.25 180.72 1llw s ILE 942 N -5.39 5.00 -0.18 0.00 1.01 -0.87 0.59 121.20 121.36 1llw s ILE 942 Ca -0.12 0.05 -0.08 0.00 0.00 0.00 0.00 60.65 60.50 1llw s ILE 942 Cb 0.15 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 1llw s ILE 942 CO 0.84 0.39 0.07 -0.54 0.00 0.00 0.00 174.94 175.71 1llw s LYS 943 N 0.83 3.95 0.11 2.79 -0.14 -0.58 -1.91 119.74 124.79 1llw s LYS 943 Ca 0.06 -0.32 -0.17 0.00 -1.36 0.00 0.00 55.97 54.17 1llw s LYS 943 Cb -0.13 -3.22 -0.07 0.00 -1.68 0.00 0.00 37.83 32.73 1llw s LYS 943 CO 0.02 0.31 0.56 -1.14 -0.76 0.00 0.00 175.35 174.34 1llw s GLN 944 N 0.28 4.09 -0.20 1.68 0.74 -1.24 -1.09 119.66 123.90 1llw s GLN 944 Ca 0.04 0.62 -0.01 0.00 0.05 0.00 0.00 55.36 56.06 1llw s GLN 944 Cb -0.12 -3.09 0.01 0.00 1.10 0.00 0.00 33.01 30.91 1llw s GLN 944 CO 0.00 0.56 -0.12 0.42 -0.55 0.00 0.00 175.29 175.60 1llw s ILE 945 N -1.28 2.67 0.38 -2.34 1.09 1.15 -4.82 121.20 118.05 1llw s ILE 945 Ca 0.33 -0.78 0.04 0.00 -1.10 0.00 0.00 60.65 59.14 1llw s ILE 945 Cb -0.17 -2.19 -0.03 0.00 -1.06 0.00 0.00 42.46 39.00 1llw s ILE 945 CO 0.19 0.45 0.10 0.00 -0.10 0.00 0.00 174.94 175.59 1llw s ALA 946 N 1.37 2.77 0.42 9.38 0.00 -1.26 -0.69 121.76 133.75 1llw s ALA 946 Ca 0.05 -1.44 0.20 0.00 0.00 0.00 0.00 51.96 50.76 1llw s ALA 946 Cb -0.14 0.71 1.16 0.00 0.00 0.00 0.00 23.12 24.85 1llw s ALA 946 CO -0.08 -0.32 2.00 0.66 0.00 0.00 0.00 175.76 178.02 1llw h SER 947 N 1.88 0.00 0.67 0.00 4.64 -1.84 0.27 113.55 119.17 1llw h SER 947 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1llw h SER 947 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1llw h SER 947 CO 0.61 0.18 -0.40 0.61 -0.87 0.00 0.00 176.83 176.96 1llw n GLY 948 N -0.79 -1.33 2.30 -0.77 0.00 -1.26 -4.73 105.19 98.60 1llw n GLY 948 Ca -0.02 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.61 1llw n GLY 948 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llw n ARG 949 N -1.60 -2.06 -0.27 1.61 5.12 0.94 -4.83 116.66 115.57 1llw n ARG 949 Ca 0.06 0.55 -0.09 0.00 -1.93 0.00 0.00 57.85 56.43 1llw n ARG 949 Cb 0.35 -5.04 -0.08 0.00 -1.16 0.00 0.00 32.46 26.53 1llw n ARG 949 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 1llw h PHE 950 N 0.00 -1.41 -0.93 -1.55 -1.00 -1.83 -1.33 116.94 108.89 1llw h PHE 950 Ca -0.25 0.09 -0.60 0.00 2.81 0.00 0.00 57.97 60.03 1llw h PHE 950 Cb 1.07 0.70 -0.27 0.00 3.61 0.00 0.00 35.95 41.06 1llw h PHE 950 CO 0.62 -0.31 0.77 0.41 -1.61 0.00 0.00 178.31 178.20 1llw n GLY 951 N -1.21 5.34 3.29 -1.45 0.00 -1.26 -4.66 105.19 105.23 1llw n GLY 951 Ca 0.00 -1.89 -0.45 0.00 0.00 0.00 0.00 46.02 43.69 1llw n GLY 951 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1llw s VAL 952 N -4.16 5.03 -0.00 1.61 1.01 -0.50 -4.71 120.40 118.68 1llw s VAL 952 Ca 0.59 -1.63 0.01 0.00 0.00 0.00 0.00 61.98 60.95 1llw s VAL 952 Cb 0.47 -4.23 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 1llw s VAL 952 CO 0.02 -0.86 -0.04 -0.89 0.00 0.00 0.00 175.10 173.32 1llw s THR 953 N 1.45 0.31 0.18 3.92 2.01 -1.26 -4.88 115.64 117.36 1llw s THR 953 Ca 0.05 -0.22 -0.22 0.00 0.31 0.00 0.00 61.69 61.61 1llw s THR 953 Cb -0.28 -0.27 0.10 0.00 0.01 0.00 0.00 72.50 72.06 1llw s THR 953 CO 0.01 0.05 1.58 -0.65 -0.69 0.00 0.00 174.62 174.93 1llw h PRO 954 N 5.96 -0.18 0.16 4.92 0.11 -1.87 0.87 132.00 141.96 1llw h PRO 954 Ca -0.27 0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.86 1llw h PRO 954 Cb 1.20 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1llw h PRO 954 CO 0.50 -0.12 -0.17 1.05 -0.21 0.00 0.00 178.00 179.05 1llw h GLU 955 N -0.19 -0.35 -0.23 1.05 4.11 -1.89 0.14 114.58 117.22 1llw h GLU 955 Ca 0.22 0.02 0.02 0.00 0.07 0.00 0.00 59.36 59.69 1llw h GLU 955 Cb 0.55 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 1llw h GLU 955 CO -0.67 -0.24 -0.14 0.98 0.07 0.00 0.00 179.01 179.02 1llw n TYR 956 N -5.30 -0.10 -0.32 2.06 9.36 -0.39 0.10 117.16 122.57 1llw n TYR 956 Ca -0.08 0.29 0.27 0.00 3.32 0.00 0.00 57.90 61.70 1llw n TYR 956 Cb 0.21 -0.41 0.59 0.00 -0.63 0.00 0.00 39.34 39.11 1llw n TYR 956 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1llw h LEU 957 N 0.00 0.30 0.00 2.98 3.38 -0.19 -1.52 115.31 120.26 1llw h LEU 957 Ca 0.04 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1llw h LEU 957 Cb 0.09 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1llw h LEU 957 CO -0.22 0.04 -0.74 0.24 0.09 0.00 0.00 178.44 177.86 1llw h MET 958 N 0.25 0.00 -5.04 1.13 2.86 0.27 -3.38 114.93 111.03 1llw h MET 958 Ca 0.59 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 57.54 1llw h MET 958 Cb 1.78 0.00 -0.18 0.00 0.06 0.00 0.00 31.60 33.26 1llw h MET 958 CO -0.21 0.11 0.84 -1.54 1.06 0.00 0.00 176.91 177.17 1llw s SER 959 N -5.79 6.63 0.00 1.22 1.04 0.12 -4.90 113.70 112.01 1llw s SER 959 Ca 0.02 -2.04 0.00 0.00 0.48 0.00 0.00 55.95 54.41 1llw s SER 959 Cb 0.08 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.80 1llw s SER 959 CO 0.76 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 174.52 1llw n GLY 960 N 5.51 1.08 0.13 7.32 0.00 -1.26 -4.70 105.19 113.27 1llw n GLY 960 Ca 0.24 0.43 0.03 0.00 0.00 0.00 0.00 46.02 46.72 1llw n GLY 960 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1llw h LYS 961 N 0.00 0.00 -4.47 1.61 1.57 -0.09 -3.46 116.57 111.72 1llw h LYS 961 Ca 0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 1llw h LYS 961 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.12 1llw h LYS 961 CO 0.00 0.36 -0.72 -0.65 -0.57 0.00 0.00 179.45 177.87 1llw s GLN 962 N -3.00 0.57 0.02 3.15 -0.21 -0.98 -3.15 119.66 116.06 1llw s GLN 962 Ca 0.02 -0.90 0.07 0.00 0.02 0.00 0.00 55.36 54.57 1llw s GLN 962 Cb 0.08 -0.18 -0.03 0.00 1.00 0.00 0.00 33.01 33.88 1llw s GLN 962 CO 0.76 0.01 -0.19 -0.51 -2.12 0.00 0.00 175.29 173.24 1llw s LEU 963 N -1.98 2.51 -0.11 2.90 1.43 0.70 -1.53 118.68 122.60 1llw s LEU 963 Ca -0.05 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 1llw s LEU 963 Cb -0.05 -1.47 0.01 0.00 0.03 0.00 0.00 46.19 44.71 1llw s LEU 963 CO -0.02 0.28 -0.15 -0.70 0.23 0.00 0.00 176.35 175.99 1llw s GLU 964 N -1.20 2.20 -0.29 1.70 2.12 -0.25 -0.50 118.70 122.47 1llw s GLU 964 Ca 0.13 -0.56 -0.16 0.00 0.36 0.00 0.00 54.97 54.74 1llw s GLU 964 Cb -0.10 -1.87 -0.03 0.00 0.26 0.00 0.00 34.13 32.39 1llw s GLU 964 CO 0.03 -0.05 0.43 0.42 -0.54 0.00 0.00 175.26 175.55 1llw s ILE 965 N 0.96 5.12 -0.91 -3.70 1.01 -0.43 0.36 121.20 123.62 1llw s ILE 965 Ca -0.07 0.53 -0.18 0.00 0.00 0.00 0.00 60.65 60.93 1llw s ILE 965 Cb -0.15 -3.79 0.15 0.00 0.01 0.00 0.00 42.46 38.68 1llw s ILE 965 CO -0.01 0.04 1.04 -0.75 0.00 0.00 0.00 174.94 175.26 1llw s LYS 966 N 2.18 3.60 0.05 2.79 2.20 0.13 -0.60 119.74 130.10 1llw s LYS 966 Ca 0.17 -1.94 -0.18 0.00 -0.36 0.00 0.00 55.97 53.65 1llw s LYS 966 Cb -0.16 -4.79 -0.14 0.00 -1.51 0.00 0.00 37.83 31.22 1llw s LYS 966 CO 0.11 -1.65 1.31 0.52 -0.36 0.00 0.00 175.35 175.28 1llw h MET 967 N 8.56 0.49 -2.60 4.03 2.86 -1.37 -3.43 114.93 123.47 1llw h MET 967 Ca 0.15 -0.31 0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1llw h MET 967 Cb 1.03 0.04 -0.13 0.00 0.06 0.00 0.00 31.60 32.59 1llw h MET 967 CO 1.02 0.91 0.37 0.00 1.06 0.00 0.00 176.91 180.27 1llw s ALA 968 N -4.06 -1.71 -0.10 6.32 0.00 -0.79 -4.94 121.76 116.47 1llw s ALA 968 Ca -0.13 0.75 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 1llw s ALA 968 Cb 0.06 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 1llw s ALA 968 CO 0.80 -0.74 -0.06 1.14 0.00 0.00 0.00 175.76 176.90 1llw s GLN 969 N -3.40 3.10 0.10 0.00 -2.07 -1.26 -4.38 119.66 111.76 1llw s GLN 969 Ca 0.04 -0.54 0.04 0.00 -1.82 0.00 0.00 55.36 53.08 1llw s GLN 969 Cb -0.01 -2.71 0.33 0.00 -1.09 0.00 0.00 33.01 29.52 1llw s GLN 969 CO -0.10 0.51 0.46 0.41 -1.32 0.00 0.00 175.29 175.25 1llw n GLY 970 N 2.71 -0.30 0.10 2.60 0.00 -1.26 0.52 105.19 109.57 1llw n GLY 970 Ca -0.18 0.26 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1llw n GLY 970 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw n ALA 971 N -3.09 2.26 -2.70 4.61 0.00 -1.26 -4.13 120.51 116.21 1llw n ALA 971 Ca 0.09 -0.02 -0.07 0.00 0.00 0.00 0.00 53.44 53.44 1llw n ALA 971 Cb 0.32 -1.47 0.09 0.00 0.00 0.00 0.00 19.45 18.39 1llw n ALA 971 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1llw n LYS 972 N -2.24 0.92 -0.07 0.00 2.85 0.19 -2.88 118.16 116.93 1llw n LYS 972 Ca 0.05 -1.65 -0.02 0.00 -1.05 0.00 0.00 58.31 55.65 1llw n LYS 972 Cb 0.42 -0.47 -0.02 0.00 -0.65 0.00 0.00 35.03 34.32 1llw n LYS 972 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1llw n PRO 973 N -0.08 -0.07 -0.95 -1.58 -0.02 -0.95 -2.70 135.00 128.65 1llw n PRO 973 Ca -0.02 0.74 -0.20 0.00 -2.02 0.00 0.00 63.50 62.00 1llw n PRO 973 Cb 0.76 -1.10 0.05 0.00 -0.02 0.00 0.00 33.50 33.19 1llw n PRO 973 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1llw n GLY 974 N -1.04 4.35 3.12 -1.23 0.00 -1.26 -4.60 105.19 104.52 1llw n GLY 974 Ca 0.00 -1.26 -0.08 0.00 0.00 0.00 0.00 46.02 44.69 1llw n GLY 974 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1llw s GLU 975 N -2.19 0.69 0.51 1.61 2.02 -1.10 -4.02 118.70 116.22 1llw s GLU 975 Ca 0.37 -1.17 0.01 0.00 0.02 0.00 0.00 54.97 54.21 1llw s GLU 975 Cb 0.29 0.24 0.02 0.00 0.10 0.00 0.00 34.13 34.79 1llw s GLU 975 CO 0.00 -0.16 0.73 0.20 0.02 0.00 0.00 175.26 176.06 1llw s GLY 976 N -2.91 1.74 0.76 -1.39 0.00 -1.26 -4.74 107.32 99.51 1llw s GLY 976 Ca 0.07 -1.25 -0.17 0.00 0.00 0.00 0.00 44.72 43.37 1llw s GLY 976 CO -0.10 -1.01 -0.31 0.61 0.00 0.00 0.00 173.10 172.30 1llw n GLY 977 N -2.23 -3.57 2.92 0.20 0.00 -1.26 -4.73 105.19 96.51 1llw n GLY 977 Ca 0.06 -0.49 -0.15 0.00 0.00 0.00 0.00 46.02 45.44 1llw n GLY 977 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1llw s GLN 978 N -1.74 0.09 -0.20 1.61 0.74 -1.26 -2.06 119.66 116.85 1llw s GLN 978 Ca 0.51 0.54 -0.05 0.00 0.05 0.00 0.00 55.36 56.41 1llw s GLN 978 Cb -0.34 -0.19 0.07 0.00 1.10 0.00 0.00 33.01 33.66 1llw s GLN 978 CO 0.72 -0.25 0.13 -1.17 -0.55 0.00 0.00 175.29 174.18 1llw s LEU 979 N 1.88 0.24 0.75 3.68 2.96 -0.07 -4.67 118.68 123.44 1llw s LEU 979 Ca -0.02 -0.60 -0.13 0.00 -0.22 0.00 0.00 54.13 53.15 1llw s LEU 979 Cb -0.12 -0.08 0.05 0.00 0.50 0.00 0.00 46.19 46.54 1llw s LEU 979 CO -0.07 -0.36 1.15 -2.16 -1.32 0.00 0.00 176.35 173.59 1llw s PRO 980 N 2.19 2.18 0.12 0.98 0.04 -1.26 -0.83 135.00 138.41 1llw s PRO 980 Ca 0.04 1.50 -0.16 0.00 0.04 0.00 0.00 61.00 62.42 1llw s PRO 980 Cb -0.16 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 1llw s PRO 980 CO -0.14 -1.75 1.59 0.78 0.04 0.00 0.00 177.00 177.53 1llw h GLY 981 N -0.61 0.66 -0.65 0.56 0.00 -1.80 -2.56 103.07 98.68 1llw h GLY 981 Ca -0.46 -0.45 0.12 0.00 0.00 0.00 0.00 47.33 46.55 1llw h GLY 981 CO 0.50 0.41 -0.19 0.28 0.00 0.00 0.00 176.54 177.55 1llw n LYS 982 N -4.55 -0.09 0.00 4.80 5.02 -1.26 0.18 118.16 122.27 1llw n LYS 982 Ca -0.01 1.01 0.14 0.00 -2.02 0.00 0.00 58.31 57.42 1llw n LYS 982 Cb 0.23 -1.50 0.61 0.00 -0.02 0.00 0.00 35.03 34.35 1llw n LYS 982 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1llw n LYS 983 N -5.03 0.17 -2.69 1.97 5.02 -0.97 -4.58 118.16 112.06 1llw n LYS 983 Ca 0.09 -0.02 -0.43 0.00 -2.02 0.00 0.00 58.31 55.93 1llw n LYS 983 Cb 0.31 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.81 1llw n LYS 983 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1llw s VAL 984 N -2.85 4.37 0.84 -0.18 1.01 0.48 -4.83 120.40 119.24 1llw s VAL 984 Ca 0.19 -2.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.00 1llw s VAL 984 Cb 0.19 -5.11 0.10 0.00 0.00 0.00 0.00 36.38 31.56 1llw s VAL 984 CO 0.53 -1.90 1.15 -0.94 0.00 0.00 0.00 175.10 173.93 1llw s SER 985 N 3.88 4.18 0.28 3.32 1.04 -1.26 -4.52 113.70 120.61 1llw s SER 985 Ca 0.50 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.85 1llw s SER 985 Cb 0.02 -1.48 0.53 0.00 0.10 0.00 0.00 66.02 65.18 1llw s SER 985 CO 0.05 -2.12 1.84 -0.33 0.98 0.00 0.00 173.24 173.65 1llw h GLU 986 N -1.20 0.96 0.16 4.02 5.08 -1.94 0.45 114.58 122.11 1llw h GLU 986 Ca -0.48 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1llw h GLU 986 Cb 1.32 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.32 1llw h GLU 986 CO 0.64 0.64 -0.40 -0.92 -1.00 0.00 0.00 179.01 177.97 1llw h TYR 987 N 0.99 -1.14 -0.74 4.33 5.03 -1.99 0.11 116.97 123.57 1llw h TYR 987 Ca 0.48 0.03 0.08 0.00 2.58 0.00 0.00 58.73 61.90 1llw h TYR 987 Cb 0.45 0.47 -0.06 0.00 1.55 0.00 0.00 36.73 39.14 1llw h TYR 987 CO -0.01 -0.47 0.41 0.82 -1.32 0.00 0.00 178.16 177.59 1llw h ILE 988 N -0.62 0.93 -0.61 1.81 1.08 -1.53 -0.43 117.51 118.14 1llw h ILE 988 Ca -0.02 -0.25 0.11 0.00 -0.39 0.00 0.00 64.86 64.31 1llw h ILE 988 Cb 0.59 0.15 -0.08 0.00 -3.07 0.00 0.00 36.82 34.41 1llw h ILE 988 CO -0.18 0.13 0.19 0.00 -0.69 0.00 0.00 178.15 177.61 1llw h ALA 989 N 1.40 0.77 0.26 1.87 0.00 0.27 0.25 119.26 124.09 1llw h ALA 989 Ca 0.34 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1llw h ALA 989 Cb 0.28 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1llw h ALA 989 CO -0.22 -0.24 -0.13 1.98 0.00 0.00 0.00 179.25 180.64 1llw h MET 990 N 0.35 -0.34 -0.78 0.00 1.85 0.70 0.30 114.93 117.01 1llw h MET 990 Ca 0.32 0.02 0.17 0.00 -0.61 0.00 0.00 59.70 59.60 1llw h MET 990 Cb 0.44 0.08 -0.15 0.00 0.43 0.00 0.00 31.60 32.40 1llw h MET 990 CO -0.35 0.01 -0.14 -0.07 -0.40 0.00 0.00 176.91 175.96 1llw h LEU 991 N -0.78 -0.62 -0.58 3.39 4.07 -0.67 -1.74 115.31 118.38 1llw h LEU 991 Ca -0.04 0.23 0.00 0.00 0.08 0.00 0.00 57.88 58.15 1llw h LEU 991 Cb 0.51 0.45 0.00 0.00 1.08 0.00 0.00 40.66 42.70 1llw h LEU 991 CO 0.06 -0.25 -0.13 0.54 -1.08 0.00 0.00 178.44 177.59 1llw n ARG 992 N -5.47 1.10 -3.61 1.13 1.74 0.85 -4.55 116.66 107.84 1llw n ARG 992 Ca 0.12 -0.58 -0.28 0.00 -0.77 0.00 0.00 57.85 56.34 1llw n ARG 992 Cb 0.43 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.43 1llw n ARG 992 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1llw n ARG 993 N -0.45 -1.56 -3.87 5.56 1.74 0.90 -4.79 116.66 114.20 1llw n ARG 993 Ca 0.16 0.53 -0.16 0.00 -0.77 0.00 0.00 57.85 57.61 1llw n ARG 993 Cb 0.32 -4.45 -0.06 0.00 -1.02 0.00 0.00 32.46 27.25 1llw n ARG 993 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1llw n SER 994 N -2.78 -0.75 -4.75 0.55 3.41 -0.26 -4.76 113.62 104.27 1llw n SER 994 Ca -0.10 -2.84 -0.37 0.00 -0.26 0.00 0.00 58.87 55.30 1llw n SER 994 Cb 0.60 1.63 -0.07 0.00 -0.26 0.00 0.00 64.21 66.12 1llw n SER 994 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1llw s LYS 995 N -3.06 4.17 0.10 4.33 -0.14 -1.26 -4.53 119.74 119.36 1llw s LYS 995 Ca 0.32 0.15 -0.20 0.00 -1.36 0.00 0.00 55.97 54.88 1llw s LYS 995 Cb 0.01 -3.39 -0.05 0.00 -1.68 0.00 0.00 37.83 32.73 1llw s LYS 995 CO 0.23 0.32 1.25 -2.30 -0.76 0.00 0.00 175.35 174.09 1llw n PRO 996 N 3.27 -0.28 -0.31 -1.68 -0.02 -1.26 -1.08 135.00 133.64 1llw n PRO 996 Ca -0.12 1.23 0.15 0.00 -2.02 0.00 0.00 63.50 62.74 1llw n PRO 996 Cb 0.52 -1.82 0.32 0.00 -0.02 0.00 0.00 33.50 32.50 1llw n PRO 996 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1llw h GLY 997 N 0.00 1.50 -4.52 -1.23 0.00 -1.92 -3.42 103.07 93.48 1llw h GLY 997 Ca 0.10 -0.08 -0.58 0.00 0.00 0.00 0.00 47.33 46.77 1llw h GLY 997 CO -0.61 -0.38 -0.15 0.14 0.00 0.00 0.00 176.54 175.54 1llw s VAL 998 N -5.88 4.95 0.35 4.60 1.01 -0.24 -4.48 120.40 120.71 1llw s VAL 998 Ca -0.12 0.76 -0.28 0.00 0.00 0.00 0.00 61.98 62.34 1llw s VAL 998 Cb 0.26 -3.72 -0.10 0.00 0.00 0.00 0.00 36.38 32.82 1llw s VAL 998 CO 0.78 0.37 1.37 -0.89 0.00 0.00 0.00 175.10 176.73 1llw s THR 999 N -1.32 2.45 -0.49 3.92 2.01 -1.26 -4.49 115.64 116.47 1llw s THR 999 Ca 0.32 0.46 -0.07 0.00 0.31 0.00 0.00 61.69 62.71 1llw s THR 999 Cb -0.16 -3.29 0.13 0.00 0.01 0.00 0.00 72.50 69.19 1llw s THR 999 CO 0.17 0.11 0.34 -0.76 -0.69 0.00 0.00 174.62 173.79 1llw s LEU 1000N -1.95 5.56 -0.41 4.42 1.43 -0.01 -4.91 118.68 122.79 1llw s LEU 1000Ca 0.51 -2.13 -0.13 0.00 -1.03 0.00 0.00 54.13 51.35 1llw s LEU 1000Cb -0.42 -1.94 0.05 0.00 0.03 0.00 0.00 46.19 43.90 1llw s LEU 1000CO 0.57 -0.60 0.28 -0.63 0.23 0.00 0.00 176.35 176.20 1llw s ILE 1001N 1.02 4.84 0.71 -0.59 1.01 -1.26 -0.89 121.20 126.04 1llw s ILE 1001Ca 0.09 -0.95 -0.11 0.00 0.00 0.00 0.00 60.65 59.68 1llw s ILE 1001Cb -0.23 -3.79 0.02 0.00 0.01 0.00 0.00 42.46 38.47 1llw s ILE 1001CO -0.03 -0.38 1.07 -0.44 0.00 0.00 0.00 174.94 175.16 1llw s SER 1002N 1.92 5.17 0.26 3.58 0.01 -0.87 -4.98 113.70 118.79 1llw s SER 1002Ca 0.03 1.67 -0.30 0.00 1.31 0.00 0.00 55.95 58.67 1llw s SER 1002Cb -0.21 -2.50 -0.09 0.00 0.21 0.00 0.00 66.02 63.42 1llw s SER 1002CO 0.07 -1.58 1.29 -2.84 0.41 0.00 0.00 173.24 170.58 1llw s PRO 1003N -4.99 4.40 0.18 12.44 0.02 -1.26 -4.20 135.00 141.60 1llw s PRO 1003Ca 0.59 2.09 -0.19 0.00 0.02 0.00 0.00 61.00 63.51 1llw s PRO 1003Cb -0.15 -3.15 0.13 0.00 0.02 0.00 0.00 34.50 31.35 1llw s PRO 1003CO 0.55 -0.18 1.62 -1.35 -0.33 0.00 0.00 177.00 177.30 1llw h PRO 1004N 4.50 -0.13 -6.63 5.54 0.11 -1.87 -3.38 132.00 130.14 1llw h PRO 1004Ca -0.46 0.01 -0.47 0.00 0.11 0.00 0.00 66.00 65.19 1llw h PRO 1004Cb 1.22 0.03 0.02 0.00 0.11 0.00 0.00 31.00 32.38 1llw h PRO 1004CO 0.72 -0.08 -0.12 -1.25 -0.21 0.00 0.00 178.00 177.05 1llw s PRO 1005N -6.11 3.31 0.15 1.05 0.04 -1.26 -4.58 135.00 127.60 1llw s PRO 1005Ca -0.14 -0.36 -0.30 0.00 0.04 0.00 0.00 61.00 60.24 1llw s PRO 1005Cb 0.16 -2.59 -0.07 0.00 0.04 0.00 0.00 34.50 32.03 1llw s PRO 1005CO 0.70 -0.06 1.14 -1.01 0.04 0.00 0.00 177.00 177.81 1llw s HIS 1006N -2.46 3.52 -0.36 0.56 3.76 -1.26 -4.76 115.29 114.29 1llw s HIS 1006Ca 0.44 1.49 0.00 0.00 -0.15 0.00 0.00 55.06 56.85 1llw s HIS 1006Cb -0.10 -3.34 0.00 0.00 1.11 0.00 0.00 32.58 30.25 1llw s HIS 1006CO 0.38 -0.89 0.67 0.72 -0.85 0.00 0.00 174.74 174.77 1llw n HIS 1007N 2.75 0.00 -0.07 1.40 8.25 -1.26 -2.24 115.22 124.05 1llw n HIS 1007Ca 0.04 -0.26 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 1llw n HIS 1007Cb 0.46 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.40 1llw n HIS 1007CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1llw n ASP 1008N 0.41 0.00 -3.53 0.41 -0.08 -1.26 -4.72 116.55 107.78 1llw n ASP 1008Ca 0.00 0.00 -0.28 0.00 -1.51 0.00 0.00 54.79 53.00 1llw n ASP 1008Cb 0.34 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.68 1llw n ASP 1008CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1llw s ILE 1009N 0.00 0.77 -1.31 5.18 1.01 -0.95 -4.64 121.20 121.26 1llw s ILE 1009Ca 0.00 -2.52 0.14 0.00 0.00 0.00 0.00 60.65 58.27 1llw s ILE 1009Cb 0.00 -1.54 0.33 0.00 0.01 0.00 0.00 42.46 41.25 1llw s ILE 1009CO 0.00 -1.07 1.24 -1.22 0.00 0.00 0.00 174.94 173.89 1llw n TYR 1010N 3.26 0.46 -3.65 3.97 0.53 -1.26 -4.53 117.16 115.94 1llw n TYR 1010Ca 0.19 -0.39 0.00 0.00 -1.02 0.00 0.00 57.90 56.68 1llw n TYR 1010Cb 0.40 -0.02 -0.01 0.00 -1.03 0.00 0.00 39.34 38.69 1llw n TYR 1010CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 1llw s SER 1011N -1.04 -0.09 0.09 7.72 1.04 -1.23 -4.37 113.70 115.81 1llw s SER 1011Ca 0.27 -0.19 -0.20 0.00 0.48 0.00 0.00 55.95 56.31 1llw s SER 1011Cb 0.15 0.24 -0.10 0.00 0.10 0.00 0.00 66.02 66.41 1llw s SER 1011CO 0.20 -0.43 1.61 -0.29 0.98 0.00 0.00 173.24 175.30 1llw h ILE 1012N 2.00 1.17 -0.36 -1.02 6.09 -1.78 -1.37 117.51 122.24 1llw h ILE 1012Ca -0.28 -0.53 0.07 0.00 -1.37 0.00 0.00 64.86 62.74 1llw h ILE 1012Cb 1.21 1.19 -0.06 0.00 0.47 0.00 0.00 36.82 39.62 1llw h ILE 1012CO 0.28 0.17 -0.02 -0.33 -3.07 0.00 0.00 178.15 175.18 1llw h GLU 1013N 0.13 0.08 -0.85 2.19 3.07 -1.91 0.75 114.58 118.04 1llw h GLU 1013Ca 0.06 -0.00 0.22 0.00 -0.50 0.00 0.00 59.36 59.13 1llw h GLU 1013Cb 0.20 -0.02 -0.14 0.00 -0.84 0.00 0.00 28.75 27.96 1llw h GLU 1013CO -0.00 0.05 0.19 -0.44 -1.40 0.00 0.00 179.01 177.40 1llw h ASP 1014N 0.08 -0.07 -0.76 1.42 3.32 -1.84 0.14 116.42 118.71 1llw h ASP 1014Ca 0.17 0.20 0.05 0.00 0.02 0.00 0.00 57.03 57.47 1llw h ASP 1014Cb 0.25 0.28 -0.05 0.00 0.22 0.00 0.00 39.33 40.02 1llw h ASP 1014CO -0.31 -0.15 0.47 0.25 -1.72 0.00 0.00 179.24 177.77 1llw h LEU 1015N 0.19 0.74 -1.48 1.55 6.46 0.16 -1.11 115.31 121.82 1llw h LEU 1015Ca 0.52 0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 58.24 1llw h LEU 1015Cb 1.02 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.80 1llw h LEU 1015CO -0.65 0.49 -0.24 0.00 -0.62 0.00 0.00 178.44 177.41 1llw h ALA 1016N 1.35 1.57 -0.85 1.25 0.00 0.65 -1.06 119.26 122.17 1llw h ALA 1016Ca 0.32 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1llw h ALA 1016Cb 0.11 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1llw h ALA 1016CO -0.15 0.32 0.41 1.96 0.00 0.00 0.00 179.25 181.80 1llw h GLN 1017N 0.02 1.23 -0.17 0.00 1.08 0.06 0.01 115.11 117.33 1llw h GLN 1017Ca 0.00 -0.18 -0.14 0.00 -1.45 0.00 0.00 58.65 56.88 1llw h GLN 1017Cb 0.44 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 1llw h GLN 1017CO 0.03 0.94 -0.44 1.25 -0.95 0.00 0.00 178.83 179.66 1llw h LEU 1018N 1.22 0.69 -1.09 1.46 5.85 -0.96 0.29 115.31 122.77 1llw h LEU 1018Ca 0.29 -0.58 0.17 0.00 0.84 0.00 0.00 57.88 58.61 1llw h LEU 1018Cb 0.11 -0.20 -0.09 0.00 0.37 0.00 0.00 40.66 40.85 1llw h LEU 1018CO -0.04 1.14 0.61 0.40 -0.34 0.00 0.00 178.44 180.22 1llw h ILE 1019N 0.26 0.77 -0.00 4.05 2.04 -1.33 0.22 117.51 123.52 1llw h ILE 1019Ca -0.01 -0.27 -0.14 0.00 1.00 0.00 0.00 64.86 65.45 1llw h ILE 1019Cb 1.05 -0.08 0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1llw h ILE 1019CO 0.10 0.14 -0.52 0.22 0.00 0.00 0.00 178.15 178.08 1llw h TYR 1020N 0.78 0.54 -0.68 1.37 3.20 -0.26 0.58 116.97 122.49 1llw h TYR 1020Ca 0.54 -0.29 0.15 0.00 3.14 0.00 0.00 58.73 62.27 1llw h TYR 1020Cb 0.81 -0.06 -0.12 0.00 1.54 0.00 0.00 36.73 38.91 1llw h TYR 1020CO -0.00 1.10 0.02 -0.44 -1.64 0.00 0.00 178.16 177.20 1llw h ASP 1021N -0.18 -0.28 -0.18 -2.11 3.32 0.23 0.32 116.42 117.53 1llw h ASP 1021Ca -0.06 0.17 -0.19 0.00 0.02 0.00 0.00 57.03 56.97 1llw h ASP 1021Cb 1.24 0.29 0.01 0.00 0.22 0.00 0.00 39.33 41.10 1llw h ASP 1021CO 0.10 -0.13 -0.61 -0.07 -1.72 0.00 0.00 179.24 176.81 1llw h LEU 1022N 0.12 0.85 -1.74 1.55 3.38 -0.45 -0.87 115.31 118.16 1llw h LEU 1022Ca 0.37 -0.60 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 1llw h LEU 1022Cb 0.62 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1llw h LEU 1022CO -0.58 1.30 -0.17 0.45 0.09 0.00 0.00 178.44 179.53 1llw h HIS 1023N 0.44 0.00 -0.41 1.13 3.86 -0.29 -0.76 115.15 119.13 1llw h HIS 1023Ca -0.03 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.06 1llw h HIS 1023Cb 1.24 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.70 1llw h HIS 1023CO 0.09 0.17 -0.25 0.37 0.86 0.00 0.00 177.93 179.17 1llw h GLN 1024N 0.00 0.89 0.03 2.45 5.75 -0.07 -2.39 115.11 121.77 1llw h GLN 1024Ca -0.00 -0.41 -0.29 0.00 -0.15 0.00 0.00 58.65 57.80 1llw h GLN 1024Cb 0.39 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.89 1llw h GLN 1024CO 0.02 1.06 -1.59 0.97 -2.65 0.00 0.00 178.83 176.64 1llw h ILE 1025N 0.71 1.02 -2.48 2.39 2.10 -0.44 -3.27 117.51 117.54 1llw h ILE 1025Ca 0.08 -2.80 -0.59 0.00 1.08 0.00 0.00 64.86 62.63 1llw h ILE 1025Cb 0.82 2.55 -0.40 0.00 -1.09 0.00 0.00 36.82 38.71 1llw h ILE 1025CO 0.07 0.66 -0.86 -3.20 -1.08 0.00 0.00 178.15 173.74 1llw n ASN 1026N -3.20 0.93 0.09 2.19 2.85 -0.36 -4.45 115.26 113.30 1llw n ASN 1026Ca -0.15 -2.74 0.20 0.00 -0.11 0.00 0.00 54.58 51.77 1llw n ASN 1026Cb 1.03 -0.63 0.63 0.00 1.24 0.00 0.00 39.78 42.05 1llw n ASN 1026CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1llw h PRO 1027N 5.17 0.00 0.00 1.20 0.11 -1.65 -0.76 132.00 136.07 1llw h PRO 1027Ca 0.20 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.30 1llw h PRO 1027Cb 0.84 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1llw h PRO 1027CO 0.52 0.00 -0.07 0.93 -0.21 0.00 0.00 178.00 179.17 1llw h GLU 1028N 0.00 0.00 -5.42 1.05 4.39 -1.94 -3.47 114.58 109.19 1llw h GLU 1028Ca 0.21 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 59.28 1llw h GLU 1028Cb 1.50 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 29.99 1llw h GLU 1028CO -0.00 0.07 -0.59 0.00 -1.16 0.00 0.00 179.01 177.32 1llw s ALA 1029N -3.35 3.33 0.35 3.43 0.00 -0.29 -4.95 121.76 120.27 1llw s ALA 1029Ca 0.05 -0.76 -0.25 0.00 0.00 0.00 0.00 51.96 50.99 1llw s ALA 1029Cb 0.07 -1.77 -0.10 0.00 0.00 0.00 0.00 23.12 21.32 1llw s ALA 1029CO 0.64 0.28 0.96 -0.65 0.00 0.00 0.00 175.76 176.99 1llw s GLN 1030N 0.07 4.50 -0.26 0.00 -0.21 -1.19 -4.79 119.66 117.78 1llw s GLN 1030Ca 0.04 1.32 -0.03 0.00 0.02 0.00 0.00 55.36 56.71 1llw s GLN 1030Cb -0.13 -2.69 0.02 0.00 1.00 0.00 0.00 33.01 31.21 1llw s GLN 1030CO 0.01 0.20 -0.02 0.08 -2.12 0.00 0.00 175.29 173.44 1llw s VAL 1031N -1.70 3.20 0.43 1.09 1.01 -1.26 -0.22 120.40 122.95 1llw s VAL 1031Ca 0.53 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1llw s VAL 1031Cb -0.18 -2.62 -0.00 0.00 0.00 0.00 0.00 36.38 33.58 1llw s VAL 1031CO 0.23 0.18 0.63 -0.94 0.00 0.00 0.00 175.10 175.20 1llw s SER 1032N 1.38 5.83 -0.02 3.32 1.04 0.34 -0.03 113.70 125.57 1llw s SER 1032Ca 0.01 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.59 1llw s SER 1032Cb -0.17 -1.41 0.02 0.00 0.10 0.00 0.00 66.02 64.56 1llw s SER 1032CO -0.03 -0.66 -0.00 -0.69 0.98 0.00 0.00 173.24 172.84 1llw s VAL 1033N -2.47 0.16 -0.15 5.02 1.01 -0.16 -1.31 120.40 122.49 1llw s VAL 1033Ca 0.48 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.52 1llw s VAL 1033Cb -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 36.06 1llw s VAL 1033CO 0.36 0.11 -0.18 -0.75 0.00 0.00 0.00 175.10 174.64 1llw s LYS 1034N 0.70 3.14 0.01 2.72 2.20 0.24 -0.76 119.74 127.98 1llw s LYS 1034Ca -0.07 -0.79 0.02 0.00 -0.36 0.00 0.00 55.97 54.78 1llw s LYS 1034Cb -0.10 -2.55 -0.01 0.00 -1.51 0.00 0.00 37.83 33.66 1llw s LYS 1034CO -0.01 0.01 -0.08 -0.51 -0.36 0.00 0.00 175.35 174.40 1llw s LEU 1035N 0.80 2.09 -0.00 5.43 1.43 0.62 -0.97 118.68 128.07 1llw s LEU 1035Ca -0.06 -0.27 -0.16 0.00 -1.03 0.00 0.00 54.13 52.61 1llw s LEU 1035Cb -0.15 -0.34 -0.06 0.00 0.03 0.00 0.00 46.19 45.67 1llw s LEU 1035CO -0.01 0.01 0.45 -0.69 0.23 0.00 0.00 176.35 176.34 1llw s VAL 1036N -0.53 4.99 -0.09 -1.59 1.01 -1.26 -1.00 120.40 121.94 1llw s VAL 1036Ca -0.00 0.93 -0.39 0.00 0.00 0.00 0.00 61.98 62.52 1llw s VAL 1036Cb -0.05 -3.76 -0.17 0.00 0.00 0.00 0.00 36.38 32.40 1llw s VAL 1036CO 0.00 0.54 1.49 0.00 0.00 0.00 0.00 175.10 177.14 1llw n ALA 1037N 2.05 -0.85 -3.46 5.51 0.00 -0.23 -4.84 120.51 118.69 1llw n ALA 1037Ca -0.12 0.47 -0.10 0.00 0.00 0.00 0.00 53.44 53.68 1llw n ALA 1037Cb 0.52 -2.11 -0.02 0.00 0.00 0.00 0.00 19.45 17.84 1llw n ALA 1037CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1llw s GLU 1038N 1.77 1.07 0.29 0.00 -1.05 -1.26 -0.97 118.70 118.55 1llw s GLU 1038Ca 0.91 -0.39 -0.30 0.00 -0.15 0.00 0.00 54.97 55.04 1llw s GLU 1038Cb -1.04 0.50 -0.11 0.00 -0.44 0.00 0.00 34.13 33.03 1llw s GLU 1038CO 0.56 -0.47 1.60 -1.50 0.95 0.00 0.00 175.26 176.41 1llw s ILE 1039N -3.47 2.07 0.00 1.83 -1.16 -1.26 -1.81 121.20 117.39 1llw s ILE 1039Ca 0.03 0.05 0.00 0.00 -0.51 0.00 0.00 60.65 60.22 1llw s ILE 1039Cb -0.01 -3.03 0.00 0.00 0.61 0.00 0.00 42.46 40.03 1llw s ILE 1039CO -0.11 0.01 0.00 0.61 -2.81 0.00 0.00 174.94 172.64 1llw n GLY 1040N 2.29 1.73 0.26 1.50 0.00 -1.26 -4.98 105.19 104.73 1llw n GLY 1040Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 1llw n GLY 1040CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1llw h ILE 1041N 0.00 0.40 -0.03 -0.61 2.10 -1.71 -2.43 117.51 115.23 1llw h ILE 1041Ca 0.00 -0.69 -0.04 0.00 1.08 0.00 0.00 64.86 65.21 1llw h ILE 1041Cb 0.00 1.50 0.00 0.00 -1.09 0.00 0.00 36.82 37.23 1llw h ILE 1041CO 0.00 0.12 -0.14 1.23 -1.08 0.00 0.00 178.15 178.28 1llw h GLY 1042N 1.46 0.16 0.46 8.18 0.00 -1.84 0.90 103.07 112.39 1llw h GLY 1042Ca -0.00 -0.22 0.10 0.00 0.00 0.00 0.00 47.33 47.21 1llw h GLY 1042CO 0.02 0.20 0.44 -0.84 0.00 0.00 0.00 176.54 176.35 1llw h THR 1043N -0.46 0.86 -0.20 4.70 2.02 -1.88 -0.37 112.91 117.59 1llw h THR 1043Ca -0.01 -0.25 -0.19 0.00 0.77 0.00 0.00 66.41 66.73 1llw h THR 1043Cb 0.81 0.08 0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1llw h THR 1043CO 0.03 0.13 -0.63 0.40 0.37 0.00 0.00 175.52 175.82 1llw h ILE 1044N 0.72 1.29 -0.72 3.11 2.04 -0.86 -2.32 117.51 120.76 1llw h ILE 1044Ca 0.40 -1.84 0.02 0.00 1.00 0.00 0.00 64.86 64.43 1llw h ILE 1044Cb 0.41 1.88 -0.04 0.00 -0.74 0.00 0.00 36.82 38.34 1llw h ILE 1044CO -0.27 0.58 0.47 0.00 0.00 0.00 0.00 178.15 178.93 1llw h ALA 1045N 0.59 0.93 -0.99 1.87 0.00 0.12 0.28 119.26 122.05 1llw h ALA 1045Ca -0.02 -0.04 0.24 0.00 0.00 0.00 0.00 54.91 55.08 1llw h ALA 1045Cb 1.26 -0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.65 1llw h ALA 1045CO 0.13 0.30 0.58 0.00 0.00 0.00 0.00 179.25 180.27 1llw h ALA 1046N 1.28 1.74 -0.09 0.00 0.00 -0.53 0.33 119.26 121.99 1llw h ALA 1046Ca 0.27 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1llw h ALA 1046Cb -0.07 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1llw h ALA 1046CO -0.08 -0.25 0.02 0.78 0.00 0.00 0.00 179.25 179.73 1llw h GLY 1047N 0.59 0.16 1.68 0.00 0.00 -0.21 -0.12 103.07 105.16 1llw h GLY 1047Ca 0.63 -0.10 -0.04 0.00 0.00 0.00 0.00 47.33 47.82 1llw h GLY 1047CO -0.47 0.09 -0.01 -2.08 0.00 0.00 0.00 176.54 174.07 1llw h VAL 1048N -0.05 1.17 -0.11 4.60 2.07 -0.06 0.84 116.25 124.70 1llw h VAL 1048Ca 0.03 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 1llw h VAL 1048Cb 0.24 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1llw h VAL 1048CO 0.00 0.23 -0.05 0.00 0.02 0.00 0.00 177.57 177.77 1llw h ALA 1049N 1.60 0.15 -0.09 1.67 0.00 -0.01 -2.87 119.26 119.72 1llw h ALA 1049Ca 0.09 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1llw h ALA 1049Cb 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1llw h ALA 1049CO 0.01 -0.07 -0.20 0.87 0.00 0.00 0.00 179.25 179.85 1llw h LYS 1050N -0.12 0.14 0.00 0.00 1.57 0.30 -1.92 116.57 116.53 1llw h LYS 1050Ca 0.02 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1llw h LYS 1050Cb 0.50 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1llw h LYS 1050CO 0.02 0.35 0.00 0.00 -0.57 0.00 0.00 179.45 179.25 1llw n ALA 1051N -2.49 1.85 -2.89 3.86 0.00 0.28 -4.87 120.51 116.25 1llw n ALA 1051Ca -0.01 -0.02 -0.15 0.00 0.00 0.00 0.00 53.44 53.26 1llw n ALA 1051Cb 0.30 -1.04 0.03 0.00 0.00 0.00 0.00 19.45 18.74 1llw n ALA 1051CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1llw n ASN 1052N -0.61 -4.73 -4.88 0.00 4.05 -0.72 -4.43 115.26 103.94 1llw n ASN 1052Ca 0.02 -0.24 -0.30 0.00 0.45 0.00 0.00 54.58 54.51 1llw n ASN 1052Cb 0.01 -3.53 0.04 0.00 1.23 0.00 0.00 39.78 37.53 1llw n ASN 1052CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1llw s ALA 1053N -3.03 2.95 -0.15 5.20 0.00 -1.09 -4.87 121.76 120.77 1llw s ALA 1053Ca 0.25 -0.26 0.16 0.00 0.00 0.00 0.00 51.96 52.12 1llw s ALA 1053Cb -0.11 -3.05 -0.24 0.00 0.00 0.00 0.00 23.12 19.72 1llw s ALA 1053CO 0.31 -1.01 0.28 -0.25 0.00 0.00 0.00 175.76 175.09 1llw n ASP 1054N -2.93 0.30 -3.85 0.00 8.00 0.96 -4.74 116.55 114.29 1llw n ASP 1054Ca 0.07 0.15 -0.11 0.00 0.71 0.00 0.00 54.79 55.60 1llw n ASP 1054Cb 0.56 0.63 -0.09 0.00 -0.02 0.00 0.00 41.12 42.20 1llw n ASP 1054CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1llw s ILE 1055N -2.53 0.09 -0.03 0.53 1.01 -0.81 -2.12 121.20 117.34 1llw s ILE 1055Ca -0.08 -0.74 0.04 0.00 0.00 0.00 0.00 60.65 59.87 1llw s ILE 1055Cb 0.07 -0.61 -0.01 0.00 0.01 0.00 0.00 42.46 41.92 1llw s ILE 1055CO 0.83 -0.41 -0.15 -0.63 0.00 0.00 0.00 174.94 174.57 1llw s ILE 1056N -1.76 1.26 -0.15 2.92 1.01 -0.77 -0.99 121.20 122.72 1llw s ILE 1056Ca -0.12 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 59.89 1llw s ILE 1056Cb -0.05 -1.07 -0.01 0.00 0.01 0.00 0.00 42.46 41.34 1llw s ILE 1056CO 0.00 0.36 -0.14 -1.58 0.00 0.00 0.00 174.94 173.58 1llw s GLN 1057N -0.11 3.26 -0.16 2.79 0.74 0.06 -0.98 119.66 125.26 1llw s GLN 1057Ca 0.01 -0.73 -0.08 0.00 0.05 0.00 0.00 55.36 54.60 1llw s GLN 1057Cb -0.09 -2.64 -0.04 0.00 1.10 0.00 0.00 33.01 31.34 1llw s GLN 1057CO 0.01 0.06 0.12 0.42 -0.55 0.00 0.00 175.29 175.35 1llw s ILE 1058N 0.71 5.29 -0.06 -2.34 1.09 -0.15 -0.28 121.20 125.47 1llw s ILE 1058Ca -0.07 0.14 0.04 0.00 -1.10 0.00 0.00 60.65 59.66 1llw s ILE 1058Cb -0.15 -3.37 -0.00 0.00 -1.06 0.00 0.00 42.46 37.88 1llw s ILE 1058CO 0.02 0.51 -0.19 -0.44 -0.10 0.00 0.00 174.94 174.74 1llw s SER 1059N -0.17 2.42 0.80 3.58 0.01 -0.17 -0.86 113.70 119.31 1llw s SER 1059Ca 0.10 -0.41 -0.12 0.00 1.31 0.00 0.00 55.95 56.83 1llw s SER 1059Cb -0.12 -0.87 0.07 0.00 0.21 0.00 0.00 66.02 65.32 1llw s SER 1059CO 0.01 0.14 1.14 -0.83 0.41 0.00 0.00 173.24 174.11 1llw s GLY 1060N 0.21 1.60 0.38 3.44 0.00 0.74 -1.07 107.32 112.62 1llw s GLY 1060Ca -0.10 -0.49 0.28 0.00 0.00 0.00 0.00 44.72 44.42 1llw s GLY 1060CO 0.04 -0.03 1.84 1.12 0.00 0.00 0.00 173.10 176.07 1llw h HIS 1061N -1.04 0.00 -0.97 1.90 2.07 -1.61 -3.04 115.15 112.47 1llw h HIS 1061Ca -0.47 0.00 0.20 0.00 -2.85 0.00 0.00 60.37 57.25 1llw h HIS 1061Cb 1.30 0.00 -0.09 0.00 2.57 0.00 0.00 27.41 31.19 1llw h HIS 1061CO 0.38 0.00 0.62 -0.44 -3.07 0.00 0.00 177.93 175.41 1llw h ASP 1062N 0.00 0.62 -4.05 3.10 3.32 -1.85 -3.39 116.42 114.17 1llw h ASP 1062Ca 0.00 0.07 -0.45 0.00 0.02 0.00 0.00 57.03 56.67 1llw h ASP 1062Cb 0.38 -0.04 0.15 0.00 0.22 0.00 0.00 39.33 40.04 1llw h ASP 1062CO 0.00 0.22 0.25 -0.83 -1.72 0.00 0.00 179.24 177.16 1llw s GLY 1063N -3.78 1.57 0.84 2.75 0.00 -1.15 -3.52 107.32 104.03 1llw s GLY 1063Ca -0.10 -0.48 -0.07 0.00 0.00 0.00 0.00 44.72 44.08 1llw s GLY 1063CO 0.80 0.12 1.15 -0.32 0.00 0.00 0.00 173.10 174.85 1llw s GLY 1064N -3.77 1.77 -0.24 0.20 0.00 -1.26 -3.65 107.32 100.37 1llw s GLY 1064Ca 0.65 -1.65 -0.27 0.00 0.00 0.00 0.00 44.72 43.46 1llw s GLY 1064CO 0.55 -0.95 1.03 -0.51 0.00 0.00 0.00 173.10 173.22 1llw s THR 1065N -3.48 0.00 -2.22 0.90 -4.23 -1.26 -4.55 115.64 100.81 1llw s THR 1065Ca 0.71 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 61.51 1llw s THR 1065Cb -0.03 -1.00 0.73 0.00 1.34 0.00 0.00 72.50 73.53 1llw s THR 1065CO 0.48 0.00 1.98 0.61 -0.54 0.00 0.00 174.62 177.15 1llw n GLY 1066N 1.76 -0.54 3.39 3.99 0.00 -1.26 0.17 105.19 112.71 1llw n GLY 1066Ca -0.12 -0.31 0.03 0.00 0.00 0.00 0.00 46.02 45.62 1llw n GLY 1066CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 1067N -1.99 -2.95 0.22 4.61 0.00 -1.26 -2.63 121.76 117.77 1llw s ALA 1067Ca 0.42 1.91 -0.12 0.00 0.00 0.00 0.00 51.96 54.17 1llw s ALA 1067Cb 0.21 -2.13 -0.00 0.00 0.00 0.00 0.00 23.12 21.20 1llw s ALA 1067CO 0.34 -0.72 0.43 -1.12 0.00 0.00 0.00 175.76 174.69 1llw s SER 1068N 1.74 -0.07 0.57 0.00 0.01 0.15 -4.68 113.70 111.42 1llw s SER 1068Ca -0.03 -0.89 -0.21 0.00 1.31 0.00 0.00 55.95 56.13 1llw s SER 1068Cb -0.02 0.55 -0.04 0.00 0.21 0.00 0.00 66.02 66.72 1llw s SER 1068CO -0.14 -1.07 1.31 -2.84 0.41 0.00 0.00 173.24 170.91 1llw s PRO 1069N -4.00 3.03 0.20 12.44 0.02 -1.26 -0.19 135.00 145.24 1llw s PRO 1069Ca 0.21 2.10 -0.05 0.00 0.02 0.00 0.00 61.00 63.28 1llw s PRO 1069Cb 0.00 -2.13 0.14 0.00 0.02 0.00 0.00 34.50 32.54 1llw s PRO 1069CO 0.06 -1.24 1.60 1.25 -0.33 0.00 0.00 177.00 178.34 1llw h LEU 1070N 1.21 0.82 -0.65 -5.54 5.85 -1.86 -2.90 115.31 112.25 1llw h LEU 1070Ca -0.51 -0.31 0.12 0.00 0.84 0.00 0.00 57.88 58.02 1llw h LEU 1070Cb 1.30 -0.23 -0.12 0.00 0.37 0.00 0.00 40.66 41.98 1llw h LEU 1070CO 0.56 1.04 -0.24 0.77 -0.34 0.00 0.00 178.44 180.22 1llw h SER 1071N 0.69 -0.87 0.14 1.25 4.64 -1.92 -1.46 113.55 116.02 1llw h SER 1071Ca 0.09 0.22 -0.12 0.00 -0.47 0.00 0.00 61.79 61.50 1llw h SER 1071Cb 0.78 0.49 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 1llw h SER 1071CO 0.06 -0.26 -0.43 0.28 -0.87 0.00 0.00 176.83 175.61 1llw h SER 1072N -0.07 0.39 -0.66 4.97 0.02 -1.81 0.36 113.55 116.74 1llw h SER 1072Ca 0.29 -0.17 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1llw h SER 1072Cb 0.53 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 1llw h SER 1072CO -0.70 0.77 0.44 0.40 -1.14 0.00 0.00 176.83 176.60 1llw h ILE 1073N 0.30 1.16 -0.02 3.27 2.04 -1.13 -3.04 117.51 120.09 1llw h ILE 1073Ca 0.02 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1llw h ILE 1073Cb 0.88 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1llw h ILE 1073CO 0.07 0.16 -0.20 0.29 0.00 0.00 0.00 178.15 178.47 1llw n LYS 1074N -4.44 1.55 0.00 2.37 4.76 -0.63 -4.06 118.16 117.72 1llw n LYS 1074Ca 0.07 -1.08 0.00 0.00 -2.87 0.00 0.00 58.31 54.43 1llw n LYS 1074Cb 0.05 -1.29 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 1llw n LYS 1074CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1llw n HIS 1075N 0.29 0.00 -4.34 2.13 8.25 0.12 -5.04 115.22 116.63 1llw n HIS 1075Ca 0.08 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.24 1llw n HIS 1075Cb 0.37 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.37 1llw n HIS 1075CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1llw s ALA 1076N 0.00 2.84 0.00 -1.41 0.00 -1.15 0.89 121.76 122.93 1llw s ALA 1076Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.72 1llw s ALA 1076Cb 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.29 1llw s ALA 1076CO 0.00 0.62 0.00 0.41 0.00 0.00 0.00 175.76 176.79 1llw n GLY 1077N 0.95 -1.46 3.20 0.00 0.00 -1.18 -4.79 105.19 101.91 1llw n GLY 1077Ca -0.15 -1.57 -0.12 0.00 0.00 0.00 0.00 46.02 44.18 1llw n GLY 1077CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1llw s SER 1078N -3.70 1.32 0.64 1.61 0.01 -0.14 -4.77 113.70 108.68 1llw s SER 1078Ca 0.00 -1.04 -0.17 0.00 1.31 0.00 0.00 55.95 56.05 1llw s SER 1078Cb 0.00 0.07 -0.06 0.00 0.21 0.00 0.00 66.02 66.24 1llw s SER 1078CO 0.00 -0.45 0.53 -2.65 0.41 0.00 0.00 173.24 171.08 1llw n PRO 1079N -0.12 0.43 0.11 12.44 -0.02 -1.26 -2.25 135.00 144.32 1llw n PRO 1079Ca -0.11 0.18 0.03 0.00 -2.02 0.00 0.00 63.50 61.58 1llw n PRO 1079Cb 0.61 -1.77 -0.01 0.00 -0.02 0.00 0.00 33.50 32.32 1llw n PRO 1079CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 1llw h TRP 1080N -0.03 0.00 -1.05 6.00 5.08 -1.89 -2.50 115.95 121.55 1llw h TRP 1080Ca -0.46 0.00 0.28 0.00 1.08 0.00 0.00 58.89 59.79 1llw h TRP 1080Cb 1.37 0.00 -0.09 0.00 -3.00 0.00 0.00 29.16 27.44 1llw h TRP 1080CO 0.33 0.48 0.68 0.93 -1.28 0.00 0.00 178.44 179.58 1llw h GLU 1081N 0.00 0.35 -0.09 0.12 3.07 -1.96 0.27 114.58 116.35 1llw h GLU 1081Ca -0.05 -0.02 -0.12 0.00 -0.50 0.00 0.00 59.36 58.67 1llw h GLU 1081Cb 1.41 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 29.25 1llw h GLU 1081CO 0.05 0.23 -0.42 -0.07 -1.40 0.00 0.00 179.01 177.41 1llw h LEU 1082N 0.36 0.52 0.62 1.33 3.38 -1.81 -3.17 115.31 116.53 1llw h LEU 1082Ca 0.60 -0.65 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1llw h LEU 1082Cb 1.58 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 42.18 1llw h LEU 1082CO -0.29 1.08 -0.30 1.23 0.09 0.00 0.00 178.44 180.25 1llw h GLY 1083N -0.01 -0.87 0.86 0.83 0.00 -0.95 -0.43 103.07 102.50 1llw h GLY 1083Ca -0.03 0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.61 1llw h GLY 1083CO 0.09 -0.32 -0.15 -2.08 0.00 0.00 0.00 176.54 174.08 1llw h VAL 1084N -0.88 0.71 -0.44 4.60 2.07 -0.67 0.94 116.25 122.58 1llw h VAL 1084Ca -0.09 -0.27 0.05 0.00 0.82 0.00 0.00 66.70 67.21 1llw h VAL 1084Cb 0.66 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 31.21 1llw h VAL 1084CO 0.14 0.06 -0.48 0.74 0.02 0.00 0.00 177.57 178.05 1llw h THR 1085N -0.57 0.00 -0.50 2.57 2.02 -1.58 0.92 112.91 115.77 1llw h THR 1085Ca -0.04 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.16 1llw h THR 1085Cb 0.42 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 1llw h THR 1085CO 0.07 0.00 0.30 -0.08 0.37 0.00 0.00 175.52 176.18 1llw h GLU 1086N -0.27 0.58 0.34 6.66 4.81 -0.82 0.12 114.58 126.00 1llw h GLU 1086Ca 0.08 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1llw h GLU 1086Cb 0.47 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1llw h GLU 1086CO -0.56 0.39 -0.16 0.28 -0.73 0.00 0.00 179.01 178.22 1llw h VAL 1087N 0.60 0.62 -0.96 0.32 2.07 -0.38 -1.27 116.25 117.26 1llw h VAL 1087Ca 0.20 -0.60 0.30 0.00 0.82 0.00 0.00 66.70 67.42 1llw h VAL 1087Cb 0.02 0.90 -0.16 0.00 -1.52 0.00 0.00 31.29 30.53 1llw h VAL 1087CO -0.09 0.11 0.30 -0.74 0.02 0.00 0.00 177.57 177.17 1llw h HIS 1088N -0.82 0.44 0.26 1.57 -0.00 0.11 0.06 115.15 116.78 1llw h HIS 1088Ca -0.05 0.05 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 1llw h HIS 1088Cb 0.52 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.90 1llw h HIS 1088CO 0.02 -0.33 -0.13 -0.09 -0.00 0.00 0.00 177.93 177.41 1llw h ARG 1089N 0.12 -0.34 -0.76 5.26 2.43 -0.40 -2.49 114.38 118.20 1llw h ARG 1089Ca 0.66 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 60.03 1llw h ARG 1089Cb 1.49 0.08 -0.12 0.00 -0.42 0.00 0.00 29.97 31.00 1llw h ARG 1089CO -0.75 -0.11 0.11 0.28 -1.51 0.00 0.00 179.97 177.99 1llw h VAL 1090N -1.05 0.41 -0.24 0.20 2.07 -1.00 -0.33 116.25 116.32 1llw h VAL 1090Ca -0.04 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1llw h VAL 1090Cb 0.38 0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 1llw h VAL 1090CO 0.06 0.03 -0.18 -0.07 0.02 0.00 0.00 177.57 177.44 1llw h LEU 1091N 0.19 -0.57 -0.33 2.57 3.38 -1.01 -0.01 115.31 119.53 1llw h LEU 1091Ca 0.43 0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.57 1llw h LEU 1091Cb 0.77 0.29 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 1llw h LEU 1091CO -0.59 -0.22 0.05 0.24 0.09 0.00 0.00 178.44 178.01 1llw h MET 1092N -0.17 0.15 -0.40 1.13 2.86 -0.79 0.28 114.93 118.00 1llw h MET 1092Ca 0.14 -0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.68 1llw h MET 1092Cb 0.37 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1llw h MET 1092CO -0.34 0.10 -0.11 0.93 1.06 0.00 0.00 176.91 178.55 1llw h GLU 1093N 0.15 0.70 -0.07 1.72 4.39 -0.55 -1.45 114.58 119.48 1llw h GLU 1093Ca 0.15 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1llw h GLU 1093Cb 0.18 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1llw h GLU 1093CO -0.22 0.79 0.00 0.09 -1.16 0.00 0.00 179.01 178.51 1llw n ASN 1094N -4.17 0.56 -3.30 1.42 3.02 -0.07 -4.89 115.26 107.83 1llw n ASN 1094Ca 0.01 -1.60 -0.24 0.00 -0.03 0.00 0.00 54.58 52.72 1llw n ASN 1094Cb 0.35 -0.04 0.04 0.00 -0.61 0.00 0.00 39.78 39.52 1llw n ASN 1094CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1llw n GLN 1095N -0.38 -5.49 0.00 3.52 7.27 -0.55 -4.70 117.38 117.06 1llw n GLN 1095Ca 0.13 0.80 0.05 0.00 0.07 0.00 0.00 57.00 58.04 1llw n GLN 1095Cb 0.14 -5.69 0.02 0.00 2.41 0.00 0.00 30.24 27.13 1llw n GLN 1095CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1llw n LEU 1096N -4.30 1.57 -0.01 1.69 4.77 0.94 -4.72 117.00 116.95 1llw n LEU 1096Ca -0.05 -0.90 0.10 0.00 -0.03 0.00 0.00 56.01 55.12 1llw n LEU 1096Cb 0.58 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.19 1llw n LEU 1096CO 0.55 0.31 1.16 -0.09 -1.33 0.00 0.00 177.39 177.99 1llw h ARG 1097N 1.61 0.35 0.00 3.23 9.65 -1.72 0.79 114.38 128.29 1llw h ARG 1097Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1llw h ARG 1097Cb 0.38 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.88 1llw h ARG 1097CO 0.00 0.23 0.00 -0.40 2.80 0.00 0.00 179.97 182.60 1llw n ASP 1098N -4.47 0.20 0.00 -3.80 5.75 -1.26 -3.37 116.55 109.61 1llw n ASP 1098Ca 0.06 0.55 0.12 0.00 -0.01 0.00 0.00 54.79 55.52 1llw n ASP 1098Cb 0.26 -0.60 0.57 0.00 -1.03 0.00 0.00 41.12 40.33 1llw n ASP 1098CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1llw n ARG 1099N -1.73 0.12 -3.67 0.11 1.74 0.27 -4.49 116.66 109.02 1llw n ARG 1099Ca 0.03 0.06 -0.14 0.00 -0.77 0.00 0.00 57.85 57.03 1llw n ARG 1099Cb 0.17 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.03 1llw n ARG 1099CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1llw s VAL 1100N -2.86 0.01 0.03 1.55 1.01 -1.22 -4.67 120.40 114.25 1llw s VAL 1100Ca 0.16 -0.06 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 1llw s VAL 1100Cb 0.17 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 1llw s VAL 1100CO 0.44 -0.03 0.34 -0.22 0.00 0.00 0.00 175.10 175.63 1llw s LEU 1101N -0.15 4.38 -0.23 3.92 2.96 -0.90 -4.98 118.68 123.68 1llw s LEU 1101Ca -0.04 0.73 -0.07 0.00 -0.22 0.00 0.00 54.13 54.53 1llw s LEU 1101Cb -0.03 -2.75 -0.03 0.00 0.50 0.00 0.00 46.19 43.88 1llw s LEU 1101CO 0.03 0.24 0.05 -0.76 -1.32 0.00 0.00 176.35 174.59 1llw s LEU 1102N -1.65 3.47 0.10 -0.68 1.43 -1.26 -1.84 118.68 118.24 1llw s LEU 1102Ca 0.28 -0.15 -0.22 0.00 -1.03 0.00 0.00 54.13 53.01 1llw s LEU 1102Cb -0.14 -1.91 -0.07 0.00 0.03 0.00 0.00 46.19 44.10 1llw s LEU 1102CO 0.16 0.03 0.66 -0.13 0.23 0.00 0.00 176.35 177.29 1llw s ARG 1103N 1.25 4.36 -0.04 1.70 0.52 -0.15 -0.75 118.95 125.85 1llw s ARG 1103Ca 0.04 0.91 0.06 0.00 -0.52 0.00 0.00 55.73 56.22 1llw s ARG 1103Cb -0.15 -3.26 -0.02 0.00 0.52 0.00 0.00 34.95 32.04 1llw s ARG 1103CO 0.03 0.57 -0.20 0.00 0.02 0.00 0.00 175.30 175.72 1llw s ALA 1104N -0.99 2.42 0.35 2.13 0.00 -1.13 -0.97 121.76 123.57 1llw s ALA 1104Ca 0.32 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1llw s ALA 1104Cb -0.21 -0.77 -0.00 0.00 0.00 0.00 0.00 23.12 22.14 1llw s ALA 1104CO 0.22 0.54 0.44 -0.40 0.00 0.00 0.00 175.76 176.56 1llw n ASP 1105N 2.39 -1.21 0.00 0.00 5.68 -0.04 -1.31 116.55 122.06 1llw n ASP 1105Ca -0.17 -3.03 0.00 0.00 -0.50 0.00 0.00 54.79 51.10 1llw n ASP 1105Cb 0.52 2.37 0.00 0.00 -1.14 0.00 0.00 41.12 42.86 1llw n ASP 1105CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1llw n GLY 1106N -0.61 1.27 2.06 6.12 0.00 -1.26 -0.19 105.19 112.58 1llw n GLY 1106Ca 0.03 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1llw n GLY 1106CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llw n GLY 1107N 0.30 0.50 3.75 -0.02 0.00 -1.26 -4.76 105.19 103.70 1llw n GLY 1107Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1llw n GLY 1107CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llw s LEU 1108N 0.00 4.42 0.00 0.99 1.43 -1.26 -4.84 118.68 119.41 1llw s LEU 1108Ca 0.00 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 55.67 1llw s LEU 1108Cb 0.00 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.59 1llw s LEU 1108CO 0.00 -0.57 0.00 2.29 0.23 0.00 0.00 176.35 178.30 1llw n LYS 1109N 1.87 0.00 -3.83 1.70 2.85 -1.26 -4.75 118.16 114.74 1llw n LYS 1109Ca 0.04 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.18 1llw n LYS 1109Cb 0.42 -0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.67 1llw n LYS 1109CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1llw s THR 1110N 0.00 0.01 0.33 0.58 -1.32 -1.26 -4.97 115.64 109.01 1llw s THR 1110Ca 0.00 -0.07 0.12 0.00 -1.21 0.00 0.00 61.69 60.53 1llw s THR 1110Cb 0.00 -0.23 0.33 0.00 -1.51 0.00 0.00 72.50 71.10 1llw s THR 1110CO 0.00 -0.04 1.64 1.23 -2.21 0.00 0.00 174.62 175.24 1llw h GLY 1111N 5.77 1.91 1.58 6.08 0.00 -1.90 1.45 103.07 117.96 1llw h GLY 1111Ca -0.26 -0.16 0.02 0.00 0.00 0.00 0.00 47.33 46.93 1llw h GLY 1111CO 0.42 -0.51 0.25 -0.25 0.00 0.00 0.00 176.54 176.44 1llw h TRP 1112N 0.24 0.43 -0.70 5.60 7.01 -1.90 0.33 115.95 126.96 1llw h TRP 1112Ca 0.71 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.70 1llw h TRP 1112Cb 1.61 -0.14 -0.03 0.00 -2.10 0.00 0.00 29.16 28.50 1llw h TRP 1112CO -0.09 0.26 0.37 -0.44 -2.79 0.00 0.00 178.44 175.75 1llw h ASP 1113N 0.45 0.89 -0.05 2.65 3.32 0.16 0.39 116.42 124.23 1llw h ASP 1113Ca 0.15 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1llw h ASP 1113Cb 0.03 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 1llw h ASP 1113CO -0.03 0.75 0.01 0.58 -1.72 0.00 0.00 179.24 178.82 1llw h VAL 1114N 0.97 1.22 -0.89 -1.35 2.07 -0.40 -1.07 116.25 116.80 1llw h VAL 1114Ca 0.24 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 67.11 1llw h VAL 1114Cb 0.07 1.59 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 1llw h VAL 1114CO -0.04 0.18 0.59 0.58 0.02 0.00 0.00 177.57 178.90 1llw h VAL 1115N -0.18 1.21 -0.45 2.57 2.07 -0.34 -0.47 116.25 120.65 1llw h VAL 1115Ca 0.01 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.15 1llw h VAL 1115Cb 0.29 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.94 1llw h VAL 1115CO 0.00 0.22 0.25 0.24 0.02 0.00 0.00 177.57 178.30 1llw h MET 1116N 1.19 0.49 0.22 1.57 2.07 -0.77 -1.48 114.93 118.22 1llw h MET 1116Ca 0.33 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.92 1llw h MET 1116Cb -0.11 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 29.51 1llw h MET 1116CO -0.08 0.32 -0.11 0.00 1.07 0.00 0.00 176.91 178.12 1llw h ALA 1117N 1.21 -0.30 -0.46 6.32 0.00 -0.46 -2.18 119.26 123.40 1llw h ALA 1117Ca 0.19 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1llw h ALA 1117Cb 0.05 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 1llw h ALA 1117CO -0.10 -0.67 -0.41 0.00 0.00 0.00 0.00 179.25 178.07 1llw h ALA 1118N 0.49 -0.35 -0.92 0.00 0.00 -0.98 -0.69 119.26 116.80 1llw h ALA 1118Ca -0.03 0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.09 1llw h ALA 1118Cb 0.23 0.88 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 1llw h ALA 1118CO 0.04 -0.83 0.59 -0.07 0.00 0.00 0.00 179.25 178.98 1llw h LEU 1119N -0.29 0.76 -0.39 0.00 3.38 -1.22 0.94 115.31 118.49 1llw h LEU 1119Ca 0.16 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1llw h LEU 1119Cb 0.57 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1llw h LEU 1119CO -0.60 0.41 0.00 0.23 0.09 0.00 0.00 178.44 178.57 1llw n MET 1120N -4.57 0.19 0.00 1.13 2.81 -0.39 -1.20 117.12 115.10 1llw n MET 1120Ca 0.17 0.32 0.00 0.00 -1.81 0.00 0.00 57.70 56.38 1llw n MET 1120Cb 0.39 -1.81 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 1llw n MET 1120CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1llw n GLY 1121N 0.50 0.16 3.82 3.03 0.00 -0.12 -3.91 105.19 108.67 1llw n GLY 1121Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1llw n GLY 1121CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 1122N -0.58 3.61 -0.15 4.61 0.00 -0.75 -4.70 121.76 123.81 1llw s ALA 1122Ca 0.00 -0.03 0.15 0.00 0.00 0.00 0.00 51.96 52.08 1llw s ALA 1122Cb 0.00 -2.57 -0.22 0.00 0.00 0.00 0.00 23.12 20.33 1llw s ALA 1122CO 0.00 0.42 0.11 0.39 0.00 0.00 0.00 175.76 176.68 1llw n GLU 1123N 1.69 1.15 -4.52 0.00 1.02 0.07 -3.85 120.64 116.21 1llw n GLU 1123Ca -0.11 -0.03 -0.26 0.00 -0.02 0.00 0.00 57.16 56.74 1llw n GLU 1123Cb 0.51 -1.43 -0.10 0.00 -0.02 0.00 0.00 31.44 30.40 1llw n GLU 1123CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1llw s GLU 1124N -2.53 1.89 -0.03 3.49 2.02 -0.84 -4.89 118.70 117.81 1llw s GLU 1124Ca -0.08 -1.94 0.01 0.00 0.02 0.00 0.00 54.97 52.98 1llw s GLU 1124Cb 0.06 -1.73 0.02 0.00 0.10 0.00 0.00 34.13 32.58 1llw s GLU 1124CO 0.70 0.10 -0.04 0.71 0.02 0.00 0.00 175.26 176.75 1llw s TYR 1125N -2.61 0.59 -0.04 1.61 1.51 -0.65 -2.84 117.35 114.91 1llw s TYR 1125Ca 0.33 -0.13 0.01 0.00 -1.01 0.00 0.00 57.07 56.27 1llw s TYR 1125Cb 0.03 -0.53 -0.03 0.00 -0.11 0.00 0.00 41.96 41.33 1llw s TYR 1125CO 0.17 -0.13 -0.03 0.20 -1.11 0.00 0.00 175.55 174.65 1llw s GLY 1126N 0.70 1.80 -0.19 0.71 0.00 -0.42 -0.97 107.32 108.94 1llw s GLY 1126Ca -0.09 -0.91 -0.03 0.00 0.00 0.00 0.00 44.72 43.70 1llw s GLY 1126CO -0.00 -0.73 0.03 -1.36 0.00 0.00 0.00 173.10 171.04 1llw s PHE 1127N -0.94 1.07 0.00 1.90 0.40 0.13 -4.33 117.98 116.20 1llw s PHE 1127Ca 0.16 -0.85 0.00 0.00 -0.60 0.00 0.00 56.93 55.64 1llw s PHE 1127Cb -0.11 -1.04 0.00 0.00 0.51 0.00 0.00 43.02 42.38 1llw s PHE 1127CO 0.05 -0.60 0.00 0.41 0.70 0.00 0.00 175.22 175.79 1llw n GLY 1128N 5.04 -0.08 0.22 4.36 0.00 -1.24 -4.26 105.19 109.22 1llw n GLY 1128Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.04 1llw n GLY 1128CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1llw n SER 1129N 0.00 -0.05 -0.03 1.61 7.64 -1.26 0.13 113.62 121.66 1llw n SER 1129Ca 0.00 1.09 -0.10 0.00 1.01 0.00 0.00 58.87 60.87 1llw n SER 1129Cb 0.00 -0.41 0.05 0.00 -1.01 0.00 0.00 64.21 62.85 1llw n SER 1129CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1llw h ILE 1130N 0.00 1.30 -0.26 0.44 -2.65 -1.87 0.22 117.51 114.69 1llw h ILE 1130Ca 0.40 -1.66 -0.04 0.00 1.03 0.00 0.00 64.86 64.59 1llw h ILE 1130Cb 0.86 1.61 -0.01 0.00 -2.05 0.00 0.00 36.82 37.22 1llw h ILE 1130CO -0.59 0.53 -0.01 0.00 0.03 0.00 0.00 178.15 178.10 1llw h ALA 1131N 0.96 1.51 0.65 0.16 0.00 0.77 0.41 119.26 123.72 1llw h ALA 1131Ca 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1llw h ALA 1131Cb 1.01 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.68 1llw h ALA 1131CO 0.09 0.35 -0.31 1.98 0.00 0.00 0.00 179.25 181.36 1llw h MET 1132N 0.37 -0.85 -0.66 0.00 -1.53 -1.00 -2.54 114.93 108.73 1llw h MET 1132Ca 0.08 0.06 0.06 0.00 -3.44 0.00 0.00 59.70 56.46 1llw h MET 1132Cb 0.27 0.19 -0.08 0.00 -0.55 0.00 0.00 31.60 31.43 1llw h MET 1132CO 0.01 -0.56 -0.39 -0.89 0.14 0.00 0.00 176.91 175.22 1llw n ILE 1133N -5.36 -0.45 0.25 1.77 2.08 0.02 0.84 119.36 118.51 1llw n ILE 1133Ca -0.11 2.02 0.10 0.00 0.56 0.00 0.00 62.75 65.32 1llw n ILE 1133Cb 0.35 -2.54 0.53 0.00 -0.75 0.00 0.00 39.64 37.23 1llw n ILE 1133CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1llw h ALA 1134N 0.05 1.30 0.00 -1.39 0.00 -0.21 0.91 119.26 119.92 1llw h ALA 1134Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1llw h ALA 1134Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1llw h ALA 1134CO -0.62 -0.30 -0.95 0.39 0.00 0.00 0.00 179.25 177.77 1llw n GLU 1135N -2.42 0.21 0.00 0.00 1.02 0.25 -4.55 120.64 115.14 1llw n GLU 1135Ca -0.01 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1llw n GLU 1135Cb 0.39 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1llw n GLU 1135CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1llw n GLY 1136N 1.40 1.08 3.66 0.62 0.00 0.31 -4.13 105.19 108.14 1llw n GLY 1136Ca 0.03 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.47 1llw n GLY 1136CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw n ILE 1138N 3.49 0.00 -2.48 0.00 5.41 -1.26 -4.54 119.36 119.98 1llw n ILE 1138Ca 0.24 -0.72 -0.38 0.00 1.00 0.00 0.00 62.75 62.89 1llw n ILE 1138Cb 0.11 -1.60 0.02 0.00 -0.71 0.00 0.00 39.64 37.46 1llw n ILE 1138CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 1llw n MET 1139N -2.86 4.37 -0.30 0.38 2.81 -1.26 -4.69 117.12 115.57 1llw n MET 1139Ca 0.11 -4.39 0.03 0.00 -1.81 0.00 0.00 57.70 51.65 1llw n MET 1139Cb 0.40 -2.38 0.11 0.00 -0.71 0.00 0.00 33.22 30.64 1llw n MET 1139CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1llw h ALA 1140N 3.65 0.55 -2.08 3.04 0.00 -1.98 -3.44 119.26 119.00 1llw h ALA 1140Ca 0.48 0.33 -0.08 0.00 0.00 0.00 0.00 54.91 55.64 1llw h ALA 1140Cb 0.30 0.65 0.03 0.00 0.00 0.00 0.00 17.79 18.77 1llw h ALA 1140CO 1.18 -0.40 -0.14 0.54 0.00 0.00 0.00 179.25 180.43 1llw n ARG 1141N -5.55 -1.67 -0.25 0.00 1.74 -1.26 -4.97 116.66 104.71 1llw n ARG 1141Ca 0.12 0.18 0.08 0.00 -0.77 0.00 0.00 57.85 57.46 1llw n ARG 1141Cb 0.43 -3.21 0.15 0.00 -1.02 0.00 0.00 32.46 28.81 1llw n ARG 1141CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1llw n VAL 1142N -2.92 1.88 -0.20 1.55 0.31 -1.26 -4.72 118.33 112.96 1llw n VAL 1142Ca -0.00 -2.43 0.13 0.00 -0.01 0.00 0.00 64.34 62.02 1llw n VAL 1142Cb 0.51 -0.20 0.44 0.00 -0.91 0.00 0.00 33.84 33.69 1llw n VAL 1142CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1llw n HIS 1144N -4.51 0.77 -0.01 0.00 1.44 -1.08 -3.81 115.22 108.03 1llw n HIS 1144Ca 0.15 -0.32 0.01 0.00 -2.01 0.00 0.00 57.72 55.55 1llw n HIS 1144Cb 0.46 -0.12 -0.06 0.00 0.12 0.00 0.00 29.99 30.40 1llw n HIS 1144CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 1llw n THR 1145N 0.59 0.15 -1.53 0.61 -1.04 -0.06 -4.89 114.28 108.11 1llw n THR 1145Ca 0.15 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1llw n THR 1145Cb 0.50 -0.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.98 1llw n THR 1145CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1llw n ASN 1146N -1.92 -1.92 -0.53 8.00 5.15 -1.23 -4.95 115.26 117.86 1llw n ASN 1146Ca -0.04 0.00 0.06 0.00 -0.60 0.00 0.00 54.58 53.99 1llw n ASN 1146Cb 0.36 -0.50 0.08 0.00 -0.53 0.00 0.00 39.78 39.20 1llw n ASN 1146CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1llw n ASN 1147N 1.99 2.28 -3.67 1.20 3.02 -1.26 -4.67 115.26 114.14 1llw n ASN 1147Ca 0.00 -1.64 -0.52 0.00 -0.03 0.00 0.00 54.58 52.39 1llw n ASN 1147Cb 0.27 -0.07 -0.09 0.00 -0.61 0.00 0.00 39.78 39.28 1llw n ASN 1147CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1llw h PRO 1149N 5.44 0.00 0.00 0.00 0.13 -1.96 -3.17 132.00 132.45 1llw h PRO 1149Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1llw h PRO 1149Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1llw h PRO 1149CO 0.83 0.00 0.00 1.55 -0.23 0.00 0.00 178.00 180.15 1llw n VAL 1150N -2.59 0.85 -0.55 1.56 3.14 -1.26 -4.93 118.33 114.55 1llw n VAL 1150Ca -0.02 -0.91 0.00 0.00 -2.96 0.00 0.00 64.34 60.45 1llw n VAL 1150Cb 0.15 0.58 0.00 0.00 -1.06 0.00 0.00 33.84 33.50 1llw n VAL 1150CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1llw n GLY 1151N -0.42 0.75 0.04 7.55 0.00 -1.20 -3.87 105.19 108.03 1llw n GLY 1151Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1llw n GLY 1151CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1llw n VAL 1152N -2.27 0.70 -1.23 1.61 0.31 -1.26 -4.53 118.33 111.66 1llw n VAL 1152Ca 0.00 0.35 -0.29 0.00 -0.01 0.00 0.00 64.34 64.40 1llw n VAL 1152Cb 0.00 -1.93 0.05 0.00 -0.91 0.00 0.00 33.84 31.06 1llw n VAL 1152CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1llw n ALA 1153N -3.09 5.94 -2.17 3.52 0.00 -1.26 0.23 120.51 123.67 1llw n ALA 1153Ca -0.05 -2.87 -0.11 0.00 0.00 0.00 0.00 53.44 50.42 1llw n ALA 1153Cb 0.17 -1.67 -0.10 0.00 0.00 0.00 0.00 19.45 17.84 1llw n ALA 1153CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1llw s THR 1154N -3.82 0.39 -0.80 0.00 2.01 -1.26 -4.49 115.64 107.66 1llw s THR 1154Ca 0.52 -1.92 0.09 0.00 0.31 0.00 0.00 61.69 60.69 1llw s THR 1154Cb 0.40 -1.93 -0.01 0.00 0.01 0.00 0.00 72.50 70.98 1llw s THR 1154CO -0.05 -0.61 0.58 0.00 -0.69 0.00 0.00 174.62 173.85 1llw n GLN 1155N -0.10 2.27 -1.86 4.92 1.13 -1.26 -3.53 117.38 118.95 1llw n GLN 1155Ca -0.08 -0.54 -0.42 0.00 -1.94 0.00 0.00 57.00 54.02 1llw n GLN 1155Cb 0.63 -1.04 -0.03 0.00 0.11 0.00 0.00 30.24 29.90 1llw n GLN 1155CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1llw s GLN 1156N -1.31 4.18 0.16 -1.09 -0.21 -1.26 -4.91 119.66 115.22 1llw s GLN 1156Ca 0.07 2.43 -0.14 0.00 0.02 0.00 0.00 55.36 57.74 1llw s GLN 1156Cb 0.07 -3.46 0.04 0.00 1.00 0.00 0.00 33.01 30.67 1llw s GLN 1156CO 0.24 -0.74 1.76 0.93 -2.12 0.00 0.00 175.29 175.36 1llw h GLU 1157N 7.94 0.71 -0.39 2.91 5.08 -1.98 -1.77 114.58 127.07 1llw h GLU 1157Ca -0.43 -0.09 0.08 0.00 -1.00 0.00 0.00 59.36 57.91 1llw h GLU 1157Cb 1.21 -0.14 -0.09 0.00 0.50 0.00 0.00 28.75 30.23 1llw h GLU 1157CO 0.93 0.57 -0.33 -0.09 -1.00 0.00 0.00 179.01 179.09 1llw h ARG 1158N 0.67 -0.25 0.30 2.33 2.43 -2.00 0.26 114.38 118.13 1llw h ARG 1158Ca 0.18 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 1llw h ARG 1158Cb 0.07 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1llw h ARG 1158CO -0.03 -0.16 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.05 1llw h LEU 1159N -0.26 -0.34 -0.95 3.80 3.38 -1.82 -2.53 115.31 116.58 1llw h LEU 1159Ca 0.17 -0.16 0.29 0.00 0.09 0.00 0.00 57.88 58.28 1llw h LEU 1159Cb 0.54 0.09 -0.18 0.00 0.09 0.00 0.00 40.66 41.20 1llw h LEU 1159CO -0.53 -0.02 0.13 0.54 0.09 0.00 0.00 178.44 178.65 1llw n ARG 1160N -5.15 -0.07 -0.25 1.13 1.74 -0.69 0.13 116.66 113.50 1llw n ARG 1160Ca -0.10 1.41 0.17 0.00 -0.77 0.00 0.00 57.85 58.56 1llw n ARG 1160Cb 0.25 -2.29 0.47 0.00 -1.02 0.00 0.00 32.46 29.87 1llw n ARG 1160CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1llw h GLN 1161N 0.00 0.47 0.00 5.56 4.20 -0.02 -1.17 115.11 124.15 1llw h GLN 1161Ca 0.63 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.31 1llw h GLN 1161Cb 1.41 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 29.08 1llw h GLN 1161CO -0.86 0.31 0.00 0.54 -0.67 0.00 0.00 178.83 178.15 1llw n ARG 1162N -4.53 0.93 -2.19 1.46 5.12 0.35 -4.66 116.66 113.13 1llw n ARG 1162Ca 0.19 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.73 1llw n ARG 1162Cb 0.62 -1.22 -0.03 0.00 -1.16 0.00 0.00 32.46 30.68 1llw n ARG 1162CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1llw s PHE 1163N -2.00 1.87 1.04 -1.55 5.36 -0.44 -4.59 117.98 117.67 1llw s PHE 1163Ca 0.19 0.49 -0.12 0.00 -0.96 0.00 0.00 56.93 56.53 1llw s PHE 1163Cb 0.09 -4.24 0.22 0.00 -0.34 0.00 0.00 43.02 38.74 1llw s PHE 1163CO 0.15 -2.17 1.07 0.15 -1.46 0.00 0.00 175.22 172.96 1llw s LYS 1164N 6.63 0.05 0.00 10.12 1.02 -1.26 -5.01 119.74 131.28 1llw s LYS 1164Ca 0.59 0.74 0.00 0.00 0.02 0.00 0.00 55.97 57.31 1llw s LYS 1164Cb -0.10 -1.67 0.00 0.00 -0.52 0.00 0.00 37.83 35.53 1llw s LYS 1164CO 0.15 -3.05 0.00 0.41 -0.92 0.00 0.00 175.35 171.95 1llw n GLY 1165N -0.31 3.10 3.01 -3.33 0.00 -1.26 -4.81 105.19 101.60 1llw n GLY 1165Ca 0.05 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 1llw n GLY 1165CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1llw s VAL 1166N 0.00 0.48 0.31 1.61 -7.23 -1.26 -4.60 120.40 109.71 1llw s VAL 1166Ca 0.00 -0.67 0.04 0.00 -1.81 0.00 0.00 61.98 59.54 1llw s VAL 1166Cb 0.00 -0.49 0.38 0.00 0.56 0.00 0.00 36.38 36.83 1llw s VAL 1166CO 0.00 -0.15 1.59 -0.65 -0.31 0.00 0.00 175.10 175.59 1llw h PRO 1167N 5.22 0.06 -1.14 4.82 0.11 -1.83 -0.19 132.00 139.05 1llw h PRO 1167Ca -0.32 -0.00 0.33 0.00 0.11 0.00 0.00 66.00 66.12 1llw h PRO 1167Cb 1.20 -0.01 -0.11 0.00 0.11 0.00 0.00 31.00 32.19 1llw h PRO 1167CO 0.45 0.04 0.73 0.78 -0.21 0.00 0.00 178.00 179.79 1llw h GLY 1168N 0.06 1.25 1.34 -0.55 0.00 -1.92 -0.25 103.07 103.00 1llw h GLY 1168Ca 0.62 -0.17 -0.18 0.00 0.00 0.00 0.00 47.33 47.60 1llw h GLY 1168CO -0.83 -0.24 -0.60 1.46 0.00 0.00 0.00 176.54 176.33 1llw h GLN 1169N 0.27 0.68 0.13 4.80 4.20 -1.27 0.87 115.11 124.79 1llw h GLN 1169Ca 0.68 -0.46 -0.32 0.00 0.06 0.00 0.00 58.65 58.61 1llw h GLN 1169Cb 1.90 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 29.74 1llw h GLN 1169CO -0.35 1.08 -1.63 -0.39 -0.67 0.00 0.00 178.83 176.87 1llw h VAL 1170N 0.51 1.05 -0.64 -0.54 -1.51 -1.28 -1.74 116.25 112.10 1llw h VAL 1170Ca -0.00 -2.68 0.13 0.00 -1.23 0.00 0.00 66.70 62.92 1llw h VAL 1170Cb 1.19 2.73 -0.12 0.00 -2.13 0.00 0.00 31.29 32.96 1llw h VAL 1170CO 0.12 0.82 -0.08 0.58 -1.23 0.00 0.00 177.57 177.78 1llw h VAL 1171N 0.08 0.41 -0.43 7.19 2.07 -1.06 0.46 116.25 124.97 1llw h VAL 1171Ca -0.28 -0.02 -0.08 0.00 0.82 0.00 0.00 66.70 67.13 1llw h VAL 1171Cb 2.04 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1llw h VAL 1171CO 0.16 0.01 -0.08 0.78 0.02 0.00 0.00 177.57 178.46 1llw h ASN 1172N 0.05 0.73 0.03 0.57 2.35 -0.77 -3.00 115.58 115.54 1llw h ASN 1172Ca 0.33 -0.20 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 1llw h ASN 1172Cb 0.53 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 1llw h ASN 1172CO -0.61 0.85 -0.10 0.15 -1.65 0.00 0.00 177.43 176.07 1llw h PHE 1173N 0.68 0.18 -0.01 1.19 3.57 0.01 0.33 116.94 122.89 1llw h PHE 1173Ca 0.12 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1llw h PHE 1173Cb 0.54 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.23 1llw h PHE 1173CO 0.03 0.28 -0.19 1.19 -2.23 0.00 0.00 178.31 177.39 1llw n PHE 1174N -4.33 0.00 -0.00 0.41 3.01 -0.67 -2.41 117.46 113.47 1llw n PHE 1174Ca -0.01 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.34 1llw n PHE 1174Cb 0.23 -0.09 -0.14 0.00 -0.01 0.00 0.00 39.48 39.47 1llw n PHE 1174CO 0.00 0.00 0.00 1.88 1.01 0.00 0.00 176.76 179.65 1llw h TYR 1175N 1.49 0.11 0.73 1.38 0.99 -0.85 -3.03 116.97 117.78 1llw h TYR 1175Ca 0.00 -0.08 -0.04 0.00 2.00 0.00 0.00 58.73 60.62 1llw h TYR 1175Cb 0.50 -0.00 0.01 0.00 1.00 0.00 0.00 36.73 38.24 1llw h TYR 1175CO 0.00 1.15 -0.35 0.74 -0.00 0.00 0.00 178.16 179.69 1llw h PHE 1176N 0.02 -0.91 -0.35 4.88 0.05 -1.20 -1.22 116.94 118.20 1llw h PHE 1176Ca -0.28 -0.02 0.08 0.00 3.82 0.00 0.00 57.97 61.57 1llw h PHE 1176Cb 2.00 0.30 -0.02 0.00 2.00 0.00 0.00 35.95 40.23 1llw h PHE 1176CO 0.02 -0.54 0.24 0.82 -0.18 0.00 0.00 178.31 178.67 1llw h ILE 1177N -1.13 0.88 0.09 -0.55 1.08 -1.61 -0.24 117.51 116.03 1llw h ILE 1177Ca -0.10 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1llw h ILE 1177Cb 0.78 0.76 0.00 0.00 -3.07 0.00 0.00 36.82 35.29 1llw h ILE 1177CO 0.17 0.02 -0.04 0.00 -0.69 0.00 0.00 178.15 177.60 1llw h ALA 1178N 1.82 -0.12 -0.98 1.87 0.00 -1.44 -2.77 119.26 117.64 1llw h ALA 1178Ca 0.16 -0.24 0.26 0.00 0.00 0.00 0.00 54.91 55.09 1llw h ALA 1178Cb 0.50 0.05 -0.18 0.00 0.00 0.00 0.00 17.79 18.15 1llw h ALA 1178CO -0.02 -0.16 -0.02 0.39 0.00 0.00 0.00 179.25 179.43 1llw n GLU 1179N -4.82 -0.08 0.11 0.00 -0.58 -0.47 -0.23 120.64 114.58 1llw n GLU 1179Ca -0.07 1.47 0.01 0.00 -0.42 0.00 0.00 57.16 58.16 1llw n GLU 1179Cb 0.26 -2.32 0.35 0.00 -0.57 0.00 0.00 31.44 29.16 1llw n GLU 1179CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1llw h GLU 1180N 0.00 0.23 0.11 3.49 4.81 -1.10 -2.57 114.58 119.56 1llw h GLU 1180Ca 0.57 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.73 1llw h GLU 1180Cb 1.14 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1llw h GLU 1180CO -0.93 0.43 -0.05 0.28 -0.73 0.00 0.00 179.01 178.00 1llw h VAL 1181N 0.22 1.09 -1.26 0.32 2.07 -0.31 -3.05 116.25 115.32 1llw h VAL 1181Ca 0.04 -0.95 0.38 0.00 0.82 0.00 0.00 66.70 66.99 1llw h VAL 1181Cb 0.48 1.67 -0.10 0.00 -1.52 0.00 0.00 31.29 31.82 1llw h VAL 1181CO 0.03 0.22 0.83 0.03 0.02 0.00 0.00 177.57 178.71 1llw h ARG 1182N -0.61 0.16 0.00 1.57 3.08 -0.53 0.12 114.38 118.17 1llw h ARG 1182Ca -0.02 -0.01 -0.22 0.00 0.07 0.00 0.00 59.98 59.80 1llw h ARG 1182Cb 0.48 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.46 1llw h ARG 1182CO 0.03 0.11 -1.48 0.66 -1.07 0.00 0.00 179.97 178.21 1llw h SER 1183N 0.17 0.00 -0.62 7.04 4.64 -1.54 -3.02 113.55 120.22 1llw h SER 1183Ca 0.72 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 62.04 1llw h SER 1183Cb 2.28 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.34 1llw h SER 1183CO -0.30 0.78 0.37 -0.07 -0.87 0.00 0.00 176.83 176.74 1llw h LEU 1184N 0.00 0.75 -2.08 5.97 3.38 -0.93 -1.36 115.31 121.04 1llw h LEU 1184Ca -0.20 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1llw h LEU 1184Cb 1.77 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 42.33 1llw h LEU 1184CO 0.07 0.59 -0.04 -0.07 0.09 0.00 0.00 178.44 179.07 1llw h LEU 1185N 0.87 0.00 0.04 1.67 3.38 -1.02 -1.46 115.31 118.79 1llw h LEU 1185Ca 0.23 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 1llw h LEU 1185Cb -0.02 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.74 1llw h LEU 1185CO -0.04 0.04 -0.40 0.00 0.09 0.00 0.00 178.44 178.13 1llw h ALA 1186N 1.96 -0.00 -0.68 1.53 0.00 -1.18 2.62 119.26 123.51 1llw h ALA 1186Ca -0.00 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 1llw h ALA 1186Cb 0.09 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1llw h ALA 1186CO 0.01 0.18 0.21 1.25 0.00 0.00 0.00 179.25 180.89 1llw h HIS 1187N -0.52 1.08 -0.09 0.00 -0.00 -1.02 -0.97 115.15 113.63 1llw h HIS 1187Ca -0.06 -0.10 -0.08 0.00 -0.00 0.00 0.00 60.37 60.13 1llw h HIS 1187Cb 1.22 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 28.32 1llw h HIS 1187CO 0.20 0.86 -0.25 -0.07 -0.00 0.00 0.00 177.93 178.67 1llw h LEU 1188N 1.01 0.38 0.00 0.26 3.38 -1.34 -3.39 115.31 115.60 1llw h LEU 1188Ca 0.22 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1llw h LEU 1188Cb 0.29 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1llw h LEU 1188CO -0.01 0.91 0.00 0.61 0.09 0.00 0.00 178.44 180.04 1llw n GLY 1189N 0.55 1.40 3.64 0.83 0.00 0.85 -4.33 105.19 108.15 1llw n GLY 1189Ca -0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 1llw n GLY 1189CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1llw s TYR 1190N -2.00 2.80 0.19 1.61 1.51 0.41 -4.81 117.35 117.07 1llw s TYR 1190Ca 0.00 -0.15 -0.08 0.00 -1.01 0.00 0.00 57.07 55.82 1llw s TYR 1190Cb 0.00 -1.36 0.10 0.00 -0.11 0.00 0.00 41.96 40.58 1llw s TYR 1190CO 0.00 0.51 1.66 0.00 -1.11 0.00 0.00 175.55 176.61 1llw h ARG 1191N 2.78 1.06 -3.21 -0.62 3.08 -1.87 -3.40 114.38 112.19 1llw h ARG 1191Ca -0.47 -0.33 -0.32 0.00 0.07 0.00 0.00 59.98 58.93 1llw h ARG 1191Cb 1.20 -0.10 -0.36 0.00 0.08 0.00 0.00 29.97 30.79 1llw h ARG 1191CO 0.57 1.03 -0.68 0.45 -1.07 0.00 0.00 179.97 180.27 1llw s SER 1192N -6.58 0.77 0.40 7.04 0.15 -1.26 -0.64 113.70 113.58 1llw s SER 1192Ca -0.12 0.22 0.26 0.00 0.70 0.00 0.00 55.95 57.02 1llw s SER 1192Cb 0.14 0.10 1.40 0.00 -1.71 0.00 0.00 66.02 65.95 1llw s SER 1192CO 0.85 -0.23 1.59 0.25 1.20 0.00 0.00 173.24 176.90 1llw h LEU 1193N 8.22 0.28 -0.75 3.45 5.85 -1.99 3.57 115.31 133.94 1llw h LEU 1193Ca -0.17 0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.79 1llw h LEU 1193Cb 1.12 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.36 1llw h LEU 1193CO 0.19 -0.34 0.81 -0.78 -0.34 0.00 0.00 178.44 177.98 1llw h ASP 1194N 0.02 0.00 0.55 1.25 -0.00 -1.99 -0.28 116.42 115.97 1llw h ASP 1194Ca 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.89 1llw h ASP 1194Cb 2.48 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 41.81 1llw h ASP 1194CO -0.62 0.00 -0.76 0.47 -0.00 0.00 0.00 179.24 178.33 1llw n ASP 1195N -2.73 0.62 -0.04 2.28 8.00 1.18 -4.58 116.55 121.29 1llw n ASP 1195Ca 0.02 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.35 1llw n ASP 1195Cb 0.86 0.47 -0.12 0.00 -0.02 0.00 0.00 41.12 42.31 1llw n ASP 1195CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1llw n ILE 1196N -1.84 0.50 -1.63 0.53 2.08 -0.12 -4.89 119.36 113.99 1llw n ILE 1196Ca 0.03 -0.49 -0.49 0.00 0.56 0.00 0.00 62.75 62.37 1llw n ILE 1196Cb 0.40 -0.23 -0.05 0.00 -0.75 0.00 0.00 39.64 39.01 1llw n ILE 1196CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 1llw n ILE 1197N -2.29 0.18 -1.42 1.39 5.41 -1.22 0.09 119.36 121.49 1llw n ILE 1197Ca -0.13 -0.05 -0.14 0.00 1.00 0.00 0.00 62.75 63.43 1llw n ILE 1197Cb 0.69 -1.18 -0.06 0.00 -0.71 0.00 0.00 39.64 38.38 1llw n ILE 1197CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1llw n GLY 1198N 2.80 1.37 2.03 7.39 0.00 0.31 -4.82 105.19 114.26 1llw n GLY 1198Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1llw n GLY 1198CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llw n ARG 1199N -1.96 2.02 0.03 1.61 5.12 0.11 -4.49 116.66 119.10 1llw n ARG 1199Ca -0.14 -1.08 0.15 0.00 -1.93 0.00 0.00 57.85 54.85 1llw n ARG 1199Cb 0.47 -2.00 0.23 0.00 -1.16 0.00 0.00 32.46 30.01 1llw n ARG 1199CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 1llw n THR 1200N 2.39 0.00 0.32 0.55 5.66 -1.17 -0.09 114.28 121.93 1llw n THR 1200Ca 0.43 1.13 0.14 0.00 -3.05 0.00 0.00 64.05 62.70 1llw n THR 1200Cb 0.89 -2.12 0.39 0.00 -1.55 0.00 0.00 70.33 67.94 1llw n THR 1200CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 175.07 169.78 1llw h ASP 1201N 0.00 0.00 0.29 1.09 2.03 -1.82 -1.69 116.42 116.31 1llw h ASP 1201Ca 0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.57 1llw h ASP 1201Cb 2.49 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.99 1llw h ASP 1201CO -0.00 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 178.39 1llw n LEU 1202N -2.88 0.00 -4.89 0.15 4.77 0.87 -4.82 117.00 110.21 1llw n LEU 1202Ca 0.03 0.30 -0.31 0.00 -0.03 0.00 0.00 56.01 56.01 1llw n LEU 1202Cb 0.42 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1llw n LEU 1202CO 0.30 -0.16 -0.18 -0.76 -1.33 0.00 0.00 177.39 175.26 1llw s LEU 1203N -2.61 4.23 0.07 2.23 1.43 -0.64 0.34 118.68 123.73 1llw s LEU 1203Ca 0.13 0.20 -0.06 0.00 -1.03 0.00 0.00 54.13 53.37 1llw s LEU 1203Cb 0.10 -2.85 -0.01 0.00 0.03 0.00 0.00 46.19 43.45 1llw s LEU 1203CO 0.22 0.17 0.11 -1.59 0.23 0.00 0.00 176.35 175.49 1llw s LYS 1204N -2.50 0.72 -0.01 1.70 -2.85 -0.69 -4.83 119.74 111.28 1llw s LYS 1204Ca 0.34 -0.97 -0.27 0.00 -1.00 0.00 0.00 55.97 54.06 1llw s LYS 1204Cb -0.13 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.89 1llw s LYS 1204CO 0.27 -0.20 0.87 0.08 0.10 0.00 0.00 175.35 176.46 1llw s VAL 1205N -3.57 4.90 0.35 1.79 1.01 -1.26 -2.25 120.40 121.37 1llw s VAL 1205Ca 0.03 1.82 -0.28 0.00 0.00 0.00 0.00 61.98 63.54 1llw s VAL 1205Cb 0.04 -4.21 -0.12 0.00 0.00 0.00 0.00 36.38 32.10 1llw s VAL 1205CO -0.09 0.22 1.44 0.54 0.00 0.00 0.00 175.10 177.20 1llw n ARG 1206N 3.70 2.48 0.10 2.72 1.74 0.10 -4.94 116.66 122.56 1llw n ARG 1206Ca 0.03 0.87 -0.05 0.00 -0.77 0.00 0.00 57.85 57.93 1llw n ARG 1206Cb 0.51 -2.56 0.08 0.00 -1.02 0.00 0.00 32.46 29.47 1llw n ARG 1206CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1llw h SER 1207N 3.13 0.15 0.00 0.55 0.02 -1.94 -3.39 113.55 112.07 1llw h SER 1207Ca -0.48 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1llw h SER 1207Cb 1.25 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1llw h SER 1207CO 0.66 0.82 -0.13 0.44 -1.14 0.00 0.00 176.83 177.48 1llw h ASP 1208N 0.08 0.00 -0.27 3.07 5.19 -1.98 -3.47 116.42 119.04 1llw h ASP 1208Ca -0.02 0.00 -0.29 0.00 -0.62 0.00 0.00 57.03 56.10 1llw h ASP 1208Cb 1.27 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.78 1llw h ASP 1208CO 0.10 0.37 0.28 0.52 -3.12 0.00 0.00 179.24 177.40 1llw n VAL 1209N -3.73 0.00 -4.54 -1.35 0.31 -1.26 -5.00 118.33 102.76 1llw n VAL 1209Ca -0.02 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.09 1llw n VAL 1209Cb 0.07 -0.17 -0.16 0.00 -0.91 0.00 0.00 33.84 32.67 1llw n VAL 1209CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1llw s GLN 1210N 1.22 1.24 0.56 5.55 -0.21 -1.26 -5.07 119.66 121.69 1llw s GLN 1210Ca 0.37 -0.41 0.02 0.00 0.02 0.00 0.00 55.36 55.36 1llw s GLN 1210Cb -0.51 -1.12 0.04 0.00 1.00 0.00 0.00 33.01 32.42 1llw s GLN 1210CO 0.27 0.16 0.78 -0.51 -2.12 0.00 0.00 175.29 173.87 1llw s LEU 1211N 0.15 3.26 0.39 2.90 1.43 -1.26 -5.00 118.68 120.56 1llw s LEU 1211Ca -0.03 -0.11 0.21 0.00 -1.03 0.00 0.00 54.13 53.17 1llw s LEU 1211Cb -0.10 -2.72 0.38 0.00 0.03 0.00 0.00 46.19 43.78 1llw s LEU 1211CO 0.01 -1.20 1.60 0.28 0.23 0.00 0.00 176.35 177.27 1llw h SER 1212N 0.05 0.00 0.00 2.29 0.02 -1.85 -3.40 113.55 110.67 1llw h SER 1212Ca -0.41 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.44 1llw h SER 1212Cb 1.29 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 1llw h SER 1212CO 0.50 0.19 -1.40 0.29 -1.14 0.00 0.00 176.83 175.28 1llw n LYS 1213N -3.17 2.96 -4.16 3.45 5.02 -1.26 -5.05 118.16 115.95 1llw n LYS 1213Ca 0.03 -0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.20 1llw n LYS 1213Cb 0.57 -1.15 -0.09 0.00 -0.02 0.00 0.00 35.03 34.35 1llw n LYS 1213CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1llw s THR 1214N -2.14 0.00 0.19 -0.18 2.01 -1.26 -4.78 115.64 109.48 1llw s THR 1214Ca -0.03 -1.86 -0.03 0.00 0.31 0.00 0.00 61.69 60.08 1llw s THR 1214Cb 0.02 -2.44 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 1llw s THR 1214CO 0.23 0.00 1.51 1.56 -0.69 0.00 0.00 174.62 177.23 1llw h GLN 1215N 2.53 0.53 -1.66 4.92 4.20 -1.90 -3.39 115.11 120.33 1llw h GLN 1215Ca -0.33 -0.34 0.30 0.00 0.06 0.00 0.00 58.65 58.34 1llw h GLN 1215Cb 1.25 0.04 -0.11 0.00 0.30 0.00 0.00 27.48 28.96 1llw h GLN 1215CO 0.49 0.95 0.77 0.54 -0.67 0.00 0.00 178.83 180.90 1llw s ASN 1216N -6.92 -0.07 0.08 1.46 6.03 -1.26 -4.79 114.94 109.46 1llw s ASN 1216Ca -0.07 -0.20 0.07 0.00 -1.03 0.00 0.00 52.86 51.63 1llw s ASN 1216Cb 0.11 0.22 -0.04 0.00 -3.03 0.00 0.00 41.25 38.52 1llw s ASN 1216CO 0.84 -0.42 -0.13 -0.76 -2.03 0.00 0.00 177.10 174.60 1llw s LEU 1217N -3.04 2.88 -0.20 3.54 1.02 -1.26 -4.59 118.68 117.03 1llw s LEU 1217Ca 0.15 -0.40 -0.22 0.00 0.02 0.00 0.00 54.13 53.68 1llw s LEU 1217Cb 0.03 -1.69 -0.02 0.00 0.02 0.00 0.00 46.19 44.53 1llw s LEU 1217CO -0.02 0.21 0.71 -0.89 0.02 0.00 0.00 176.35 176.38 1llw s THR 1218N -1.10 4.95 -0.24 5.49 2.01 0.17 -4.95 115.64 121.97 1llw s THR 1218Ca 0.18 1.35 0.12 0.00 0.31 0.00 0.00 61.69 63.66 1llw s THR 1218Cb -0.11 -4.02 0.50 0.00 0.01 0.00 0.00 72.50 68.88 1llw s THR 1218CO 0.10 0.05 1.43 0.18 -0.69 0.00 0.00 174.62 175.70 1llw n LEU 1219N 5.30 3.94 -0.23 4.42 4.77 -1.26 -4.12 117.00 129.81 1llw n LEU 1219Ca 0.01 -3.45 -0.06 0.00 -0.03 0.00 0.00 56.01 52.48 1llw n LEU 1219Cb 0.49 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1llw n LEU 1219CO 0.45 1.01 1.08 0.44 -1.33 0.00 0.00 177.39 179.04 1llw h ASP 1220N 1.22 0.81 -0.63 -1.43 3.32 -1.93 -0.45 116.42 117.34 1llw h ASP 1220Ca 0.13 -0.10 0.18 0.00 0.02 0.00 0.00 57.03 57.26 1llw h ASP 1220Cb 1.55 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.86 1llw h ASP 1220CO 0.31 0.68 0.45 0.00 -1.72 0.00 0.00 179.24 178.95 1llw n LEU 1222N -4.36 0.08 -0.06 0.00 4.77 -0.54 -4.60 117.00 112.29 1llw n LEU 1222Ca 0.12 -0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.91 1llw n LEU 1222Cb 0.69 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.64 1llw n LEU 1222CO 0.37 0.02 -0.93 0.18 -1.33 0.00 0.00 177.39 175.71 1llw n LEU 1223N -2.14 1.61 -4.54 2.23 4.77 -0.29 -4.74 117.00 113.90 1llw n LEU 1223Ca -0.03 0.14 -0.43 0.00 -0.03 0.00 0.00 56.01 55.66 1llw n LEU 1223Cb 0.51 -0.34 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1llw n LEU 1223CO 0.42 0.66 1.74 0.20 -1.33 0.00 0.00 177.39 179.09 1llw s ASN 1224N -6.30 6.91 0.36 -1.43 0.01 -0.44 -4.60 114.94 109.44 1llw s ASN 1224Ca -0.17 -2.60 0.09 0.00 -0.71 0.00 0.00 52.86 49.46 1llw s ASN 1224Cb 0.07 -2.51 -0.07 0.00 0.41 0.00 0.00 41.25 39.15 1llw s ASN 1224CO 0.76 -1.03 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.50 1llw s LEU 1225N 3.30 2.75 0.09 0.60 1.43 -1.26 -4.93 118.68 120.66 1llw s LEU 1225Ca 0.49 -1.24 -0.35 0.00 -1.03 0.00 0.00 54.13 52.00 1llw s LEU 1225Cb 0.01 -0.95 -0.15 0.00 0.03 0.00 0.00 46.19 45.13 1llw s LEU 1225CO 0.04 -0.27 1.49 -2.65 0.23 0.00 0.00 176.35 175.20 1llw n PRO 1226N -0.82 1.65 -1.63 1.29 -0.02 -1.26 -4.83 135.00 129.37 1llw n PRO 1226Ca -0.05 0.60 -0.54 0.00 -2.02 0.00 0.00 63.50 61.49 1llw n PRO 1226Cb 0.64 -2.31 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 1llw n PRO 1226CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1llw n ASP 1227N 3.28 1.93 -0.55 2.55 -0.08 -1.26 -4.90 116.55 117.52 1llw n ASP 1227Ca 0.18 1.10 0.05 0.00 -1.51 0.00 0.00 54.79 54.61 1llw n ASP 1227Cb 0.24 -1.18 0.14 0.00 2.34 0.00 0.00 41.12 42.65 1llw n ASP 1227CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1llw n THR 1228N 3.25 1.10 -0.15 5.18 -1.04 -1.26 -4.71 114.28 116.64 1llw n THR 1228Ca 0.21 -1.08 -0.03 0.00 -2.04 0.00 0.00 64.05 61.11 1llw n THR 1228Cb 0.17 0.44 0.04 0.00 -1.82 0.00 0.00 70.33 69.16 1llw n THR 1228CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1llw h LYS 1229N 1.66 0.02 0.00 -2.82 1.57 -1.93 -3.35 116.57 111.72 1llw h LYS 1229Ca 0.00 -0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.59 1llw h LYS 1229Cb 0.75 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.02 1llw h LYS 1229CO 0.02 0.01 -1.72 1.04 -0.57 0.00 0.00 179.45 178.22 1llw n GLN 1230N -5.34 1.18 -2.13 3.15 3.00 -1.26 -4.84 117.38 111.15 1llw n GLN 1230Ca 0.04 0.04 -0.30 0.00 -0.01 0.00 0.00 57.00 56.78 1llw n GLN 1230Cb 0.26 -1.26 -0.05 0.00 0.00 0.00 0.00 30.24 29.19 1llw n GLN 1230CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 1llw s ASN 1231N -4.83 5.24 -0.28 1.08 0.01 -1.25 -4.70 114.94 110.20 1llw s ASN 1231Ca -0.12 -1.67 0.10 0.00 -0.71 0.00 0.00 52.86 50.46 1llw s ASN 1231Cb 0.04 -2.59 0.54 0.00 0.41 0.00 0.00 41.25 39.65 1llw s ASN 1231CO 0.35 -2.84 1.52 0.54 -1.51 0.00 0.00 177.10 175.15 1llw n ARG 1232N 8.34 2.24 0.08 -0.60 1.74 -1.26 -4.73 116.66 122.46 1llw n ARG 1232Ca 0.45 -3.08 -0.09 0.00 -0.77 0.00 0.00 57.85 54.36 1llw n ARG 1232Cb 0.47 -1.88 -0.09 0.00 -1.02 0.00 0.00 32.46 29.93 1llw n ARG 1232CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1llw h GLN 1233N 1.27 0.11 -0.05 5.56 4.20 -1.98 -2.78 115.11 121.45 1llw h GLN 1233Ca 0.21 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1llw h GLN 1233Cb 1.76 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 29.60 1llw h GLN 1233CO 0.44 1.03 0.50 0.11 -0.67 0.00 0.00 178.83 180.24 1llw h TRP 1234N 0.04 0.00 0.00 2.96 5.08 -1.92 0.24 115.95 122.35 1llw h TRP 1234Ca -0.05 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.92 1llw h TRP 1234Cb 1.75 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.91 1llw h TRP 1234CO 0.02 0.00 0.00 -0.11 -1.28 0.00 0.00 178.44 177.07 1llw n LEU 1235N -2.86 0.00 -4.23 0.11 7.94 -1.05 -4.08 117.00 112.82 1llw n LEU 1235Ca -0.01 0.00 -0.40 0.00 -1.11 0.00 0.00 56.01 54.50 1llw n LEU 1235Cb 0.55 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.40 1llw n LEU 1235CO 0.12 0.00 -0.09 0.20 -1.11 0.00 0.00 177.39 176.50 1llw s ASN 1236N -1.72 5.59 0.12 1.96 0.01 0.84 -5.09 114.94 116.64 1llw s ASN 1236Ca 0.28 -1.69 0.00 0.00 -0.71 0.00 0.00 52.86 50.74 1llw s ASN 1236Cb 0.13 -1.97 -0.04 0.00 0.41 0.00 0.00 41.25 39.78 1llw s ASN 1236CO 0.22 -0.58 0.28 -1.00 -1.51 0.00 0.00 177.10 174.50 1llw s HIS 1237N 1.36 3.50 0.50 2.20 3.76 -1.26 -4.95 115.29 120.40 1llw s HIS 1237Ca 0.04 0.25 -0.22 0.00 -0.15 0.00 0.00 55.06 54.97 1llw s HIS 1237Cb -0.24 -1.76 -0.06 0.00 1.11 0.00 0.00 32.58 31.62 1llw s HIS 1237CO 0.00 0.52 1.24 -1.83 -0.85 0.00 0.00 174.74 173.82 1llw s GLU 1238N -2.88 3.50 0.30 1.40 -1.05 -1.26 -4.92 118.70 113.79 1llw s GLU 1238Ca 0.36 1.95 0.03 0.00 -0.15 0.00 0.00 54.97 57.16 1llw s GLU 1238Cb -0.12 -2.33 0.62 0.00 -0.44 0.00 0.00 34.13 31.86 1llw s GLU 1238CO 0.28 -0.82 1.84 -1.00 0.95 0.00 0.00 175.26 176.51 1llw h PRO 1239N 1.78 0.90 -1.78 -4.83 0.13 -2.01 -3.42 132.00 122.76 1llw h PRO 1239Ca -0.50 -0.05 0.04 0.00 -0.87 0.00 0.00 66.00 64.62 1llw h PRO 1239Cb 1.27 -0.20 -0.24 0.00 0.13 0.00 0.00 31.00 31.96 1llw h PRO 1239CO 0.59 0.59 0.24 0.08 -0.23 0.00 0.00 178.00 179.27 1llw s VAL 1240N -5.90 0.00 0.31 1.56 1.01 -1.26 -4.83 120.40 111.29 1llw s VAL 1240Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 61.57 1llw s VAL 1240Cb 0.22 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.50 1llw s VAL 1240CO 0.80 0.00 1.40 -1.00 0.00 0.00 0.00 175.10 176.30 1llw s HIS 1241N 1.02 2.94 0.22 5.22 3.76 -1.26 -5.02 115.29 122.16 1llw s HIS 1241Ca -0.05 1.22 0.01 0.00 -0.15 0.00 0.00 55.06 56.08 1llw s HIS 1241Cb -0.05 -3.81 -0.04 0.00 1.11 0.00 0.00 32.58 29.80 1llw s HIS 1241CO -0.12 -2.41 0.39 0.45 -0.85 0.00 0.00 174.74 172.20 1llw s SER 1242N -0.10 6.36 0.08 1.40 0.15 -1.26 -5.01 113.70 115.32 1llw s SER 1242Ca 0.54 0.33 0.28 0.00 0.70 0.00 0.00 55.95 57.79 1llw s SER 1242Cb -0.42 -1.98 1.01 0.00 -1.71 0.00 0.00 66.02 62.93 1llw s SER 1242CO 0.52 -0.07 1.83 0.59 1.20 0.00 0.00 173.24 177.31 1llw n ASN 1243N -0.91 0.36 0.00 5.45 3.02 -1.26 -5.06 115.26 116.86 1llw n ASN 1243Ca -0.06 0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.98 1llw n ASN 1243Cb 0.55 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 1llw n ASN 1243CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1llw n GLY 1244N 1.42 2.15 2.29 7.41 0.00 -1.26 -4.90 105.19 112.30 1llw n GLY 1244Ca 0.06 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 1llw n GLY 1244CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1llw n PRO 1245N 1.72 0.00 -4.05 1.61 -0.02 -1.26 -4.93 135.00 128.07 1llw n PRO 1245Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.35 1llw n PRO 1245Cb 0.00 -0.92 -0.12 0.00 -0.02 0.00 0.00 33.50 32.44 1llw n PRO 1245CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1llw s VAL 1246N 1.74 0.40 0.15 -1.45 0.11 -1.26 -5.05 120.40 115.04 1llw s VAL 1246Ca 0.64 -0.85 -0.17 0.00 -2.93 0.00 0.00 61.98 58.66 1llw s VAL 1246Cb -0.91 -0.46 0.05 0.00 -1.53 0.00 0.00 36.38 33.52 1llw s VAL 1246CO 0.49 -0.31 1.69 0.25 -3.33 0.00 0.00 175.10 173.90 1llw h LEU 1247N 4.86 -0.22 -1.82 2.54 5.85 -1.94 0.90 115.31 125.48 1llw h LEU 1247Ca -0.33 0.09 0.55 0.00 0.84 0.00 0.00 57.88 59.03 1llw h LEU 1247Cb 1.20 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 42.30 1llw h LEU 1247CO 0.43 -0.07 1.28 0.44 -0.34 0.00 0.00 178.44 180.18 1llw h ASP 1248N 0.05 0.06 -0.64 1.25 5.19 -1.94 0.67 116.42 121.05 1llw h ASP 1248Ca 0.16 0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 56.56 1llw h ASP 1248Cb 0.24 0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 1llw h ASP 1248CO -0.31 -0.08 0.19 0.44 -3.12 0.00 0.00 179.24 176.36 1llw h ASP 1249N 0.00 0.94 0.23 6.45 3.32 0.43 0.99 116.42 128.78 1llw h ASP 1249Ca 0.93 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.75 1llw h ASP 1249Cb 3.54 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 42.84 1llw h ASP 1249CO -0.15 0.91 -0.11 0.44 -1.72 0.00 0.00 179.24 178.62 1llw h ASP 1250N 0.93 -0.26 -0.93 6.45 3.32 -0.99 -3.14 116.42 121.81 1llw h ASP 1250Ca 0.20 -0.27 0.24 0.00 0.02 0.00 0.00 57.03 57.23 1llw h ASP 1250Cb 0.31 0.07 -0.17 0.00 0.22 0.00 0.00 39.33 39.76 1llw h ASP 1250CO -0.00 0.21 -0.02 -0.38 -1.72 0.00 0.00 179.24 177.32 1llw n ILE 1251N -5.02 -0.39 1.41 0.35 2.08 -0.34 0.38 119.36 117.83 1llw n ILE 1251Ca -0.08 2.06 0.09 0.00 0.56 0.00 0.00 62.75 65.38 1llw n ILE 1251Cb 0.26 -2.98 0.55 0.00 -0.75 0.00 0.00 39.64 36.72 1llw n ILE 1251CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1llw n LEU 1252N -5.40 0.00 -0.07 1.39 4.77 0.30 -3.77 117.00 114.23 1llw n LEU 1252Ca 0.21 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 56.04 1llw n LEU 1252Cb 0.67 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.63 1llw n LEU 1252CO -0.08 0.00 -1.01 0.00 -1.33 0.00 0.00 177.39 174.98 1llw n ALA 1253N -0.91 1.32 -1.00 -1.18 0.00 1.22 -4.52 120.51 115.44 1llw n ALA 1253Ca 0.14 -0.97 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1llw n ALA 1253Cb 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1llw n ALA 1253CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1llw n ASP 1254N -3.15 0.00 -0.16 0.00 8.00 -1.24 -4.65 116.55 115.35 1llw n ASP 1254Ca -0.34 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.16 1llw n ASP 1254Cb 1.06 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 42.16 1llw n ASP 1254CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1llw n PRO 1255N 0.00 0.59 0.04 -0.24 -0.02 -1.26 -3.55 135.00 130.56 1llw n PRO 1255Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.40 1llw n PRO 1255Cb 0.00 -1.10 0.07 0.00 -0.02 0.00 0.00 33.50 32.46 1llw n PRO 1255CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1llw h ASP 1256N 0.13 0.49 0.16 2.55 3.58 -1.86 -2.52 116.42 118.95 1llw h ASP 1256Ca 0.00 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.18 1llw h ASP 1256Cb 0.10 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.00 1llw h ASP 1256CO 0.00 0.97 0.00 -0.38 -2.88 0.00 0.00 179.24 176.95 1llw n ILE 1257N -3.92 0.09 0.06 2.25 5.41 -1.23 -1.92 119.36 120.09 1llw n ILE 1257Ca -0.03 0.02 -0.18 0.00 1.00 0.00 0.00 62.75 63.56 1llw n ILE 1257Cb 0.62 -0.63 -0.14 0.00 -0.71 0.00 0.00 39.64 38.78 1llw n ILE 1257CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 1llw h GLN 1258N 0.00 0.27 -0.10 0.38 4.15 -1.75 -2.41 115.11 115.65 1llw h GLN 1258Ca 0.00 -0.46 -0.11 0.00 0.77 0.00 0.00 58.65 58.84 1llw h GLN 1258Cb 0.08 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1llw h GLN 1258CO 0.00 1.13 -0.45 1.05 -1.93 0.00 0.00 178.83 178.64 1llw h GLU 1259N 0.07 0.24 0.00 1.69 9.09 -1.47 0.14 114.58 124.34 1llw h GLU 1259Ca -0.28 -0.12 0.00 0.00 0.05 0.00 0.00 59.36 59.00 1llw h GLU 1259Cb 2.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.14 1llw h GLU 1259CO 0.16 0.65 0.00 0.00 0.05 0.00 0.00 179.01 179.86 1llw n ALA 1260N -2.47 -0.09 0.20 1.06 0.00 -1.06 -3.81 120.51 114.33 1llw n ALA 1260Ca -0.02 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.59 1llw n ALA 1260Cb 0.50 0.00 0.81 0.00 0.00 0.00 0.00 19.45 20.76 1llw n ALA 1260CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1llw h ILE 1261N 0.00 0.52 -2.97 0.00 1.08 -1.47 -2.91 117.51 111.77 1llw h ILE 1261Ca 0.00 0.00 -0.72 0.00 -0.39 0.00 0.00 64.86 63.75 1llw h ILE 1261Cb 0.00 0.85 -0.21 0.00 -3.07 0.00 0.00 36.82 34.38 1llw h ILE 1261CO 0.00 0.00 0.01 0.20 -0.69 0.00 0.00 178.15 177.67 1llw s ASN 1262N -5.91 6.18 0.33 1.72 0.01 0.49 -4.94 114.94 112.83 1llw s ASN 1262Ca -0.05 -1.54 0.15 0.00 -0.71 0.00 0.00 52.86 50.72 1llw s ASN 1262Cb 0.16 -2.27 0.83 0.00 0.41 0.00 0.00 41.25 40.38 1llw s ASN 1262CO 0.57 -1.03 1.39 1.57 -1.51 0.00 0.00 177.10 178.09 1llw n HIS 1263N 5.98 0.52 -3.65 2.20 -0.00 -1.10 -3.41 115.22 115.76 1llw n HIS 1263Ca -0.11 0.27 -0.29 0.00 -0.00 0.00 0.00 57.72 57.59 1llw n HIS 1263Cb 0.42 -0.78 -0.14 0.00 -0.00 0.00 0.00 29.99 29.49 1llw n HIS 1263CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 1llw s GLN 1264N -3.39 0.71 0.01 1.57 -0.21 -1.26 -2.06 119.66 115.04 1llw s GLN 1264Ca -0.02 -1.22 -0.08 0.00 0.02 0.00 0.00 55.36 54.07 1llw s GLN 1264Cb 0.04 -1.80 0.00 0.00 1.00 0.00 0.00 33.01 32.26 1llw s GLN 1264CO 0.14 -1.07 0.14 0.99 -2.12 0.00 0.00 175.29 173.37 1llw s THR 1265N 1.34 0.09 0.27 -0.19 2.01 -1.22 -4.90 115.64 113.04 1llw s THR 1265Ca 0.13 -0.73 -0.29 0.00 0.31 0.00 0.00 61.69 61.10 1llw s THR 1265Cb -0.20 -0.50 -0.09 0.00 0.01 0.00 0.00 72.50 71.72 1llw s THR 1265CO -0.17 -0.40 1.21 -0.89 -0.69 0.00 0.00 174.62 173.68 1llw s THR 1266N -1.56 3.22 0.01 -0.82 2.01 -1.26 -0.62 115.64 116.63 1llw s THR 1266Ca -0.13 1.15 0.02 0.00 0.31 0.00 0.00 61.69 63.03 1llw s THR 1266Cb -0.07 -3.73 -0.01 0.00 0.01 0.00 0.00 72.50 68.70 1llw s THR 1266CO 0.01 0.24 -0.05 0.00 -0.69 0.00 0.00 174.62 174.13 1llw s ALA 1267N -0.75 0.42 0.11 7.40 0.00 -0.99 -4.94 121.76 123.00 1llw s ALA 1267Ca 0.49 -0.42 0.08 0.00 0.00 0.00 0.00 51.96 52.11 1llw s ALA 1267Cb -0.35 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.70 1llw s ALA 1267CO 0.43 0.03 -0.15 0.99 0.00 0.00 0.00 175.76 177.07 1llw s THR 1268N -0.65 3.06 0.00 0.00 2.01 -1.26 -0.86 115.64 117.93 1llw s THR 1268Ca -0.04 -1.38 -0.12 0.00 0.31 0.00 0.00 61.69 60.46 1llw s THR 1268Cb -0.05 -2.41 0.02 0.00 0.01 0.00 0.00 72.50 70.07 1llw s THR 1268CO -0.00 0.12 0.26 -0.54 -0.69 0.00 0.00 174.62 173.77 1llw s LYS 1269N -2.11 0.65 -0.01 4.92 -0.14 -0.84 -4.97 119.74 117.22 1llw s LYS 1269Ca 0.19 -0.33 0.02 0.00 -1.36 0.00 0.00 55.97 54.49 1llw s LYS 1269Cb -0.11 0.28 0.00 0.00 -1.68 0.00 0.00 37.83 36.32 1llw s LYS 1269CO 0.11 -0.18 -0.06 0.99 -0.76 0.00 0.00 175.35 175.45 1llw s THR 1270N -1.62 0.51 -0.00 2.17 2.01 -1.26 -0.84 115.64 116.60 1llw s THR 1270Ca -0.12 -0.24 -0.04 0.00 0.31 0.00 0.00 61.69 61.60 1llw s THR 1270Cb -0.05 -0.46 -0.00 0.00 0.01 0.00 0.00 72.50 72.00 1llw s THR 1270CO 0.02 0.16 0.08 -0.31 -0.69 0.00 0.00 174.62 173.88 1llw s TYR 1271N 0.08 0.07 0.15 4.92 1.51 -0.53 -5.00 117.35 118.56 1llw s TYR 1271Ca -0.01 -0.15 -0.30 0.00 -1.01 0.00 0.00 57.07 55.60 1llw s TYR 1271Cb -0.05 -0.07 -0.07 0.00 -0.11 0.00 0.00 41.96 41.65 1llw s TYR 1271CO -0.00 -0.20 1.21 0.50 -1.11 0.00 0.00 175.55 175.94 1llw s ARG 1272N -1.05 4.47 -0.12 -0.62 6.06 -1.26 -0.76 118.95 125.68 1llw s ARG 1272Ca -0.11 1.86 -0.04 0.00 -2.50 0.00 0.00 55.73 54.94 1llw s ARG 1272Cb -0.07 -3.26 -0.03 0.00 0.06 0.00 0.00 34.95 31.64 1llw s ARG 1272CO 0.00 -0.14 0.02 -0.51 -2.50 0.00 0.00 175.30 172.18 1llw s LEU 1273N 0.12 3.68 0.25 -0.88 1.43 0.12 -4.83 118.68 118.56 1llw s LEU 1273Ca 0.55 0.14 0.09 0.00 -1.03 0.00 0.00 54.13 53.88 1llw s LEU 1273Cb -0.32 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 1llw s LEU 1273CO 0.35 0.32 -0.03 0.54 0.23 0.00 0.00 176.35 177.75 1llw s VAL 1274N -0.52 3.35 -2.00 -1.59 0.11 -1.26 -3.51 120.40 114.98 1llw s VAL 1274Ca 0.09 -1.87 0.10 0.00 -2.93 0.00 0.00 61.98 57.38 1llw s VAL 1274Cb -0.12 -2.76 0.29 0.00 -1.53 0.00 0.00 36.38 32.26 1llw s VAL 1274CO 0.02 -0.31 1.13 -0.46 -3.33 0.00 0.00 175.10 172.15 1llw n ASN 1275N -0.65 0.00 0.21 3.54 0.23 -1.05 0.36 115.26 117.90 1llw n ASN 1275Ca -0.07 -1.02 0.14 0.00 -0.53 0.00 0.00 54.58 53.10 1llw n ASN 1275Cb 0.58 0.00 0.51 0.00 -2.08 0.00 0.00 39.78 38.79 1llw n ASN 1275CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1llw h THR 1276N 0.00 0.00 -3.07 5.53 2.02 -1.88 -3.34 112.91 112.18 1llw h THR 1276Ca 0.00 -0.52 -0.55 0.00 0.77 0.00 0.00 66.41 66.11 1llw h THR 1276Cb 0.00 1.45 -0.07 0.00 -1.74 0.00 0.00 68.15 67.79 1llw h THR 1276CO 0.00 0.00 1.02 -1.81 0.37 0.00 0.00 175.52 175.10 1llw s ASP 1277N -5.26 6.35 0.16 4.18 1.01 0.16 -4.92 116.67 118.34 1llw s ASP 1277Ca 0.04 0.15 0.10 0.00 0.71 0.00 0.00 52.55 53.55 1llw s ASP 1277Cb 0.09 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.42 1llw s ASP 1277CO 0.53 -1.56 -0.17 -0.13 0.21 0.00 0.00 175.17 174.06 1llw s ARG 1278N 5.13 1.80 -1.44 8.23 0.52 -1.26 -1.14 118.95 130.79 1llw s ARG 1278Ca 0.46 -1.30 -0.06 0.00 -0.52 0.00 0.00 55.73 54.30 1llw s ARG 1278Cb -0.08 -2.05 0.04 0.00 0.52 0.00 0.00 34.95 33.37 1llw s ARG 1278CO 0.25 0.44 0.75 2.41 0.02 0.00 0.00 175.30 179.17 1llw n THR 1279N 0.40 -3.05 -2.97 0.02 -1.04 -0.08 -4.87 114.28 102.68 1llw n THR 1279Ca -0.13 -0.29 -0.40 0.00 -2.04 0.00 0.00 64.05 61.19 1llw n THR 1279Cb 0.54 -3.05 -0.05 0.00 -1.82 0.00 0.00 70.33 65.95 1llw n THR 1279CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1llw s VAL 1280N -3.57 4.68 0.00 12.58 0.11 -1.26 -2.50 120.40 130.45 1llw s VAL 1280Ca 0.29 1.66 0.00 0.00 -2.93 0.00 0.00 61.98 61.01 1llw s VAL 1280Cb -0.15 -4.13 0.00 0.00 -1.53 0.00 0.00 36.38 30.57 1llw s VAL 1280CO 0.84 0.38 0.00 0.61 -3.33 0.00 0.00 175.10 173.60 1llw n GLY 1281N 2.31 3.19 0.07 6.54 0.00 -1.26 -1.67 105.19 114.37 1llw n GLY 1281Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 1llw n GLY 1281CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1llw h THR 1282N 0.00 1.11 -0.68 2.61 2.02 -1.72 -2.18 112.91 114.07 1llw h THR 1282Ca 0.00 -0.55 0.12 0.00 0.77 0.00 0.00 66.41 66.75 1llw h THR 1282Cb 0.00 1.47 -0.08 0.00 -1.74 0.00 0.00 68.15 67.80 1llw h THR 1282CO 0.00 0.14 0.25 -0.09 0.37 0.00 0.00 175.52 176.19 1llw h ARG 1283N -0.31 0.40 -0.21 6.66 2.43 -1.77 0.27 114.38 121.86 1llw h ARG 1283Ca -0.01 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1llw h ARG 1283Cb 0.28 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1llw h ARG 1283CO 0.01 0.27 0.14 1.25 -1.51 0.00 0.00 179.97 180.13 1llw h LEU 1284N 0.42 0.18 -0.55 3.80 5.85 -1.84 0.72 115.31 123.88 1llw h LEU 1284Ca 0.36 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 59.01 1llw h LEU 1284Cb 0.50 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1llw h LEU 1284CO -0.36 0.12 0.10 0.28 -0.34 0.00 0.00 178.44 178.24 1llw h SER 1285N 0.21 0.86 -0.22 1.25 0.02 0.17 -0.82 113.55 115.01 1llw h SER 1285Ca 0.08 -0.25 -0.05 0.00 -0.84 0.00 0.00 61.79 60.73 1llw h SER 1285Cb 0.08 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 1llw h SER 1285CO -0.02 0.90 -0.00 1.23 -1.14 0.00 0.00 176.83 177.80 1llw h GLY 1286N 0.79 0.56 0.77 -3.77 0.00 -1.00 0.71 103.07 101.13 1llw h GLY 1286Ca 0.17 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1llw h GLY 1286CO 0.01 0.31 0.00 0.00 0.00 0.00 0.00 176.54 176.86 1llw h ALA 1287N 1.50 0.01 -0.13 3.60 0.00 -0.23 0.65 119.26 124.67 1llw h ALA 1287Ca 0.11 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1llw h ALA 1287Cb 0.33 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1llw h ALA 1287CO 0.01 -0.37 -0.14 0.82 0.00 0.00 0.00 179.25 179.57 1llw h ILE 1288N -0.22 1.36 -0.52 0.00 2.04 -0.69 -3.26 117.51 116.21 1llw h ILE 1288Ca 0.00 -1.32 0.08 0.00 1.00 0.00 0.00 64.86 64.62 1llw h ILE 1288Cb 0.24 1.94 -0.07 0.00 -0.74 0.00 0.00 36.82 38.19 1llw h ILE 1288CO 0.00 0.38 0.15 0.00 0.00 0.00 0.00 178.15 178.68 1llw h ALA 1289N 0.58 0.63 0.00 1.87 0.00 0.68 0.95 119.26 123.97 1llw h ALA 1289Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1llw h ALA 1289Cb 0.68 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1llw h ALA 1289CO 0.03 -0.26 0.22 -0.22 0.00 0.00 0.00 179.25 179.02 1llw h LYS 1290N 0.31 0.00 0.00 0.00 3.64 -0.91 0.66 116.57 120.27 1llw h LYS 1290Ca 0.26 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.52 1llw h LYS 1290Cb 0.33 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1llw h LYS 1290CO -0.30 0.00 -1.56 1.63 -2.27 0.00 0.00 179.45 176.95 1llw n LYS 1291N -2.81 2.13 -0.16 1.90 5.02 0.11 -4.76 118.16 119.60 1llw n LYS 1291Ca -0.02 -0.02 0.05 0.00 -2.02 0.00 0.00 58.31 56.30 1llw n LYS 1291Cb 0.27 -1.22 0.07 0.00 -0.02 0.00 0.00 35.03 34.13 1llw n LYS 1291CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1llw n TYR 1292N -2.22 0.00 -3.36 2.13 0.53 0.04 -5.06 117.16 109.22 1llw n TYR 1292Ca -0.12 -0.60 0.00 0.00 -1.02 0.00 0.00 57.90 56.16 1llw n TYR 1292Cb 0.67 -0.10 0.00 0.00 -1.03 0.00 0.00 39.34 38.88 1llw n TYR 1292CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1llw n GLY 1293N -0.83 0.87 0.11 2.72 0.00 0.23 -1.14 105.19 107.15 1llw n GLY 1293Ca 0.08 -0.76 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 1llw n GLY 1293CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1llw h ASN 1294N 2.19 0.39 0.00 1.61 2.35 -1.95 -3.39 115.58 116.78 1llw h ASN 1294Ca 0.00 -0.38 -0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1llw h ASN 1294Cb 0.00 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1llw h ASN 1294CO 0.00 1.26 -0.13 0.59 -1.65 0.00 0.00 177.43 177.50 1llw n ASN 1295N -3.57 1.87 -0.53 5.81 3.02 -1.22 -4.30 115.26 116.35 1llw n ASN 1295Ca -0.07 -2.92 0.13 0.00 -0.03 0.00 0.00 54.58 51.69 1llw n ASN 1295Cb 0.96 -0.39 0.35 0.00 -0.61 0.00 0.00 39.78 40.08 1llw n ASN 1295CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1llw n GLY 1296N -1.13 0.07 3.77 7.41 0.00 -0.29 -4.93 105.19 110.09 1llw n GLY 1296Ca 0.13 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 1llw n GLY 1296CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1llw s PHE 1297N -2.17 3.47 -0.14 1.61 5.36 -1.26 -4.96 117.98 119.89 1llw s PHE 1297Ca 0.31 0.42 0.02 0.00 -0.96 0.00 0.00 56.93 56.72 1llw s PHE 1297Cb 0.20 -2.12 0.05 0.00 -0.34 0.00 0.00 43.02 40.81 1llw s PHE 1297CO 0.40 0.41 1.04 0.39 -1.46 0.00 0.00 175.22 176.00 1llw n GLU 1298N 3.09 2.97 -0.57 10.12 1.02 -1.21 -4.59 120.64 131.47 1llw n GLU 1298Ca -0.17 -1.59 -0.11 0.00 -0.02 0.00 0.00 57.16 55.27 1llw n GLU 1298Cb 0.53 -1.05 0.09 0.00 -0.02 0.00 0.00 31.44 30.99 1llw n GLU 1298CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1llw n GLY 1299N -0.36 -1.86 2.66 0.62 0.00 -0.87 -4.65 105.19 100.73 1llw n GLY 1299Ca 0.02 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 1llw n GLY 1299CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1llw n ASN 1300N -3.50 -2.68 -4.68 1.61 5.15 0.21 -4.35 115.26 107.02 1llw n ASN 1300Ca 0.06 -2.83 -0.41 0.00 -0.60 0.00 0.00 54.58 50.80 1llw n ASN 1300Cb 0.22 1.21 -0.04 0.00 -0.53 0.00 0.00 39.78 40.64 1llw n ASN 1300CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1llw s ILE 1301N 0.62 4.90 -0.37 -1.44 1.01 -0.47 -2.33 121.20 123.12 1llw s ILE 1301Ca 0.31 1.67 -0.05 0.00 0.00 0.00 0.00 60.65 62.58 1llw s ILE 1301Cb 0.03 -4.15 0.07 0.00 0.01 0.00 0.00 42.46 38.43 1llw s ILE 1301CO -0.10 0.07 0.15 -0.89 0.00 0.00 0.00 174.94 174.17 1llw s THR 1302N 1.83 3.57 -0.24 2.92 2.01 -0.04 -1.36 115.64 124.33 1llw s THR 1302Ca 0.40 -1.55 -0.13 0.00 0.31 0.00 0.00 61.69 60.72 1llw s THR 1302Cb -0.17 -3.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1llw s THR 1302CO 0.15 -0.41 0.27 -0.76 -0.69 0.00 0.00 174.62 173.18 1llw s LEU 1303N 1.29 4.09 -0.11 4.42 1.43 -0.14 -2.00 118.68 127.68 1llw s LEU 1303Ca 0.02 0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.33 1llw s LEU 1303Cb -0.22 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.69 1llw s LEU 1303CO -0.00 -0.04 -0.01 0.20 0.23 0.00 0.00 176.35 176.72 1llw s ASN 1304N 1.29 5.13 0.18 2.29 0.01 -0.02 -0.48 114.94 123.33 1llw s ASN 1304Ca 0.12 0.06 0.06 0.00 -0.71 0.00 0.00 52.86 52.39 1llw s ASN 1304Cb -0.15 -1.56 -0.05 0.00 0.41 0.00 0.00 41.25 39.91 1llw s ASN 1304CO 0.08 0.31 -0.11 -0.36 -1.51 0.00 0.00 177.10 175.51 1llw s PHE 1305N -0.48 1.47 -0.09 2.20 0.40 0.26 -1.45 117.98 120.29 1llw s PHE 1305Ca 0.08 -0.70 -0.04 0.00 -0.60 0.00 0.00 56.93 55.68 1llw s PHE 1305Cb -0.12 -0.73 0.05 0.00 0.51 0.00 0.00 43.02 42.73 1llw s PHE 1305CO 0.02 0.18 0.18 -1.14 0.70 0.00 0.00 175.22 175.16 1llw s GLN 1306N -3.72 0.08 0.00 0.44 0.74 0.06 -1.04 119.66 116.22 1llw s GLN 1306Ca 0.20 0.55 0.00 0.00 0.05 0.00 0.00 55.36 56.16 1llw s GLN 1306Cb 0.02 -0.20 0.00 0.00 1.10 0.00 0.00 33.01 33.93 1llw s GLN 1306CO 0.04 -0.26 0.00 0.41 -0.55 0.00 0.00 175.29 174.93 1llw n GLY 1307N 4.98 0.59 3.45 2.59 0.00 -0.32 0.11 105.19 116.58 1llw n GLY 1307Ca -0.12 -1.53 -0.36 0.00 0.00 0.00 0.00 46.02 44.01 1llw n GLY 1307CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 1308N -1.00 3.15 0.10 4.61 0.00 -1.23 -1.94 121.76 125.46 1llw s ALA 1308Ca 0.00 -1.12 -0.30 0.00 0.00 0.00 0.00 51.96 50.54 1llw s ALA 1308Cb 0.00 -2.06 -0.06 0.00 0.00 0.00 0.00 23.12 21.00 1llw s ALA 1308CO 0.00 -0.46 1.08 0.00 0.00 0.00 0.00 175.76 176.37 1llw s ALA 1309N 1.57 3.31 1.10 0.00 0.00 0.99 -2.53 121.76 126.21 1llw s ALA 1309Ca 0.06 0.73 -0.14 0.00 0.00 0.00 0.00 51.96 52.61 1llw s ALA 1309Cb -0.15 -3.36 0.24 0.00 0.00 0.00 0.00 23.12 19.85 1llw s ALA 1309CO 0.03 -0.23 1.07 0.20 0.00 0.00 0.00 175.76 176.83 1llw s GLY 1310N 0.40 1.55 0.46 0.00 0.00 -0.29 -1.82 107.32 107.61 1llw s GLY 1310Ca 0.52 -0.42 -0.17 0.00 0.00 0.00 0.00 44.72 44.65 1llw s GLY 1310CO 0.31 0.29 -0.09 -1.06 0.00 0.00 0.00 173.10 172.55 1llw n GLN 1311N -4.56 0.00 -1.79 2.90 1.13 -1.26 -3.03 117.38 110.77 1llw n GLN 1311Ca 0.05 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 54.94 1llw n GLN 1311Cb 0.57 -0.95 -0.05 0.00 0.11 0.00 0.00 30.24 29.92 1llw n GLN 1311CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1llw n SER 1312N 2.35 -4.66 -4.67 1.08 7.64 -0.36 -0.90 113.62 114.10 1llw n SER 1312Ca 0.08 0.31 -0.61 0.00 1.01 0.00 0.00 58.87 59.66 1llw n SER 1312Cb 0.44 -4.11 -0.08 0.00 -1.01 0.00 0.00 64.21 59.45 1llw n SER 1312CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1llw n PHE 1313N -2.64 1.63 -2.42 1.43 7.35 -1.17 -1.99 117.46 119.65 1llw n PHE 1313Ca -0.18 0.86 -0.11 0.00 -0.76 0.00 0.00 57.45 57.26 1llw n PHE 1313Cb 0.59 -2.30 0.01 0.00 0.35 0.00 0.00 39.48 38.13 1llw n PHE 1313CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1llw n GLY 1314N 3.43 0.01 3.53 7.13 0.00 -0.67 -0.35 105.19 118.27 1llw n GLY 1314Ca 0.26 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1llw n GLY 1314CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 1315N -2.68 -0.04 -0.50 4.61 0.00 -0.84 -3.53 121.76 118.77 1llw s ALA 1315Ca 0.07 -0.01 -0.06 0.00 0.00 0.00 0.00 51.96 51.96 1llw s ALA 1315Cb -0.03 -3.28 0.06 0.00 0.00 0.00 0.00 23.12 19.87 1llw s ALA 1315CO 0.09 -3.59 0.16 1.19 0.00 0.00 0.00 175.76 173.61 1llw n PHE 1316N -4.75 -1.08 -2.01 0.00 3.01 0.15 -4.53 117.46 108.25 1llw n PHE 1316Ca 0.05 0.18 -0.42 0.00 1.01 0.00 0.00 57.45 58.27 1llw n PHE 1316Cb 0.54 -0.88 -0.03 0.00 -0.01 0.00 0.00 39.48 39.10 1llw n PHE 1316CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1llw s ASN 1317N -1.77 6.66 0.65 4.37 3.84 -1.23 -4.56 114.94 122.89 1llw s ASN 1317Ca 0.22 2.55 0.01 0.00 0.21 0.00 0.00 52.86 55.85 1llw s ASN 1317Cb -0.13 -2.60 0.09 0.00 -0.55 0.00 0.00 41.25 38.06 1llw s ASN 1317CO 0.27 -0.76 0.90 -0.76 -2.79 0.00 0.00 177.10 173.96 1llw s LEU 1318N 0.86 3.09 0.44 3.21 1.43 -1.10 -0.02 118.68 126.59 1llw s LEU 1318Ca 0.67 -0.26 -0.23 0.00 -1.03 0.00 0.00 54.13 53.27 1llw s LEU 1318Cb -0.42 -2.30 -0.08 0.00 0.03 0.00 0.00 46.19 43.43 1llw s LEU 1318CO 0.33 -1.55 1.10 -1.81 0.23 0.00 0.00 176.35 174.64 1llw s ASP 1319N -4.61 6.45 -0.18 2.29 1.01 -1.23 -2.90 116.67 117.50 1llw s ASP 1319Ca 0.63 2.14 0.00 0.00 0.71 0.00 0.00 52.55 56.02 1llw s ASP 1319Cb -0.07 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.27 1llw s ASP 1319CO 0.42 -0.71 0.00 0.61 0.21 0.00 0.00 175.17 175.70 1llw n GLY 1320N 0.32 0.39 2.64 0.21 0.00 -1.26 -4.81 105.19 102.67 1llw n GLY 1320Ca 0.06 -0.89 -0.24 0.00 0.00 0.00 0.00 46.02 44.96 1llw n GLY 1320CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1llw s MET 1321N -3.30 0.01 -0.13 1.61 0.00 -1.19 -1.36 119.30 114.95 1llw s MET 1321Ca 0.00 0.10 0.02 0.00 0.00 0.00 0.00 55.69 55.81 1llw s MET 1321Cb 0.00 -1.32 -0.00 0.00 0.00 0.00 0.00 34.83 33.51 1llw s MET 1321CO 0.00 -0.54 -0.19 0.99 0.00 0.00 0.00 175.02 175.28 1llw s THR 1322N 2.16 2.41 -0.18 10.11 2.01 -0.46 -2.34 115.64 129.35 1llw s THR 1322Ca 0.03 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.16 1llw s THR 1322Cb -0.15 -1.98 0.03 0.00 0.01 0.00 0.00 72.50 70.42 1llw s THR 1322CO -0.07 0.54 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.48 1llw s LEU 1323N 0.57 2.10 -0.22 4.42 1.43 0.23 -0.96 118.68 126.25 1llw s LEU 1323Ca -0.11 -0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 52.11 1llw s LEU 1323Cb -0.16 -1.34 -0.03 0.00 0.03 0.00 0.00 46.19 44.69 1llw s LEU 1323CO 0.04 -0.06 0.50 -1.00 0.23 0.00 0.00 176.35 176.06 1llw s HIS 1324N 1.36 3.34 -0.58 0.29 3.76 0.36 -0.90 115.29 122.93 1llw s HIS 1324Ca 0.03 0.71 -0.09 0.00 -0.15 0.00 0.00 55.06 55.56 1llw s HIS 1324Cb -0.14 -2.67 0.15 0.00 1.11 0.00 0.00 32.58 31.03 1llw s HIS 1324CO -0.11 -0.15 0.46 -1.17 -0.85 0.00 0.00 174.74 172.92 1llw s LEU 1325N 1.80 5.83 -0.67 0.89 2.96 0.15 0.90 118.68 130.56 1llw s LEU 1325Ca 0.23 -2.27 -0.27 0.00 -0.22 0.00 0.00 54.13 51.59 1llw s LEU 1325Cb -0.15 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.52 1llw s LEU 1325CO 0.09 -0.61 1.49 -1.10 -1.32 0.00 0.00 176.35 174.90 1llw s GLN 1326N 0.82 3.03 0.00 1.98 -0.21 -0.21 0.15 119.66 125.23 1llw s GLN 1326Ca 0.10 0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.64 1llw s GLN 1326Cb -0.22 -4.24 0.00 0.00 1.00 0.00 0.00 33.01 29.56 1llw s GLN 1326CO -0.03 -2.29 0.00 0.41 -2.12 0.00 0.00 175.29 171.26 1llw n GLY 1327N 5.46 0.28 3.45 3.09 0.00 0.81 -1.18 105.19 117.10 1llw n GLY 1327Ca 0.10 -0.31 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1llw n GLY 1327CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1llw s GLU 1328N 0.00 1.30 0.34 1.61 -1.05 -0.82 -3.85 118.70 116.24 1llw s GLU 1328Ca 0.00 -1.04 0.03 0.00 -0.15 0.00 0.00 54.97 53.81 1llw s GLU 1328Cb 0.00 0.45 -0.05 0.00 -0.44 0.00 0.00 34.13 34.10 1llw s GLU 1328CO 0.00 -0.52 0.09 0.00 0.95 0.00 0.00 175.26 175.78 1llw s ALA 1329N -3.93 2.41 0.09 -0.84 0.00 -0.78 -0.01 121.76 118.70 1llw s ALA 1329Ca 0.14 -1.76 0.01 0.00 0.00 0.00 0.00 51.96 50.35 1llw s ALA 1329Cb 0.01 0.77 0.01 0.00 0.00 0.00 0.00 23.12 23.91 1llw s ALA 1329CO -0.00 -0.35 0.09 0.09 0.00 0.00 0.00 175.76 175.59 1llw n ASN 1330N -0.84 0.87 -3.13 0.00 3.02 -0.76 -4.22 115.26 110.20 1llw n ASN 1330Ca -0.03 -1.27 -0.33 0.00 -0.03 0.00 0.00 54.58 52.92 1llw n ASN 1330Cb 0.66 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.78 1llw n ASN 1330CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1llw n ASP 1331N -2.37 -1.13 -0.33 6.41 8.00 -1.26 -3.68 116.55 122.19 1llw n ASP 1331Ca 0.01 0.76 -0.04 0.00 0.71 0.00 0.00 54.79 56.23 1llw n ASP 1331Cb 0.10 -0.67 -0.02 0.00 -0.02 0.00 0.00 41.12 40.51 1llw n ASP 1331CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1llw n TYR 1332N -0.15 -0.01 -1.70 1.24 0.53 -0.60 -1.22 117.16 115.25 1llw n TYR 1332Ca 0.12 0.00 -0.41 0.00 -1.02 0.00 0.00 57.90 56.59 1llw n TYR 1332Cb 0.20 -1.13 0.02 0.00 -1.03 0.00 0.00 39.34 37.39 1llw n TYR 1332CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1llw n VAL 1333N -2.96 2.69 -0.96 -0.72 0.31 -1.24 -1.15 118.33 114.31 1llw n VAL 1333Ca -0.04 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.79 1llw n VAL 1333Cb 0.17 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.54 1llw n VAL 1333CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1llw n GLY 1334N 0.83 0.19 3.55 2.92 0.00 0.52 -1.44 105.19 111.76 1llw n GLY 1334Ca 0.07 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.54 1llw n GLY 1334CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1llw n LYS 1335N -0.58 0.61 -0.24 1.61 4.81 -0.30 -0.93 118.16 123.14 1llw n LYS 1335Ca 0.00 0.22 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 1llw n LYS 1335Cb 0.29 -1.79 0.00 0.00 0.02 0.00 0.00 35.03 33.55 1llw n LYS 1335CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1llw n GLY 1336N 2.03 1.73 3.69 3.14 0.00 -0.26 0.34 105.19 115.86 1llw n GLY 1336Ca 0.19 0.00 -0.58 0.00 0.00 0.00 0.00 46.02 45.63 1llw n GLY 1336CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1llw n MET 1337N -2.00 0.92 -0.07 1.61 1.56 -0.11 -4.22 117.12 114.81 1llw n MET 1337Ca 0.00 0.33 -0.12 0.00 -0.27 0.00 0.00 57.70 57.65 1llw n MET 1337Cb 0.00 -1.97 -0.15 0.00 2.15 0.00 0.00 33.22 33.25 1llw n MET 1337CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 1llw n ASN 1338N 4.49 0.75 -3.61 6.12 5.15 -0.05 -0.02 115.26 128.09 1llw n ASN 1338Ca 0.25 0.11 -0.07 0.00 -0.60 0.00 0.00 54.58 54.28 1llw n ASN 1338Cb 0.11 0.31 -0.05 0.00 -0.53 0.00 0.00 39.78 39.61 1llw n ASN 1338CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1llw s GLY 1339N -5.55 -0.09 0.00 8.20 0.00 0.96 -2.21 107.32 108.63 1llw s GLY 1339Ca -0.14 2.50 0.00 0.00 0.00 0.00 0.00 44.72 47.08 1llw s GLY 1339CO 0.79 1.26 0.00 0.61 0.00 0.00 0.00 173.10 175.76 1llw n GLY 1340N 0.98 -0.97 2.90 0.20 0.00 -1.14 -2.70 105.19 104.45 1llw n GLY 1340Ca -0.08 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.29 1llw n GLY 1340CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1llw s GLU 1341N 0.00 0.05 -0.24 1.61 2.02 -0.99 -0.06 118.70 121.10 1llw s GLU 1341Ca 0.00 0.13 -0.01 0.00 0.02 0.00 0.00 54.97 55.11 1llw s GLU 1341Cb 0.00 -0.04 0.07 0.00 0.10 0.00 0.00 34.13 34.26 1llw s GLU 1341CO 0.00 -0.06 0.04 0.42 0.02 0.00 0.00 175.26 175.68 1llw s ILE 1342N 0.36 0.83 -0.16 -1.63 1.01 -0.89 -0.60 121.20 120.11 1llw s ILE 1342Ca -0.03 -0.94 -0.06 0.00 0.00 0.00 0.00 60.65 59.62 1llw s ILE 1342Cb -0.04 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.02 1llw s ILE 1342CO -0.01 -0.33 0.03 -0.69 0.00 0.00 0.00 174.94 173.94 1llw s VAL 1343N 1.69 4.55 -0.10 2.92 1.01 -0.07 -0.35 120.40 130.05 1llw s VAL 1343Ca 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 1llw s VAL 1343Cb -0.17 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.21 1llw s VAL 1343CO -0.13 0.49 -0.04 -0.63 0.00 0.00 0.00 175.10 174.79 1llw s ILE 1344N 0.16 0.74 -0.05 2.22 1.01 -0.40 0.35 121.20 125.23 1llw s ILE 1344Ca 0.03 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.58 1llw s ILE 1344Cb -0.13 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.52 1llw s ILE 1344CO 0.01 0.31 -0.10 -0.69 0.00 0.00 0.00 174.94 174.47 1llw s VAL 1345N 1.82 0.96 0.82 2.92 1.01 0.12 -2.69 120.40 125.36 1llw s VAL 1345Ca 0.05 -0.39 -0.13 0.00 0.00 0.00 0.00 61.98 61.51 1llw s VAL 1345Cb -0.13 -0.89 0.08 0.00 0.00 0.00 0.00 36.38 35.45 1llw s VAL 1345CO -0.07 0.31 1.15 -0.81 0.00 0.00 0.00 175.10 175.68 1llw n PRO 1346N 3.79 0.11 -2.32 2.72 -0.04 -1.25 -0.13 135.00 137.87 1llw n PRO 1346Ca -0.23 0.11 -0.42 0.00 -0.04 0.00 0.00 63.50 62.92 1llw n PRO 1346Cb 0.52 -2.39 -0.03 0.00 -0.04 0.00 0.00 33.50 31.56 1llw n PRO 1346CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1llw s HIS 1347N -2.17 3.36 0.64 0.54 2.46 -1.25 -4.43 115.29 114.44 1llw s HIS 1347Ca 0.72 1.20 0.29 0.00 0.47 0.00 0.00 55.06 57.74 1llw s HIS 1347Cb -0.29 -3.52 1.54 0.00 -0.13 0.00 0.00 32.58 30.18 1llw s HIS 1347CO 0.52 -1.68 1.89 -1.00 -2.47 0.00 0.00 174.74 172.01 1llw h PRO 1348N 6.45 0.00 0.00 2.88 0.13 -1.99 0.14 132.00 139.61 1llw h PRO 1348Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1llw h PRO 1348Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1llw h PRO 1348CO 0.82 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.63 1llw n GLN 1349N -3.15 0.88 -2.25 0.86 6.02 -1.26 -4.76 117.38 113.72 1llw n GLN 1349Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.59 1llw n GLN 1349Cb 0.48 -1.37 -0.03 0.00 1.02 0.00 0.00 30.24 30.34 1llw n GLN 1349CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1llw s ALA 1350N -2.00 3.49 -0.96 -1.58 0.00 0.49 -3.85 121.76 117.36 1llw s ALA 1350Ca 0.31 1.10 0.18 0.00 0.00 0.00 0.00 51.96 53.55 1llw s ALA 1350Cb 0.14 -3.45 0.73 0.00 0.00 0.00 0.00 23.12 20.54 1llw s ALA 1350CO 0.24 -0.48 1.64 -1.13 0.00 0.00 0.00 175.76 176.03 1llw n SER 1351N 1.80 4.88 -4.93 0.00 3.41 -1.26 -4.98 113.62 112.54 1llw n SER 1351Ca 0.03 -2.54 -0.20 0.00 -0.26 0.00 0.00 58.87 55.90 1llw n SER 1351Cb 0.43 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 1llw n SER 1351CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1llw s PHE 1352N -2.01 3.05 -0.62 7.33 -0.12 -1.26 -5.04 117.98 119.30 1llw s PHE 1352Ca 0.51 -0.24 -0.27 0.00 -0.05 0.00 0.00 56.93 56.88 1llw s PHE 1352Cb 0.34 -1.89 0.03 0.00 -0.63 0.00 0.00 43.02 40.88 1llw s PHE 1352CO 0.23 0.10 1.17 0.00 -0.05 0.00 0.00 175.22 176.67 1llw s ALA 1353N -2.22 2.96 0.19 1.99 0.00 -1.26 -4.93 121.76 118.49 1llw s ALA 1353Ca 0.43 -1.06 -0.25 0.00 0.00 0.00 0.00 51.96 51.07 1llw s ALA 1353Cb -0.08 -4.05 0.07 0.00 0.00 0.00 0.00 23.12 19.06 1llw s ALA 1353CO 0.29 -2.79 1.55 -1.35 0.00 0.00 0.00 175.76 173.45 1llw h PRO 1354N 9.64 -0.00 -0.04 0.00 0.11 -1.88 -1.22 132.00 138.61 1llw h PRO 1354Ca -0.26 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.86 1llw h PRO 1354Cb 1.06 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1llw h PRO 1354CO 1.20 -0.00 0.03 0.93 -0.21 0.00 0.00 178.00 179.95 1llw h GLU 1355N -0.00 0.00 -0.00 1.05 3.07 -1.92 0.13 114.58 116.91 1llw h GLU 1355Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1llw h GLU 1355Cb 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1llw h GLU 1355CO -0.96 0.00 -0.05 -0.25 -1.40 0.00 0.00 179.01 176.35 1llw n ASP 1356N -4.49 0.15 -3.90 1.42 9.92 -0.49 -4.34 116.55 114.82 1llw n ASP 1356Ca -0.02 -0.21 -0.26 0.00 -0.53 0.00 0.00 54.79 53.77 1llw n ASP 1356Cb 0.13 -0.23 -0.17 0.00 -0.64 0.00 0.00 41.12 40.21 1llw n ASP 1356CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1llw s ASN 1357N -2.60 2.05 0.39 -2.24 0.01 0.45 -4.90 114.94 108.10 1llw s ASN 1357Ca 0.27 -0.27 -0.27 0.00 -0.71 0.00 0.00 52.86 51.88 1llw s ASN 1357Cb 0.20 -0.79 -0.11 0.00 0.41 0.00 0.00 41.25 40.97 1llw s ASN 1357CO 0.48 -0.11 1.30 0.52 -1.51 0.00 0.00 177.10 177.77 1llw n VAL 1358N 4.86 2.28 -0.57 1.60 0.31 -0.24 -3.70 118.33 122.88 1llw n VAL 1358Ca -0.13 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 1llw n VAL 1358Cb 0.50 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.83 1llw n VAL 1358CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1llw n ILE 1359N 0.07 0.00 -3.97 2.52 3.06 -0.76 -4.80 119.36 115.48 1llw n ILE 1359Ca 0.05 0.00 -0.08 0.00 -2.50 0.00 0.00 62.75 60.22 1llw n ILE 1359Cb 0.38 0.85 -0.09 0.00 0.54 0.00 0.00 39.64 41.32 1llw n ILE 1359CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 1llw s ILE 1360N 0.00 0.17 0.00 9.51 1.01 -1.20 -1.87 121.20 128.81 1llw s ILE 1360Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 60.65 59.29 1llw s ILE 1360Cb 0.00 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.27 1llw s ILE 1360CO 0.00 -0.75 0.00 0.61 0.00 0.00 0.00 174.94 174.80 1llw n GLY 1361N 0.37 3.39 3.59 6.18 0.00 -1.24 -2.75 105.19 114.73 1llw n GLY 1361Ca -0.16 -2.09 -0.35 0.00 0.00 0.00 0.00 46.02 43.42 1llw n GLY 1361CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1llw n ASN 1362N -1.07 0.08 -2.93 1.61 3.02 -1.26 -2.86 115.26 111.85 1llw n ASN 1362Ca 0.00 0.58 -0.20 0.00 -0.03 0.00 0.00 54.58 54.94 1llw n ASN 1362Cb 0.00 -1.39 0.01 0.00 -0.61 0.00 0.00 39.78 37.79 1llw n ASN 1362CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1llw n THR 1363N -2.90 -1.13 -2.10 3.41 -1.04 -0.31 -1.56 114.28 108.64 1llw n THR 1363Ca 0.12 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.75 1llw n THR 1363Cb 0.50 -2.31 0.01 0.00 -1.82 0.00 0.00 70.33 66.71 1llw n THR 1363CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1llw n LEU 1365N -0.64 0.48 -0.56 0.00 4.77 -0.52 0.12 117.00 120.64 1llw n LEU 1365Ca 0.08 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.99 1llw n LEU 1365Cb 0.47 -0.73 -0.02 0.00 -2.33 0.00 0.00 43.42 40.81 1llw n LEU 1365CO 0.49 -0.24 0.25 0.00 -1.33 0.00 0.00 177.39 176.57 1llw n TYR 1366N -2.00 0.12 -2.08 -1.77 -0.00 -1.21 0.68 117.16 110.90 1llw n TYR 1366Ca 0.00 0.08 -0.18 0.00 -0.00 0.00 0.00 57.90 57.80 1llw n TYR 1366Cb 0.00 -0.30 -0.03 0.00 -0.00 0.00 0.00 39.34 39.01 1llw n TYR 1366CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1llw n GLY 1367N 0.91 0.29 3.73 2.98 0.00 -1.20 -1.10 105.19 110.81 1llw n GLY 1367Ca 0.08 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1llw n GLY 1367CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw n ALA 1368N -0.86 1.75 0.08 4.61 0.00 0.21 -4.58 120.51 121.73 1llw n ALA 1368Ca -0.20 0.32 0.01 0.00 0.00 0.00 0.00 53.44 53.57 1llw n ALA 1368Cb 0.63 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.74 1llw n ALA 1368CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1llw n THR 1369N 0.17 0.00 -3.37 0.00 5.66 0.97 0.60 114.28 118.31 1llw n THR 1369Ca 0.04 -0.33 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 1llw n THR 1369Cb 0.38 0.84 0.00 0.00 -1.55 0.00 0.00 70.33 70.00 1llw n THR 1369CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1llw n GLY 1370N 1.43 1.09 0.00 1.09 0.00 -0.64 -4.25 105.19 103.91 1llw n GLY 1370Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1llw n GLY 1370CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llw n GLY 1371N 0.00 -0.18 2.86 -0.02 0.00 -1.14 -3.93 105.19 102.79 1llw n GLY 1371Ca 0.00 -1.72 -0.15 0.00 0.00 0.00 0.00 46.02 44.15 1llw n GLY 1371CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1llw s ASN 1372N -2.17 0.12 -0.16 1.61 0.02 0.92 -1.20 114.94 114.08 1llw s ASN 1372Ca 0.00 0.24 0.01 0.00 -1.02 0.00 0.00 52.86 52.09 1llw s ASN 1372Cb 0.00 0.13 0.01 0.00 0.02 0.00 0.00 41.25 41.40 1llw s ASN 1372CO 0.00 -0.16 -0.18 -0.22 0.02 0.00 0.00 177.10 176.56 1llw s LEU 1373N 1.37 2.32 -0.22 0.60 2.96 0.21 -2.11 118.68 123.82 1llw s LEU 1373Ca -0.07 -0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 53.27 1llw s LEU 1373Cb -0.12 -1.52 -0.00 0.00 0.50 0.00 0.00 46.19 45.05 1llw s LEU 1373CO -0.05 0.06 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.68 1llw s TYR 1374N 0.94 2.96 -0.09 5.38 1.51 0.53 -1.51 117.35 127.06 1llw s TYR 1374Ca -0.03 -1.01 -0.04 0.00 -1.01 0.00 0.00 57.07 54.98 1llw s TYR 1374Cb -0.15 -2.10 0.05 0.00 -0.11 0.00 0.00 41.96 39.65 1llw s TYR 1374CO -0.03 -0.57 0.19 0.00 -1.11 0.00 0.00 175.55 174.02 1llw s ALA 1375N 1.46 -0.28 -1.22 3.71 0.00 0.14 -1.27 121.76 124.31 1llw s ALA 1375Ca 0.05 0.67 -0.11 0.00 0.00 0.00 0.00 51.96 52.57 1llw s ALA 1375Cb -0.14 -0.84 -0.06 0.00 0.00 0.00 0.00 23.12 22.08 1llw s ALA 1375CO -0.04 -0.54 2.38 0.09 0.00 0.00 0.00 175.76 177.65 1llw n ASN 1376N 5.22 5.59 0.00 0.00 3.02 -1.10 -2.72 115.26 125.27 1llw n ASN 1376Ca -0.07 -2.55 0.00 0.00 -0.03 0.00 0.00 54.58 51.93 1llw n ASN 1376Cb 0.50 -1.35 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 1llw n ASN 1376CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1llw n GLY 1377N 3.89 1.63 3.52 7.41 0.00 -1.26 -4.45 105.19 115.92 1llw n GLY 1377Ca 0.58 -0.75 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1llw n GLY 1377CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1llw n ARG 1378N -0.41 0.84 -3.66 1.61 1.74 -1.24 -2.75 116.66 112.79 1llw n ARG 1378Ca 0.00 0.31 -0.23 0.00 -0.77 0.00 0.00 57.85 57.16 1llw n ARG 1378Cb 0.00 -1.76 -0.02 0.00 -1.02 0.00 0.00 32.46 29.66 1llw n ARG 1378CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1llw n ALA 1379N -0.91 0.60 -1.05 7.54 0.00 0.13 -1.82 120.51 125.00 1llw n ALA 1379Ca 0.11 -1.85 0.00 0.00 0.00 0.00 0.00 53.44 51.70 1llw n ALA 1379Cb 0.41 0.84 0.00 0.00 0.00 0.00 0.00 19.45 20.70 1llw n ALA 1379CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llw n GLY 1380N -0.34 -0.14 3.77 0.00 0.00 -1.11 -2.45 105.19 104.91 1llw n GLY 1380Ca -0.06 -1.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.05 1llw n GLY 1380CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1llw s GLU 1381N 0.15 0.14 -1.10 1.61 1.03 -1.26 -1.21 118.70 118.07 1llw s GLU 1381Ca 0.00 -0.07 0.00 0.00 0.03 0.00 0.00 54.97 54.93 1llw s GLU 1381Cb 0.00 -1.76 0.00 0.00 -0.80 0.00 0.00 34.13 31.57 1llw s GLU 1381CO 0.00 -2.80 0.00 0.54 -1.33 0.00 0.00 175.26 171.67 1llw n ARG 1382N -4.11 -2.10 -1.62 -4.83 3.00 -0.69 -1.16 116.66 105.15 1llw n ARG 1382Ca 0.12 0.62 -0.49 0.00 -0.01 0.00 0.00 57.85 58.09 1llw n ARG 1382Cb 0.59 -5.17 -0.05 0.00 0.00 0.00 0.00 32.46 27.83 1llw n ARG 1382CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1llw n PHE 1383N -3.19 2.12 -2.72 -1.55 7.35 -1.26 -2.18 117.46 116.02 1llw n PHE 1383Ca -0.14 0.07 -0.10 0.00 -0.76 0.00 0.00 57.45 56.51 1llw n PHE 1383Cb 0.59 -2.63 0.05 0.00 0.35 0.00 0.00 39.48 37.83 1llw n PHE 1383CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1llw n ALA 1384N 7.91 -1.65 0.35 3.13 0.00 0.32 -1.40 120.51 129.17 1llw n ALA 1384Ca 0.28 0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.63 1llw n ALA 1384Cb 0.29 -3.30 -0.06 0.00 0.00 0.00 0.00 19.45 16.37 1llw n ALA 1384CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1llw h VAL 1385N -0.86 0.00 -1.21 0.00 2.07 -1.53 -3.05 116.25 111.67 1llw h VAL 1385Ca -0.39 0.00 -0.63 0.00 0.82 0.00 0.00 66.70 66.50 1llw h VAL 1385Cb 1.21 0.00 -0.37 0.00 -1.52 0.00 0.00 31.29 30.61 1llw h VAL 1385CO 0.30 0.00 -0.06 0.54 0.02 0.00 0.00 177.57 178.36 1llw n ARG 1386N -4.38 3.20 -1.76 1.57 5.12 -1.26 0.15 116.66 119.30 1llw n ARG 1386Ca -0.11 -3.93 -0.43 0.00 -1.93 0.00 0.00 57.85 51.46 1llw n ARG 1386Cb 0.35 -2.27 -0.03 0.00 -1.16 0.00 0.00 32.46 29.35 1llw n ARG 1386CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 1llw s ASN 1387N -2.73 6.06 -0.15 0.55 2.47 -1.15 -3.25 114.94 116.74 1llw s ASN 1387Ca 0.54 2.11 0.03 0.00 0.42 0.00 0.00 52.86 55.96 1llw s ASN 1387Cb 0.44 -2.52 -0.23 0.00 -1.45 0.00 0.00 41.25 37.48 1llw s ASN 1387CO -0.10 -1.45 0.22 -1.20 -3.72 0.00 0.00 177.10 170.85 1llw n SER 1388N 9.33 1.53 0.00 -4.21 7.64 0.20 -1.41 113.62 126.69 1llw n SER 1388Ca 0.23 0.12 0.00 0.00 1.01 0.00 0.00 58.87 60.24 1llw n SER 1388Cb 0.44 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1llw n SER 1388CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1llw n VAL 1389N -3.23 0.00 -2.46 0.44 0.31 -0.28 -3.38 118.33 109.73 1llw n VAL 1389Ca -0.33 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 63.72 1llw n VAL 1389Cb 1.05 0.45 0.00 0.00 -0.91 0.00 0.00 33.84 34.43 1llw n VAL 1389CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1llw s GLY 1390N 0.00 1.53 0.31 2.92 0.00 -1.25 -4.15 107.32 106.68 1llw s GLY 1390Ca 0.00 -0.41 0.09 0.00 0.00 0.00 0.00 44.72 44.40 1llw s GLY 1390CO 0.00 -0.22 -0.10 0.54 0.00 0.00 0.00 173.10 173.32 1llw s LYS 1391N -4.84 1.71 -0.15 2.90 1.02 -0.34 -2.75 119.74 117.29 1llw s LYS 1391Ca 0.49 -1.86 -0.30 0.00 0.02 0.00 0.00 55.97 54.32 1llw s LYS 1391Cb -0.10 -1.53 0.12 0.00 -0.52 0.00 0.00 37.83 35.80 1llw s LYS 1391CO 0.47 0.14 0.98 0.00 -0.92 0.00 0.00 175.35 176.01 1llw s ALA 1392N -2.73 -1.92 -0.16 5.17 0.00 -0.87 -0.62 121.76 120.64 1llw s ALA 1392Ca 0.31 1.54 0.02 0.00 0.00 0.00 0.00 51.96 53.83 1llw s ALA 1392Cb 0.02 -0.61 0.02 0.00 0.00 0.00 0.00 23.12 22.55 1llw s ALA 1392CO 0.15 -0.34 -0.20 0.08 0.00 0.00 0.00 175.76 175.45 1llw s VAL 1393N -1.24 1.97 0.36 0.00 1.01 -0.57 -1.40 120.40 120.53 1llw s VAL 1393Ca -0.02 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.11 1llw s VAL 1393Cb -0.00 -1.77 -0.07 0.00 0.00 0.00 0.00 36.38 34.54 1llw s VAL 1393CO 0.01 0.53 0.04 0.27 0.00 0.00 0.00 175.10 175.95 1llw s ILE 1394N 1.12 1.44 -1.73 2.22 -4.36 -0.61 0.25 121.20 119.53 1llw s ILE 1394Ca -0.00 -2.00 0.15 0.00 -0.26 0.00 0.00 60.65 58.54 1llw s ILE 1394Cb -0.14 -2.83 0.23 0.00 1.25 0.00 0.00 42.46 40.97 1llw s ILE 1394CO -0.08 0.00 1.13 -0.62 0.24 0.00 0.00 174.94 175.61 1llw n GLU 1395N -0.80 1.76 0.00 0.37 1.02 -1.10 -1.19 120.64 120.70 1llw n GLU 1395Ca -0.04 -1.74 0.00 0.00 -0.02 0.00 0.00 57.16 55.37 1llw n GLU 1395Cb 0.67 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.76 1llw n GLU 1395CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1llw n GLY 1396N 0.90 0.98 3.65 0.62 0.00 -1.24 -1.98 105.19 108.12 1llw n GLY 1396Ca 0.12 -0.97 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 1llw n GLY 1396CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw s ALA 1397N -2.00 -1.56 0.50 4.61 0.00 -0.53 0.17 121.76 122.96 1llw s ALA 1397Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 51.96 52.23 1llw s ALA 1397Cb 0.00 0.71 0.04 0.00 0.00 0.00 0.00 23.12 23.88 1llw s ALA 1397CO 0.00 -0.90 0.30 0.41 0.00 0.00 0.00 175.76 175.57 1llw n GLY 1398N -0.40 0.67 2.29 0.00 0.00 -0.35 -2.72 105.19 104.69 1llw n GLY 1398Ca -0.09 -1.97 -0.28 0.00 0.00 0.00 0.00 46.02 43.69 1llw n GLY 1398CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1llw n ASP 1399N -2.98 -4.37 -0.77 1.61 8.00 -1.26 -2.93 116.55 113.85 1llw n ASP 1399Ca 0.05 0.18 -0.10 0.00 0.71 0.00 0.00 54.79 55.63 1llw n ASP 1399Cb 0.17 -0.58 -0.04 0.00 -0.02 0.00 0.00 41.12 40.65 1llw n ASP 1399CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1llw n HIS 1400N -1.80 -0.05 -1.65 1.24 8.25 -0.68 -1.70 115.22 118.84 1llw n HIS 1400Ca -0.01 0.00 -0.51 0.00 -0.26 0.00 0.00 57.72 56.94 1llw n HIS 1400Cb 0.42 -1.91 -0.06 0.00 1.12 0.00 0.00 29.99 29.55 1llw n HIS 1400CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1llw n GLU 1403N -2.46 0.00 -1.20 0.00 2.13 0.35 -2.37 120.64 117.10 1llw n GLU 1403Ca -0.05 0.00 -0.23 0.00 0.66 0.00 0.00 57.16 57.55 1llw n GLU 1403Cb 0.20 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.80 1llw n GLU 1403CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1llw n TYR 1404N 0.00 1.01 -2.14 4.31 4.02 0.40 -3.49 117.16 121.26 1llw n TYR 1404Ca 0.00 -2.07 -0.28 0.00 -0.01 0.00 0.00 57.90 55.54 1llw n TYR 1404Cb 0.00 -1.84 0.04 0.00 -0.02 0.00 0.00 39.34 37.52 1llw n TYR 1404CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 176.86 177.26 1llw s MET 1405N 0.89 2.77 0.00 -0.72 1.75 -1.00 -4.50 119.30 118.49 1llw s MET 1405Ca 0.66 0.16 0.00 0.00 -1.25 0.00 0.00 55.69 55.27 1llw s MET 1405Cb 0.28 -2.14 0.00 0.00 2.84 0.00 0.00 34.83 35.81 1llw s MET 1405CO -0.05 -0.94 0.00 -2.37 -0.65 0.00 0.00 175.02 171.01 1llw n THR 1406N -2.83 0.00 0.00 10.11 5.66 -0.50 0.41 114.28 127.13 1llw n THR 1406Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1llw n THR 1406Cb 0.58 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 1llw n THR 1406CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1llw n GLY 1407N 0.00 0.60 4.22 1.09 0.00 -1.03 -4.24 105.19 105.82 1llw n GLY 1407Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1llw n GLY 1407CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1llw n GLY 1408N -0.93 -1.91 2.72 -0.02 0.00 -1.23 -3.87 105.19 99.95 1llw n GLY 1408Ca 0.00 -1.67 -0.18 0.00 0.00 0.00 0.00 46.02 44.17 1llw n GLY 1408CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1llw s VAL 1409N 0.00 -0.07 -0.08 1.61 1.01 -1.11 -1.83 120.40 119.92 1llw s VAL 1409Ca 0.00 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.34 1llw s VAL 1409Cb 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 36.38 36.26 1llw s VAL 1409CO 0.00 0.14 -0.19 -0.63 0.00 0.00 0.00 175.10 174.43 1llw s ILE 1410N 1.69 1.64 -0.14 2.22 -1.09 -0.26 -2.04 121.20 123.23 1llw s ILE 1410Ca -0.01 -0.78 0.01 0.00 -2.23 0.00 0.00 60.65 57.64 1llw s ILE 1410Cb -0.12 -1.45 0.02 0.00 -1.58 0.00 0.00 42.46 39.33 1llw s ILE 1410CO -0.03 0.47 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.30 1llw s VAL 1411N 0.49 1.65 -0.18 2.92 1.01 -0.49 -0.94 120.40 124.85 1llw s VAL 1411Ca -0.17 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1llw s VAL 1411Cb -0.17 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.72 1llw s VAL 1411CO 0.07 0.47 -0.15 -0.69 0.00 0.00 0.00 175.10 174.80 1llw s VAL 1412N 1.29 1.82 -0.95 2.92 1.01 -0.48 -1.58 120.40 124.43 1llw s VAL 1412Ca 0.01 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 1llw s VAL 1412Cb -0.14 -1.75 0.33 0.00 0.00 0.00 0.00 36.38 34.82 1llw s VAL 1412CO -0.08 0.37 1.82 0.18 0.00 0.00 0.00 175.10 177.39 1llw n LEU 1413N 4.66 7.22 0.00 3.92 4.77 -0.34 -2.58 117.00 134.65 1llw n LEU 1413Ca -0.17 -5.26 0.00 0.00 -0.03 0.00 0.00 56.01 50.55 1llw n LEU 1413Cb 0.48 -1.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.47 1llw n LEU 1413CO 0.23 1.99 0.00 0.61 -1.33 0.00 0.00 177.39 178.89 1llw n GLY 1414N -0.20 1.06 3.40 -0.72 0.00 -0.84 -4.55 105.19 103.34 1llw n GLY 1414Ca 0.48 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 1llw n GLY 1414CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1llw n PRO 1415N -0.52 -1.65 -3.67 1.61 -0.02 -1.26 -4.58 135.00 124.92 1llw n PRO 1415Ca 0.00 -0.45 -0.14 0.00 -2.02 0.00 0.00 63.50 60.89 1llw n PRO 1415Cb 0.00 -1.94 -0.08 0.00 -0.02 0.00 0.00 33.50 31.45 1llw n PRO 1415CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1llw s VAL 1416N -2.35 0.00 0.57 -1.45 1.01 -1.24 -1.45 120.40 115.49 1llw s VAL 1416Ca 0.62 -0.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.50 1llw s VAL 1416Cb -0.19 -0.85 0.15 0.00 0.00 0.00 0.00 36.38 35.49 1llw s VAL 1416CO 0.65 -0.00 0.38 0.61 0.00 0.00 0.00 175.10 176.74 1llw n GLY 1417N 2.73 -3.47 0.00 4.51 0.00 -1.10 -4.83 105.19 103.04 1llw n GLY 1417Ca -0.14 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1llw n GLY 1417CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1llw n ARG 1418N -3.35 -0.17 -3.69 1.61 1.85 -1.26 -4.45 116.66 107.21 1llw n ARG 1418Ca 0.06 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.63 1llw n ARG 1418Cb 0.24 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.66 1llw n ARG 1418CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1llw n ASN 1419N -2.85 -4.38 -0.61 2.89 4.05 -0.51 -1.68 115.26 112.18 1llw n ASN 1419Ca 0.00 -0.63 0.00 0.00 0.45 0.00 0.00 54.58 54.40 1llw n ASN 1419Cb 0.00 -3.55 0.00 0.00 1.23 0.00 0.00 39.78 37.46 1llw n ASN 1419CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1llw n VAL 1420N -4.38 0.16 -1.89 3.44 0.31 -1.25 -3.12 118.33 111.60 1llw n VAL 1420Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1llw n VAL 1420Cb 0.53 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.97 1llw n VAL 1420CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1llw n GLY 1421N 0.22 0.56 3.21 2.92 0.00 -1.25 -4.50 105.19 106.36 1llw n GLY 1421Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.46 1llw n GLY 1421CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1llw n ALA 1422N 0.00 -2.58 -2.81 4.61 0.00 -1.18 -0.80 120.51 117.75 1llw n ALA 1422Ca 0.00 0.51 -0.07 0.00 0.00 0.00 0.00 53.44 53.88 1llw n ALA 1422Cb 0.50 -1.63 -0.01 0.00 0.00 0.00 0.00 19.45 18.31 1llw n ALA 1422CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1llw n GLY 1423N 2.13 -0.48 3.61 0.00 0.00 -1.26 -3.99 105.19 105.19 1llw n GLY 1423Ca 0.21 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1llw n GLY 1423CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1llw s MET 1424N -5.34 3.87 -0.00 1.61 0.00 0.02 -3.79 119.30 115.68 1llw s MET 1424Ca 0.13 0.60 0.15 0.00 0.00 0.00 0.00 55.69 56.57 1llw s MET 1424Cb -0.07 -3.79 -0.17 0.00 0.00 0.00 0.00 34.83 30.80 1llw s MET 1424CO 0.16 -0.89 0.63 2.41 0.00 0.00 0.00 175.02 177.33 1llw n THR 1425N 5.88 0.00 -3.71 10.11 -1.04 0.17 -4.60 114.28 121.08 1llw n THR 1425Ca 0.07 -0.15 -0.07 0.00 -2.04 0.00 0.00 64.05 61.86 1llw n THR 1425Cb 0.48 0.97 -0.02 0.00 -1.82 0.00 0.00 70.33 69.94 1llw n THR 1425CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1llw s GLY 1426N -2.48 -0.26 0.00 3.41 0.00 -1.20 -4.79 107.32 102.00 1llw s GLY 1426Ca 0.05 0.10 0.00 0.00 0.00 0.00 0.00 44.72 44.87 1llw s GLY 1426CO 0.62 0.03 0.00 0.61 0.00 0.00 0.00 173.10 174.36 1llw n GLY 1427N -0.43 -0.23 3.85 0.20 0.00 -1.26 -2.45 105.19 104.87 1llw n GLY 1427Ca -0.07 -1.63 -0.36 0.00 0.00 0.00 0.00 46.02 43.96 1llw n GLY 1427CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1llw s LEU 1428N -1.85 4.24 -0.08 0.99 1.43 -0.76 -4.51 118.68 118.14 1llw s LEU 1428Ca 0.00 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 1llw s LEU 1428Cb 0.00 -2.17 0.02 0.00 0.03 0.00 0.00 46.19 44.07 1llw s LEU 1428CO 0.00 0.36 -0.07 0.00 0.23 0.00 0.00 176.35 176.88 1llw s ALA 1429N -1.09 1.04 -0.20 4.21 0.00 -1.20 -1.10 121.76 123.42 1llw s ALA 1429Ca 0.18 -0.32 -0.04 0.00 0.00 0.00 0.00 51.96 51.77 1llw s ALA 1429Cb -0.12 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 1llw s ALA 1429CO 0.08 -0.20 -0.02 0.71 0.00 0.00 0.00 175.76 176.32 1llw s TYR 1430N 1.32 3.00 0.04 0.00 1.51 -0.11 -0.11 117.35 123.00 1llw s TYR 1430Ca -0.03 -0.59 0.00 0.00 -1.01 0.00 0.00 57.07 55.44 1llw s TYR 1430Cb -0.14 -2.07 0.01 0.00 -0.11 0.00 0.00 41.96 39.65 1llw s TYR 1430CO -0.03 -0.31 0.05 1.19 -1.11 0.00 0.00 175.55 175.34 1llw n PHE 1431N 4.33 -3.25 -3.24 2.71 3.01 -1.04 -1.39 117.46 118.58 1llw n PHE 1431Ca -0.17 -0.10 -0.04 0.00 1.01 0.00 0.00 57.45 58.15 1llw n PHE 1431Cb 0.52 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.92 1llw n PHE 1431CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1llw s LEU 1432N 0.00 -1.12 -0.33 4.37 2.96 -1.07 -4.45 118.68 119.05 1llw s LEU 1432Ca 0.03 -0.62 0.04 0.00 -0.22 0.00 0.00 54.13 53.36 1llw s LEU 1432Cb -0.00 1.53 0.10 0.00 0.50 0.00 0.00 46.19 48.31 1llw s LEU 1432CO 0.02 -0.26 0.03 -1.81 -1.32 0.00 0.00 176.35 173.02 1llw s ASP 1433N 2.15 4.73 0.12 3.68 1.11 -1.26 -3.83 116.67 123.37 1llw s ASP 1433Ca 0.13 -2.07 0.08 0.00 0.18 0.00 0.00 52.55 50.87 1llw s ASP 1433Cb -0.09 -1.61 -0.19 0.00 1.07 0.00 0.00 42.92 42.09 1llw s ASP 1433CO -0.16 -0.36 1.25 -0.33 1.18 0.00 0.00 175.17 176.76 1llw h GLU 1434N 7.63 0.00 0.00 8.23 5.08 -1.95 -2.87 114.58 130.70 1llw h GLU 1434Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1llw h GLU 1434Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1llw h GLU 1434CO 0.51 0.93 0.04 0.28 -1.00 0.00 0.00 179.01 179.77 1llw h VAL 1435N 0.00 0.00 0.00 3.13 2.07 -1.97 -3.46 116.25 116.03 1llw h VAL 1435Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1llw h VAL 1435Cb 1.75 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1llw h VAL 1435CO 0.12 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.32 1llw n GLY 1436N -1.23 2.95 0.12 2.17 0.00 -1.09 -4.88 105.19 103.25 1llw n GLY 1436Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.13 1llw n GLY 1436CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1llw h ASP 1437N 0.00 0.00 -0.84 1.61 2.03 -1.89 -3.41 116.42 113.93 1llw h ASP 1437Ca 0.00 0.00 0.20 0.00 -0.73 0.00 0.00 57.03 56.50 1llw h ASP 1437Cb 0.00 0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 38.34 1llw h ASP 1437CO 0.00 0.00 -0.10 -0.11 -1.03 0.00 0.00 179.24 178.00 1llw n LEU 1438N -2.36 -0.20 0.08 0.15 7.94 -1.26 0.65 117.00 122.00 1llw n LEU 1438Ca 0.05 1.44 0.20 0.00 -1.11 0.00 0.00 56.01 56.59 1llw n LEU 1438Cb 0.43 -0.48 0.75 0.00 0.53 0.00 0.00 43.42 44.65 1llw n LEU 1438CO 0.30 -1.41 1.18 -0.65 -1.11 0.00 0.00 177.39 175.70 1llw h PRO 1439N 0.00 0.00 0.00 1.96 0.11 -1.97 0.36 132.00 132.46 1llw h PRO 1439Ca 0.46 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.49 1llw h PRO 1439Cb 0.83 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 1llw h PRO 1439CO -0.83 0.00 -0.38 1.49 -0.21 0.00 0.00 178.00 178.07 1llw h GLU 1440N 0.00 0.00 0.00 1.05 4.81 -0.12 -3.37 114.58 116.94 1llw h GLU 1440Ca 0.20 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.32 1llw h GLU 1440Cb 1.04 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 1llw h GLU 1440CO -0.00 0.38 -0.75 0.87 -0.73 0.00 0.00 179.01 178.78 1llw h LYS 1441N 0.00 0.00 -2.25 1.92 1.57 -0.40 -3.47 116.57 113.94 1llw h LYS 1441Ca -0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 1llw h LYS 1441Cb 0.85 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.20 1llw h LYS 1441CO 0.05 0.63 -0.15 -0.89 -0.57 0.00 0.00 179.45 178.52 1llw n ILE 1442N -4.54 0.58 -2.80 1.86 5.41 -0.74 -1.43 119.36 117.70 1llw n ILE 1442Ca -0.19 -0.15 -0.43 0.00 1.00 0.00 0.00 62.75 62.99 1llw n ILE 1442Cb 0.47 0.00 -0.04 0.00 -0.71 0.00 0.00 39.64 39.37 1llw n ILE 1442CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1llw s ASN 1443N -0.29 6.69 0.00 4.38 3.84 -1.26 -4.59 114.94 123.71 1llw s ASN 1443Ca 0.26 0.61 0.28 0.00 0.21 0.00 0.00 52.86 54.23 1llw s ASN 1443Cb -0.38 -2.47 1.15 0.00 -0.55 0.00 0.00 41.25 39.01 1llw s ASN 1443CO 0.21 -0.85 1.81 -0.81 -2.79 0.00 0.00 177.10 174.67 1llw n PRO 1444N 6.76 0.81 -0.06 0.43 -0.04 -1.26 -4.09 135.00 137.54 1llw n PRO 1444Ca 0.07 -0.33 0.03 0.00 -0.04 0.00 0.00 63.50 63.24 1llw n PRO 1444Cb 0.48 -1.49 0.38 0.00 -0.04 0.00 0.00 33.50 32.83 1llw n PRO 1444CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1llw h GLU 1445N 0.80 0.65 0.00 0.54 5.08 -1.95 -3.38 114.58 116.32 1llw h GLU 1445Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1llw h GLU 1445Cb 0.38 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1llw h GLU 1445CO 0.00 0.43 -0.29 0.44 -1.00 0.00 0.00 179.01 178.59 1llw n ILE 1446N -4.46 0.00 -3.09 3.13 -5.35 -1.26 -5.08 119.36 103.25 1llw n ILE 1446Ca 0.05 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.21 1llw n ILE 1446Cb 0.06 -0.20 -0.05 0.00 -1.74 0.00 0.00 39.64 37.71 1llw n ILE 1446CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 1llw s ILE 1447N -1.14 4.72 0.01 7.28 2.07 -1.26 -4.25 121.20 128.64 1llw s ILE 1447Ca 0.00 0.83 0.09 0.00 -1.41 0.00 0.00 60.65 60.16 1llw s ILE 1447Cb 0.00 -3.64 -0.02 0.00 0.13 0.00 0.00 42.46 38.93 1llw s ILE 1447CO 0.00 -0.26 -0.26 0.28 -1.91 0.00 0.00 174.94 172.79 1llw s THR 1448N -2.07 2.09 -0.48 4.00 -1.32 0.10 -4.72 115.64 113.24 1llw s THR 1448Ca 0.53 -1.25 -0.18 0.00 -1.21 0.00 0.00 61.69 59.59 1llw s THR 1448Cb -0.10 -1.76 0.06 0.00 -1.51 0.00 0.00 72.50 69.19 1llw s THR 1448CO 0.21 0.47 0.51 -0.22 -2.21 0.00 0.00 174.62 173.38 1llw s LEU 1449N -0.92 5.17 0.46 9.08 2.96 -1.26 -1.28 118.68 132.88 1llw s LEU 1449Ca 0.11 -1.01 0.08 0.00 -0.22 0.00 0.00 54.13 53.08 1llw s LEU 1449Cb -0.10 -2.35 0.00 0.00 0.50 0.00 0.00 46.19 44.25 1llw s LEU 1449CO 0.01 -0.75 0.45 -1.10 -1.32 0.00 0.00 176.35 173.63 1llw s GLN 1450N 2.20 2.50 -0.09 1.98 -0.21 -0.47 -4.91 119.66 120.66 1llw s GLN 1450Ca 0.11 -1.59 -0.03 0.00 0.02 0.00 0.00 55.36 53.87 1llw s GLN 1450Cb -0.21 -2.41 -0.03 0.00 1.00 0.00 0.00 33.01 31.36 1llw s GLN 1450CO 0.10 -0.35 0.03 1.03 -2.12 0.00 0.00 175.29 173.98 1llw s ARG 1451N -4.24 3.06 0.03 2.91 0.52 -1.26 -0.96 118.95 119.01 1llw s ARG 1451Ca 0.48 -0.37 -0.36 0.00 -0.52 0.00 0.00 55.73 54.96 1llw s ARG 1451Cb -0.04 -2.86 -0.15 0.00 0.52 0.00 0.00 34.95 32.42 1llw s ARG 1451CO 0.29 0.71 1.51 -0.89 0.02 0.00 0.00 175.30 176.94 1llw n ILE 1452N 2.07 0.10 0.00 1.52 2.08 -1.26 -4.73 119.36 119.14 1llw n ILE 1452Ca -0.19 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.11 1llw n ILE 1452Cb 0.54 -1.16 0.00 0.00 -0.75 0.00 0.00 39.64 38.27 1llw n ILE 1452CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1llw n THR 1453N 3.30 0.00 -2.10 1.39 -1.04 -1.26 -5.03 114.28 109.55 1llw n THR 1453Ca 0.20 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.79 1llw n THR 1453Cb 0.22 -0.05 -0.03 0.00 -1.82 0.00 0.00 70.33 68.65 1llw n THR 1453CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1llw s ALA 1454N -1.09 3.63 -1.00 2.41 0.00 -1.26 -4.83 121.76 119.62 1llw s ALA 1454Ca 0.00 1.10 0.17 0.00 0.00 0.00 0.00 51.96 53.22 1llw s ALA 1454Cb 0.00 -3.61 0.71 0.00 0.00 0.00 0.00 23.12 20.23 1llw s ALA 1454CO 0.00 -0.85 1.54 -1.13 0.00 0.00 0.00 175.76 175.31 1llw n SER 1455N 4.82 0.00 0.03 0.00 3.41 -1.22 -1.83 113.62 118.83 1llw n SER 1455Ca 0.13 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.36 1llw n SER 1455Cb 0.42 -0.50 0.23 0.00 -0.26 0.00 0.00 64.21 64.10 1llw n SER 1455CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1llw n LYS 1456N -1.50 0.15 -0.01 4.33 4.81 -1.26 -2.73 118.16 121.95 1llw n LYS 1456Ca 0.04 0.04 -0.09 0.00 -0.87 0.00 0.00 58.31 57.43 1llw n LYS 1456Cb 0.20 -1.60 -0.07 0.00 0.02 0.00 0.00 35.03 33.58 1llw n LYS 1456CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 1llw h GLY 1457N 4.74 -0.10 -0.56 3.14 0.00 -1.51 -2.19 103.07 106.58 1llw h GLY 1457Ca 0.00 0.04 0.23 0.00 0.00 0.00 0.00 47.33 47.60 1llw h GLY 1457CO 0.00 -0.04 0.12 -2.09 0.00 0.00 0.00 176.54 174.53 1llw h GLU 1458N -0.94 0.12 0.00 4.80 4.81 -1.65 0.48 114.58 122.21 1llw h GLU 1458Ca -0.01 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1llw h GLU 1458Cb 0.54 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 1llw h GLU 1458CO 0.02 0.08 -0.08 0.93 -0.73 0.00 0.00 179.01 179.23 1llw h GLU 1459N 0.12 0.00 0.05 1.92 4.39 -1.45 -0.58 114.58 119.04 1llw h GLU 1459Ca 0.53 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.14 1llw h GLU 1459Cb 1.05 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.71 1llw h GLU 1459CO -0.73 0.08 -0.37 0.37 -1.16 0.00 0.00 179.01 177.20 1llw h GLN 1460N 0.00 0.17 -0.31 2.33 4.15 0.50 -3.14 115.11 118.80 1llw h GLN 1460Ca -0.00 -0.24 -0.10 0.00 0.77 0.00 0.00 58.65 59.07 1llw h GLN 1460Cb 0.21 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 1llw h GLN 1460CO 0.01 1.07 -0.23 1.25 -1.93 0.00 0.00 178.83 179.00 1llw h LEU 1461N -0.62 0.60 -0.31 -2.39 5.85 -0.44 -2.96 115.31 115.04 1llw h LEU 1461Ca -0.06 -0.20 -0.19 0.00 0.84 0.00 0.00 57.88 58.27 1llw h LEU 1461Cb 1.24 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.11 1llw h LEU 1461CO 0.07 0.82 -0.59 0.50 -0.34 0.00 0.00 178.44 178.90 1llw h LYS 1462N 0.53 0.82 -0.02 1.25 3.64 -1.28 0.79 116.57 122.29 1llw h LYS 1462Ca 0.08 -0.54 0.03 0.00 -1.27 0.00 0.00 60.65 58.94 1llw h LYS 1462Cb 0.68 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 1llw h LYS 1462CO 0.05 1.17 -0.14 0.66 -2.27 0.00 0.00 179.45 178.92 1llw h SER 1463N 0.62 -0.42 -0.09 4.20 4.64 -1.49 0.41 113.55 121.41 1llw h SER 1463Ca 0.00 0.07 -0.19 0.00 -0.47 0.00 0.00 61.79 61.20 1llw h SER 1463Cb 1.19 0.18 0.01 0.00 -0.31 0.00 0.00 62.40 63.48 1llw h SER 1463CO 0.13 -0.20 -0.68 -0.07 -0.87 0.00 0.00 176.83 175.14 1llw h LEU 1464N -0.23 0.76 -1.95 5.97 4.07 -1.53 0.73 115.31 123.13 1llw h LEU 1464Ca 0.06 -0.66 -0.01 0.00 0.08 0.00 0.00 57.88 57.34 1llw h LEU 1464Cb 0.30 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 41.81 1llw h LEU 1464CO -0.16 1.31 -0.06 0.40 -1.08 0.00 0.00 178.44 178.85 1llw h ILE 1465N 0.27 0.95 0.28 1.22 2.04 0.75 -1.63 117.51 121.38 1llw h ILE 1465Ca -0.06 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 1llw h ILE 1465Cb 1.33 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1llw h ILE 1465CO 0.14 0.06 -0.13 0.74 0.00 0.00 0.00 178.15 178.96 1llw h THR 1466N 0.00 0.54 -1.00 -0.27 2.02 0.00 -3.25 112.91 110.95 1llw h THR 1466Ca -0.00 -0.85 0.21 0.00 0.77 0.00 0.00 66.41 66.54 1llw h THR 1466Cb 0.12 0.88 -0.11 0.00 -1.74 0.00 0.00 68.15 67.30 1llw h THR 1466CO 0.01 0.13 0.61 0.00 0.37 0.00 0.00 175.52 176.64 1llw h ALA 1467N -0.57 1.80 -0.44 6.16 0.00 0.13 0.51 119.26 126.85 1llw h ALA 1467Ca -0.04 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1llw h ALA 1467Cb 0.50 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1llw h ALA 1467CO 0.06 -0.20 0.20 1.25 0.00 0.00 0.00 179.25 180.56 1llw h HIS 1468N 0.66 0.35 -0.04 0.00 6.17 -1.46 -0.48 115.15 120.35 1llw h HIS 1468Ca 0.59 0.02 -0.12 0.00 0.71 0.00 0.00 60.37 61.57 1llw h HIS 1468Cb 1.07 -0.09 -0.01 0.00 2.52 0.00 0.00 27.41 30.89 1llw h HIS 1468CO -0.00 0.16 -0.53 0.28 0.71 0.00 0.00 177.93 178.55 1llw h VAL 1469N 0.39 1.37 -0.65 5.26 2.07 -0.08 0.36 116.25 124.98 1llw h VAL 1469Ca 0.20 -1.83 -0.08 0.00 0.82 0.00 0.00 66.70 65.81 1llw h VAL 1469Cb 0.14 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.83 1llw h VAL 1469CO -0.16 0.53 0.07 -0.33 0.02 0.00 0.00 177.57 177.70 1llw h GLU 1470N 0.08 1.09 0.00 1.57 4.39 -0.16 -2.34 114.58 119.21 1llw h GLU 1470Ca -0.00 -0.30 -0.04 0.00 0.34 0.00 0.00 59.36 59.36 1llw h GLU 1470Cb 0.97 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.49 1llw h GLU 1470CO 0.07 1.01 -1.00 0.45 -1.16 0.00 0.00 179.01 178.38 1llw h HIS 1471N 1.01 0.00 0.00 4.33 3.86 -0.67 -3.42 115.15 120.26 1llw h HIS 1471Ca 0.19 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.32 1llw h HIS 1471Cb 0.47 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1llw h HIS 1471CO 0.03 0.13 -0.96 2.41 0.86 0.00 0.00 177.93 180.40 1llw n THR 1472N -2.76 1.04 -0.12 2.45 -1.04 0.08 -4.97 114.28 108.95 1llw n THR 1472Ca -0.02 0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1llw n THR 1472Cb 0.61 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 1llw n THR 1472CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1llw n GLY 1473N 2.48 0.77 1.60 3.41 0.00 -0.88 -5.05 105.19 107.53 1llw n GLY 1473Ca -0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 1llw n GLY 1473CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1llw n SER 1474N 0.00 0.15 0.08 1.61 2.88 -1.26 -4.78 113.62 112.30 1llw n SER 1474Ca 0.00 0.53 -0.09 0.00 -1.33 0.00 0.00 58.87 57.98 1llw n SER 1474Cb 0.00 -0.41 0.01 0.00 -0.75 0.00 0.00 64.21 63.06 1llw n SER 1474CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1llw h PRO 1475N 1.59 0.23 0.00 -1.46 0.11 -1.99 -0.18 132.00 130.30 1llw h PRO 1475Ca -0.22 -0.23 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1llw h PRO 1475Cb 0.64 0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1llw h PRO 1475CO 0.33 0.94 -0.34 -0.22 -0.21 0.00 0.00 178.00 178.50 1llw h LYS 1476N 0.13 0.00 0.13 1.05 3.64 -1.96 -3.25 116.57 116.32 1llw h LYS 1476Ca -0.04 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1llw h LYS 1476Cb 1.46 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.28 1llw h LYS 1476CO 0.13 0.00 -0.06 0.78 -2.27 0.00 0.00 179.45 178.03 1llw h GLY 1477N 4.09 -0.19 0.93 5.01 0.00 -1.90 -2.88 103.07 108.12 1llw h GLY 1477Ca 0.00 0.07 0.03 0.00 0.00 0.00 0.00 47.33 47.43 1llw h GLY 1477CO 0.00 -0.07 0.62 0.50 0.00 0.00 0.00 176.54 177.59 1llw h LYS 1478N -0.77 1.19 -0.03 4.80 1.57 -1.19 -2.61 116.57 119.52 1llw h LYS 1478Ca -0.02 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1llw h LYS 1478Cb 0.54 -0.27 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1llw h LYS 1478CO 0.03 0.78 -0.35 0.00 -0.57 0.00 0.00 179.45 179.35 1llw h ALA 1479N 1.37 -0.77 -0.93 3.86 0.00 -1.64 -2.52 119.26 118.63 1llw h ALA 1479Ca 0.36 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.40 1llw h ALA 1479Cb -0.05 0.82 -0.10 0.00 0.00 0.00 0.00 17.79 18.45 1llw h ALA 1479CO -0.10 -0.88 0.52 0.82 0.00 0.00 0.00 179.25 179.61 1llw h ILE 1480N -0.41 0.68 0.36 0.00 2.04 -1.31 -2.68 117.51 116.20 1llw h ILE 1480Ca 0.01 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1llw h ILE 1480Cb 0.45 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1llw h ILE 1480CO -0.25 0.12 -0.19 -0.07 0.00 0.00 0.00 178.15 177.76 1llw h LEU 1481N 0.67 -0.47 -0.87 1.44 3.38 -1.07 0.24 115.31 118.63 1llw h LEU 1481Ca 0.54 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.53 1llw h LEU 1481Cb 0.83 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1llw h LEU 1481CO -0.39 -0.32 0.00 0.00 0.09 0.00 0.00 178.44 177.81 1llw n ALA 1482N -2.35 2.53 -1.32 1.53 0.00 -1.14 -2.87 120.51 116.89 1llw n ALA 1482Ca -0.10 -0.43 0.08 0.00 0.00 0.00 0.00 53.44 52.98 1llw n ALA 1482Cb 0.23 -1.11 0.12 0.00 0.00 0.00 0.00 19.45 18.69 1llw n ALA 1482CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1llw n ASN 1483N 0.09 1.85 -0.28 0.00 3.02 -1.02 -4.91 115.26 114.01 1llw n ASN 1483Ca 0.15 -2.97 0.18 0.00 -0.03 0.00 0.00 54.58 51.91 1llw n ASN 1483Cb 0.26 -0.40 0.34 0.00 -0.61 0.00 0.00 39.78 39.37 1llw n ASN 1483CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 1llw n TRP 1484N -1.11 0.70 0.28 3.10 -0.00 0.84 -0.69 117.44 120.56 1llw n TRP 1484Ca 0.13 1.01 0.14 0.00 -0.00 0.00 0.00 57.50 58.78 1llw n TRP 1484Cb 0.67 -1.23 0.82 0.00 -0.00 0.00 0.00 31.31 31.56 1llw n TRP 1484CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 177.69 178.46 1llw h SER 1485N 0.00 0.00 0.00 5.87 0.02 -1.88 -3.21 113.55 114.35 1llw h SER 1485Ca 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 1llw h SER 1485Cb 1.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1llw h SER 1485CO -0.74 0.06 -0.21 0.47 -1.14 0.00 0.00 176.83 175.27 1llw n ASP 1486N -3.77 0.57 -0.30 3.07 8.00 0.13 -4.59 116.55 119.67 1llw n ASP 1486Ca -0.02 0.27 0.12 0.00 0.71 0.00 0.00 54.79 55.87 1llw n ASP 1486Cb 0.16 -0.60 0.35 0.00 -0.02 0.00 0.00 41.12 41.00 1llw n ASP 1486CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1llw h TYR 1487N -0.31 0.91 -1.21 1.24 -1.99 -1.70 -2.78 116.97 111.14 1llw h TYR 1487Ca 0.00 0.03 0.43 0.00 2.00 0.00 0.00 58.73 61.19 1llw h TYR 1487Cb 0.21 -0.29 -0.14 0.00 2.00 0.00 0.00 36.73 38.52 1llw h TYR 1487CO -0.09 0.32 0.75 -0.11 -0.00 0.00 0.00 178.16 179.03 1llw n LEU 1488N -4.60 0.23 0.00 3.88 0.00 -1.21 -4.27 117.00 111.02 1llw n LEU 1488Ca 0.19 1.35 0.00 0.00 0.00 0.00 0.00 56.01 57.55 1llw n LEU 1488Cb 0.47 -0.66 0.00 0.00 0.00 0.00 0.00 43.42 43.23 1llw n LEU 1488CO 0.28 -1.48 0.00 0.61 0.00 0.00 0.00 177.39 176.80 1llw n GLY 1489N -1.43 -1.19 3.51 -3.96 0.00 -1.05 -4.67 105.19 96.40 1llw n GLY 1489Ca 0.37 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.97 1llw n GLY 1489CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1llw n LYS 1490N 0.00 0.09 0.00 1.61 5.02 -1.26 -4.58 118.16 119.04 1llw n LYS 1490Ca 0.00 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1llw n LYS 1490Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 1llw n LYS 1490CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1llw n PHE 1491N 8.53 0.00 -1.83 2.13 -0.00 -1.26 -4.57 117.46 120.45 1llw n PHE 1491Ca 0.64 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.79 1llw n PHE 1491Cb 0.15 0.00 0.07 0.00 -0.00 0.00 0.00 39.48 39.70 1llw n PHE 1491CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.76 175.18 1llw s TRP 1492N 0.00 3.14 -0.05 -5.13 0.52 -1.26 -4.33 118.94 111.83 1llw s TRP 1492Ca 0.00 0.98 0.02 0.00 0.02 0.00 0.00 56.10 57.12 1llw s TRP 1492Cb 0.00 -3.19 0.01 0.00 -1.15 0.00 0.00 33.47 29.14 1llw s TRP 1492CO 0.00 -1.44 -0.10 -1.14 0.02 0.00 0.00 176.95 174.29 1llw s GLN 1493N -5.38 1.32 -0.42 4.98 0.74 -0.14 -2.50 119.66 118.27 1llw s GLN 1493Ca 0.60 -0.33 -0.21 0.00 0.05 0.00 0.00 55.36 55.47 1llw s GLN 1493Cb -0.12 -1.16 0.02 0.00 1.10 0.00 0.00 33.01 32.85 1llw s GLN 1493CO 0.51 0.03 0.64 0.00 -0.55 0.00 0.00 175.29 175.93 1llw s ALA 1494N 0.58 3.37 -0.17 1.58 0.00 0.85 -1.37 121.76 126.60 1llw s ALA 1494Ca -0.11 -1.11 -0.01 0.00 0.00 0.00 0.00 51.96 50.74 1llw s ALA 1494Cb -0.14 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.71 1llw s ALA 1494CO 0.02 -1.67 -0.13 0.08 0.00 0.00 0.00 175.76 174.06 1llw s VAL 1495N 2.80 2.83 0.26 0.00 1.01 -0.40 -3.27 120.40 123.63 1llw s VAL 1495Ca 0.23 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 61.22 1llw s VAL 1495Cb -0.14 -2.21 -0.09 0.00 0.00 0.00 0.00 36.38 33.93 1llw s VAL 1495CO 0.18 0.50 0.93 -2.16 0.00 0.00 0.00 175.10 174.55 1llw s PRO 1496N 0.90 4.74 -0.63 2.72 0.04 -1.26 0.01 135.00 141.51 1llw s PRO 1496Ca -0.03 1.40 -0.27 0.00 0.04 0.00 0.00 61.00 62.15 1llw s PRO 1496Cb -0.15 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.26 1llw s PRO 1496CO -0.01 0.45 1.76 -1.25 0.04 0.00 0.00 177.00 177.99 1llw s PRO 1497N -1.47 2.72 0.00 0.56 0.04 -1.26 0.73 135.00 136.32 1llw s PRO 1497Ca 0.44 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.94 1llw s PRO 1497Cb -0.23 -4.35 0.00 0.00 0.04 0.00 0.00 34.50 29.95 1llw s PRO 1497CO 0.29 -2.64 0.00 0.45 0.04 0.00 0.00 177.00 175.14 1llw n SER 1498N 12.18 0.00 0.00 6.66 2.88 -1.26 -4.84 113.62 129.24 1llw n SER 1498Ca 0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 1llw n SER 1498Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1llw n SER 1498CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1llw n GLU 1499N 0.00 -0.07 -0.26 -1.46 -0.58 0.23 -4.81 120.64 113.69 1llw n GLU 1499Ca 0.00 -0.05 0.06 0.00 -0.42 0.00 0.00 57.16 56.74 1llw n GLU 1499Cb 0.00 -0.53 0.12 0.00 -0.57 0.00 0.00 31.44 30.46 1llw n GLU 1499CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1llw n LYS 1500N -0.01 -0.06 -2.26 3.49 5.02 -1.16 -2.40 118.16 120.77 1llw n LYS 1500Ca 0.00 1.12 -0.34 0.00 -2.02 0.00 0.00 58.31 57.07 1llw n LYS 1500Cb 0.21 -1.69 0.02 0.00 -0.02 0.00 0.00 35.03 33.54 1llw n LYS 1500CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1llw n ASP 1501N -5.14 6.12 -4.56 4.39 8.00 -1.26 -4.34 116.55 119.75 1llw n ASP 1501Ca 0.13 -3.77 -0.24 0.00 0.71 0.00 0.00 54.79 51.61 1llw n ASP 1501Cb 0.40 -0.78 -0.09 0.00 -0.02 0.00 0.00 41.12 40.63 1llw n ASP 1501CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1llw s SER 1502N -2.30 3.96 0.00 -2.24 1.04 -1.01 -4.99 113.70 108.16 1llw s SER 1502Ca 0.49 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.94 1llw s SER 1502Cb 0.40 -0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.04 1llw s SER 1502CO -0.29 -0.09 1.01 -2.65 0.98 0.00 0.00 173.24 172.20 1llw n PRO 1503N -0.80 0.54 0.00 4.02 -0.02 -1.26 -2.60 135.00 134.88 1llw n PRO 1503Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1llw n PRO 1503Cb 0.61 -1.23 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 1llw n PRO 1503CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1llw n GLU 1504N 1.61 0.10 0.00 -0.52 0.00 -1.26 -4.33 120.64 116.23 1llw n GLU 1504Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.21 1llw n GLU 1504Cb 0.27 -0.01 0.04 0.00 0.00 0.00 0.00 31.44 31.74 1llw n GLU 1504CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1llw n ALA 1505N 0.00 2.53 -3.71 -1.84 0.00 -1.07 -4.07 120.51 112.34 1llw n ALA 1505Ca 0.00 -0.56 -0.12 0.00 0.00 0.00 0.00 53.44 52.76 1llw n ALA 1505Cb 0.00 -0.35 -0.12 0.00 0.00 0.00 0.00 19.45 18.98 1llw n ALA 1505CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1llw s ASN 1506N -0.92 -0.33 0.00 0.00 -0.87 -1.10 -4.71 114.94 107.01 1llw s ASN 1506Ca 0.11 0.67 0.00 0.00 -1.57 0.00 0.00 52.86 52.07 1llw s ASN 1506Cb 0.08 0.57 0.00 0.00 -0.02 0.00 0.00 41.25 41.88 1llw s ASN 1506CO 0.14 -0.18 0.00 0.59 -2.57 0.00 0.00 177.10 175.08