#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4s h GLN 2 N 0.00 0.40 -0.87 0.00 -0.00 -2.05 -0.96 115.11 111.63 1a4s h GLN 2 Ca 0.00 -0.33 -0.02 0.00 -0.00 0.00 0.00 58.65 58.30 1a4s h GLN 2 Cb 0.00 0.07 -0.04 0.00 -0.00 0.00 0.00 27.48 27.51 1a4s h GLN 2 CO 0.00 0.97 0.48 1.25 -0.00 0.00 0.00 178.83 181.53 1a4s h LEU 3 N 0.27 1.09 -0.48 0.06 5.85 -2.00 -1.53 115.31 118.57 1a4s h LEU 3 Ca -0.03 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 1a4s h LEU 3 Cb 1.30 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1a4s h LEU 3 CO 0.13 0.87 -0.08 0.58 -0.34 0.00 0.00 178.44 179.59 1a4s h VAL 4 N 1.22 1.27 0.00 1.05 2.07 -1.88 -2.73 116.25 117.25 1a4s h VAL 4 Ca 0.31 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1a4s h VAL 4 Cb 0.02 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1a4s h VAL 4 CO -0.05 0.42 0.00 0.44 0.02 0.00 0.00 177.57 178.39 1a4s h ASP 5 N 0.75 0.00 -0.18 0.57 3.32 -0.63 -2.39 116.42 117.86 1a4s h ASP 5 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1a4s h ASP 5 Cb 0.63 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1a4s h ASP 5 CO 0.04 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.02 1a4s n SER 6 N -3.04 1.45 -0.01 6.45 3.41 -0.63 -4.32 113.62 116.94 1a4s n SER 6 Ca -0.00 -1.74 -0.04 0.00 -0.26 0.00 0.00 58.87 56.83 1a4s n SER 6 Cb 0.25 -0.11 0.18 0.00 -0.26 0.00 0.00 64.21 64.26 1a4s n SER 6 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1a4s h MET 7 N 1.85 0.54 -0.24 4.33 2.86 -1.41 -2.97 114.93 119.89 1a4s h MET 7 Ca 0.00 -0.21 0.07 0.00 -2.06 0.00 0.00 59.70 57.50 1a4s h MET 7 Cb 0.41 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1a4s h MET 7 CO 0.00 0.75 0.18 -1.35 1.06 0.00 0.00 176.91 177.55 1a4s h PRO 8 N 0.48 0.00 -0.65 -0.22 0.11 -1.83 0.17 132.00 130.06 1a4s h PRO 8 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1a4s h PRO 8 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1a4s h PRO 8 CO 0.05 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.71 1a4s n SER 9 N -4.33 4.03 -4.95 -2.05 3.41 -1.12 -5.00 113.62 103.60 1a4s n SER 9 Ca 0.03 -2.14 -0.23 0.00 -0.26 0.00 0.00 58.87 56.27 1a4s n SER 9 Cb 0.33 -0.48 0.02 0.00 -0.26 0.00 0.00 64.21 63.82 1a4s n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a4s s ALA 10 N -1.26 3.74 0.25 7.33 0.00 0.05 -5.11 121.76 126.76 1a4s s ALA 10 Ca 0.46 -1.09 -0.22 0.00 0.00 0.00 0.00 51.96 51.12 1a4s s ALA 10 Cb 0.26 -2.17 0.03 0.00 0.00 0.00 0.00 23.12 21.24 1a4s s ALA 10 CO 0.28 -0.50 0.72 -1.54 0.00 0.00 0.00 175.76 174.71 1a4s s SER 11 N -4.27 -0.30 0.33 0.00 1.04 -1.26 -5.04 113.70 104.19 1a4s s SER 11 Ca 0.51 -0.51 -0.29 0.00 0.48 0.00 0.00 55.95 56.14 1a4s s SER 11 Cb -0.10 0.70 -0.12 0.00 0.10 0.00 0.00 66.02 66.60 1a4s s SER 11 CO 0.39 -1.27 1.45 0.41 0.98 0.00 0.00 173.24 175.20 1a4s n THR 12 N -0.45 1.64 -0.65 2.02 -1.04 -1.26 -1.51 114.28 113.03 1a4s n THR 12 Ca -0.06 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.54 1a4s n THR 12 Cb 0.60 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 1a4s n THR 12 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1a4s n GLY 13 N 1.16 1.59 0.07 3.41 0.00 -1.26 -4.88 105.19 105.29 1a4s n GLY 13 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 1a4s n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4s n SER 14 N 0.00 0.12 -4.81 1.61 3.41 -0.57 -5.00 113.62 108.38 1a4s n SER 14 Ca 0.00 0.05 -0.35 0.00 -0.26 0.00 0.00 58.87 58.31 1a4s n SER 14 Cb 0.00 1.20 -0.06 0.00 -0.26 0.00 0.00 64.21 65.09 1a4s n SER 14 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1a4s s VAL 15 N -2.87 4.42 -0.01 -3.33 1.01 -1.26 -4.99 120.40 113.37 1a4s s VAL 15 Ca -0.08 1.46 0.04 0.00 0.00 0.00 0.00 61.98 63.39 1a4s s VAL 15 Cb 0.09 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1a4s s VAL 15 CO 0.85 -0.00 -0.12 0.54 0.00 0.00 0.00 175.10 176.37 1a4s s VAL 16 N -1.78 0.98 -0.23 2.92 0.11 -1.26 -4.85 120.40 116.28 1a4s s VAL 16 Ca 0.52 -0.54 -0.09 0.00 -2.93 0.00 0.00 61.98 58.93 1a4s s VAL 16 Cb -0.14 -0.82 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 1a4s s VAL 16 CO 0.19 0.27 0.12 -0.69 -3.33 0.00 0.00 175.10 171.66 1a4s s VAL 17 N -0.31 4.95 -0.62 2.04 1.01 0.31 -4.97 120.40 122.81 1a4s s VAL 17 Ca 0.05 0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.12 1a4s s VAL 17 Cb -0.05 -3.29 0.08 0.00 0.00 0.00 0.00 36.38 33.12 1a4s s VAL 17 CO -0.00 0.36 0.83 0.35 0.00 0.00 0.00 175.10 176.64 1a4s n THR 18 N 4.32 0.34 -2.22 3.92 -2.24 -1.26 -4.56 114.28 112.57 1a4s n THR 18 Ca -0.16 -0.67 -0.31 0.00 -2.27 0.00 0.00 64.05 60.64 1a4s n THR 18 Cb 0.52 0.91 -0.02 0.00 -2.10 0.00 0.00 70.33 69.64 1a4s n THR 18 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1a4s s ASP 19 N -0.65 6.45 0.19 3.42 1.01 -1.26 -5.02 116.67 120.81 1a4s s ASP 19 Ca 0.08 1.46 -0.30 0.00 0.71 0.00 0.00 52.55 54.51 1a4s s ASP 19 Cb 0.05 -2.47 -0.08 0.00 1.01 0.00 0.00 42.92 41.43 1a4s s ASP 19 CO 0.07 -0.69 1.12 -1.81 0.21 0.00 0.00 175.17 174.08 1a4s s ASP 20 N -3.55 7.22 0.00 0.27 1.01 -1.26 -4.95 116.67 115.41 1a4s s ASP 20 Ca 0.57 2.14 0.21 0.00 0.71 0.00 0.00 52.55 56.18 1a4s s ASP 20 Cb -0.10 -2.61 0.08 0.00 1.01 0.00 0.00 42.92 41.30 1a4s s ASP 20 CO 0.41 -0.25 1.11 0.18 0.21 0.00 0.00 175.17 176.82 1a4s n LEU 21 N 2.27 2.36 -4.85 1.23 4.77 -1.26 -4.73 117.00 116.78 1a4s n LEU 21 Ca 0.03 -0.87 -0.35 0.00 -0.03 0.00 0.00 56.01 54.78 1a4s n LEU 21 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 1a4s n LEU 21 CO 0.54 0.42 0.17 0.20 -1.33 0.00 0.00 177.39 177.39 1a4s s ASN 22 N -2.09 6.75 -0.24 -1.43 0.01 -1.26 -4.74 114.94 111.94 1a4s s ASN 22 Ca 0.21 0.96 -0.03 0.00 -0.71 0.00 0.00 52.86 53.29 1a4s s ASN 22 Cb 0.17 -2.24 0.13 0.00 0.41 0.00 0.00 41.25 39.72 1a4s s ASN 22 CO 0.41 0.13 0.39 -0.47 -1.51 0.00 0.00 177.10 176.05 1a4s s TYR 23 N -1.43 -0.85 0.11 2.20 6.14 -0.31 -0.31 117.35 122.90 1a4s s TYR 23 Ca 0.36 0.92 -0.16 0.00 0.64 0.00 0.00 57.07 58.83 1a4s s TYR 23 Cb -0.15 0.06 0.03 0.00 0.42 0.00 0.00 41.96 42.33 1a4s s TYR 23 CO 0.19 -0.70 0.40 1.67 0.64 0.00 0.00 175.55 177.74 1a4s s TRP 24 N 2.56 -0.20 -1.31 4.97 -2.14 -0.97 0.23 118.94 122.09 1a4s s TRP 24 Ca 0.12 -0.07 0.00 0.00 2.66 0.00 0.00 56.10 58.81 1a4s s TRP 24 Cb -0.15 0.24 0.00 0.00 -3.10 0.00 0.00 33.47 30.46 1a4s s TRP 24 CO -0.16 -0.67 0.00 0.41 -2.66 0.00 0.00 176.95 173.87 1a4s n GLY 25 N -0.09 0.40 2.20 3.67 0.00 -1.26 -2.34 105.19 107.77 1a4s n GLY 25 Ca -0.16 -0.32 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 1a4s n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 26 N -1.10 0.67 3.48 -0.02 0.00 -1.26 -4.72 105.19 102.23 1a4s n GLY 26 Ca -0.16 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.05 1a4s n GLY 26 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1a4s s ARG 27 N -3.26 0.98 0.23 1.61 1.70 -0.99 -5.03 118.95 114.19 1a4s s ARG 27 Ca 0.00 0.22 -0.30 0.00 -0.47 0.00 0.00 55.73 55.18 1a4s s ARG 27 Cb 0.00 0.46 -0.09 0.00 -0.57 0.00 0.00 34.95 34.75 1a4s s ARG 27 CO 0.00 -0.29 1.31 1.03 -1.08 0.00 0.00 175.30 176.27 1a4s s ARG 28 N -1.14 4.38 -0.24 3.89 0.52 -1.26 -2.28 118.95 122.82 1a4s s ARG 28 Ca -0.11 2.09 -0.11 0.00 -0.52 0.00 0.00 55.73 57.08 1a4s s ARG 28 Cb -0.01 -3.17 -0.05 0.00 0.52 0.00 0.00 34.95 32.24 1a4s s ARG 28 CO 0.09 -0.24 0.19 0.42 0.02 0.00 0.00 175.30 175.77 1a4s s ILE 29 N -0.13 5.34 -0.17 1.52 -1.09 0.58 -4.96 121.20 122.28 1a4s s ILE 29 Ca 0.55 0.23 -0.29 0.00 -2.23 0.00 0.00 60.65 58.91 1a4s s ILE 29 Cb -0.37 -3.53 -0.04 0.00 -1.58 0.00 0.00 42.46 36.94 1a4s s ILE 29 CO 0.41 0.33 1.68 -0.54 -1.23 0.00 0.00 174.94 175.58 1a4s s LYS 30 N 1.16 3.85 0.85 2.79 3.01 -1.26 -4.43 119.74 125.72 1a4s s LYS 30 Ca 0.09 1.85 -0.12 0.00 -1.01 0.00 0.00 55.97 56.78 1a4s s LYS 30 Cb -0.14 -4.05 0.11 0.00 -1.01 0.00 0.00 37.83 32.74 1a4s s LYS 30 CO 0.05 -1.23 1.18 -1.54 0.51 0.00 0.00 175.35 174.32 1a4s s SER 31 N 4.31 3.34 0.05 2.83 1.04 -1.26 -5.03 113.70 118.97 1a4s s SER 31 Ca 0.74 2.28 -0.03 0.00 0.48 0.00 0.00 55.95 59.42 1a4s s SER 31 Cb -0.28 -2.58 0.01 0.00 0.10 0.00 0.00 66.02 63.27 1a4s s SER 31 CO 0.30 -2.83 0.16 1.17 0.98 0.00 0.00 173.24 173.02 1a4s n LYS 32 N -3.68 0.15 0.00 4.02 3.00 -1.26 -4.97 118.16 115.41 1a4s n LYS 32 Ca 0.13 -0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 1a4s n LYS 32 Cb 0.51 0.40 0.00 0.00 0.00 0.00 0.00 35.03 35.94 1a4s n LYS 32 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1a4s n ASP 33 N -0.85 0.00 -2.91 3.14 2.03 -1.26 -3.55 116.55 113.15 1a4s n ASP 33 Ca -0.01 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.12 1a4s n ASP 33 Cb 0.10 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.57 1a4s n ASP 33 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a4s n GLY 34 N -0.08 -0.21 3.71 0.27 0.00 -1.26 -4.96 105.19 102.65 1a4s n GLY 34 Ca 0.00 0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1a4s n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s n ALA 35 N -4.31 1.29 -1.67 4.61 0.00 -1.23 -4.83 120.51 114.36 1a4s n ALA 35 Ca -0.03 0.16 -0.44 0.00 0.00 0.00 0.00 53.44 53.14 1a4s n ALA 35 Cb 0.56 -2.29 -0.04 0.00 0.00 0.00 0.00 19.45 17.68 1a4s n ALA 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1a4s n THR 36 N -0.82 0.68 -2.48 0.00 -1.04 -1.26 -4.96 114.28 104.38 1a4s n THR 36 Ca 0.09 -0.12 -0.24 0.00 -2.04 0.00 0.00 64.05 61.74 1a4s n THR 36 Cb 0.43 -2.17 0.09 0.00 -1.82 0.00 0.00 70.33 66.86 1a4s n THR 36 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1a4s s THR 37 N 4.16 2.28 0.01 12.58 -4.23 -1.26 -4.63 115.64 124.54 1a4s s THR 37 Ca 0.89 -0.51 0.03 0.00 -1.18 0.00 0.00 61.69 60.92 1a4s s THR 37 Cb -0.51 -2.76 -0.01 0.00 1.34 0.00 0.00 72.50 70.55 1a4s s THR 37 CO 0.44 0.00 -0.08 -1.61 -0.54 0.00 0.00 174.62 172.83 1a4s s GLU 38 N -5.13 0.61 0.43 3.99 0.41 -0.43 -4.93 118.70 113.65 1a4s s GLU 38 Ca 0.64 -0.44 -0.24 0.00 -0.41 0.00 0.00 54.97 54.51 1a4s s GLU 38 Cb -0.07 -0.54 -0.08 0.00 -1.78 0.00 0.00 34.13 31.66 1a4s s GLU 38 CO 0.44 0.14 1.17 -1.25 -0.49 0.00 0.00 175.26 175.26 1a4s s PRO 39 N -0.64 3.91 -0.12 0.39 0.04 -1.26 0.11 135.00 137.43 1a4s s PRO 39 Ca -0.00 1.82 0.01 0.00 0.04 0.00 0.00 61.00 62.87 1a4s s PRO 39 Cb -0.05 -2.55 0.02 0.00 0.04 0.00 0.00 34.50 31.96 1a4s s PRO 39 CO 0.00 -0.44 -0.15 0.14 0.04 0.00 0.00 177.00 176.59 1a4s s VAL 40 N -1.47 1.56 0.23 -0.36 -7.23 -0.13 -4.81 120.40 108.19 1a4s s VAL 40 Ca 0.60 -0.67 0.06 0.00 -1.81 0.00 0.00 61.98 60.16 1a4s s VAL 40 Cb -0.30 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.17 1a4s s VAL 40 CO 0.37 0.46 0.24 -0.36 -0.31 0.00 0.00 175.10 175.49 1a4s s PHE 41 N 1.12 3.24 -0.37 2.82 0.08 -1.26 0.53 117.98 124.14 1a4s s PHE 41 Ca -0.03 -0.05 -0.13 0.00 0.12 0.00 0.00 56.93 56.83 1a4s s PHE 41 Cb -0.14 -1.49 0.01 0.00 -0.57 0.00 0.00 43.02 40.82 1a4s s PHE 41 CO -0.04 0.50 0.26 -2.00 -0.10 0.00 0.00 175.22 173.83 1a4s s GLU 42 N -3.71 3.17 0.30 0.44 2.12 -0.18 -4.74 118.70 116.11 1a4s s GLU 42 Ca 0.33 -0.87 -0.00 0.00 0.36 0.00 0.00 54.97 54.79 1a4s s GLU 42 Cb -0.09 -3.86 0.49 0.00 0.26 0.00 0.00 34.13 30.94 1a4s s GLU 42 CO 0.26 -0.61 1.95 -1.35 -0.54 0.00 0.00 175.26 174.97 1a4s h PRO 43 N 8.54 1.03 0.00 4.30 0.11 -1.78 0.30 132.00 144.49 1a4s h PRO 43 Ca -0.29 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.72 1a4s h PRO 43 Cb 1.13 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1a4s h PRO 43 CO 0.68 0.68 -0.20 0.00 -0.21 0.00 0.00 178.00 178.96 1a4s h ALA 44 N 1.50 1.45 0.00 -0.75 0.00 -1.87 -0.82 119.26 118.77 1a4s h ALA 44 Ca 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1a4s h ALA 44 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1a4s h ALA 44 CO -0.10 0.25 -0.82 0.25 0.00 0.00 0.00 179.25 178.83 1a4s n THR 45 N -3.97 0.00 -0.32 0.00 -2.24 -1.07 -3.93 114.28 102.75 1a4s n THR 45 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1a4s n THR 45 Cb 0.28 0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1a4s n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a4s n GLY 46 N 2.19 0.94 3.76 3.38 0.00 0.10 -3.85 105.19 111.72 1a4s n GLY 46 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1a4s n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a4s s ARG 47 N -0.54 1.90 -0.23 1.61 0.52 -1.25 -4.75 118.95 116.21 1a4s s ARG 47 Ca 0.00 0.87 -0.13 0.00 -0.52 0.00 0.00 55.73 55.95 1a4s s ARG 47 Cb 0.00 -1.88 -0.04 0.00 0.52 0.00 0.00 34.95 33.55 1a4s s ARG 47 CO 0.00 -1.81 0.29 0.08 0.02 0.00 0.00 175.30 173.88 1a4s s VAL 48 N -3.00 5.26 -0.09 3.52 1.01 -1.26 -1.01 120.40 124.84 1a4s s VAL 48 Ca 0.62 0.45 0.15 0.00 0.00 0.00 0.00 61.98 63.19 1a4s s VAL 48 Cb -0.16 -3.62 -0.19 0.00 0.00 0.00 0.00 36.38 32.41 1a4s s VAL 48 CO 0.56 0.27 0.71 0.18 0.00 0.00 0.00 175.10 176.82 1a4s n LEU 49 N 4.59 0.82 0.00 3.92 4.77 0.19 -4.94 117.00 126.35 1a4s n LEU 49 Ca -0.11 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 1a4s n LEU 49 Cb 0.51 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1a4s n LEU 49 CO 0.37 0.27 0.00 0.00 -1.33 0.00 0.00 177.39 176.70 1a4s s GLN 51 N -2.00 2.94 -0.10 0.00 -1.52 -1.26 -0.95 119.66 116.76 1a4s s GLN 51 Ca 0.00 -0.47 -0.16 0.00 -1.95 0.00 0.00 55.36 52.78 1a4s s GLN 51 Cb 0.00 -2.72 -0.05 0.00 -0.22 0.00 0.00 33.01 30.02 1a4s s GLN 51 CO 0.00 0.66 0.41 0.00 -0.25 0.00 0.00 175.29 176.11 1a4s s MET 52 N -0.77 4.21 -0.41 2.91 0.23 0.31 -4.88 119.30 120.90 1a4s s MET 52 Ca 0.12 0.34 -0.05 0.00 -1.03 0.00 0.00 55.69 55.07 1a4s s MET 52 Cb -0.11 -3.38 0.10 0.00 -1.53 0.00 0.00 34.83 29.91 1a4s s MET 52 CO 0.02 0.31 0.22 0.54 -2.03 0.00 0.00 175.02 174.08 1a4s s VAL 53 N 0.17 3.57 0.52 5.16 0.11 -1.26 -1.31 120.40 127.35 1a4s s VAL 53 Ca 0.23 -1.84 -0.22 0.00 -2.93 0.00 0.00 61.98 57.21 1a4s s VAL 53 Cb -0.15 -3.35 -0.06 0.00 -1.53 0.00 0.00 36.38 31.30 1a4s s VAL 53 CO 0.09 -0.62 1.30 -2.16 -3.33 0.00 0.00 175.10 170.38 1a4s s PRO 54 N 1.23 3.35 0.13 1.54 0.04 -1.26 -4.69 135.00 135.34 1a4s s PRO 54 Ca 0.06 2.09 -0.13 0.00 0.04 0.00 0.00 61.00 63.06 1a4s s PRO 54 Cb -0.23 -2.32 -0.07 0.00 0.04 0.00 0.00 34.50 31.93 1a4s s PRO 54 CO -0.02 -0.98 0.51 0.00 0.04 0.00 0.00 177.00 176.55 1a4s n GLY 56 N 0.82 2.90 0.29 0.00 0.00 -1.26 -4.38 105.19 103.56 1a4s n GLY 56 Ca -0.06 -2.11 -0.01 0.00 0.00 0.00 0.00 46.02 43.84 1a4s n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s h ALA 57 N 0.26 1.03 -0.85 4.61 0.00 -1.98 -1.52 119.26 120.79 1a4s h ALA 57 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1a4s h ALA 57 Cb 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1a4s h ALA 57 CO 0.00 0.19 0.44 0.93 0.00 0.00 0.00 179.25 180.81 1a4s h GLU 58 N 0.85 1.21 -0.15 0.00 3.07 -1.99 -1.70 114.58 115.87 1a4s h GLU 58 Ca 0.33 -0.16 -0.14 0.00 -0.50 0.00 0.00 59.36 58.89 1a4s h GLU 58 Cb 0.14 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1a4s h GLU 58 CO -0.16 0.90 -0.44 0.93 -1.40 0.00 0.00 179.01 178.84 1a4s h GLU 59 N 1.20 0.56 -0.54 2.33 3.07 -1.76 -2.51 114.58 116.94 1a4s h GLU 59 Ca 0.30 -0.41 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1a4s h GLU 59 Cb 0.07 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.02 1a4s h GLU 59 CO -0.04 1.03 0.31 0.28 -1.40 0.00 0.00 179.01 179.18 1a4s h VAL 60 N 0.20 1.17 -0.48 3.13 2.07 -1.18 -1.77 116.25 119.39 1a4s h VAL 60 Ca -0.01 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 1a4s h VAL 60 Cb 1.06 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1a4s h VAL 60 CO 0.09 0.18 0.16 -0.78 0.02 0.00 0.00 177.57 177.25 1a4s h ASP 61 N 0.72 0.65 -0.53 0.57 3.58 -1.34 -0.20 116.42 119.86 1a4s h ASP 61 Ca 0.19 -0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.50 1a4s h ASP 61 Cb 0.02 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.89 1a4s h ASP 61 CO -0.03 0.61 0.14 1.56 -2.88 0.00 0.00 179.24 178.64 1a4s h GLN 62 N 0.69 0.85 -0.27 0.28 4.20 -0.91 -0.84 115.11 119.12 1a4s h GLN 62 Ca 0.16 -0.20 0.02 0.00 0.06 0.00 0.00 58.65 58.69 1a4s h GLN 62 Cb 0.20 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 1a4s h GLN 62 CO -0.01 0.80 0.13 0.00 -0.67 0.00 0.00 178.83 179.08 1a4s h ALA 63 N 1.01 0.32 -0.34 3.87 0.00 -0.81 -1.17 119.26 122.15 1a4s h ALA 63 Ca 0.17 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1a4s h ALA 63 Cb 0.32 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1a4s h ALA 63 CO -0.00 -0.26 0.01 0.28 0.00 0.00 0.00 179.25 179.28 1a4s h VAL 64 N 0.28 1.25 -0.96 0.00 2.07 -0.90 -1.64 116.25 116.36 1a4s h VAL 64 Ca 0.11 -0.94 0.07 0.00 0.82 0.00 0.00 66.70 66.76 1a4s h VAL 64 Cb 0.03 1.20 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 1a4s h VAL 64 CO -0.07 0.31 0.61 1.56 0.02 0.00 0.00 177.57 179.99 1a4s h GLN 65 N 0.40 1.05 -0.50 1.57 4.20 -1.05 0.15 115.11 120.93 1a4s h GLN 65 Ca 0.10 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.66 1a4s h GLN 65 Cb 0.43 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1a4s h GLN 65 CO 0.02 0.70 -0.03 1.03 -0.67 0.00 0.00 178.83 179.87 1a4s h SER 66 N 1.08 0.90 -0.81 1.46 0.87 -0.92 -2.42 113.55 113.72 1a4s h SER 66 Ca 0.43 -0.32 0.03 0.00 -1.23 0.00 0.00 61.79 60.69 1a4s h SER 66 Cb 0.22 -0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 61.89 1a4s h SER 66 CO -0.19 1.01 0.52 0.00 -0.53 0.00 0.00 176.83 177.64 1a4s h ALA 67 N 0.93 1.06 -0.24 6.23 0.00 -0.63 -2.49 119.26 124.11 1a4s h ALA 67 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1a4s h ALA 67 Cb 0.57 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1a4s h ALA 67 CO 0.03 0.34 0.09 0.37 0.00 0.00 0.00 179.25 180.08 1a4s h GLN 68 N 1.01 0.37 -0.50 0.00 5.75 -0.27 -0.48 115.11 120.98 1a4s h GLN 68 Ca 0.32 -0.07 -0.07 0.00 -0.15 0.00 0.00 58.65 58.68 1a4s h GLN 68 Cb 0.01 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 1a4s h GLN 68 CO -0.11 0.43 0.03 0.00 -2.65 0.00 0.00 178.83 176.53 1a4s h ALA 69 N 0.92 1.11 -0.28 3.38 0.00 -1.31 -2.03 119.26 121.06 1a4s h ALA 69 Ca 0.08 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1a4s h ALA 69 Cb 0.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1a4s h ALA 69 CO -0.00 0.57 -0.31 0.00 0.00 0.00 0.00 179.25 179.50 1a4s h ALA 70 N 1.26 0.94 -0.87 0.00 0.00 -1.12 -3.04 119.26 116.43 1a4s h ALA 70 Ca 0.15 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.74 1a4s h ALA 70 Cb 0.42 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1a4s h ALA 70 CO 0.02 0.61 0.54 -0.92 0.00 0.00 0.00 179.25 179.50 1a4s h TYR 71 N 0.50 0.99 -0.90 0.00 3.20 -0.53 0.18 116.97 120.41 1a4s h TYR 71 Ca 0.06 0.03 0.15 0.00 3.14 0.00 0.00 58.73 62.11 1a4s h TYR 71 Cb 0.79 -0.32 -0.07 0.00 1.54 0.00 0.00 36.73 38.67 1a4s h TYR 71 CO 0.03 0.48 0.58 -0.07 -1.64 0.00 0.00 178.16 177.54 1a4s h LEU 72 N 0.96 0.66 0.02 2.82 4.07 -1.26 -1.69 115.31 120.89 1a4s h LEU 72 Ca 0.39 0.04 -0.07 0.00 0.08 0.00 0.00 57.88 58.32 1a4s h LEU 72 Cb 0.22 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 41.87 1a4s h LEU 72 CO -0.19 0.33 -0.38 0.50 -1.08 0.00 0.00 178.44 177.62 1a4s h LYS 73 N 0.70 0.04 -0.75 1.13 1.63 -1.09 -3.36 116.57 114.86 1a4s h LYS 73 Ca 0.46 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 60.17 1a4s h LYS 73 Cb 0.74 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.36 1a4s h LYS 73 CO -0.22 1.03 0.36 2.35 -3.45 0.00 0.00 179.45 179.52 1a4s h TRP 74 N -0.91 1.07 0.00 1.91 2.91 -0.92 -2.20 115.95 117.80 1a4s h TRP 74 Ca -0.09 -0.05 0.00 0.00 1.13 0.00 0.00 58.89 59.88 1a4s h TRP 74 Cb 1.15 -0.33 0.00 0.00 -0.51 0.00 0.00 29.16 29.46 1a4s h TRP 74 CO 0.23 0.78 0.00 -1.13 -1.03 0.00 0.00 178.44 177.29 1a4s n SER 75 N -4.32 0.46 -0.35 2.65 3.41 -0.65 -0.73 113.62 114.09 1a4s n SER 75 Ca 0.07 0.61 0.13 0.00 -0.26 0.00 0.00 58.87 59.43 1a4s n SER 75 Cb 0.14 -0.71 0.37 0.00 -0.26 0.00 0.00 64.21 63.75 1a4s n SER 75 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1a4s n LYS 76 N -2.01 1.14 -3.13 4.33 4.01 -0.83 -4.83 118.16 116.83 1a4s n LYS 76 Ca 0.03 -0.71 -0.39 0.00 -0.51 0.00 0.00 58.31 56.72 1a4s n LYS 76 Cb 0.21 -1.49 -0.06 0.00 -0.51 0.00 0.00 35.03 33.19 1a4s n LYS 76 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1a4s s MET 77 N -2.35 4.37 1.00 1.97 -1.94 0.09 -5.06 119.30 117.38 1a4s s MET 77 Ca 0.27 0.91 -0.12 0.00 -1.71 0.00 0.00 55.69 55.04 1a4s s MET 77 Cb 0.20 -3.28 0.19 0.00 2.01 0.00 0.00 34.83 33.94 1a4s s MET 77 CO 0.47 0.51 1.09 0.00 -0.01 0.00 0.00 175.02 177.08 1a4s s ALA 78 N -0.78 0.90 0.26 3.03 0.00 -1.26 -4.76 121.76 119.16 1a4s s ALA 78 Ca 0.33 -0.31 -0.02 0.00 0.00 0.00 0.00 51.96 51.95 1a4s s ALA 78 Cb -0.20 -3.13 0.46 0.00 0.00 0.00 0.00 23.12 20.25 1a4s s ALA 78 CO 0.21 -2.87 1.80 0.78 0.00 0.00 0.00 175.76 175.69 1a4s h GLY 79 N -1.92 1.39 2.00 0.00 0.00 -1.93 -0.94 103.07 101.67 1a4s h GLY 79 Ca -0.55 -0.33 -0.06 0.00 0.00 0.00 0.00 47.33 46.40 1a4s h GLY 79 CO 0.57 0.10 -0.26 1.19 0.00 0.00 0.00 176.54 178.13 1a4s h ILE 80 N 0.80 0.72 0.16 2.60 2.10 -1.90 0.38 117.51 122.37 1a4s h ILE 80 Ca 0.44 -1.14 -0.30 0.00 1.08 0.00 0.00 64.86 64.93 1a4s h ILE 80 Cb 0.46 1.72 0.01 0.00 -1.09 0.00 0.00 36.82 37.92 1a4s h ILE 80 CO -0.28 0.26 -1.42 -0.33 -1.08 0.00 0.00 178.15 175.30 1a4s h GLU 81 N 0.00 0.34 -0.52 2.19 5.08 -1.56 -3.18 114.58 116.93 1a4s h GLU 81 Ca -0.00 -0.57 -0.10 0.00 -1.00 0.00 0.00 59.36 57.69 1a4s h GLU 81 Cb 0.70 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1a4s h GLU 81 CO 0.03 1.25 -0.06 0.00 -1.00 0.00 0.00 179.01 179.23 1a4s h ARG 82 N 0.09 0.95 -0.58 2.33 3.08 -1.00 -3.18 114.38 116.07 1a4s h ARG 82 Ca -0.21 -0.33 0.12 0.00 0.07 0.00 0.00 59.98 59.63 1a4s h ARG 82 Cb 2.04 -0.07 -0.10 0.00 0.08 0.00 0.00 29.97 31.92 1a4s h ARG 82 CO 0.21 1.00 -0.02 1.03 -1.07 0.00 0.00 179.97 181.11 1a4s h SER 83 N 0.82 -0.31 -0.71 7.04 0.87 -0.99 -1.96 113.55 118.31 1a4s h SER 83 Ca 0.14 0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.82 1a4s h SER 83 Cb 0.61 0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.80 1a4s h SER 83 CO 0.04 -0.12 0.35 0.03 -0.53 0.00 0.00 176.83 176.60 1a4s h ARG 84 N 0.09 1.03 -0.09 2.24 2.47 -1.53 -0.85 114.38 117.74 1a4s h ARG 84 Ca 0.30 -0.14 -0.06 0.00 -1.26 0.00 0.00 59.98 58.82 1a4s h ARG 84 Cb 0.47 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.60 1a4s h ARG 84 CO -0.51 0.79 -0.17 0.28 0.56 0.00 0.00 179.97 180.92 1a4s h VAL 85 N 1.02 1.39 -0.80 2.04 2.07 -1.60 -2.73 116.25 117.65 1a4s h VAL 85 Ca 0.25 -1.44 0.06 0.00 0.82 0.00 0.00 66.70 66.39 1a4s h VAL 85 Cb 0.09 2.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.93 1a4s h VAL 85 CO -0.03 0.41 0.52 0.24 0.02 0.00 0.00 177.57 178.73 1a4s h MET 86 N -0.17 0.86 -0.58 1.57 2.86 -1.08 -1.55 114.93 116.84 1a4s h MET 86 Ca 0.01 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.54 1a4s h MET 86 Cb 0.74 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.18 1a4s h MET 86 CO 0.04 0.57 0.13 -0.07 1.06 0.00 0.00 176.91 178.64 1a4s h LEU 87 N 0.88 0.88 -1.18 1.22 3.38 -1.06 -2.36 115.31 117.07 1a4s h LEU 87 Ca 0.34 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1a4s h LEU 87 Cb 0.20 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1a4s h LEU 87 CO -0.11 0.89 0.32 -0.33 0.09 0.00 0.00 178.44 179.30 1a4s h GLU 88 N 0.83 0.89 0.17 1.13 4.39 -1.12 -1.26 114.58 119.61 1a4s h GLU 88 Ca 0.18 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1a4s h GLU 88 Cb 0.36 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1a4s h GLU 88 CO 0.00 0.67 -0.08 0.00 -1.16 0.00 0.00 179.01 178.45 1a4s h ALA 89 N 1.46 -0.23 -0.90 3.43 0.00 -1.01 -1.50 119.26 120.51 1a4s h ALA 89 Ca 0.22 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1a4s h ALA 89 Cb 0.06 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1a4s h ALA 89 CO -0.03 -0.61 0.59 0.00 0.00 0.00 0.00 179.25 179.19 1a4s h ALA 90 N 0.56 1.42 -0.89 0.00 0.00 -1.28 -2.14 119.26 116.93 1a4s h ALA 90 Ca -0.02 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1a4s h ALA 90 Cb 0.20 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 17.61 1a4s h ALA 90 CO 0.04 0.50 0.56 -0.09 0.00 0.00 0.00 179.25 180.26 1a4s h ARG 91 N 1.14 1.02 -0.20 0.00 2.43 -0.95 -1.64 114.38 116.19 1a4s h ARG 91 Ca 0.35 -0.06 -0.16 0.00 -0.81 0.00 0.00 59.98 59.30 1a4s h ARG 91 Cb -0.00 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.31 1a4s h ARG 91 CO -0.10 0.68 -0.54 0.82 -1.51 0.00 0.00 179.97 179.31 1a4s h ILE 92 N 1.05 1.32 -0.58 1.20 2.04 -0.93 -2.20 117.51 119.41 1a4s h ILE 92 Ca 0.38 -1.78 -0.09 0.00 1.00 0.00 0.00 64.86 64.36 1a4s h ILE 92 Cb 0.11 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1a4s h ILE 92 CO -0.15 0.56 -0.01 0.40 0.00 0.00 0.00 178.15 178.95 1a4s h ILE 93 N 0.45 1.27 -0.08 -0.67 2.04 -1.22 -2.58 117.51 116.71 1a4s h ILE 93 Ca 0.01 -1.15 0.04 0.00 1.00 0.00 0.00 64.86 64.76 1a4s h ILE 93 Cb 1.09 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.96 1a4s h ILE 93 CO 0.10 0.41 -0.31 0.03 0.00 0.00 0.00 178.15 178.39 1a4s h ARG 94 N 0.93 -0.40 -0.71 2.37 3.08 -1.01 -1.38 114.38 117.25 1a4s h ARG 94 Ca 0.16 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.32 1a4s h ARG 94 Cb 0.56 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.66 1a4s h ARG 94 CO 0.03 -0.27 0.47 0.93 -1.07 0.00 0.00 179.97 180.06 1a4s h GLU 95 N -0.42 0.64 -0.45 0.04 5.08 -1.29 -2.76 114.58 115.42 1a4s h GLU 95 Ca 0.08 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1a4s h GLU 95 Cb 0.54 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 1a4s h GLU 95 CO -0.32 0.42 0.07 0.54 -1.00 0.00 0.00 179.01 178.73 1a4s n ARG 96 N -4.49 3.12 0.19 2.33 1.74 -0.98 -4.75 116.66 113.81 1a4s n ARG 96 Ca 0.11 -3.01 -0.15 0.00 -0.77 0.00 0.00 57.85 54.03 1a4s n ARG 96 Cb 0.29 -1.99 -0.07 0.00 -1.02 0.00 0.00 32.46 29.67 1a4s n ARG 96 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1a4s h ARG 97 N 2.08 -0.68 -0.75 5.56 1.12 -0.95 -0.49 114.38 120.26 1a4s h ARG 97 Ca 0.13 0.05 -0.04 0.00 -1.11 0.00 0.00 59.98 59.00 1a4s h ARG 97 Cb 1.81 0.15 -0.03 0.00 -0.01 0.00 0.00 29.97 31.89 1a4s h ARG 97 CO 0.44 -0.45 0.30 -0.44 -3.11 0.00 0.00 179.97 176.70 1a4s h ASP 98 N -0.70 1.05 -0.35 -3.80 3.32 -1.85 -1.06 116.42 113.02 1a4s h ASP 98 Ca -0.01 -0.18 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 1a4s h ASP 98 Cb 0.67 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1a4s h ASP 98 CO -0.13 0.94 0.05 0.78 -1.72 0.00 0.00 179.24 179.16 1a4s h ASN 99 N 1.09 0.56 -0.78 6.45 2.35 -1.80 -2.33 115.58 121.12 1a4s h ASN 99 Ca 0.25 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1a4s h ASN 99 Cb 0.22 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.40 1a4s h ASN 99 CO -0.02 0.68 0.50 0.40 -1.65 0.00 0.00 177.43 177.34 1a4s h ILE 100 N 0.42 1.21 -0.36 2.81 2.04 -1.03 -2.12 117.51 120.48 1a4s h ILE 100 Ca 0.11 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.55 1a4s h ILE 100 Cb 0.36 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1a4s h ILE 100 CO 0.01 0.21 0.23 0.00 0.00 0.00 0.00 178.15 178.60 1a4s h ALA 101 N 1.27 0.46 -0.09 1.87 0.00 -1.02 -1.09 119.26 120.65 1a4s h ALA 101 Ca 0.28 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.20 1a4s h ALA 101 Cb -0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1a4s h ALA 101 CO -0.06 -0.07 -0.22 -0.22 0.00 0.00 0.00 179.25 178.68 1a4s h LYS 102 N 0.48 -0.29 -0.25 0.00 3.64 -1.06 0.01 116.57 119.10 1a4s h LYS 102 Ca 0.13 0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1a4s h LYS 102 Cb -0.04 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1a4s h LYS 102 CO -0.03 -0.19 0.04 1.25 -2.27 0.00 0.00 179.45 178.25 1a4s h LEU 103 N -0.30 0.33 -0.77 5.20 6.46 -1.22 -2.43 115.31 122.58 1a4s h LEU 103 Ca 0.09 -0.04 -0.07 0.00 -0.12 0.00 0.00 57.88 57.74 1a4s h LEU 103 Cb 0.43 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 1a4s h LEU 103 CO -0.27 0.36 0.11 -0.08 -0.62 0.00 0.00 178.44 177.94 1a4s h GLU 104 N 0.36 1.04 -0.65 1.25 4.57 -0.49 -2.72 114.58 117.93 1a4s h GLU 104 Ca 0.09 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 57.96 1a4s h GLU 104 Cb 0.18 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1a4s h GLU 104 CO -0.00 0.95 0.25 0.28 -1.18 0.00 0.00 179.01 179.31 1a4s h VAL 105 N 0.98 1.24 -0.72 0.32 2.07 -0.67 -1.71 116.25 117.76 1a4s h VAL 105 Ca 0.20 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1a4s h VAL 105 Cb 0.41 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1a4s h VAL 105 CO 0.01 0.30 0.39 0.40 0.02 0.00 0.00 177.57 178.69 1a4s h ILE 106 N 0.92 1.22 0.03 4.57 2.04 -1.15 0.25 117.51 125.39 1a4s h ILE 106 Ca 0.22 -0.56 -0.22 0.00 1.00 0.00 0.00 64.86 65.30 1a4s h ILE 106 Cb 0.22 0.28 0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1a4s h ILE 106 CO -0.02 0.25 -0.86 -1.13 0.00 0.00 0.00 178.15 176.39 1a4s h ASN 107 N 0.99 0.71 0.25 1.72 -0.00 -1.43 -3.35 115.58 114.47 1a4s h ASN 107 Ca 0.25 -0.78 -0.33 0.00 -0.00 0.00 0.00 56.30 55.44 1a4s h ASN 107 Cb 0.05 -0.22 -0.05 0.00 -0.00 0.00 0.00 38.32 38.09 1a4s h ASN 107 CO -0.04 1.40 -2.03 -3.20 -0.00 0.00 0.00 177.43 173.56 1a4s n ASN 108 N -4.03 0.83 0.00 1.15 2.85 -0.65 -4.46 115.26 110.95 1a4s n ASN 108 Ca -0.11 0.21 0.00 0.00 -0.11 0.00 0.00 54.58 54.57 1a4s n ASN 108 Cb 0.80 0.16 0.00 0.00 1.24 0.00 0.00 39.78 41.98 1a4s n ASN 108 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1a4s n GLY 109 N 1.73 0.33 3.90 8.20 0.00 0.86 -4.61 105.19 115.58 1a4s n GLY 109 Ca -0.26 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 1a4s n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a4s s LYS 110 N -0.91 2.28 0.68 1.61 -2.85 -1.26 -3.86 119.74 115.42 1a4s s LYS 110 Ca 0.00 0.22 -0.13 0.00 -1.00 0.00 0.00 55.97 55.06 1a4s s LYS 110 Cb 0.00 -1.98 0.00 0.00 -2.06 0.00 0.00 37.83 33.79 1a4s s LYS 110 CO 0.00 -1.39 1.08 0.95 0.10 0.00 0.00 175.35 176.09 1a4s s THR 111 N -3.49 3.63 0.30 3.79 -4.23 -1.26 -4.65 115.64 109.73 1a4s s THR 111 Ca 0.61 0.64 0.16 0.00 -1.18 0.00 0.00 61.69 61.92 1a4s s THR 111 Cb -0.11 -3.22 0.11 0.00 1.34 0.00 0.00 72.50 70.62 1a4s s THR 111 CO 0.50 -0.58 1.79 0.16 -0.54 0.00 0.00 174.62 175.95 1a4s h ILE 112 N -0.32 1.11 -0.23 2.99 -0.00 -1.58 0.96 117.51 120.43 1a4s h ILE 112 Ca -0.45 -1.41 0.04 0.00 -0.00 0.00 0.00 64.86 63.03 1a4s h ILE 112 Cb 1.23 1.80 -0.04 0.00 -0.00 0.00 0.00 36.82 39.81 1a4s h ILE 112 CO 0.55 0.38 -0.01 0.74 -0.00 0.00 0.00 178.15 179.82 1a4s h THR 113 N 0.00 0.83 -0.25 0.16 2.02 -1.87 -2.25 112.91 111.54 1a4s h THR 113 Ca -0.00 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 67.09 1a4s h THR 113 Cb 0.77 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1a4s h THR 113 CO 0.05 0.01 -0.08 -0.33 0.37 0.00 0.00 175.52 175.54 1a4s h GLU 114 N 0.07 0.49 -0.75 6.66 5.08 -1.81 -3.29 114.58 121.02 1a4s h GLU 114 Ca 0.11 -0.20 0.09 0.00 -1.00 0.00 0.00 59.36 58.36 1a4s h GLU 114 Cb 0.14 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1a4s h GLU 114 CO -0.19 0.73 0.49 0.00 -1.00 0.00 0.00 179.01 179.04 1a4s h ALA 115 N 0.74 1.80 -0.72 3.43 0.00 -0.69 0.30 119.26 124.13 1a4s h ALA 115 Ca 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1a4s h ALA 115 Cb 0.57 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1a4s h ALA 115 CO 0.03 0.05 0.30 0.93 0.00 0.00 0.00 179.25 180.56 1a4s h GLU 116 N 0.68 1.06 -0.37 0.00 5.08 -1.48 -1.83 114.58 117.72 1a4s h GLU 116 Ca 0.34 -0.17 -0.09 0.00 -1.00 0.00 0.00 59.36 58.44 1a4s h GLU 116 Cb 0.44 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1a4s h GLU 116 CO -0.12 0.85 -0.16 1.88 -1.00 0.00 0.00 179.01 180.45 1a4s h TYR 117 N 1.04 0.75 -0.41 4.33 0.05 -1.06 -1.80 116.97 119.86 1a4s h TYR 117 Ca 0.24 -0.14 0.02 0.00 0.05 0.00 0.00 58.73 58.90 1a4s h TYR 117 Cb 0.18 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.70 1a4s h TYR 117 CO 0.02 0.80 0.24 -0.44 -1.05 0.00 0.00 178.16 177.72 1a4s h ASP 118 N 0.61 0.39 0.63 3.88 5.19 -1.01 -0.19 116.42 125.91 1a4s h ASP 118 Ca 0.10 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.31 1a4s h ASP 118 Cb 0.62 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.04 1a4s h ASP 118 CO 0.04 0.28 -0.90 0.40 -3.12 0.00 0.00 179.24 175.94 1a4s h ILE 119 N 0.49 1.52 -0.22 0.35 1.08 -1.00 -1.94 117.51 117.78 1a4s h ILE 119 Ca 0.16 -2.71 -0.03 0.00 -0.39 0.00 0.00 64.86 61.89 1a4s h ILE 119 Cb 0.01 2.52 -0.01 0.00 -3.07 0.00 0.00 36.82 36.28 1a4s h ILE 119 CO -0.08 0.79 0.01 0.44 -0.69 0.00 0.00 178.15 178.62 1a4s h ASP 120 N 0.09 0.37 -1.00 1.72 3.32 -1.11 -1.60 116.42 118.21 1a4s h ASP 120 Ca -0.04 -0.29 0.16 0.00 0.02 0.00 0.00 57.03 56.87 1a4s h ASP 120 Cb 1.55 -0.10 -0.10 0.00 0.22 0.00 0.00 39.33 40.90 1a4s h ASP 120 CO 0.14 0.57 0.62 0.00 -1.72 0.00 0.00 179.24 178.85 1a4s h ALA 121 N 0.82 1.62 -0.03 3.45 0.00 -0.95 -0.21 119.26 123.95 1a4s h ALA 121 Ca 0.06 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1a4s h ALA 121 Cb 0.37 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1a4s h ALA 121 CO 0.01 0.07 0.01 0.00 0.00 0.00 0.00 179.25 179.34 1a4s h ALA 122 N 1.60 0.04 -0.02 0.00 0.00 -0.50 -0.81 119.26 119.57 1a4s h ALA 122 Ca 0.54 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 55.25 1a4s h ALA 122 Cb 0.72 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1a4s h ALA 122 CO -0.32 -0.38 -0.54 0.11 0.00 0.00 0.00 179.25 178.12 1a4s h TRP 123 N -0.10 0.08 -0.14 0.00 5.08 -1.13 -2.88 115.95 116.86 1a4s h TRP 123 Ca 0.01 -0.03 -0.11 0.00 1.08 0.00 0.00 58.89 59.85 1a4s h TRP 123 Cb 0.16 -0.01 -0.01 0.00 -3.00 0.00 0.00 29.16 26.29 1a4s h TRP 123 CO -0.02 0.59 -0.38 1.96 -1.28 0.00 0.00 178.44 179.31 1a4s h GLN 124 N 0.05 0.30 -0.40 0.12 1.08 -0.92 -1.32 115.11 114.01 1a4s h GLN 124 Ca -0.00 -0.14 -0.13 0.00 -1.45 0.00 0.00 58.65 56.93 1a4s h GLN 124 Cb 0.98 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.39 1a4s h GLN 124 CO 0.07 0.64 -0.28 0.00 -0.95 0.00 0.00 178.83 178.32 1a4s h ILE 126 N 0.73 1.27 -0.46 0.00 2.04 -1.36 -1.66 117.51 118.08 1a4s h ILE 126 Ca 0.09 -1.47 -0.13 0.00 1.00 0.00 0.00 64.86 64.35 1a4s h ILE 126 Cb 0.83 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 1a4s h ILE 126 CO 0.07 0.50 -0.21 -0.08 0.00 0.00 0.00 178.15 178.43 1a4s h GLU 127 N 0.76 0.95 -0.82 2.37 4.81 -0.64 -2.34 114.58 119.68 1a4s h GLU 127 Ca 0.08 -0.41 0.03 0.00 -0.13 0.00 0.00 59.36 58.93 1a4s h GLU 127 Cb 0.88 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 1a4s h GLU 127 CO 0.08 1.07 0.54 -0.92 -0.73 0.00 0.00 179.01 179.05 1a4s h TYR 128 N 0.79 0.99 0.00 0.92 3.20 -0.40 -2.40 116.97 120.07 1a4s h TYR 128 Ca 0.10 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.82 1a4s h TYR 128 Cb 0.78 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 1a4s h TYR 128 CO 0.05 0.59 -0.99 1.88 -1.64 0.00 0.00 178.16 178.05 1a4s h TYR 129 N 1.04 0.00 -0.40 -3.82 0.05 -1.30 -2.18 116.97 110.35 1a4s h TYR 129 Ca 0.32 0.00 0.06 0.00 0.05 0.00 0.00 58.73 59.16 1a4s h TYR 129 Cb -0.01 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.68 1a4s h TYR 129 CO -0.00 0.77 0.06 0.00 -1.05 0.00 0.00 178.16 177.94 1a4s h ALA 130 N 1.23 0.42 -0.58 3.88 0.00 -1.41 -0.77 119.26 122.04 1a4s h ALA 130 Ca -0.07 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1a4s h ALA 130 Cb 1.65 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 1a4s h ALA 130 CO 0.09 -0.34 0.29 0.78 0.00 0.00 0.00 179.25 180.07 1a4s h GLY 131 N 0.19 0.86 2.00 0.00 0.00 -0.87 -3.13 103.07 102.11 1a4s h GLY 131 Ca 0.19 -0.39 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 1a4s h GLY 131 CO -0.27 0.37 -0.36 1.41 0.00 0.00 0.00 176.54 177.70 1a4s h LEU 132 N 0.81 0.00 -0.61 3.11 4.07 -0.81 -3.38 115.31 118.50 1a4s h LEU 132 Ca 0.20 0.00 0.12 0.00 0.08 0.00 0.00 57.88 58.28 1a4s h LEU 132 Cb 0.07 0.00 -0.12 0.00 1.08 0.00 0.00 40.66 41.69 1a4s h LEU 132 CO -0.03 0.36 -0.19 0.00 -1.08 0.00 0.00 178.44 177.49 1a4s h ALA 133 N 1.64 0.32 0.00 1.53 0.00 -1.12 0.16 119.26 121.78 1a4s h ALA 133 Ca -0.00 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1a4s h ALA 133 Cb 0.98 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1a4s h ALA 133 CO 0.05 -0.48 0.00 -2.30 0.00 0.00 0.00 179.25 176.52 1a4s n PRO 134 N -5.43 0.55 -0.02 0.00 -0.02 -1.26 -2.76 135.00 126.06 1a4s n PRO 134 Ca 0.07 0.03 0.07 0.00 -2.02 0.00 0.00 63.50 61.65 1a4s n PRO 134 Cb 0.33 -1.50 -0.16 0.00 -0.02 0.00 0.00 33.50 32.15 1a4s n PRO 134 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1a4s n THR 135 N -1.12 0.31 -1.65 3.45 -1.04 0.52 -4.89 114.28 109.86 1a4s n THR 135 Ca 0.15 -0.57 -0.51 0.00 -2.04 0.00 0.00 64.05 61.07 1a4s n THR 135 Cb 0.12 -0.11 -0.06 0.00 -1.82 0.00 0.00 70.33 68.46 1a4s n THR 135 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1a4s n LEU 136 N -2.38 2.38 -3.68 -4.42 4.32 -1.04 -4.97 117.00 107.22 1a4s n LEU 136 Ca -0.09 1.08 -0.06 0.00 -0.02 0.00 0.00 56.01 56.92 1a4s n LEU 136 Cb 0.69 -1.26 -0.02 0.00 -1.62 0.00 0.00 43.42 41.21 1a4s n LEU 136 CO 0.45 -0.61 0.64 -0.94 -1.22 0.00 0.00 177.39 175.71 1a4s s SER 137 N 1.68 -0.27 0.00 -1.43 1.04 -1.26 -4.99 113.70 108.47 1a4s s SER 137 Ca 0.87 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.99 1a4s s SER 137 Cb -0.88 0.52 0.00 0.00 0.10 0.00 0.00 66.02 65.76 1a4s s SER 137 CO 0.49 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 174.40 1a4s n GLY 138 N -0.41 4.27 3.63 7.32 0.00 -1.25 -4.63 105.19 114.11 1a4s n GLY 138 Ca -0.07 -1.97 -0.26 0.00 0.00 0.00 0.00 46.02 43.72 1a4s n GLY 138 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1a4s s GLN 139 N 2.40 2.02 -0.12 1.61 -0.21 -1.22 -4.86 119.66 119.28 1a4s s GLN 139 Ca 0.00 -1.87 0.00 0.00 0.02 0.00 0.00 55.36 53.51 1a4s s GLN 139 Cb 0.00 -1.84 0.02 0.00 1.00 0.00 0.00 33.01 32.19 1a4s s GLN 139 CO 0.00 0.07 -0.11 -1.58 -2.12 0.00 0.00 175.29 171.55 1a4s s HIS 140 N -2.58 1.70 -0.07 0.91 5.65 -1.26 -1.61 115.29 118.02 1a4s s HIS 140 Ca 0.35 -0.85 0.03 0.00 0.25 0.00 0.00 55.06 54.84 1a4s s HIS 140 Cb 0.03 -1.32 0.01 0.00 -1.18 0.00 0.00 32.58 30.12 1a4s s HIS 140 CO 0.19 -0.52 -0.15 0.42 -0.65 0.00 0.00 174.74 174.03 1a4s s ILE 141 N 1.45 1.31 -0.09 0.89 1.01 -0.06 -5.02 121.20 120.69 1a4s s ILE 141 Ca 0.01 -0.60 -0.24 0.00 0.00 0.00 0.00 60.65 59.83 1a4s s ILE 141 Cb -0.13 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1a4s s ILE 141 CO -0.07 0.39 0.73 -1.10 0.00 0.00 0.00 174.94 174.90 1a4s s GLN 142 N 0.50 4.40 0.28 2.79 -0.21 -1.26 -1.69 119.66 124.47 1a4s s GLN 142 Ca -0.13 0.91 0.09 0.00 0.02 0.00 0.00 55.36 56.25 1a4s s GLN 142 Cb -0.15 -3.48 -0.04 0.00 1.00 0.00 0.00 33.01 30.33 1a4s s GLN 142 CO 0.04 -0.03 0.02 -0.51 -2.12 0.00 0.00 175.29 172.69 1a4s s LEU 143 N 1.13 3.20 0.20 2.90 1.43 -0.70 -4.98 118.68 121.86 1a4s s LEU 143 Ca 0.38 -0.69 -0.32 0.00 -1.03 0.00 0.00 54.13 52.47 1a4s s LEU 143 Cb -0.18 -1.70 -0.14 0.00 0.03 0.00 0.00 46.19 44.20 1a4s s LEU 143 CO 0.17 -0.07 1.33 -2.65 0.23 0.00 0.00 176.35 175.36 1a4s n PRO 144 N -0.95 1.68 -2.85 1.29 -0.02 -1.26 -3.10 135.00 129.79 1a4s n PRO 144 Ca -0.06 0.60 -0.11 0.00 -2.02 0.00 0.00 63.50 61.91 1a4s n PRO 144 Cb 0.60 -2.21 0.03 0.00 -0.02 0.00 0.00 33.50 31.90 1a4s n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a4s n GLY 145 N 2.21 0.15 2.69 -1.23 0.00 -1.26 -3.62 105.19 104.13 1a4s n GLY 145 Ca 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1a4s n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 146 N -1.19 3.11 3.60 -0.02 0.00 -1.18 -4.95 105.19 104.57 1a4s n GLY 146 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1a4s n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s s ALA 147 N -1.59 0.62 0.05 4.61 0.00 -1.24 -4.64 121.76 119.58 1a4s s ALA 147 Ca 0.00 0.11 -0.09 0.00 0.00 0.00 0.00 51.96 51.99 1a4s s ALA 147 Cb 0.00 -3.30 -0.00 0.00 0.00 0.00 0.00 23.12 19.82 1a4s s ALA 147 CO 0.00 -3.15 0.18 -0.59 0.00 0.00 0.00 175.76 172.20 1a4s s PHE 148 N -2.64 0.11 0.27 0.00 -0.71 -0.93 -1.72 117.98 112.36 1a4s s PHE 148 Ca 0.67 -0.40 0.11 0.00 -1.04 0.00 0.00 56.93 56.27 1a4s s PHE 148 Cb -0.23 -0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.48 1a4s s PHE 148 CO 0.61 -0.45 -0.19 0.00 -1.34 0.00 0.00 175.22 173.84 1a4s s ALA 149 N -2.94 2.64 -0.02 1.99 0.00 -0.68 -0.16 121.76 122.59 1a4s s ALA 149 Ca -0.02 -1.85 -0.09 0.00 0.00 0.00 0.00 51.96 50.00 1a4s s ALA 149 Cb 0.01 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1a4s s ALA 149 CO -0.06 0.25 0.20 1.52 0.00 0.00 0.00 175.76 177.67 1a4s s TYR 150 N -2.58 -0.08 -0.02 0.00 -0.85 -0.23 -0.88 117.35 112.71 1a4s s TYR 150 Ca 0.29 0.13 0.02 0.00 -0.52 0.00 0.00 57.07 56.99 1a4s s TYR 150 Cb -0.04 0.02 -0.03 0.00 0.38 0.00 0.00 41.96 42.28 1a4s s TYR 150 CO 0.14 -0.27 -0.03 0.95 -1.52 0.00 0.00 175.55 174.82 1a4s s THR 151 N -1.01 3.98 -0.18 -3.49 -4.23 -0.64 -1.20 115.64 108.87 1a4s s THR 151 Ca -0.11 -0.60 -0.07 0.00 -1.18 0.00 0.00 61.69 59.73 1a4s s THR 151 Cb -0.06 -2.73 -0.04 0.00 1.34 0.00 0.00 72.50 71.01 1a4s s THR 151 CO 0.02 0.43 0.04 -0.13 -0.54 0.00 0.00 174.62 174.45 1a4s s ARG 152 N -1.36 3.92 -0.24 3.99 0.52 -0.65 -3.43 118.95 121.71 1a4s s ARG 152 Ca 0.17 -0.37 -0.23 0.00 -0.52 0.00 0.00 55.73 54.78 1a4s s ARG 152 Cb -0.11 -3.16 -0.01 0.00 0.52 0.00 0.00 34.95 32.19 1a4s s ARG 152 CO 0.08 0.27 0.76 0.50 0.02 0.00 0.00 175.30 176.93 1a4s s ARG 153 N 0.35 4.17 0.18 3.54 3.52 -1.26 -1.38 118.95 128.07 1a4s s ARG 153 Ca 0.02 0.82 0.10 0.00 -0.13 0.00 0.00 55.73 56.54 1a4s s ARG 153 Cb -0.13 -3.64 -0.04 0.00 -1.56 0.00 0.00 34.95 29.58 1a4s s ARG 153 CO 0.01 -0.46 -0.21 -1.21 -0.81 0.00 0.00 175.30 172.61 1a4s s GLU 154 N 2.66 1.41 0.98 5.12 2.02 0.03 -4.91 118.70 126.01 1a4s s GLU 154 Ca 0.32 -1.47 -0.12 0.00 0.02 0.00 0.00 54.97 53.72 1a4s s GLU 154 Cb -0.15 -1.60 0.18 0.00 0.10 0.00 0.00 34.13 32.65 1a4s s GLU 154 CO 0.08 0.34 1.08 -1.25 0.02 0.00 0.00 175.26 175.53 1a4s s PRO 155 N -2.73 0.52 -0.19 0.39 0.04 -1.24 -0.70 135.00 131.09 1a4s s PRO 155 Ca 0.18 0.96 -0.21 0.00 0.04 0.00 0.00 61.00 61.97 1a4s s PRO 155 Cb -0.07 -1.71 -0.18 0.00 0.04 0.00 0.00 34.50 32.58 1a4s s PRO 155 CO 0.08 -2.79 0.24 -0.07 0.04 0.00 0.00 177.00 174.51 1a4s h LEU 156 N -1.95 0.00 0.00 -3.56 4.07 -1.87 -3.43 115.31 108.57 1a4s h LEU 156 Ca -0.52 -0.51 0.00 0.00 0.08 0.00 0.00 57.88 56.93 1a4s h LEU 156 Cb 1.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.04 1a4s h LEU 156 CO 0.51 1.31 0.00 0.61 -1.08 0.00 0.00 178.44 179.79 1a4s n GLY 157 N 1.49 0.28 3.59 0.83 0.00 -1.26 -4.85 105.19 105.27 1a4s n GLY 157 Ca -0.25 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 44.83 1a4s n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4s s VAL 158 N 0.00 5.14 -0.11 1.61 1.01 -1.26 -1.91 120.40 124.88 1a4s s VAL 158 Ca 0.00 0.51 -0.06 0.00 0.00 0.00 0.00 61.98 62.43 1a4s s VAL 158 Cb 0.00 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1a4s s VAL 158 CO 0.00 0.07 0.11 0.00 0.00 0.00 0.00 175.10 175.28 1a4s s ALA 160 N -1.00 3.13 -0.02 0.00 0.00 -0.03 -1.75 121.76 122.09 1a4s s ALA 160 Ca 0.15 -0.83 0.07 0.00 0.00 0.00 0.00 51.96 51.35 1a4s s ALA 160 Cb -0.12 -1.44 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 1a4s s ALA 160 CO 0.04 0.48 -0.24 0.20 0.00 0.00 0.00 175.76 176.23 1a4s s GLY 161 N -0.51 1.31 -0.17 0.00 0.00 -0.75 -0.28 107.32 106.92 1a4s s GLY 161 Ca 0.08 -1.10 0.01 0.00 0.00 0.00 0.00 44.72 43.71 1a4s s GLY 161 CO 0.02 -0.91 -0.20 -0.42 0.00 0.00 0.00 173.10 171.59 1a4s s ILE 162 N -0.63 2.03 0.38 0.90 1.01 -0.06 -1.55 121.20 123.29 1a4s s ILE 162 Ca 0.10 -0.93 0.08 0.00 0.00 0.00 0.00 60.65 59.90 1a4s s ILE 162 Cb -0.10 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 1a4s s ILE 162 CO -0.01 0.54 0.19 -0.76 0.00 0.00 0.00 174.94 174.90 1a4s s LEU 163 N 1.19 3.21 0.44 2.97 1.43 -1.04 -1.76 118.68 125.13 1a4s s LEU 163 Ca 0.02 -0.91 0.07 0.00 -1.03 0.00 0.00 54.13 52.29 1a4s s LEU 163 Cb -0.14 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.42 1a4s s LEU 163 CO -0.10 -0.46 0.37 0.00 0.23 0.00 0.00 176.35 176.39 1a4s s ALA 164 N -2.51 4.08 -2.29 4.21 0.00 -1.26 -3.40 121.76 120.59 1a4s s ALA 164 Ca 0.41 -1.84 0.24 0.00 0.00 0.00 0.00 51.96 50.77 1a4s s ALA 164 Cb 0.00 -0.92 0.29 0.00 0.00 0.00 0.00 23.12 22.49 1a4s s ALA 164 CO 0.23 -0.27 1.29 -2.67 0.00 0.00 0.00 175.76 174.34 1a4s n TRP 165 N -1.57 0.00 0.15 0.00 4.27 -1.26 -4.42 117.44 114.61 1a4s n TRP 165 Ca 0.03 0.00 0.07 0.00 -3.89 0.00 0.00 57.50 53.71 1a4s n TRP 165 Cb 0.62 -0.02 0.06 0.00 -1.36 0.00 0.00 31.31 30.61 1a4s n TRP 165 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 1a4s h ASN 166 N 2.82 0.00 -1.75 -0.67 -1.07 -1.97 -3.39 115.58 109.55 1a4s h ASN 166 Ca 0.00 0.00 -0.51 0.00 0.07 0.00 0.00 56.30 55.86 1a4s h ASN 166 Cb 0.75 0.00 -0.35 0.00 -2.07 0.00 0.00 38.32 36.65 1a4s h ASN 166 CO 0.00 0.25 -0.99 -1.22 0.07 0.00 0.00 177.43 175.54 1a4s n TYR 167 N -3.04 -0.97 0.27 4.14 4.02 -1.26 -5.04 117.16 115.28 1a4s n TYR 167 Ca 0.01 -3.21 -0.16 0.00 -0.01 0.00 0.00 57.90 54.53 1a4s n TYR 167 Cb 0.64 0.06 -0.08 0.00 -0.02 0.00 0.00 39.34 39.94 1a4s n TYR 167 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1a4s h PRO 168 N 4.28 -0.67 -0.08 -0.72 0.11 -1.77 0.12 132.00 133.26 1a4s h PRO 168 Ca 0.07 0.05 -0.19 0.00 0.11 0.00 0.00 66.00 66.04 1a4s h PRO 168 Cb 0.91 0.15 0.01 0.00 0.11 0.00 0.00 31.00 32.19 1a4s h PRO 168 CO 0.42 -0.45 -0.69 0.35 -0.21 0.00 0.00 178.00 177.41 1a4s h PHE 169 N -0.70 0.85 -0.24 0.65 3.57 -1.94 -2.71 116.94 116.42 1a4s h PHE 169 Ca -0.05 -0.41 -0.03 0.00 3.53 0.00 0.00 57.97 61.01 1a4s h PHE 169 Cb 0.57 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1a4s h PHE 169 CO -0.09 1.22 0.02 1.98 -2.23 0.00 0.00 178.31 179.21 1a4s h MET 170 N 0.24 0.42 -0.04 1.11 4.05 -1.79 -2.81 114.93 116.10 1a4s h MET 170 Ca -0.06 -0.12 -0.06 0.00 -0.28 0.00 0.00 59.70 59.18 1a4s h MET 170 Cb 1.35 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 32.09 1a4s h MET 170 CO 0.14 0.57 -0.24 0.97 0.23 0.00 0.00 176.91 178.58 1a4s h ILE 171 N 0.21 1.20 -0.39 1.77 2.10 -1.05 0.51 117.51 121.85 1a4s h ILE 171 Ca 0.07 -0.93 0.00 0.00 1.08 0.00 0.00 64.86 65.09 1a4s h ILE 171 Cb 0.37 1.44 -0.02 0.00 -1.09 0.00 0.00 36.82 37.52 1a4s h ILE 171 CO 0.01 0.27 0.25 0.00 -1.08 0.00 0.00 178.15 177.60 1a4s h ALA 172 N 1.69 0.50 -0.26 0.18 0.00 -1.44 -2.62 119.26 117.30 1a4s h ALA 172 Ca 0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1a4s h ALA 172 Cb 0.47 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1a4s h ALA 172 CO 0.03 -0.04 -0.10 0.00 0.00 0.00 0.00 179.25 179.15 1a4s h ALA 173 N 1.13 0.36 -0.11 0.00 0.00 -1.13 -0.78 119.26 118.74 1a4s h ALA 173 Ca 0.14 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1a4s h ALA 173 Cb -0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1a4s h ALA 173 CO -0.03 0.20 0.14 -1.49 0.00 0.00 0.00 179.25 178.07 1a4s h TRP 174 N 0.27 0.00 0.02 0.00 4.06 -0.71 -0.11 115.95 119.47 1a4s h TRP 174 Ca 0.06 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.67 1a4s h TRP 174 Cb 0.59 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.69 1a4s h TRP 174 CO 0.06 0.00 -2.08 1.63 -3.56 0.00 0.00 178.44 174.48 1a4s n LYS 175 N -3.67 0.67 -0.05 0.49 5.02 -1.01 -4.30 118.16 115.32 1a4s n LYS 175 Ca -0.00 0.17 -0.05 0.00 -2.02 0.00 0.00 58.31 56.41 1a4s n LYS 175 Cb 0.24 -1.65 0.15 0.00 -0.02 0.00 0.00 35.03 33.75 1a4s n LYS 175 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a4s h ALA 177 N 1.21 -0.74 -0.59 0.00 0.00 -1.21 -1.03 119.26 116.90 1a4s h ALA 177 Ca 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1a4s h ALA 177 Cb 0.65 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1a4s h ALA 177 CO 0.05 -0.76 0.38 -1.00 0.00 0.00 0.00 179.25 177.92 1a4s h PRO 178 N -1.06 0.79 -0.24 0.00 0.13 -1.77 -0.85 132.00 128.99 1a4s h PRO 178 Ca -0.08 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.99 1a4s h PRO 178 Cb 0.63 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1a4s h PRO 178 CO 0.12 0.53 0.11 0.00 -0.23 0.00 0.00 178.00 178.54 1a4s h ALA 179 N 1.61 0.31 -0.26 -0.56 0.00 -1.47 -1.54 119.26 117.35 1a4s h ALA 179 Ca 0.22 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1a4s h ALA 179 Cb -0.07 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1a4s h ALA 179 CO -0.04 -0.12 -0.38 -0.07 0.00 0.00 0.00 179.25 178.64 1a4s h LEU 180 N 0.26 0.78 -1.05 0.00 4.07 -1.04 -0.93 115.31 117.39 1a4s h LEU 180 Ca 0.08 -0.51 -0.03 0.00 0.08 0.00 0.00 57.88 57.50 1a4s h LEU 180 Cb 0.13 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 1a4s h LEU 180 CO -0.01 1.14 0.31 0.00 -1.08 0.00 0.00 178.44 178.80 1a4s h ALA 181 N 0.66 1.26 0.00 1.53 0.00 -0.88 -1.48 119.26 120.35 1a4s h ALA 181 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1a4s h ALA 181 Cb 0.97 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1a4s h ALA 181 CO 0.09 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.90 1a4s n GLY 183 N 0.32 0.99 3.97 0.00 0.00 -0.56 -3.72 105.19 106.20 1a4s n GLY 183 Ca 0.10 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1a4s n GLY 183 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a4s s ASN 184 N -2.01 5.21 0.26 1.61 0.01 -0.37 -3.94 114.94 115.70 1a4s s ASN 184 Ca 0.00 0.00 0.07 0.00 -0.71 0.00 0.00 52.86 52.22 1a4s s ASN 184 Cb 0.00 -0.85 -0.03 0.00 0.41 0.00 0.00 41.25 40.77 1a4s s ASN 184 CO 0.00 -1.20 0.23 0.00 -1.51 0.00 0.00 177.10 174.62 1a4s s ALA 185 N -2.81 3.66 0.00 0.60 0.00 -0.80 -4.32 121.76 118.10 1a4s s ALA 185 Ca 0.58 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1a4s s ALA 185 Cb -0.10 -1.37 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 1a4s s ALA 185 CO 0.39 0.23 -0.05 0.08 0.00 0.00 0.00 175.76 176.41 1a4s s VAL 186 N -2.12 0.41 -0.16 0.00 1.01 0.02 -1.85 120.40 117.71 1a4s s VAL 186 Ca 0.34 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1a4s s VAL 186 Cb -0.08 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 35.95 1a4s s VAL 186 CO 0.26 0.03 -0.15 -0.69 0.00 0.00 0.00 175.10 174.55 1a4s s VAL 187 N -0.33 1.66 0.24 2.92 1.01 -0.72 -0.87 120.40 124.31 1a4s s VAL 187 Ca -0.00 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.35 1a4s s VAL 187 Cb -0.03 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1a4s s VAL 187 CO -0.00 0.44 -0.16 0.72 0.00 0.00 0.00 175.10 176.10 1a4s s PHE 188 N 1.45 1.95 -0.27 5.22 -0.12 -0.42 -1.81 117.98 123.98 1a4s s PHE 188 Ca 0.04 -0.49 0.00 0.00 -0.05 0.00 0.00 56.93 56.44 1a4s s PHE 188 Cb -0.13 -0.90 0.08 0.00 -0.63 0.00 0.00 43.02 41.44 1a4s s PHE 188 CO -0.11 0.49 0.02 0.21 -0.05 0.00 0.00 175.22 175.78 1a4s s LYS 189 N -3.60 1.18 0.71 1.99 2.20 -0.59 -1.17 119.74 120.45 1a4s s LYS 189 Ca 0.26 -1.06 -0.15 0.00 -0.36 0.00 0.00 55.97 54.65 1a4s s LYS 189 Cb -0.02 -2.43 0.03 0.00 -1.51 0.00 0.00 37.83 33.90 1a4s s LYS 189 CO 0.10 -0.77 1.20 -2.14 -0.36 0.00 0.00 175.35 173.38 1a4s s PRO 190 N 1.46 2.30 0.31 4.03 0.02 -1.25 -2.48 135.00 139.38 1a4s s PRO 190 Ca 0.02 1.74 -0.27 0.00 0.02 0.00 0.00 61.00 62.51 1a4s s PRO 190 Cb -0.18 -1.85 -0.14 0.00 0.02 0.00 0.00 34.50 32.35 1a4s s PRO 190 CO -0.12 -1.71 0.91 0.45 -0.33 0.00 0.00 177.00 176.20 1a4s n SER 191 N -2.55 0.82 0.00 2.53 2.88 -1.22 -4.59 113.62 111.49 1a4s n SER 191 Ca 0.13 1.13 0.06 0.00 -1.33 0.00 0.00 58.87 58.86 1a4s n SER 191 Cb 0.50 -1.24 0.26 0.00 -0.75 0.00 0.00 64.21 62.98 1a4s n SER 191 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1a4s n PRO 192 N 0.67 0.01 0.10 -1.46 -0.04 -1.26 -1.83 135.00 131.20 1a4s n PRO 192 Ca 0.11 0.28 0.07 0.00 -0.04 0.00 0.00 63.50 63.92 1a4s n PRO 192 Cb 0.33 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 1a4s n PRO 192 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1a4s h MET 193 N 0.00 0.00 -2.05 0.54 2.86 -1.91 -3.39 114.93 110.98 1a4s h MET 193 Ca 0.00 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.07 1a4s h MET 193 Cb 0.20 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 31.46 1a4s h MET 193 CO 0.00 0.15 -0.98 0.25 1.06 0.00 0.00 176.91 177.40 1a4s n THR 194 N -2.88 0.12 0.87 2.22 -2.24 -0.76 -4.62 114.28 106.99 1a4s n THR 194 Ca -0.02 -4.34 0.12 0.00 -2.27 0.00 0.00 64.05 57.54 1a4s n THR 194 Cb 0.66 -1.97 0.32 0.00 -2.10 0.00 0.00 70.33 67.25 1a4s n THR 194 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1a4s n PRO 195 N 1.24 0.09 -0.03 -0.78 -0.04 -1.19 -4.52 135.00 129.76 1a4s n PRO 195 Ca 0.23 0.03 -0.20 0.00 -0.04 0.00 0.00 63.50 63.52 1a4s n PRO 195 Cb 0.50 -1.56 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 1a4s n PRO 195 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1a4s n VAL 196 N -1.69 1.71 0.25 0.52 3.14 -1.26 -4.12 118.33 116.88 1a4s n VAL 196 Ca 0.05 -0.64 0.15 0.00 -2.96 0.00 0.00 64.34 60.94 1a4s n VAL 196 Cb 0.37 -1.65 0.51 0.00 -1.06 0.00 0.00 33.84 32.01 1a4s n VAL 196 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 1a4s h THR 197 N 0.05 0.08 -0.85 1.55 1.35 -1.93 -3.02 112.91 110.14 1a4s h THR 197 Ca -0.46 -0.75 0.15 0.00 -0.55 0.00 0.00 66.41 64.80 1a4s h THR 197 Cb 2.00 1.69 -0.09 0.00 -1.73 0.00 0.00 68.15 70.02 1a4s h THR 197 CO 0.04 0.04 0.43 1.23 -0.25 0.00 0.00 175.52 177.02 1a4s h GLY 198 N 2.60 1.38 2.00 5.82 0.00 -1.84 -1.44 103.07 111.59 1a4s h GLY 198 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 1a4s h GLY 198 CO 0.00 -0.04 0.00 -0.24 0.00 0.00 0.00 176.54 176.26 1a4s h VAL 199 N 0.62 0.00 -0.27 4.60 3.04 -1.72 -2.81 116.25 119.70 1a4s h VAL 199 Ca 0.47 -0.72 -0.04 0.00 -1.01 0.00 0.00 66.70 65.40 1a4s h VAL 199 Cb 0.66 1.70 -0.01 0.00 -2.01 0.00 0.00 31.29 31.63 1a4s h VAL 199 CO -0.37 0.00 0.02 0.40 -1.01 0.00 0.00 177.57 176.61 1a4s h ILE 200 N 0.00 1.25 -0.49 3.17 1.08 -1.40 0.33 117.51 121.45 1a4s h ILE 200 Ca 0.00 -0.86 0.09 0.00 -0.39 0.00 0.00 64.86 63.70 1a4s h ILE 200 Cb 0.81 1.29 -0.07 0.00 -3.07 0.00 0.00 36.82 35.77 1a4s h ILE 200 CO 0.00 0.27 0.04 0.25 -0.69 0.00 0.00 178.15 178.03 1a4s h LEU 201 N 0.25 -0.12 -1.13 1.44 5.85 -1.33 0.33 115.31 120.60 1a4s h LEU 201 Ca 0.08 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1a4s h LEU 201 Cb 0.38 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1a4s h LEU 201 CO 0.01 -0.03 0.15 0.00 -0.34 0.00 0.00 178.44 178.23 1a4s h ALA 202 N 1.41 1.31 -0.22 1.25 0.00 -1.18 -1.51 119.26 120.31 1a4s h ALA 202 Ca 0.24 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1a4s h ALA 202 Cb 0.35 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1a4s h ALA 202 CO -0.37 0.50 -0.36 0.93 0.00 0.00 0.00 179.25 179.95 1a4s h GLU 203 N 0.74 0.48 -0.14 0.00 5.08 0.09 -3.03 114.58 117.80 1a4s h GLU 203 Ca 0.17 -0.22 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 1a4s h GLU 203 Cb 0.23 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1a4s h GLU 203 CO -0.01 0.78 -0.40 0.82 -1.00 0.00 0.00 179.01 179.20 1a4s h ILE 204 N 0.41 1.30 -0.79 3.13 2.04 -0.01 -0.22 117.51 123.37 1a4s h ILE 204 Ca 0.04 -1.51 -0.03 0.00 1.00 0.00 0.00 64.86 64.36 1a4s h ILE 204 Cb 0.82 1.63 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 1a4s h ILE 204 CO 0.07 0.46 0.36 -0.26 0.00 0.00 0.00 178.15 178.78 1a4s h PHE 205 N 0.27 1.16 -0.53 1.37 0.04 -1.24 0.22 116.94 118.23 1a4s h PHE 205 Ca 0.03 -0.07 -0.05 0.00 2.80 0.00 0.00 57.97 60.68 1a4s h PHE 205 Cb 0.82 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 38.59 1a4s h PHE 205 CO 0.02 0.85 0.12 0.45 -0.60 0.00 0.00 178.31 179.15 1a4s h HIS 206 N 1.13 0.91 -0.87 -0.55 3.86 -1.35 -2.20 115.15 116.06 1a4s h HIS 206 Ca 0.27 -0.11 0.07 0.00 -1.16 0.00 0.00 60.37 59.44 1a4s h HIS 206 Cb 0.15 -0.25 -0.06 0.00 1.06 0.00 0.00 27.41 28.30 1a4s h HIS 206 CO 0.01 0.80 0.54 0.93 0.86 0.00 0.00 177.93 181.07 1a4s h GLU 207 N 0.75 0.94 0.00 2.45 5.08 -0.49 -1.21 114.58 122.09 1a4s h GLU 207 Ca 0.17 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1a4s h GLU 207 Cb 0.36 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1a4s h GLU 207 CO 0.00 0.62 0.00 0.00 -1.00 0.00 0.00 179.01 178.63 1a4s h ALA 208 N 1.42 1.00 0.00 3.43 0.00 -0.18 -3.47 119.26 121.47 1a4s h ALA 208 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1a4s h ALA 208 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1a4s h ALA 208 CO -0.19 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.47 1a4s n GLY 209 N -0.15 1.06 3.77 0.00 0.00 -0.46 -4.74 105.19 104.67 1a4s n GLY 209 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1a4s n GLY 209 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a4s s VAL 210 N -1.57 2.58 0.16 1.61 0.11 -0.89 -4.94 120.40 117.46 1a4s s VAL 210 Ca 0.00 0.51 -0.34 0.00 -2.93 0.00 0.00 61.98 59.22 1a4s s VAL 210 Cb 0.00 -3.29 -0.15 0.00 -1.53 0.00 0.00 36.38 31.40 1a4s s VAL 210 CO 0.00 0.07 1.29 -2.65 -3.33 0.00 0.00 175.10 170.47 1a4s n PRO 211 N -0.00 1.39 -1.67 1.54 -0.02 -1.26 -4.76 135.00 130.22 1a4s n PRO 211 Ca 0.04 0.50 -0.50 0.00 -2.02 0.00 0.00 63.50 61.52 1a4s n PRO 211 Cb 0.44 -2.09 -0.05 0.00 -0.02 0.00 0.00 33.50 31.78 1a4s n PRO 211 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1a4s n VAL 212 N 2.01 0.26 0.00 -1.45 0.31 -1.26 -1.53 118.33 116.67 1a4s n VAL 212 Ca 0.16 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 1a4s n VAL 212 Cb 0.25 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 1a4s n VAL 212 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a4s n GLY 213 N 3.74 0.37 0.37 2.92 0.00 -1.26 -4.32 105.19 107.01 1a4s n GLY 213 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.21 1a4s n GLY 213 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1a4s h LEU 214 N 0.00 1.12 -8.06 0.99 5.85 -1.53 -3.23 115.31 110.45 1a4s h LEU 214 Ca 0.00 -0.04 -0.67 0.00 0.84 0.00 0.00 57.88 58.01 1a4s h LEU 214 Cb 0.00 -0.28 -0.35 0.00 0.37 0.00 0.00 40.66 40.40 1a4s h LEU 214 CO 0.00 0.82 -0.83 -0.69 -0.34 0.00 0.00 178.44 177.40 1a4s s VAL 215 N -6.05 2.21 0.19 1.05 1.01 -1.26 -0.80 120.40 116.75 1a4s s VAL 215 Ca -0.13 -1.02 0.11 0.00 0.00 0.00 0.00 61.98 60.94 1a4s s VAL 215 Cb 0.18 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1a4s s VAL 215 CO 0.82 0.43 -0.23 0.20 0.00 0.00 0.00 175.10 176.32 1a4s s ASN 216 N 1.28 3.26 -0.07 3.32 0.01 -0.05 -4.86 114.94 117.83 1a4s s ASN 216 Ca 0.03 -0.87 0.01 0.00 -0.71 0.00 0.00 52.86 51.31 1a4s s ASN 216 Cb -0.14 -0.23 0.02 0.00 0.41 0.00 0.00 41.25 41.31 1a4s s ASN 216 CO -0.11 0.08 -0.06 -0.69 -1.51 0.00 0.00 177.10 174.82 1a4s s VAL 217 N -1.77 0.70 -0.08 1.60 1.01 0.14 -1.31 120.40 120.69 1a4s s VAL 217 Ca 0.20 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.04 1a4s s VAL 217 Cb -0.07 -0.73 0.01 0.00 0.00 0.00 0.00 36.38 35.58 1a4s s VAL 217 CO 0.09 0.28 -0.18 0.68 0.00 0.00 0.00 175.10 175.98 1a4s s VAL 218 N 1.20 1.57 0.26 2.92 -7.23 -0.32 -1.16 120.40 117.65 1a4s s VAL 218 Ca -0.06 -0.73 0.01 0.00 -1.81 0.00 0.00 61.98 59.39 1a4s s VAL 218 Cb -0.14 -1.39 -0.04 0.00 0.56 0.00 0.00 36.38 35.37 1a4s s VAL 218 CO -0.02 0.45 0.44 -1.10 -0.31 0.00 0.00 175.10 174.56 1a4s s GLN 219 N 0.56 3.49 0.00 4.82 -1.52 -1.26 -3.95 119.66 121.80 1a4s s GLN 219 Ca -0.16 -0.46 0.00 0.00 -1.95 0.00 0.00 55.36 52.80 1a4s s GLN 219 Cb -0.17 -2.79 0.00 0.00 -0.22 0.00 0.00 33.01 29.83 1a4s s GLN 219 CO 0.05 0.32 0.00 0.41 -0.25 0.00 0.00 175.29 175.83 1a4s n GLY 220 N -1.25 -1.72 0.00 3.09 0.00 -1.26 -0.57 105.19 103.48 1a4s n GLY 220 Ca -0.06 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1a4s n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 221 N -1.18 2.64 0.23 -0.02 0.00 -1.26 -4.22 105.19 101.38 1a4s n GLY 221 Ca 0.00 -1.35 -0.04 0.00 0.00 0.00 0.00 46.02 44.63 1a4s n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s h ALA 222 N -0.31 0.74 -0.39 4.61 0.00 -2.01 -0.94 119.26 120.95 1a4s h ALA 222 Ca 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1a4s h ALA 222 Cb 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1a4s h ALA 222 CO 0.00 0.01 0.23 1.49 0.00 0.00 0.00 179.25 180.98 1a4s h GLU 223 N 0.62 0.54 -1.01 0.00 4.81 -1.96 0.38 114.58 117.96 1a4s h GLU 223 Ca 0.24 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.45 1a4s h GLU 223 Cb 0.10 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.31 1a4s h GLU 223 CO -0.14 0.42 0.66 1.15 -0.73 0.00 0.00 179.01 180.38 1a4s h THR 224 N 0.51 1.19 -0.37 0.32 2.02 -1.68 -0.68 112.91 114.22 1a4s h THR 224 Ca 0.14 -0.44 -0.14 0.00 0.77 0.00 0.00 66.41 66.74 1a4s h THR 224 Cb 0.03 -0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.22 1a4s h THR 224 CO -0.02 0.24 -0.33 1.23 0.37 0.00 0.00 175.52 177.00 1a4s h GLY 225 N 1.29 0.90 0.98 2.16 0.00 -0.34 -2.78 103.07 105.29 1a4s h GLY 225 Ca 0.39 -0.87 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 1a4s h GLY 225 CO -0.12 0.79 0.27 1.76 0.00 0.00 0.00 176.54 179.23 1a4s h SER 226 N 0.69 0.69 -0.90 0.19 0.02 0.08 -2.55 113.55 111.78 1a4s h SER 226 Ca 0.07 -0.12 0.10 0.00 -0.84 0.00 0.00 61.79 61.00 1a4s h SER 226 Cb 0.89 -0.18 -0.08 0.00 0.14 0.00 0.00 62.40 63.17 1a4s h SER 226 CO 0.08 0.62 0.55 -0.07 -1.14 0.00 0.00 176.83 176.87 1a4s h LEU 227 N 0.72 0.81 -0.34 5.07 3.38 -0.87 -0.80 115.31 123.28 1a4s h LEU 227 Ca 0.18 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1a4s h LEU 227 Cb 0.10 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1a4s h LEU 227 CO -0.02 0.46 0.20 -0.07 0.09 0.00 0.00 178.44 179.09 1a4s h LEU 228 N 0.91 0.41 -1.73 1.67 3.38 -1.30 -0.02 115.31 118.62 1a4s h LEU 228 Ca 0.43 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.32 1a4s h LEU 228 Cb 0.37 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1a4s h LEU 228 CO -0.24 0.35 -0.05 0.00 0.09 0.00 0.00 178.44 178.59 1a4s n HIS 230 N -4.42 0.33 -1.96 0.00 8.25 -0.52 -4.29 115.22 112.61 1a4s n HIS 230 Ca -0.02 0.10 -0.42 0.00 -0.26 0.00 0.00 57.72 57.12 1a4s n HIS 230 Cb 0.16 -0.49 -0.03 0.00 1.12 0.00 0.00 29.99 30.76 1a4s n HIS 230 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1a4s s HIS 231 N -3.14 2.89 -0.08 4.41 5.04 -0.04 -4.89 115.29 119.48 1a4s s HIS 231 Ca 0.06 0.57 0.30 0.00 -1.54 0.00 0.00 55.06 54.45 1a4s s HIS 231 Cb 0.15 -3.91 1.35 0.00 0.04 0.00 0.00 32.58 30.21 1a4s s HIS 231 CO 0.75 -3.43 1.89 -1.00 -2.34 0.00 0.00 174.74 170.61 1a4s h PRO 232 N 7.27 0.00 -0.27 2.88 0.13 -1.90 -3.01 132.00 137.09 1a4s h PRO 232 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1a4s h PRO 232 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1a4s h PRO 232 CO 0.91 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.77 1a4s n ASN 233 N -2.66 3.44 -4.69 1.44 5.03 -1.26 -4.90 115.26 111.67 1a4s n ASN 233 Ca 0.00 -2.63 -0.37 0.00 0.87 0.00 0.00 54.58 52.45 1a4s n ASN 233 Cb 0.21 -0.41 -0.08 0.00 -1.02 0.00 0.00 39.78 38.48 1a4s n ASN 233 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1a4s s VAL 234 N -2.12 5.26 -0.25 2.41 1.01 -1.14 -4.47 120.40 121.10 1a4s s VAL 234 Ca 0.34 0.55 0.22 0.00 0.00 0.00 0.00 61.98 63.09 1a4s s VAL 234 Cb 0.25 -3.65 0.04 0.00 0.00 0.00 0.00 36.38 33.01 1a4s s VAL 234 CO 0.11 0.31 1.11 0.00 0.00 0.00 0.00 175.10 176.64 1a4s h ALA 235 N 7.19 0.59 -2.50 5.51 0.00 -1.02 -3.48 119.26 125.55 1a4s h ALA 235 Ca -0.38 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 1a4s h ALA 235 Cb 1.16 0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.76 1a4s h ALA 235 CO 0.72 0.11 -0.16 0.21 0.00 0.00 0.00 179.25 180.12 1a4s s LYS 236 N -3.29 0.66 -0.05 0.00 2.20 -1.23 -2.60 119.74 115.44 1a4s s LYS 236 Ca 0.00 0.26 0.07 0.00 -0.36 0.00 0.00 55.97 55.94 1a4s s LYS 236 Cb 0.09 0.31 -0.01 0.00 -1.51 0.00 0.00 37.83 36.70 1a4s s LYS 236 CO 0.77 -0.15 -0.25 0.08 -0.36 0.00 0.00 175.35 175.44 1a4s s VAL 237 N -0.57 2.03 -0.14 4.02 1.01 -0.18 -0.85 120.40 125.73 1a4s s VAL 237 Ca -0.07 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 60.86 1a4s s VAL 237 Cb -0.03 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.65 1a4s s VAL 237 CO 0.03 0.57 -0.18 -0.55 0.00 0.00 0.00 175.10 174.98 1a4s s SER 238 N -0.29 2.80 0.02 3.32 0.15 0.61 -1.97 113.70 118.33 1a4s s SER 238 Ca 0.01 -0.53 0.07 0.00 0.70 0.00 0.00 55.95 56.20 1a4s s SER 238 Cb -0.13 -1.27 -0.03 0.00 -1.71 0.00 0.00 66.02 62.88 1a4s s SER 238 CO 0.02 0.01 -0.21 0.12 1.20 0.00 0.00 173.24 174.38 1a4s s PHE 239 N 1.11 2.47 -0.05 3.44 5.36 -0.77 -0.88 117.98 128.66 1a4s s PHE 239 Ca -0.02 -0.32 0.03 0.00 -0.96 0.00 0.00 56.93 55.66 1a4s s PHE 239 Cb -0.14 -1.47 0.00 0.00 -0.34 0.00 0.00 43.02 41.07 1a4s s PHE 239 CO -0.06 0.16 -0.14 0.99 -1.46 0.00 0.00 175.22 174.71 1a4s s THR 240 N -0.81 1.23 -4.43 0.12 2.01 -0.72 -1.72 115.64 111.31 1a4s s THR 240 Ca 0.13 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1a4s s THR 240 Cb -0.10 -1.08 0.00 0.00 0.01 0.00 0.00 72.50 71.33 1a4s s THR 240 CO 0.03 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 1a4s n GLY 241 N 3.40 -0.50 3.86 4.40 0.00 -0.96 -4.28 105.19 111.11 1a4s n GLY 241 Ca -0.20 -1.01 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 1a4s n GLY 241 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a4s s SER 242 N -4.00 5.27 0.07 1.61 1.04 -1.26 -3.23 113.70 113.19 1a4s s SER 242 Ca 0.00 1.23 -0.25 0.00 0.48 0.00 0.00 55.95 57.41 1a4s s SER 242 Cb 0.00 -2.04 -0.16 0.00 0.10 0.00 0.00 66.02 63.91 1a4s s SER 242 CO 0.00 -1.46 1.63 0.58 0.98 0.00 0.00 173.24 174.96 1a4s h VAL 243 N -0.74 0.90 -0.79 5.02 2.07 -1.95 0.18 116.25 120.95 1a4s h VAL 243 Ca -0.45 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 1a4s h VAL 243 Cb 1.25 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1a4s h VAL 243 CO 0.62 0.04 0.39 -0.65 0.02 0.00 0.00 177.57 177.99 1a4s h PRO 244 N -0.27 1.13 -0.04 1.57 0.11 -1.98 -0.68 132.00 131.85 1a4s h PRO 244 Ca -0.02 -0.16 -0.17 0.00 0.11 0.00 0.00 66.00 65.76 1a4s h PRO 244 Cb 0.22 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1a4s h PRO 244 CO 0.03 0.86 -0.74 1.15 -0.21 0.00 0.00 178.00 179.09 1a4s h THR 245 N 1.13 1.43 -0.42 -1.15 2.02 -1.86 -3.02 112.91 111.05 1a4s h THR 245 Ca 0.27 -2.29 -0.12 0.00 0.77 0.00 0.00 66.41 65.05 1a4s h THR 245 Cb 0.10 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.72 1a4s h THR 245 CO -0.04 0.67 -0.22 1.23 0.37 0.00 0.00 175.52 177.53 1a4s h GLY 246 N 1.61 0.91 0.29 2.16 0.00 0.41 -1.23 103.07 107.22 1a4s h GLY 246 Ca -0.03 -0.79 0.08 0.00 0.00 0.00 0.00 47.33 46.60 1a4s h GLY 246 CO 0.12 0.72 0.01 0.50 0.00 0.00 0.00 176.54 177.88 1a4s h LYS 247 N 0.73 0.12 -0.48 4.80 1.57 -1.16 -1.48 116.57 120.67 1a4s h LYS 247 Ca 0.10 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 1a4s h LYS 247 Cb 0.75 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 1a4s h LYS 247 CO 0.06 0.08 -0.14 0.87 -0.57 0.00 0.00 179.45 179.74 1a4s h LYS 248 N 0.12 0.91 -0.67 3.15 1.57 -1.29 -2.07 116.57 118.29 1a4s h LYS 248 Ca 0.22 -0.34 0.07 0.00 -1.87 0.00 0.00 60.65 58.73 1a4s h LYS 248 Cb 0.32 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.51 1a4s h LYS 248 CO -0.36 0.99 0.35 0.28 -0.57 0.00 0.00 179.45 180.14 1a4s h VAL 249 N 0.81 0.91 -0.36 0.50 2.07 -0.61 0.90 116.25 120.46 1a4s h VAL 249 Ca 0.12 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 1a4s h VAL 249 Cb 0.68 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1a4s h VAL 249 CO 0.05 0.11 -0.02 -0.03 0.02 0.00 0.00 177.57 177.70 1a4s h MET 250 N 0.62 0.65 -0.18 1.57 1.85 -0.82 -1.41 114.93 117.22 1a4s h MET 250 Ca 0.31 -0.22 0.05 0.00 -0.61 0.00 0.00 59.70 59.23 1a4s h MET 250 Cb 0.26 -0.05 -0.05 0.00 0.43 0.00 0.00 31.60 32.19 1a4s h MET 250 CO -0.22 0.77 -0.13 0.93 -0.40 0.00 0.00 176.91 177.86 1a4s h GLU 251 N 0.46 -0.13 -0.27 0.39 5.08 -1.20 -1.93 114.58 116.98 1a4s h GLU 251 Ca 0.10 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1a4s h GLU 251 Cb 0.49 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1a4s h GLU 251 CO 0.02 -0.08 -0.09 0.52 -1.00 0.00 0.00 179.01 178.38 1a4s h MET 252 N -0.13 0.44 0.00 2.33 2.86 -0.74 -2.59 114.93 117.10 1a4s h MET 252 Ca 0.11 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1a4s h MET 252 Cb 0.29 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 1a4s h MET 252 CO -0.26 0.54 -0.05 0.77 1.06 0.00 0.00 176.91 178.97 1a4s h SER 253 N 0.41 0.00 0.24 1.22 0.02 -0.90 -2.74 113.55 111.81 1a4s h SER 253 Ca 0.08 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 1a4s h SER 253 Cb 0.42 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 1a4s h SER 253 CO 0.02 0.05 -0.11 0.00 -1.14 0.00 0.00 176.83 175.65 1a4s h ALA 254 N 1.95 1.45 0.00 3.77 0.00 -0.94 -2.39 119.26 123.11 1a4s h ALA 254 Ca -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1a4s h ALA 254 Cb 0.74 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1a4s h ALA 254 CO 0.01 0.14 -0.14 0.87 0.00 0.00 0.00 179.25 180.13 1a4s h LYS 255 N 0.00 0.00 -0.03 0.00 1.57 -1.62 -2.06 116.57 114.43 1a4s h LYS 255 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a4s h LYS 255 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1a4s h LYS 255 CO 0.01 0.14 -0.03 2.41 -0.57 0.00 0.00 179.45 181.41 1a4s n THR 256 N -4.21 1.96 -3.87 -0.16 -1.04 -1.14 -5.00 114.28 100.83 1a4s n THR 256 Ca -0.02 -2.30 -0.28 0.00 -2.04 0.00 0.00 64.05 59.41 1a4s n THR 256 Cb 0.21 -0.24 0.03 0.00 -1.82 0.00 0.00 70.33 68.51 1a4s n THR 256 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1a4s n VAL 257 N -1.32 -2.63 -2.53 12.58 0.31 -0.78 -4.93 118.33 119.03 1a4s n VAL 257 Ca 0.17 -0.14 -0.36 0.00 -0.01 0.00 0.00 64.34 64.01 1a4s n VAL 257 Cb 0.67 -3.05 -0.04 0.00 -0.91 0.00 0.00 33.84 30.52 1a4s n VAL 257 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1a4s s LYS 258 N -6.47 4.01 0.22 5.55 1.02 -0.92 -5.01 119.74 118.14 1a4s s LYS 258 Ca 0.49 1.47 -0.31 0.00 0.02 0.00 0.00 55.97 57.64 1a4s s LYS 258 Cb -0.24 -2.36 -0.10 0.00 -0.52 0.00 0.00 37.83 34.60 1a4s s LYS 258 CO 0.83 -0.27 1.52 -1.01 -0.92 0.00 0.00 175.35 175.49 1a4s s HIS 259 N -1.77 3.00 -0.04 3.18 3.76 -1.07 -4.89 115.29 117.46 1a4s s HIS 259 Ca 0.62 0.82 0.03 0.00 -0.15 0.00 0.00 55.06 56.38 1a4s s HIS 259 Cb -0.20 -3.90 0.00 0.00 1.11 0.00 0.00 32.58 29.59 1a4s s HIS 259 CO 0.25 -3.13 -0.14 0.08 -0.85 0.00 0.00 174.74 170.95 1a4s s VAL 260 N 0.51 1.23 -0.02 -0.90 1.01 -1.26 -1.01 120.40 119.95 1a4s s VAL 260 Ca 0.65 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 62.09 1a4s s VAL 260 Cb -0.43 -1.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 1a4s s VAL 260 CO 0.38 0.36 -0.19 0.42 0.00 0.00 0.00 175.10 176.08 1a4s s THR 261 N 0.20 1.50 -0.08 3.92 -4.23 -0.83 -4.87 115.64 111.25 1a4s s THR 261 Ca -0.06 -0.80 0.03 0.00 -1.18 0.00 0.00 61.69 59.68 1a4s s THR 261 Cb -0.12 -1.25 0.01 0.00 1.34 0.00 0.00 72.50 72.48 1a4s s THR 261 CO 0.02 0.43 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.61 1a4s s LEU 262 N -0.36 1.78 -0.47 4.79 1.43 -0.43 -1.85 118.68 123.57 1a4s s LEU 262 Ca 0.05 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.80 1a4s s LEU 262 Cb -0.08 -1.02 0.12 0.00 0.03 0.00 0.00 46.19 45.24 1a4s s LEU 262 CO -0.00 0.07 0.21 -1.61 0.23 0.00 0.00 176.35 175.25 1a4s s GLU 263 N 0.59 1.87 0.00 1.70 0.41 -0.70 -1.05 118.70 121.51 1a4s s GLU 263 Ca -0.15 -2.39 0.00 0.00 -0.41 0.00 0.00 54.97 52.02 1a4s s GLU 263 Cb -0.16 -3.32 0.00 0.00 -1.78 0.00 0.00 34.13 28.87 1a4s s GLU 263 CO 0.05 -1.06 0.00 1.28 -0.49 0.00 0.00 175.26 175.04 1a4s n LEU 264 N 3.49 0.00 0.00 1.80 4.32 0.64 -2.27 117.00 124.99 1a4s n LEU 264 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.04 1a4s n LEU 264 Cb 0.35 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.15 1a4s n LEU 264 CO 0.31 -0.25 0.00 0.61 -1.22 0.00 0.00 177.39 176.84 1a4s n GLY 265 N 5.00 1.40 3.83 -0.72 0.00 -1.20 -4.82 105.19 108.69 1a4s n GLY 265 Ca 0.00 -1.70 -0.06 0.00 0.00 0.00 0.00 46.02 44.26 1a4s n GLY 265 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4s s GLY 266 N -0.01 0.14 -0.37 -0.02 0.00 -1.24 -4.56 107.32 101.26 1a4s s GLY 266 Ca 0.00 -0.43 0.13 0.00 0.00 0.00 0.00 44.72 44.41 1a4s s GLY 266 CO 0.00 0.64 0.80 1.17 0.00 0.00 0.00 173.10 175.71 1a4s n LYS 267 N -0.57 1.01 -2.13 2.90 3.00 -1.26 -4.43 118.16 116.69 1a4s n LYS 267 Ca -0.06 -3.26 -0.39 0.00 -0.00 0.00 0.00 58.31 54.61 1a4s n LYS 267 Cb 0.60 -1.57 -0.01 0.00 0.00 0.00 0.00 35.03 34.06 1a4s n LYS 267 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1a4s s SER 268 N -2.48 6.30 0.00 3.14 0.01 -1.23 -4.72 113.70 114.71 1a4s s SER 268 Ca 0.36 2.54 -0.04 0.00 1.31 0.00 0.00 55.95 60.12 1a4s s SER 268 Cb 0.37 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 1a4s s SER 268 CO -0.06 -0.85 0.22 -2.16 0.41 0.00 0.00 173.24 170.80 1a4s s PRO 269 N -2.33 3.49 -0.19 12.44 0.04 -1.26 -1.76 135.00 145.43 1a4s s PRO 269 Ca 0.58 -0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1a4s s PRO 269 Cb -0.35 -3.08 0.04 0.00 0.04 0.00 0.00 34.50 31.15 1a4s s PRO 269 CO 0.44 0.66 -0.09 -1.17 0.04 0.00 0.00 177.00 176.88 1a4s s LEU 270 N -1.94 2.10 -0.23 -3.56 2.96 -0.14 -0.67 118.68 117.20 1a4s s LEU 270 Ca 0.28 -0.83 -0.09 0.00 -0.22 0.00 0.00 54.13 53.27 1a4s s LEU 270 Cb -0.13 -1.14 -0.04 0.00 0.50 0.00 0.00 46.19 45.38 1a4s s LEU 270 CO 0.18 -0.16 0.12 -0.76 -1.32 0.00 0.00 176.35 174.41 1a4s s LEU 271 N 1.46 3.86 -0.32 -0.68 1.43 0.46 -0.35 118.68 124.54 1a4s s LEU 271 Ca -0.01 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 1a4s s LEU 271 Cb -0.16 -2.03 0.08 0.00 0.03 0.00 0.00 46.19 44.12 1a4s s LEU 271 CO -0.08 0.05 0.01 -0.63 0.23 0.00 0.00 176.35 175.93 1a4s s ILE 272 N 1.12 2.45 0.63 -0.59 -1.09 -0.51 0.16 121.20 123.37 1a4s s ILE 272 Ca 0.06 -1.95 -0.07 0.00 -2.23 0.00 0.00 60.65 56.46 1a4s s ILE 272 Cb -0.14 -2.62 0.02 0.00 -1.58 0.00 0.00 42.46 38.14 1a4s s ILE 272 CO 0.04 -0.35 0.96 -0.36 -1.23 0.00 0.00 174.94 174.00 1a4s s PHE 273 N 1.04 3.21 0.14 3.97 0.40 -0.62 -1.56 117.98 124.56 1a4s s PHE 273 Ca 0.02 0.69 0.24 0.00 -0.60 0.00 0.00 56.93 57.28 1a4s s PHE 273 Cb -0.20 -2.89 0.94 0.00 0.51 0.00 0.00 43.02 41.38 1a4s s PHE 273 CO -0.06 -1.00 1.83 1.57 0.70 0.00 0.00 175.22 178.27 1a4s h LYS 274 N -0.35 0.00 -0.44 0.44 2.10 -1.88 -1.99 116.57 114.44 1a4s h LYS 274 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1a4s h LYS 274 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1a4s h LYS 274 CO 0.61 0.22 0.00 -0.40 -2.00 0.00 0.00 179.45 177.88 1a4s n ASP 275 N -3.40 1.41 -4.53 7.07 5.75 -1.26 -4.96 116.55 116.63 1a4s n ASP 275 Ca 0.00 -2.08 -0.29 0.00 -0.01 0.00 0.00 54.79 52.41 1a4s n ASP 275 Cb 0.42 -0.28 0.18 0.00 -1.03 0.00 0.00 41.12 40.42 1a4s n ASP 275 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1a4s s GLU 277 N -5.13 3.41 0.22 0.00 2.02 -1.26 -4.97 118.70 112.99 1a4s s GLU 277 Ca 0.66 -0.10 -0.08 0.00 0.02 0.00 0.00 54.97 55.47 1a4s s GLU 277 Cb -0.16 -4.00 0.34 0.00 0.10 0.00 0.00 34.13 30.41 1a4s s GLU 277 CO 0.56 -1.35 1.71 1.25 0.02 0.00 0.00 175.26 177.46 1a4s h LEU 278 N 10.73 0.08 -0.91 1.80 6.46 -1.96 -1.12 115.31 130.39 1a4s h LEU 278 Ca -0.25 0.11 -0.05 0.00 -0.12 0.00 0.00 57.88 57.57 1a4s h LEU 278 Cb 1.08 0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 41.11 1a4s h LEU 278 CO 1.05 0.04 0.23 -0.08 -0.62 0.00 0.00 178.44 179.06 1a4s h GLU 279 N 0.31 1.03 -0.40 1.25 4.57 -1.99 0.12 114.58 119.48 1a4s h GLU 279 Ca 0.34 -0.20 -0.15 0.00 -1.18 0.00 0.00 59.36 58.17 1a4s h GLU 279 Cb 0.51 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1a4s h GLU 279 CO -0.40 0.87 -0.35 -0.91 -1.18 0.00 0.00 179.01 177.03 1a4s h ASN 280 N 1.00 1.00 -0.73 1.04 2.35 -1.74 0.22 115.58 118.72 1a4s h ASN 280 Ca 0.22 -0.45 0.02 0.00 -0.55 0.00 0.00 56.30 55.55 1a4s h ASN 280 Cb 0.25 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.30 1a4s h ASN 280 CO -0.01 1.25 0.47 0.00 -1.65 0.00 0.00 177.43 177.48 1a4s h ALA 281 N 0.79 0.95 0.17 -0.83 0.00 -0.84 0.24 119.26 119.73 1a4s h ALA 281 Ca 0.07 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1a4s h ALA 281 Cb 0.95 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1a4s h ALA 281 CO 0.09 0.28 -0.10 0.28 0.00 0.00 0.00 179.25 179.80 1a4s h VAL 282 N 0.93 0.79 -0.50 0.00 2.07 -0.30 0.17 116.25 119.41 1a4s h VAL 282 Ca 0.29 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.90 1a4s h VAL 282 Cb -0.02 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 30.46 1a4s h VAL 282 CO -0.10 0.00 0.01 0.03 0.02 0.00 0.00 177.57 177.54 1a4s h ARG 283 N -0.26 0.12 -0.07 1.57 3.08 -0.65 -1.72 114.38 116.46 1a4s h ARG 283 Ca -0.02 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.07 1a4s h ARG 283 Cb 0.21 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 1a4s h ARG 283 CO 0.02 0.08 -0.30 0.78 -1.07 0.00 0.00 179.97 179.48 1a4s h GLY 284 N 0.13 -0.42 1.19 0.04 0.00 -0.07 0.10 103.07 104.04 1a4s h GLY 284 Ca 0.25 0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.96 1a4s h GLY 284 CO -0.41 -0.22 0.52 0.00 0.00 0.00 0.00 176.54 176.43 1a4s h ALA 285 N 0.41 1.47 -0.13 3.60 0.00 -0.49 0.14 119.26 124.26 1a4s h ALA 285 Ca 0.08 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1a4s h ALA 285 Cb 0.52 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1a4s h ALA 285 CO -0.30 0.47 -0.04 -0.07 0.00 0.00 0.00 179.25 179.32 1a4s h LEU 286 N 1.02 0.26 -1.20 0.00 -0.00 -0.90 -2.50 115.31 111.98 1a4s h LEU 286 Ca 0.29 -0.38 0.00 0.00 -0.00 0.00 0.00 57.88 57.79 1a4s h LEU 286 Cb -0.07 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 40.52 1a4s h LEU 286 CO -0.07 0.58 0.00 0.24 -0.00 0.00 0.00 178.44 179.19 1a4s h MET 287 N -0.07 0.00 0.00 1.13 2.86 -0.49 -1.52 114.93 116.85 1a4s h MET 287 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1a4s h MET 287 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1a4s h MET 287 CO 0.01 0.00 -0.19 0.00 1.06 0.00 0.00 176.91 177.79 1a4s n ALA 288 N -1.92 2.70 0.00 6.32 0.00 0.45 -4.42 120.51 123.64 1a4s n ALA 288 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1a4s n ALA 288 Cb 0.24 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1a4s n ALA 288 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1a4s n ASN 289 N -1.66 2.63 -0.66 0.00 3.02 -0.86 -0.87 115.26 116.87 1a4s n ASN 289 Ca 0.06 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.67 1a4s n ASN 289 Cb 0.36 0.29 0.16 0.00 -0.61 0.00 0.00 39.78 39.98 1a4s n ASN 289 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1a4s n PHE 290 N -1.24 0.50 -2.21 3.10 3.72 -0.63 -3.90 117.46 116.80 1a4s n PHE 290 Ca 0.00 -0.52 -0.35 0.00 -0.05 0.00 0.00 57.45 56.53 1a4s n PHE 290 Cb 0.24 -0.05 0.01 0.00 -0.94 0.00 0.00 39.48 38.74 1a4s n PHE 290 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1a4s s LEU 291 N -1.12 3.72 -1.56 4.37 1.43 -1.26 -3.52 118.68 120.74 1a4s s LEU 291 Ca 0.24 2.19 -0.08 0.00 -1.03 0.00 0.00 54.13 55.45 1a4s s LEU 291 Cb 0.14 -4.58 0.07 0.00 0.03 0.00 0.00 46.19 41.85 1a4s s LEU 291 CO 0.15 -1.28 0.52 0.41 0.23 0.00 0.00 176.35 176.38 1a4s n THR 292 N -1.38 -1.85 -2.35 5.49 -1.04 -1.26 -0.63 114.28 111.26 1a4s n THR 292 Ca 0.12 -0.28 -0.20 0.00 -2.04 0.00 0.00 64.05 61.64 1a4s n THR 292 Cb 0.51 -1.96 -0.01 0.00 -1.82 0.00 0.00 70.33 67.05 1a4s n THR 292 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a4s n GLN 293 N -4.41 -1.72 -1.10 -2.82 3.00 -1.23 -1.46 117.38 107.64 1a4s n GLN 293 Ca -0.14 0.99 -0.04 0.00 -0.01 0.00 0.00 57.00 57.80 1a4s n GLN 293 Cb 0.60 -5.63 -0.02 0.00 0.00 0.00 0.00 30.24 25.19 1a4s n GLN 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1a4s n GLY 294 N -0.96 0.65 2.75 1.08 0.00 0.20 -3.07 105.19 105.84 1a4s n GLY 294 Ca -0.24 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 1a4s n GLY 294 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1a4s n GLN 295 N -2.50 4.59 -4.22 1.61 6.02 -0.53 -2.57 117.38 119.77 1a4s n GLN 295 Ca -0.04 -4.74 -0.20 0.00 -0.01 0.00 0.00 57.00 52.02 1a4s n GLN 295 Cb 0.16 -2.39 -0.16 0.00 1.02 0.00 0.00 30.24 28.88 1a4s n GLN 295 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1a4s s VAL 296 N -4.30 0.58 0.23 5.09 1.01 -1.26 -4.84 120.40 116.90 1a4s s VAL 296 Ca 0.42 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 1a4s s VAL 296 Cb 0.22 -0.58 0.10 0.00 0.00 0.00 0.00 36.38 36.12 1a4s s VAL 296 CO -0.12 0.22 1.72 0.00 0.00 0.00 0.00 175.10 176.92 1a4s n THR 298 N -4.21 0.00 -1.52 0.00 -2.24 -1.26 -3.65 114.28 101.40 1a4s n THR 298 Ca 0.03 -0.06 -0.48 0.00 -2.27 0.00 0.00 64.05 61.27 1a4s n THR 298 Cb 0.30 -0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 68.36 1a4s n THR 298 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1a4s n ASN 299 N -0.92 0.40 -4.46 3.42 5.03 -0.90 -4.69 115.26 113.14 1a4s n ASN 299 Ca 0.16 1.15 -0.44 0.00 0.87 0.00 0.00 54.58 56.32 1a4s n ASN 299 Cb 0.26 -1.13 -0.01 0.00 -1.02 0.00 0.00 39.78 37.87 1a4s n ASN 299 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1a4s s GLY 300 N -0.51 2.14 0.00 7.41 0.00 -0.05 -3.58 107.32 112.73 1a4s s GLY 300 Ca 0.67 -3.05 0.27 0.00 0.00 0.00 0.00 44.72 42.60 1a4s s GLY 300 CO 0.56 2.06 1.58 -1.30 0.00 0.00 0.00 173.10 176.01 1a4s n THR 301 N 5.13 0.00 -3.94 0.90 -2.24 -0.72 -4.41 114.28 109.00 1a4s n THR 301 Ca 0.31 -0.25 -0.33 0.00 -2.27 0.00 0.00 64.05 61.51 1a4s n THR 301 Cb 0.46 0.67 -0.14 0.00 -2.10 0.00 0.00 70.33 69.22 1a4s n THR 301 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1a4s s ARG 302 N -2.17 1.78 -0.41 -0.78 0.52 -1.09 -2.03 118.95 114.76 1a4s s ARG 302 Ca 0.31 -1.77 -0.16 0.00 -0.52 0.00 0.00 55.73 53.59 1a4s s ARG 302 Cb 0.20 -3.30 0.02 0.00 0.52 0.00 0.00 34.95 32.39 1a4s s ARG 302 CO 0.40 -0.93 0.38 0.08 0.02 0.00 0.00 175.30 175.25 1a4s s VAL 303 N 1.02 5.16 -0.31 3.52 1.01 0.20 -0.96 120.40 130.03 1a4s s VAL 303 Ca 0.07 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 61.48 1a4s s VAL 303 Cb -0.20 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1a4s s VAL 303 CO -0.06 -0.35 0.36 -0.36 0.00 0.00 0.00 175.10 174.69 1a4s s PHE 304 N 1.97 3.22 -0.13 5.22 0.08 0.52 -1.33 117.98 127.53 1a4s s PHE 304 Ca 0.10 0.18 0.02 0.00 0.12 0.00 0.00 56.93 57.35 1a4s s PHE 304 Cb -0.18 -2.62 0.01 0.00 -0.57 0.00 0.00 43.02 39.66 1a4s s PHE 304 CO 0.12 -0.33 -0.21 0.08 -0.10 0.00 0.00 175.22 174.78 1a4s s VAL 305 N 2.04 1.97 0.09 -0.44 1.01 0.50 -1.43 120.40 124.15 1a4s s VAL 305 Ca 0.13 -0.93 -0.35 0.00 0.00 0.00 0.00 61.98 60.83 1a4s s VAL 305 Cb -0.16 -1.75 -0.14 0.00 0.00 0.00 0.00 36.38 34.33 1a4s s VAL 305 CO 0.11 0.53 1.60 1.67 0.00 0.00 0.00 175.10 179.01 1a4s n GLN 306 N 4.05 1.97 -0.34 2.72 7.27 -0.60 -2.57 117.38 129.87 1a4s n GLN 306 Ca -0.20 0.71 0.16 0.00 0.07 0.00 0.00 57.00 57.75 1a4s n GLN 306 Cb 0.52 -2.47 0.32 0.00 2.41 0.00 0.00 30.24 31.01 1a4s n GLN 306 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 1a4s h ARG 307 N 6.33 0.00 -0.95 3.69 2.43 -1.61 -1.11 114.38 123.16 1a4s h ARG 307 Ca -0.46 -0.00 0.10 0.00 -0.81 0.00 0.00 59.98 58.81 1a4s h ARG 307 Cb 1.27 -0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.75 1a4s h ARG 307 CO 0.88 0.00 0.61 0.93 -1.51 0.00 0.00 179.97 180.89 1a4s h GLU 308 N 0.00 0.96 -0.50 0.20 3.07 -1.88 -2.60 114.58 113.83 1a4s h GLU 308 Ca 0.63 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 1a4s h GLU 308 Cb 1.34 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 1a4s h GLU 308 CO -0.92 0.63 0.00 0.44 -1.40 0.00 0.00 179.01 177.77 1a4s n ILE 309 N -4.55 0.80 0.03 3.13 -5.35 -0.43 -4.73 119.36 108.27 1a4s n ILE 309 Ca 0.16 -0.90 -0.11 0.00 -0.27 0.00 0.00 62.75 61.63 1a4s n ILE 309 Cb 0.29 0.68 -0.06 0.00 -1.74 0.00 0.00 39.64 38.82 1a4s n ILE 309 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 1a4s h MET 310 N 3.68 -0.04 -0.03 6.28 4.05 -1.41 -0.47 114.93 126.98 1a4s h MET 310 Ca 0.00 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.46 1a4s h MET 310 Cb 0.90 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.66 1a4s h MET 310 CO 0.00 -0.03 -0.21 -1.35 0.23 0.00 0.00 176.91 175.55 1a4s h PRO 311 N -0.04 -0.31 0.00 0.39 0.11 -1.85 -0.43 132.00 129.88 1a4s h PRO 311 Ca 0.03 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.10 1a4s h PRO 311 Cb 0.08 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 1a4s h PRO 311 CO -0.06 -0.20 -0.28 -0.56 -0.21 0.00 0.00 178.00 176.68 1a4s h GLN 312 N -0.32 0.00 -0.18 1.05 -0.00 -1.88 -1.41 115.11 112.37 1a4s h GLN 312 Ca 0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.68 1a4s h GLN 312 Cb 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.89 1a4s h GLN 312 CO -0.22 0.28 -0.05 0.35 -0.00 0.00 0.00 178.83 179.20 1a4s h PHE 313 N 0.00 0.39 -0.77 0.06 3.57 -0.26 -2.98 116.94 116.94 1a4s h PHE 313 Ca -0.00 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.37 1a4s h PHE 313 Cb 0.55 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 1a4s h PHE 313 CO 0.00 0.61 0.30 -0.07 -2.23 0.00 0.00 178.31 176.93 1a4s h LEU 314 N 0.06 1.07 0.19 0.59 4.07 -0.92 0.94 115.31 121.30 1a4s h LEU 314 Ca 0.04 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.83 1a4s h LEU 314 Cb 0.49 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 1a4s h LEU 314 CO 0.02 0.96 -0.17 -0.08 -1.08 0.00 0.00 178.44 178.09 1a4s h GLU 315 N 1.13 -0.36 -0.09 1.13 4.81 -1.26 -0.76 114.58 119.18 1a4s h GLU 315 Ca 0.26 0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.35 1a4s h GLU 315 Cb 0.22 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1a4s h GLU 315 CO -0.02 -0.24 -0.65 1.49 -0.73 0.00 0.00 179.01 178.86 1a4s h GLU 316 N -0.37 0.35 -0.03 1.92 4.57 -1.38 -2.91 114.58 116.73 1a4s h GLU 316 Ca -0.00 -0.26 -0.19 0.00 -1.18 0.00 0.00 59.36 57.73 1a4s h GLU 316 Cb 0.35 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 1a4s h GLU 316 CO -0.03 0.88 -0.81 -0.24 -1.18 0.00 0.00 179.01 177.63 1a4s h VAL 317 N 0.25 1.44 -0.37 0.32 3.04 -0.59 -1.73 116.25 118.61 1a4s h VAL 317 Ca -0.01 -2.39 -0.11 0.00 -1.01 0.00 0.00 66.70 63.17 1a4s h VAL 317 Cb 1.19 2.31 -0.01 0.00 -2.01 0.00 0.00 31.29 32.76 1a4s h VAL 317 CO 0.11 0.70 -0.23 0.58 -1.01 0.00 0.00 177.57 177.72 1a4s h VAL 318 N 0.17 1.27 -0.34 1.51 2.07 -1.20 -1.25 116.25 118.48 1a4s h VAL 318 Ca -0.04 -1.34 -0.07 0.00 0.82 0.00 0.00 66.70 66.07 1a4s h VAL 318 Cb 1.41 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 1a4s h VAL 318 CO 0.13 0.45 -0.07 0.50 0.02 0.00 0.00 177.57 178.60 1a4s h LYS 319 N 0.65 0.64 -0.58 1.57 3.64 -1.36 -2.12 116.57 119.00 1a4s h LYS 319 Ca 0.09 -0.24 -0.03 0.00 -1.27 0.00 0.00 60.65 59.20 1a4s h LYS 319 Cb 0.74 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 1a4s h LYS 319 CO 0.06 0.80 0.24 0.00 -2.27 0.00 0.00 179.45 178.28 1a4s h ARG 320 N 0.43 0.84 -0.17 1.90 2.47 -1.27 -1.46 114.38 117.12 1a4s h ARG 320 Ca 0.09 -0.13 -0.08 0.00 -1.26 0.00 0.00 59.98 58.60 1a4s h ARG 320 Cb 0.56 -0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 28.73 1a4s h ARG 320 CO 0.03 0.69 -0.19 1.15 0.56 0.00 0.00 179.97 182.21 1a4s h THR 321 N 0.83 1.34 0.00 2.04 2.02 -1.12 -2.26 112.91 115.77 1a4s h THR 321 Ca 0.20 -1.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.00 1a4s h THR 321 Cb 0.16 1.86 -0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1a4s h THR 321 CO -0.02 0.41 -0.01 0.11 0.37 0.00 0.00 175.52 176.38 1a4s h LYS 322 N 0.06 0.00 0.00 6.66 1.57 -1.28 -1.23 116.57 122.35 1a4s h LYS 322 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1a4s h LYS 322 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1a4s h LYS 322 CO 0.05 0.01 0.00 0.00 -0.57 0.00 0.00 179.45 178.94 1a4s n ALA 323 N -2.43 2.06 -1.68 3.86 0.00 -0.56 -4.85 120.51 116.92 1a4s n ALA 323 Ca -0.03 0.01 -0.46 0.00 0.00 0.00 0.00 53.44 52.96 1a4s n ALA 323 Cb 0.09 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.07 1a4s n ALA 323 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1a4s n ILE 324 N -2.18 0.29 -2.67 0.00 5.41 -0.47 -4.93 119.36 114.81 1a4s n ILE 324 Ca 0.04 -0.05 -0.43 0.00 1.00 0.00 0.00 62.75 63.31 1a4s n ILE 324 Cb 0.35 -1.82 -0.02 0.00 -0.71 0.00 0.00 39.64 37.44 1a4s n ILE 324 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1a4s s VAL 325 N 2.44 4.63 -0.19 1.39 1.01 -1.26 -4.92 120.40 123.50 1a4s s VAL 325 Ca 0.84 1.89 -0.04 0.00 0.00 0.00 0.00 61.98 64.67 1a4s s VAL 325 Cb -0.62 -4.33 -0.02 0.00 0.00 0.00 0.00 36.38 31.40 1a4s s VAL 325 CO 0.42 -0.28 -0.03 -0.69 0.00 0.00 0.00 175.10 174.52 1a4s s VAL 326 N 3.33 3.69 -0.27 2.92 1.01 -1.26 -0.13 120.40 129.70 1a4s s VAL 326 Ca 0.44 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1a4s s VAL 326 Cb -0.14 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.59 1a4s s VAL 326 CO 0.09 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1a4s n GLY 327 N 4.18 -0.76 3.64 4.51 0.00 -0.78 -4.91 105.19 111.07 1a4s n GLY 327 Ca -0.18 -0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 1a4s n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a4s s ASP 328 N -4.00 6.42 0.56 1.61 2.15 -1.26 -4.49 116.67 117.67 1a4s s ASP 328 Ca 0.00 1.74 0.36 0.00 0.43 0.00 0.00 52.55 55.08 1a4s s ASP 328 Cb 0.00 -2.53 1.63 0.00 -0.30 0.00 0.00 42.92 41.72 1a4s s ASP 328 CO 0.00 -1.20 2.07 1.55 -0.17 0.00 0.00 175.17 177.42 1a4s h PRO 329 N 10.55 0.00 -0.00 4.34 0.13 -1.87 -2.27 132.00 142.88 1a4s h PRO 329 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1a4s h PRO 329 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1a4s h PRO 329 CO 0.99 0.00 -0.00 1.28 -0.23 0.00 0.00 178.00 180.04 1a4s n LEU 330 N -3.03 0.02 -4.82 1.56 4.32 -1.26 -1.59 117.00 112.20 1a4s n LEU 330 Ca -0.00 0.16 -0.38 0.00 -0.02 0.00 0.00 56.01 55.77 1a4s n LEU 330 Cb 0.23 -0.17 -0.06 0.00 -1.62 0.00 0.00 43.42 41.81 1a4s n LEU 330 CO 0.25 0.00 0.20 -0.76 -1.22 0.00 0.00 177.39 175.86 1a4s s LEU 331 N -2.34 4.50 0.57 2.23 1.02 -0.85 -4.88 118.68 118.93 1a4s s LEU 331 Ca 0.36 1.13 0.32 0.00 0.02 0.00 0.00 54.13 55.96 1a4s s LEU 331 Cb 0.21 -2.76 1.74 0.00 0.02 0.00 0.00 46.19 45.40 1a4s s LEU 331 CO 0.42 0.29 2.17 0.71 0.02 0.00 0.00 176.35 179.96 1a4s h THR 332 N 3.64 0.37 -0.02 5.49 1.35 -1.89 -2.49 112.91 119.36 1a4s h THR 332 Ca -0.50 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 1a4s h THR 332 Cb 1.22 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1a4s h THR 332 CO 0.63 0.05 -0.19 -1.84 -0.25 0.00 0.00 175.52 173.92 1a4s n GLU 333 N -3.51 1.87 -2.13 4.72 0.00 -1.26 -4.82 120.64 115.51 1a4s n GLU 333 Ca -0.02 -1.55 -0.37 0.00 0.00 0.00 0.00 57.16 55.23 1a4s n GLU 333 Cb 0.17 -1.46 0.01 0.00 0.00 0.00 0.00 31.44 30.16 1a4s n GLU 333 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1a4s s THR 334 N -2.17 2.84 0.00 3.84 2.01 -0.94 -4.75 115.64 116.47 1a4s s THR 334 Ca 0.24 0.60 0.00 0.00 0.31 0.00 0.00 61.69 62.83 1a4s s THR 334 Cb 0.19 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 69.42 1a4s s THR 334 CO 0.40 -0.04 0.04 0.54 -0.69 0.00 0.00 174.62 174.87 1a4s n ARG 335 N -0.91 3.16 -3.71 4.92 5.12 0.82 -4.87 116.66 121.20 1a4s n ARG 335 Ca 0.10 -0.04 -0.11 0.00 -1.93 0.00 0.00 57.85 55.86 1a4s n ARG 335 Cb 0.48 -0.36 -0.11 0.00 -1.16 0.00 0.00 32.46 31.32 1a4s n ARG 335 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1a4s s MET 336 N -0.46 0.39 0.00 5.56 1.75 -0.58 -4.87 119.30 121.09 1a4s s MET 336 Ca 0.00 0.69 0.00 0.00 -1.25 0.00 0.00 55.69 55.13 1a4s s MET 336 Cb 0.00 0.04 0.00 0.00 2.84 0.00 0.00 34.83 37.71 1a4s s MET 336 CO 0.00 -0.13 0.00 0.41 -0.65 0.00 0.00 175.02 174.65 1a4s n GLY 337 N 3.86 3.45 3.89 2.11 0.00 -1.26 -1.87 105.19 115.37 1a4s n GLY 337 Ca -0.21 -1.97 -0.29 0.00 0.00 0.00 0.00 46.02 43.55 1a4s n GLY 337 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4s s GLY 338 N -0.41 1.79 0.96 -0.02 0.00 -1.25 -4.80 107.32 103.59 1a4s s GLY 338 Ca 0.00 -0.40 -0.12 0.00 0.00 0.00 0.00 44.72 44.20 1a4s s GLY 338 CO 0.00 -0.25 1.11 1.08 0.00 0.00 0.00 173.10 175.04 1a4s s LEU 339 N -3.99 1.77 0.30 0.66 1.43 0.42 -4.72 118.68 114.54 1a4s s LEU 339 Ca 0.48 1.11 0.05 0.00 -1.03 0.00 0.00 54.13 54.74 1a4s s LEU 339 Cb -0.10 -3.35 0.47 0.00 0.03 0.00 0.00 46.19 43.23 1a4s s LEU 339 CO 0.34 -2.90 1.72 -0.29 0.23 0.00 0.00 176.35 175.45 1a4s h ILE 340 N -1.74 1.28 -3.55 -0.59 -0.00 -1.88 -3.42 117.51 107.62 1a4s h ILE 340 Ca -0.53 -1.38 -0.04 0.00 -0.00 0.00 0.00 64.86 62.91 1a4s h ILE 340 Cb 1.33 1.55 -0.09 0.00 -0.00 0.00 0.00 36.82 39.61 1a4s h ILE 340 CO 0.59 0.42 -0.07 -0.94 -0.00 0.00 0.00 178.15 178.16 1a4s s SER 341 N -6.86 -0.12 0.04 2.19 1.04 -1.26 -4.72 113.70 104.01 1a4s s SER 341 Ca -0.05 -0.87 -0.21 0.00 0.48 0.00 0.00 55.95 55.30 1a4s s SER 341 Cb 0.14 0.61 -0.14 0.00 0.10 0.00 0.00 66.02 66.72 1a4s s SER 341 CO 0.77 -1.17 1.36 0.50 0.98 0.00 0.00 173.24 175.69 1a4s h LYS 342 N 2.22 0.33 -0.98 4.02 1.63 -1.97 -2.26 116.57 119.57 1a4s h LYS 342 Ca -0.25 -0.16 0.06 0.00 -0.85 0.00 0.00 60.65 59.44 1a4s h LYS 342 Cb 1.25 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.82 1a4s h LYS 342 CO 0.34 0.70 0.64 -1.35 -3.45 0.00 0.00 179.45 176.32 1a4s h PRO 343 N -0.02 1.14 -0.18 1.90 0.11 -1.98 -0.03 132.00 132.93 1a4s h PRO 343 Ca 0.03 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 1a4s h PRO 343 Cb 0.62 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 1a4s h PRO 343 CO 0.03 0.75 0.02 1.96 -0.21 0.00 0.00 178.00 180.55 1a4s h GLN 344 N 1.17 0.30 -0.19 1.05 1.08 -1.96 -0.19 115.11 116.37 1a4s h GLN 344 Ca 0.41 -0.09 0.05 0.00 -1.45 0.00 0.00 58.65 57.57 1a4s h GLN 344 Cb 0.12 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.47 1a4s h GLN 344 CO -0.15 0.48 -0.13 1.25 -0.95 0.00 0.00 178.83 179.33 1a4s h LEU 345 N 0.07 -0.42 -0.54 1.46 5.85 -1.00 0.13 115.31 120.86 1a4s h LEU 345 Ca 0.05 0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.93 1a4s h LEU 345 Cb 0.34 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 1a4s h LEU 345 CO 0.01 -0.17 0.23 0.44 -0.34 0.00 0.00 178.44 178.61 1a4s h ASP 346 N -0.13 0.28 -0.49 1.25 3.32 -0.91 0.28 116.42 120.02 1a4s h ASP 346 Ca 0.11 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 1a4s h ASP 346 Cb 0.30 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1a4s h ASP 346 CO -0.27 0.19 0.20 0.50 -1.72 0.00 0.00 179.24 178.13 1a4s h LYS 347 N 0.44 0.72 -0.68 3.56 3.64 -0.52 0.21 116.57 123.94 1a4s h LYS 347 Ca 0.26 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1a4s h LYS 347 Cb 0.24 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1a4s h LYS 347 CO -0.23 0.65 0.38 0.28 -2.27 0.00 0.00 179.45 178.26 1a4s h VAL 348 N 0.64 1.21 -0.57 2.00 2.07 0.04 -0.81 116.25 120.83 1a4s h VAL 348 Ca 0.16 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 67.09 1a4s h VAL 348 Cb 0.19 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 1a4s h VAL 348 CO -0.01 0.23 0.05 -0.07 0.02 0.00 0.00 177.57 177.78 1a4s h LEU 349 N 0.93 0.91 -1.05 2.57 3.38 -0.28 -2.44 115.31 119.34 1a4s h LEU 349 Ca 0.24 -0.22 0.14 0.00 0.09 0.00 0.00 57.88 58.12 1a4s h LEU 349 Cb 0.03 -0.24 -0.09 0.00 0.09 0.00 0.00 40.66 40.45 1a4s h LEU 349 CO -0.04 0.94 0.62 1.23 0.09 0.00 0.00 178.44 181.29 1a4s h GLY 350 N 1.01 1.62 1.03 0.83 0.00 -0.05 -0.74 103.07 106.77 1a4s h GLY 350 Ca 0.17 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 1a4s h GLY 350 CO 0.02 0.11 0.17 0.74 0.00 0.00 0.00 176.54 177.57 1a4s h PHE 351 N 0.91 1.07 -0.39 5.60 0.04 -0.68 -0.07 116.94 123.43 1a4s h PHE 351 Ca 0.51 -0.12 -0.15 0.00 2.80 0.00 0.00 57.97 61.01 1a4s h PHE 351 Cb 0.60 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 1a4s h PHE 351 CO -0.00 0.88 -0.34 0.28 -0.60 0.00 0.00 178.31 178.53 1a4s h VAL 352 N 0.94 1.27 -0.52 -0.55 2.07 -1.15 0.48 116.25 118.79 1a4s h VAL 352 Ca 0.20 -1.51 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 1a4s h VAL 352 Cb 0.34 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 1a4s h VAL 352 CO -0.00 0.51 0.21 0.00 0.02 0.00 0.00 177.57 178.30 1a4s h ALA 353 N 0.86 0.68 -0.62 1.67 0.00 -1.08 -2.16 119.26 118.62 1a4s h ALA 353 Ca 0.07 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1a4s h ALA 353 Cb 0.92 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1a4s h ALA 353 CO 0.09 0.30 0.28 0.37 0.00 0.00 0.00 179.25 180.29 1a4s h GLN 354 N 0.71 0.87 -0.66 0.00 4.15 -0.81 -2.18 115.11 117.20 1a4s h GLN 354 Ca 0.17 -0.12 -0.05 0.00 0.77 0.00 0.00 58.65 59.43 1a4s h GLN 354 Cb 0.20 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 1a4s h GLN 354 CO -0.01 0.69 0.23 0.00 -1.93 0.00 0.00 178.83 177.81 1a4s h ALA 355 N 1.44 0.86 -0.00 3.38 0.00 -0.51 -1.53 119.26 122.90 1a4s h ALA 355 Ca 0.21 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1a4s h ALA 355 Cb 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1a4s h ALA 355 CO -0.03 0.51 -0.42 1.57 0.00 0.00 0.00 179.25 180.88 1a4s h LYS 356 N 0.94 0.01 0.00 0.00 2.10 -0.80 0.99 116.57 119.81 1a4s h LYS 356 Ca 0.22 -0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.81 1a4s h LYS 356 Cb 0.25 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.58 1a4s h LYS 356 CO -0.01 0.43 -0.24 0.87 -2.00 0.00 0.00 179.45 178.50 1a4s h LYS 357 N 0.01 0.00 0.00 0.07 1.57 -0.86 -1.78 116.57 115.59 1a4s h LYS 357 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a4s h LYS 357 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1a4s h LYS 357 CO 0.06 0.24 -0.41 0.39 -0.57 0.00 0.00 179.45 179.15 1a4s n GLU 358 N -4.18 0.11 0.00 3.15 1.02 -0.62 -4.92 120.64 115.20 1a4s n GLU 358 Ca -0.02 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1a4s n GLU 358 Cb 0.30 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1a4s n GLU 358 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4s n GLY 359 N 1.44 1.07 3.75 0.62 0.00 -0.67 -5.09 105.19 106.30 1a4s n GLY 359 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1a4s n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s s ALA 360 N -0.62 2.35 -0.28 4.61 0.00 0.25 -4.95 121.76 123.12 1a4s s ALA 360 Ca 0.00 0.82 -0.08 0.00 0.00 0.00 0.00 51.96 52.70 1a4s s ALA 360 Cb 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 1a4s s ALA 360 CO 0.00 -1.48 0.10 0.50 0.00 0.00 0.00 175.76 174.89 1a4s s ARG 361 N -3.77 3.40 -0.30 0.00 3.00 0.93 -4.33 118.95 117.87 1a4s s ARG 361 Ca 0.73 -0.66 -0.29 0.00 -1.00 0.00 0.00 55.73 54.51 1a4s s ARG 361 Cb -0.27 -3.43 0.01 0.00 0.00 0.00 0.00 34.95 31.26 1a4s s ARG 361 CO 0.40 -0.33 1.22 0.08 0.00 0.00 0.00 175.30 176.66 1a4s s VAL 362 N 1.59 4.28 -0.20 7.11 1.01 -1.26 -0.30 120.40 132.63 1a4s s VAL 362 Ca 0.05 1.47 0.21 0.00 0.00 0.00 0.00 61.98 63.70 1a4s s VAL 362 Cb -0.16 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 1a4s s VAL 362 CO 0.04 -0.45 0.98 -0.07 0.00 0.00 0.00 175.10 175.60 1a4s h LEU 363 N 10.50 0.00 -7.00 3.92 3.38 -1.30 -3.48 115.31 121.33 1a4s h LEU 363 Ca -0.24 0.00 0.22 0.00 0.09 0.00 0.00 57.88 57.95 1a4s h LEU 363 Cb 1.08 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.64 1a4s h LEU 363 CO 1.03 0.18 0.77 0.00 0.09 0.00 0.00 178.44 180.51 1a4s n GLY 365 N 0.04 0.95 1.03 0.00 0.00 -1.24 -2.49 105.19 103.48 1a4s n GLY 365 Ca -0.01 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1a4s n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 366 N 0.00 0.77 3.09 -0.02 0.00 -0.44 -4.89 105.19 103.70 1a4s n GLY 366 Ca 0.00 -0.55 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 1a4s n GLY 366 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a4s s GLU 367 N -1.31 0.63 0.80 1.61 2.02 -1.26 -4.86 118.70 116.32 1a4s s GLU 367 Ca 0.00 -1.14 -0.14 0.00 0.02 0.00 0.00 54.97 53.71 1a4s s GLU 367 Cb 0.00 0.05 0.04 0.00 0.10 0.00 0.00 34.13 34.32 1a4s s GLU 367 CO 0.00 -0.07 0.92 -2.30 0.02 0.00 0.00 175.26 173.83 1a4s n PRO 368 N 0.35 0.18 -3.77 0.39 -0.02 -1.26 -1.66 135.00 129.21 1a4s n PRO 368 Ca -0.15 0.12 -0.13 0.00 -2.02 0.00 0.00 63.50 61.32 1a4s n PRO 368 Cb 0.60 -2.20 -0.11 0.00 -0.02 0.00 0.00 33.50 31.76 1a4s n PRO 368 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1a4s s LEU 369 N -3.54 0.85 -0.26 2.45 0.20 -0.80 -4.66 118.68 112.92 1a4s s LEU 369 Ca 0.69 0.59 0.03 0.00 0.69 0.00 0.00 54.13 56.13 1a4s s LEU 369 Cb -0.30 0.99 0.07 0.00 -0.43 0.00 0.00 46.19 46.52 1a4s s LEU 369 CO 0.55 -0.11 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.53 1a4s s THR 370 N 0.22 2.04 0.85 3.68 2.01 -1.26 -4.44 115.64 118.74 1a4s s THR 370 Ca -0.01 -1.64 -0.11 0.00 0.31 0.00 0.00 61.69 60.25 1a4s s THR 370 Cb -0.02 -2.23 0.11 0.00 0.01 0.00 0.00 72.50 70.37 1a4s s THR 370 CO -0.00 -0.12 1.15 -2.84 -0.69 0.00 0.00 174.62 172.12 1a4s s PRO 371 N 1.14 1.49 0.11 4.92 0.02 -1.26 -4.97 135.00 136.45 1a4s s PRO 371 Ca -0.06 1.52 -0.21 0.00 0.02 0.00 0.00 61.00 62.27 1a4s s PRO 371 Cb -0.20 -1.78 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 1a4s s PRO 371 CO -0.06 -2.28 1.72 0.77 -0.33 0.00 0.00 177.00 176.83 1a4s h SER 372 N -1.40 -0.08 -2.10 2.53 0.02 -1.97 -3.43 113.55 107.12 1a4s h SER 372 Ca -0.44 0.03 -0.59 0.00 -0.84 0.00 0.00 61.79 59.94 1a4s h SER 372 Cb 1.27 0.05 0.02 0.00 0.14 0.00 0.00 62.40 63.88 1a4s h SER 372 CO 0.45 -0.02 1.15 -0.67 -1.14 0.00 0.00 176.83 176.60 1a4s n ASP 373 N -5.13 3.63 0.32 3.07 -0.08 -1.26 -4.88 116.55 112.20 1a4s n ASP 373 Ca -0.05 0.93 0.21 0.00 -1.51 0.00 0.00 54.79 54.37 1a4s n ASP 373 Cb 0.07 -1.41 1.09 0.00 2.34 0.00 0.00 41.12 43.21 1a4s n ASP 373 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1a4s h PRO 374 N 9.78 0.00 0.00 -0.67 0.11 -2.03 -2.44 132.00 136.75 1a4s h PRO 374 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1a4s h PRO 374 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1a4s h PRO 374 CO 0.95 0.00 -0.02 0.36 -0.21 0.00 0.00 178.00 179.08 1a4s n LYS 375 N -3.03 0.00 -0.10 1.05 2.85 -1.26 -3.12 118.16 114.55 1a4s n LYS 375 Ca -0.02 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.35 1a4s n LYS 375 Cb 0.11 -1.50 0.16 0.00 -0.65 0.00 0.00 35.03 33.15 1a4s n LYS 375 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1a4s n LEU 376 N -1.51 3.18 0.04 -5.58 4.32 -0.92 -4.58 117.00 111.94 1a4s n LEU 376 Ca 0.07 -1.29 0.02 0.00 -0.02 0.00 0.00 56.01 54.79 1a4s n LEU 376 Cb 0.34 -0.14 0.38 0.00 -1.62 0.00 0.00 43.42 42.38 1a4s n LEU 376 CO 0.27 0.63 1.01 0.11 -1.22 0.00 0.00 177.39 178.19 1a4s h LYS 377 N 4.35 0.45 -0.62 3.23 6.56 -1.67 -2.22 116.57 126.65 1a4s h LYS 377 Ca 0.00 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1a4s h LYS 377 Cb 0.95 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.53 1a4s h LYS 377 CO 0.00 0.42 0.00 0.09 -2.06 0.00 0.00 179.45 177.90 1a4s n ASN 378 N -4.36 5.19 -4.85 0.86 5.03 -1.26 -4.96 115.26 110.91 1a4s n ASN 378 Ca 0.01 -2.73 -0.29 0.00 0.87 0.00 0.00 54.58 52.44 1a4s n ASN 378 Cb 0.18 -0.64 0.10 0.00 -1.02 0.00 0.00 39.78 38.40 1a4s n ASN 378 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1a4s s GLY 379 N -0.77 1.60 -1.13 7.41 0.00 -0.83 -3.59 107.32 110.00 1a4s s GLY 379 Ca 0.51 -0.66 -0.04 0.00 0.00 0.00 0.00 44.72 44.53 1a4s s GLY 379 CO 0.18 -0.14 1.76 -1.72 0.00 0.00 0.00 173.10 173.17 1a4s n TYR 380 N -3.40 2.53 -4.00 1.90 4.01 -0.31 -4.93 117.16 112.96 1a4s n TYR 380 Ca 0.08 -2.63 -0.32 0.00 -0.16 0.00 0.00 57.90 54.87 1a4s n TYR 380 Cb 0.61 -1.42 -0.06 0.00 -0.31 0.00 0.00 39.34 38.16 1a4s n TYR 380 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1a4s s PHE 381 N -2.50 3.39 0.15 -0.72 0.08 -1.26 -0.44 117.98 116.68 1a4s s PHE 381 Ca 0.37 0.23 -0.10 0.00 0.12 0.00 0.00 56.93 57.55 1a4s s PHE 381 Cb 0.11 -1.74 -0.00 0.00 -0.57 0.00 0.00 43.02 40.82 1a4s s PHE 381 CO 0.00 0.58 0.30 0.00 -0.10 0.00 0.00 175.22 176.00 1a4s s MET 382 N -2.12 1.11 -0.02 0.44 0.23 -1.26 -1.91 119.30 115.76 1a4s s MET 382 Ca 0.28 -1.07 -0.15 0.00 -1.03 0.00 0.00 55.69 53.72 1a4s s MET 382 Cb -0.12 0.39 -0.05 0.00 -1.53 0.00 0.00 34.83 33.51 1a4s s MET 382 CO 0.20 -0.41 0.42 -1.54 -2.03 0.00 0.00 175.02 171.66 1a4s s SER 383 N -2.92 6.78 0.50 -1.18 1.04 -0.67 -4.83 113.70 112.42 1a4s s SER 383 Ca 0.13 0.93 -0.23 0.00 0.48 0.00 0.00 55.95 57.25 1a4s s SER 383 Cb 0.03 -2.26 -0.06 0.00 0.10 0.00 0.00 66.02 63.83 1a4s s SER 383 CO -0.03 0.26 1.41 -0.81 0.98 0.00 0.00 173.24 175.04 1a4s n PRO 384 N 2.20 1.97 -4.70 4.02 -0.04 -1.26 -1.33 135.00 135.87 1a4s n PRO 384 Ca -0.13 0.71 -0.24 0.00 -0.04 0.00 0.00 63.50 63.81 1a4s n PRO 384 Cb 0.52 -2.62 -0.16 0.00 -0.04 0.00 0.00 33.50 31.21 1a4s n PRO 384 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a4s s VAL 386 N -0.06 2.12 -0.01 0.00 1.01 -1.04 -0.75 120.40 121.68 1a4s s VAL 386 Ca -0.00 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.03 1a4s s VAL 386 Cb -0.09 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 1a4s s VAL 386 CO 0.01 0.55 -0.08 -0.76 0.00 0.00 0.00 175.10 174.82 1a4s s LEU 387 N 0.54 3.10 0.31 3.92 1.43 0.03 -0.73 118.68 127.27 1a4s s LEU 387 Ca -0.14 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 52.85 1a4s s LEU 387 Cb -0.17 -1.76 -0.06 0.00 0.03 0.00 0.00 46.19 44.23 1a4s s LEU 387 CO 0.04 0.30 0.04 -0.62 0.23 0.00 0.00 176.35 176.34 1a4s s ASP 388 N -1.29 2.36 -1.15 2.29 2.15 0.59 -1.74 116.67 119.88 1a4s s ASP 388 Ca 0.16 -1.34 -0.06 0.00 0.43 0.00 0.00 52.55 51.73 1a4s s ASP 388 Cb -0.11 -0.08 0.01 0.00 -0.30 0.00 0.00 42.92 42.43 1a4s s ASP 388 CO 0.06 -0.57 1.00 -3.20 -0.17 0.00 0.00 175.17 172.29 1a4s n ASN 389 N -0.65 -5.18 -4.97 -0.34 5.15 -1.26 -0.05 115.26 107.96 1a4s n ASN 389 Ca -0.03 -0.48 -0.21 0.00 -0.60 0.00 0.00 54.58 53.26 1a4s n ASN 389 Cb 0.66 -4.42 -0.02 0.00 -0.53 0.00 0.00 39.78 35.47 1a4s n ASN 389 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1a4s s ARG 391 N -4.04 1.03 0.58 0.00 0.52 -1.26 -4.93 118.95 110.85 1a4s s ARG 391 Ca 0.36 -1.40 0.31 0.00 -0.52 0.00 0.00 55.73 54.47 1a4s s ARG 391 Cb -0.09 -0.63 1.76 0.00 0.52 0.00 0.00 34.95 36.51 1a4s s ARG 391 CO 0.30 0.08 2.20 -0.44 0.02 0.00 0.00 175.30 177.47 1a4s h ASP 392 N 2.92 0.00 0.27 0.23 3.32 -2.00 -1.52 116.42 119.64 1a4s h ASP 392 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1a4s h ASP 392 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1a4s h ASP 392 CO 0.61 0.04 -0.36 -0.90 -1.72 0.00 0.00 179.24 176.91 1a4s n ASP 393 N -3.69 0.97 -4.76 6.45 5.75 -1.26 -4.55 116.55 115.46 1a4s n ASP 393 Ca -0.03 -0.79 -0.35 0.00 -0.01 0.00 0.00 54.79 53.62 1a4s n ASP 393 Cb 0.14 0.22 0.03 0.00 -1.03 0.00 0.00 41.12 40.47 1a4s n ASP 393 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1a4s s MET 394 N -2.64 3.03 0.28 0.11 -1.94 -0.57 -4.91 119.30 112.65 1a4s s MET 394 Ca 0.20 1.63 -0.03 0.00 -1.71 0.00 0.00 55.69 55.79 1a4s s MET 394 Cb 0.19 -1.96 0.38 0.00 2.01 0.00 0.00 34.83 35.44 1a4s s MET 394 CO 0.58 -1.11 1.87 1.15 -0.01 0.00 0.00 175.02 177.50 1a4s h THR 395 N 0.73 1.23 0.00 2.05 2.02 -1.91 -1.92 112.91 115.11 1a4s h THR 395 Ca -0.49 -0.65 -0.00 0.00 0.77 0.00 0.00 66.41 66.03 1a4s h THR 395 Cb 1.27 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1a4s h THR 395 CO 0.55 0.27 -0.01 0.00 0.37 0.00 0.00 175.52 176.70 1a4s h VAL 397 N 0.00 0.87 0.02 0.00 2.07 -1.63 -3.39 116.25 114.18 1a4s h VAL 397 Ca -0.00 -2.44 -0.32 0.00 0.82 0.00 0.00 66.70 64.77 1a4s h VAL 397 Cb 0.86 2.34 -0.05 0.00 -1.52 0.00 0.00 31.29 32.93 1a4s h VAL 397 CO 0.00 0.49 -1.86 0.29 0.02 0.00 0.00 177.57 176.52 1a4s n LYS 398 N -3.08 0.66 -3.99 1.57 5.02 -0.84 -4.97 118.16 112.53 1a4s n LYS 398 Ca -0.06 0.25 -0.33 0.00 -2.02 0.00 0.00 58.31 56.14 1a4s n LYS 398 Cb 0.87 -1.74 -0.06 0.00 -0.02 0.00 0.00 35.03 34.09 1a4s n LYS 398 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1a4s s GLU 399 N -2.58 3.27 -0.10 1.97 0.41 -0.58 -4.96 118.70 116.13 1a4s s GLU 399 Ca -0.09 -0.40 -0.30 0.00 -0.41 0.00 0.00 54.97 53.77 1a4s s GLU 399 Cb 0.08 -2.99 -0.03 0.00 -1.78 0.00 0.00 34.13 29.41 1a4s s GLU 399 CO 0.81 0.66 1.38 -2.00 -0.49 0.00 0.00 175.26 175.62 1a4s s GLU 400 N -1.89 4.24 -0.14 1.61 2.12 -1.26 -4.85 118.70 118.52 1a4s s GLU 400 Ca 0.26 1.84 -0.11 0.00 0.36 0.00 0.00 54.97 57.32 1a4s s GLU 400 Cb -0.12 -3.77 -0.24 0.00 0.26 0.00 0.00 34.13 30.25 1a4s s GLU 400 CO 0.17 -0.70 0.32 -0.89 -0.54 0.00 0.00 175.26 173.62 1a4s n ILE 401 N 5.23 1.72 -3.04 -3.70 5.41 -1.26 -5.00 119.36 118.72 1a4s n ILE 401 Ca 0.14 -0.48 -0.14 0.00 1.00 0.00 0.00 62.75 63.27 1a4s n ILE 401 Cb 0.44 -1.83 0.04 0.00 -0.71 0.00 0.00 39.64 37.59 1a4s n ILE 401 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1a4s n PHE 402 N -3.76 -1.61 -4.06 1.39 7.35 -1.26 -4.80 117.46 110.71 1a4s n PHE 402 Ca -0.32 0.54 -0.14 0.00 -0.76 0.00 0.00 57.45 56.77 1a4s n PHE 402 Cb 0.94 -3.37 -0.04 0.00 0.35 0.00 0.00 39.48 37.37 1a4s n PHE 402 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1a4s s GLY 403 N -3.09 1.34 -1.33 7.13 0.00 -1.06 -4.38 107.32 105.93 1a4s s GLY 403 Ca 0.31 -1.42 -0.16 0.00 0.00 0.00 0.00 44.72 43.45 1a4s s GLY 403 CO 0.38 -0.92 1.83 -1.55 0.00 0.00 0.00 173.10 172.84 1a4s n PRO 404 N -0.55 3.15 -3.70 2.90 -0.04 -1.18 -4.61 135.00 130.98 1a4s n PRO 404 Ca -0.00 -3.19 -0.29 0.00 -0.04 0.00 0.00 63.50 59.99 1a4s n PRO 404 Cb 0.61 -3.37 -0.16 0.00 -0.04 0.00 0.00 33.50 30.54 1a4s n PRO 404 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1a4s s VAL 405 N 3.52 0.51 -0.04 0.52 1.01 -1.25 -0.25 120.40 124.42 1a4s s VAL 405 Ca 0.50 -0.85 -0.22 0.00 0.00 0.00 0.00 61.98 61.42 1a4s s VAL 405 Cb 0.06 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 1a4s s VAL 405 CO 0.03 -0.45 0.65 -0.32 0.00 0.00 0.00 175.10 175.01 1a4s s MET 406 N 1.83 4.40 -0.19 2.72 1.75 0.07 -4.94 119.30 124.94 1a4s s MET 406 Ca 0.04 0.81 -0.07 0.00 -1.25 0.00 0.00 55.69 55.23 1a4s s MET 406 Cb -0.17 -3.41 -0.04 0.00 2.84 0.00 0.00 34.83 34.06 1a4s s MET 406 CO -0.19 0.19 0.05 -1.12 -0.65 0.00 0.00 175.02 173.30 1a4s s SER 407 N 0.40 5.40 -0.06 1.11 0.01 -0.86 -0.79 113.70 118.91 1a4s s SER 407 Ca 0.34 -0.00 0.04 0.00 1.31 0.00 0.00 55.95 57.64 1a4s s SER 407 Cb -0.18 -1.93 -0.02 0.00 0.21 0.00 0.00 66.02 64.10 1a4s s SER 407 CO 0.18 0.14 -0.16 -0.69 0.41 0.00 0.00 173.24 173.11 1a4s s VAL 408 N 0.57 2.85 -0.03 3.43 1.01 -0.71 -0.63 120.40 126.89 1a4s s VAL 408 Ca 0.02 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 1a4s s VAL 408 Cb -0.13 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1a4s s VAL 408 CO 0.01 0.58 0.12 -0.76 0.00 0.00 0.00 175.10 175.05 1a4s s LEU 409 N -0.46 1.57 0.59 3.92 1.02 -0.44 -4.17 118.68 120.72 1a4s s LEU 409 Ca 0.05 0.07 -0.09 0.00 0.02 0.00 0.00 54.13 54.18 1a4s s LEU 409 Cb -0.12 0.48 -0.03 0.00 0.02 0.00 0.00 46.19 46.55 1a4s s LEU 409 CO 0.02 -0.16 0.97 -2.16 0.02 0.00 0.00 176.35 175.04 1a4s s PRO 410 N -0.46 3.46 0.07 1.29 0.04 -1.26 -0.37 135.00 137.77 1a4s s PRO 410 Ca -0.05 0.53 -0.12 0.00 0.04 0.00 0.00 61.00 61.39 1a4s s PRO 410 Cb -0.04 -2.16 0.02 0.00 0.04 0.00 0.00 34.50 32.36 1a4s s PRO 410 CO 0.00 -0.54 0.28 -0.59 0.04 0.00 0.00 177.00 176.19 1a4s s PHE 411 N -3.08 -0.04 -0.14 0.56 -0.12 -1.06 -4.77 117.98 109.34 1a4s s PHE 411 Ca 0.53 -0.23 0.03 0.00 -0.05 0.00 0.00 56.93 57.22 1a4s s PHE 411 Cb -0.11 0.07 -0.11 0.00 -0.63 0.00 0.00 43.02 42.24 1a4s s PHE 411 CO 0.51 -0.55 -0.09 -0.25 -0.05 0.00 0.00 175.22 174.79 1a4s n ASP 412 N 0.24 2.66 -4.28 1.98 8.00 -1.26 -1.47 116.55 122.42 1a4s n ASP 412 Ca -0.17 -0.06 -0.15 0.00 0.71 0.00 0.00 54.79 55.12 1a4s n ASP 412 Cb 0.61 0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.62 1a4s n ASP 412 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1a4s s THR 413 N -2.30 1.25 0.14 -3.53 -4.23 -1.26 -4.92 115.64 100.79 1a4s s THR 413 Ca -0.17 -2.08 -0.15 0.00 -1.18 0.00 0.00 61.69 58.11 1a4s s THR 413 Cb 0.05 -1.96 0.01 0.00 1.34 0.00 0.00 72.50 71.94 1a4s s THR 413 CO 0.38 -0.66 1.69 -0.08 -0.54 0.00 0.00 174.62 175.41 1a4s h GLU 414 N 2.70 0.66 -0.35 3.99 4.81 -1.99 -1.14 114.58 123.26 1a4s h GLU 414 Ca -0.37 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 58.69 1a4s h GLU 414 Cb 1.20 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 1a4s h GLU 414 CO 0.63 0.61 0.02 1.49 -0.73 0.00 0.00 179.01 181.03 1a4s h GLU 415 N 0.57 0.54 0.50 1.92 4.81 -2.00 -0.92 114.58 120.00 1a4s h GLU 415 Ca 0.15 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1a4s h GLU 415 Cb 0.20 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1a4s h GLU 415 CO -0.01 0.55 -0.24 1.49 -0.73 0.00 0.00 179.01 180.07 1a4s h GLU 416 N 0.52 -0.65 -0.61 1.92 4.81 -1.91 -2.96 114.58 115.70 1a4s h GLU 416 Ca 0.11 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1a4s h GLU 416 Cb 0.31 0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 1a4s h GLU 416 CO 0.01 -0.34 0.37 -0.39 -0.73 0.00 0.00 179.01 177.93 1a4s h VAL 417 N -1.00 1.06 -0.98 0.32 -1.51 -0.90 -1.89 116.25 111.34 1a4s h VAL 417 Ca -0.07 -0.25 0.09 0.00 -1.23 0.00 0.00 66.70 65.24 1a4s h VAL 417 Cb 0.60 0.27 -0.07 0.00 -2.13 0.00 0.00 31.29 29.96 1a4s h VAL 417 CO 0.11 0.13 0.63 -0.07 -1.23 0.00 0.00 177.57 177.14 1a4s h LEU 418 N 0.72 0.96 -0.54 4.19 3.38 -1.23 0.24 115.31 123.03 1a4s h LEU 418 Ca 0.25 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 58.10 1a4s h LEU 418 Cb 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1a4s h LEU 418 CO -0.11 0.57 -0.38 0.06 0.09 0.00 0.00 178.44 178.67 1a4s h GLN 419 N 1.06 0.77 -0.06 1.13 -0.00 -1.18 -1.72 115.11 115.11 1a4s h GLN 419 Ca 0.45 -0.39 -0.17 0.00 -0.00 0.00 0.00 58.65 58.54 1a4s h GLN 419 Cb 0.32 0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 27.79 1a4s h GLN 419 CO -0.20 1.01 -0.70 0.00 -0.00 0.00 0.00 178.83 178.95 1a4s h ARG 420 N 0.63 0.28 -0.54 0.06 3.08 -1.21 -2.06 114.38 114.62 1a4s h ARG 420 Ca 0.06 -0.22 -0.10 0.00 0.07 0.00 0.00 59.98 59.78 1a4s h ARG 420 Cb 0.93 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1a4s h ARG 420 CO 0.08 0.86 -0.07 0.00 -1.07 0.00 0.00 179.97 179.78 1a4s h ALA 421 N 1.07 0.85 0.00 0.04 0.00 -0.28 -3.20 119.26 117.74 1a4s h ALA 421 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1a4s h ALA 421 Cb 1.25 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1a4s h ALA 421 CO 0.11 0.66 -0.29 0.09 0.00 0.00 0.00 179.25 179.82 1a4s n ASN 422 N -4.16 0.78 -3.79 0.00 3.02 -0.67 -4.61 115.26 105.84 1a4s n ASN 422 Ca 0.02 0.37 -0.42 0.00 -0.03 0.00 0.00 54.58 54.52 1a4s n ASN 422 Cb 0.38 -0.37 -0.02 0.00 -0.61 0.00 0.00 39.78 39.16 1a4s n ASN 422 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1a4s n ASN 423 N -2.21 3.47 -3.61 6.41 4.05 -0.78 -4.77 115.26 117.82 1a4s n ASN 423 Ca 0.04 -2.79 -0.08 0.00 0.45 0.00 0.00 54.58 52.20 1a4s n ASN 423 Cb 0.44 -1.49 -0.02 0.00 1.23 0.00 0.00 39.78 39.94 1a4s n ASN 423 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1a4s s THR 424 N 4.16 0.00 -1.46 -0.44 -1.32 -1.26 -5.02 115.64 110.30 1a4s s THR 424 Ca 0.52 -0.39 0.22 0.00 -1.21 0.00 0.00 61.69 60.84 1a4s s THR 424 Cb 0.13 -1.44 -0.08 0.00 -1.51 0.00 0.00 72.50 69.59 1a4s s THR 424 CO -0.00 0.00 1.07 1.07 -2.21 0.00 0.00 174.62 174.55 1a4s n THR 425 N -0.39 0.00 -2.46 5.08 5.66 -1.26 -4.84 114.28 116.07 1a4s n THR 425 Ca -0.10 -0.11 -0.30 0.00 -3.05 0.00 0.00 64.05 60.50 1a4s n THR 425 Cb 0.62 0.98 -0.01 0.00 -1.55 0.00 0.00 70.33 70.37 1a4s n THR 425 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1a4s s PHE 426 N -2.76 3.55 -0.37 1.09 0.08 -1.26 -0.80 117.98 117.50 1a4s s PHE 426 Ca 0.14 1.07 0.06 0.00 0.12 0.00 0.00 56.93 58.31 1a4s s PHE 426 Cb 0.17 -2.50 0.25 0.00 -0.57 0.00 0.00 43.02 40.37 1a4s s PHE 426 CO 0.71 -0.35 1.23 0.41 -0.10 0.00 0.00 175.22 177.12 1a4s n GLY 427 N -2.07 0.32 0.04 4.36 0.00 -1.24 -4.79 105.19 101.81 1a4s n GLY 427 Ca 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1a4s n GLY 427 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1a4s h LEU 428 N 1.76 0.00 0.00 0.99 5.85 -1.80 -0.73 115.31 121.38 1a4s h LEU 428 Ca -0.39 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.01 1a4s h LEU 428 Cb 1.26 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 42.20 1a4s h LEU 428 CO -0.11 0.38 -0.29 0.00 -0.34 0.00 0.00 178.44 178.08 1a4s n ALA 429 N -2.67 0.32 -3.58 1.25 0.00 -1.26 -1.93 120.51 112.63 1a4s n ALA 429 Ca -0.01 -1.43 0.05 0.00 0.00 0.00 0.00 53.44 52.06 1a4s n ALA 429 Cb 0.04 1.15 0.01 0.00 0.00 0.00 0.00 19.45 20.65 1a4s n ALA 429 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1a4s n SER 430 N -1.92 -1.14 -3.46 0.00 3.41 -0.57 -3.99 113.62 105.94 1a4s n SER 430 Ca 0.04 -1.60 -0.11 0.00 -0.26 0.00 0.00 58.87 56.95 1a4s n SER 430 Cb 0.46 1.86 -0.02 0.00 -0.26 0.00 0.00 64.21 66.25 1a4s n SER 430 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1a4s s GLY 431 N -2.89 -0.55 -0.06 5.00 0.00 0.15 -2.02 107.32 106.95 1a4s s GLY 431 Ca 0.15 0.61 -0.03 0.00 0.00 0.00 0.00 44.72 45.44 1a4s s GLY 431 CO 0.04 0.20 0.14 0.54 0.00 0.00 0.00 173.10 174.02 1a4s s VAL 432 N -3.57 -0.03 -0.23 1.40 0.11 -0.09 -0.40 120.40 117.59 1a4s s VAL 432 Ca 0.03 0.12 -0.03 0.00 -2.93 0.00 0.00 61.98 59.17 1a4s s VAL 432 Cb -0.01 -0.22 0.01 0.00 -1.53 0.00 0.00 36.38 34.62 1a4s s VAL 432 CO -0.11 0.05 -0.07 -0.36 -3.33 0.00 0.00 175.10 171.28 1a4s s PHE 433 N 0.82 2.97 0.00 1.54 0.40 0.12 -1.02 117.98 122.81 1a4s s PHE 433 Ca -0.06 -1.22 -0.28 0.00 -0.60 0.00 0.00 56.93 54.77 1a4s s PHE 433 Cb -0.08 -2.07 0.10 0.00 0.51 0.00 0.00 43.02 41.48 1a4s s PHE 433 CO -0.04 -0.64 0.86 -0.08 0.70 0.00 0.00 175.22 176.02 1a4s s THR 434 N 1.41 0.00 -0.08 0.64 -1.32 -1.26 -1.60 115.64 113.44 1a4s s THR 434 Ca 0.04 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.68 1a4s s THR 434 Cb -0.15 -1.00 -0.24 0.00 -1.51 0.00 0.00 72.50 69.60 1a4s s THR 434 CO -0.05 0.00 0.26 0.54 -2.21 0.00 0.00 174.62 173.16 1a4s n ARG 435 N -0.19 0.85 -2.17 7.08 5.12 -1.25 -4.87 116.66 121.23 1a4s n ARG 435 Ca -0.10 -0.10 -0.42 0.00 -1.93 0.00 0.00 57.85 55.30 1a4s n ARG 435 Cb 0.62 -1.41 -0.03 0.00 -1.16 0.00 0.00 32.46 30.48 1a4s n ARG 435 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1a4s s ASP 436 N -4.37 6.82 0.13 0.55 2.15 -1.26 -4.95 116.67 115.74 1a4s s ASP 436 Ca -0.07 2.28 -0.14 0.00 0.43 0.00 0.00 52.55 55.05 1a4s s ASP 436 Cb 0.09 -2.58 -0.00 0.00 -0.30 0.00 0.00 42.92 40.13 1a4s s ASP 436 CO 0.70 -0.68 1.61 -0.29 -0.17 0.00 0.00 175.17 176.34 1a4s h ILE 437 N 4.46 1.25 -0.19 4.11 2.10 -2.00 -1.64 117.51 125.60 1a4s h ILE 437 Ca -0.41 -0.90 -0.02 0.00 1.08 0.00 0.00 64.86 64.61 1a4s h ILE 437 Cb 1.20 0.99 -0.01 0.00 -1.09 0.00 0.00 36.82 37.91 1a4s h ILE 437 CO 0.88 0.31 0.03 0.28 -1.08 0.00 0.00 178.15 178.57 1a4s h SER 438 N 0.58 0.30 -0.19 2.19 0.02 -2.00 -2.82 113.55 111.63 1a4s h SER 438 Ca 0.13 -0.25 0.05 0.00 -0.84 0.00 0.00 61.79 60.88 1a4s h SER 438 Cb 0.39 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 1a4s h SER 438 CO 0.01 0.48 -0.20 -0.09 -1.14 0.00 0.00 176.83 175.89 1a4s h ARG 439 N 0.11 -0.21 -0.22 3.45 2.43 -1.92 -0.18 114.38 117.84 1a4s h ARG 439 Ca 0.06 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.30 1a4s h ARG 439 Cb 0.30 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.83 1a4s h ARG 439 CO 0.00 -0.14 -0.39 0.00 -1.51 0.00 0.00 179.97 177.93 1a4s h ALA 440 N 0.84 -0.47 -0.10 2.80 0.00 -1.28 0.46 119.26 121.50 1a4s h ALA 440 Ca 0.12 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 1a4s h ALA 440 Cb 0.40 0.77 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1a4s h ALA 440 CO -0.32 -0.87 -0.58 0.45 0.00 0.00 0.00 179.25 177.93 1a4s h HIS 441 N -0.41 0.40 -0.32 0.00 3.86 -1.22 -2.45 115.15 115.00 1a4s h HIS 441 Ca 0.10 -0.15 -0.08 0.00 -1.16 0.00 0.00 60.37 59.09 1a4s h HIS 441 Cb 0.59 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 1a4s h HIS 441 CO -0.51 0.82 -0.10 -0.09 0.86 0.00 0.00 177.93 178.91 1a4s h ARG 442 N 0.24 0.63 -0.54 2.45 2.43 -0.85 -1.71 114.38 117.02 1a4s h ARG 442 Ca -0.00 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 58.87 1a4s h ARG 442 Cb 1.08 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1a4s h ARG 442 CO 0.09 0.82 0.14 0.28 -1.51 0.00 0.00 179.97 179.80 1a4s h VAL 443 N 0.40 1.24 -0.34 0.20 2.07 -0.89 -1.87 116.25 117.05 1a4s h VAL 443 Ca 0.08 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 1a4s h VAL 443 Cb 0.60 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1a4s h VAL 443 CO 0.04 0.31 -0.02 0.00 0.02 0.00 0.00 177.57 177.92 1a4s h ALA 444 N 1.02 1.33 -0.03 1.67 0.00 -1.40 -1.10 119.26 120.75 1a4s h ALA 444 Ca 0.17 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1a4s h ALA 444 Cb 0.32 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1a4s h ALA 444 CO -0.00 0.46 -0.59 0.00 0.00 0.00 0.00 179.25 179.12 1a4s h ALA 445 N 1.47 0.96 0.00 0.00 0.00 -1.04 -3.25 119.26 117.40 1a4s h ALA 445 Ca 0.11 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1a4s h ALA 445 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1a4s h ALA 445 CO 0.01 0.73 -0.65 0.09 0.00 0.00 0.00 179.25 179.43 1a4s n ASN 446 N -3.86 0.59 -4.69 0.00 3.02 -0.67 -4.85 115.26 104.80 1a4s n ASN 446 Ca -0.02 -0.19 -0.42 0.00 -0.03 0.00 0.00 54.58 53.92 1a4s n ASN 446 Cb 0.60 0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 40.10 1a4s n ASN 446 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1a4s s LEU 447 N -3.46 4.26 -1.26 3.41 1.02 -0.51 -4.96 118.68 117.19 1a4s s LEU 447 Ca 0.08 1.63 -0.14 0.00 0.02 0.00 0.00 54.13 55.72 1a4s s LEU 447 Cb 0.16 -3.56 0.14 0.00 0.02 0.00 0.00 46.19 42.95 1a4s s LEU 447 CO 0.73 -0.49 1.62 -0.62 0.02 0.00 0.00 176.35 177.61 1a4s n GLU 448 N 5.03 3.34 -3.56 1.70 1.02 -1.26 -4.94 120.64 121.98 1a4s n GLU 448 Ca 0.09 -3.61 -0.11 0.00 -0.02 0.00 0.00 57.16 53.51 1a4s n GLU 448 Cb 0.48 -3.14 -0.04 0.00 -0.02 0.00 0.00 31.44 28.72 1a4s n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1a4s s ALA 449 N 2.05 -1.18 0.38 0.62 0.00 -1.26 -4.59 121.76 117.78 1a4s s ALA 449 Ca 0.45 0.18 0.13 0.00 0.00 0.00 0.00 51.96 52.72 1a4s s ALA 449 Cb 0.02 0.73 0.76 0.00 0.00 0.00 0.00 23.12 24.63 1a4s s ALA 449 CO 0.01 -0.67 1.85 0.78 0.00 0.00 0.00 175.76 177.74 1a4s h GLY 450 N 2.29 0.00 -5.34 0.00 0.00 -0.86 -3.45 103.07 95.73 1a4s h GLY 450 Ca -0.34 -0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.54 1a4s h GLY 450 CO 0.43 0.00 -0.80 -1.59 0.00 0.00 0.00 176.54 174.59 1a4s s THR 451 N -4.27 0.92 -0.07 4.70 2.01 -1.06 -4.76 115.64 113.11 1a4s s THR 451 Ca -0.03 -0.46 0.03 0.00 0.31 0.00 0.00 61.69 61.54 1a4s s THR 451 Cb 0.15 -0.79 0.01 0.00 0.01 0.00 0.00 72.50 71.87 1a4s s THR 451 CO 0.72 0.27 -0.16 0.00 -0.69 0.00 0.00 174.62 174.77 1a4s s TYR 453 N 0.46 3.47 -0.32 0.00 2.02 -0.86 -4.98 117.35 117.15 1a4s s TYR 453 Ca -0.13 0.51 -0.08 0.00 -0.37 0.00 0.00 57.07 57.00 1a4s s TYR 453 Cb -0.15 -2.23 0.02 0.00 -0.40 0.00 0.00 41.96 39.19 1a4s s TYR 453 CO 0.05 0.32 0.11 0.42 -1.57 0.00 0.00 175.55 174.88 1a4s s ILE 454 N 0.22 4.10 -1.29 2.71 1.01 -1.26 -0.91 121.20 125.77 1a4s s ILE 454 Ca 0.14 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 1a4s s ILE 454 Cb -0.12 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.17 1a4s s ILE 454 CO 0.02 -0.02 0.25 0.59 0.00 0.00 0.00 174.94 175.78 1a4s n ASN 455 N 4.89 -4.96 -1.72 3.58 3.02 -0.19 -4.93 115.26 114.95 1a4s n ASN 455 Ca -0.14 -0.12 -0.01 0.00 -0.03 0.00 0.00 54.58 54.28 1a4s n ASN 455 Cb 0.47 -3.94 0.01 0.00 -0.61 0.00 0.00 39.78 35.71 1a4s n ASN 455 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1a4s n THR 456 N -4.13 0.00 -3.55 3.41 5.66 -1.26 -4.99 114.28 109.42 1a4s n THR 456 Ca -0.14 -0.20 -0.15 0.00 -3.05 0.00 0.00 64.05 60.51 1a4s n THR 456 Cb 0.62 0.26 -0.06 0.00 -1.55 0.00 0.00 70.33 69.60 1a4s n THR 456 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1a4s s TYR 457 N -5.00 -0.57 -1.18 1.09 6.14 -1.26 -4.76 117.35 111.80 1a4s s TYR 457 Ca 0.07 1.02 0.00 0.00 0.64 0.00 0.00 57.07 58.80 1a4s s TYR 457 Cb -0.01 0.41 0.00 0.00 0.42 0.00 0.00 41.96 42.78 1a4s s TYR 457 CO 0.02 -0.50 0.00 0.43 0.64 0.00 0.00 175.55 176.14 1a4s n SER 458 N 0.98 -4.51 -4.78 4.32 7.64 -1.26 -4.85 113.62 111.16 1a4s n SER 458 Ca -0.16 0.28 -0.37 0.00 1.01 0.00 0.00 58.87 59.63 1a4s n SER 458 Cb 0.57 -2.99 -0.03 0.00 -1.01 0.00 0.00 64.21 60.76 1a4s n SER 458 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1a4s s ILE 459 N -2.36 3.42 -0.47 0.44 -1.09 -1.26 -5.02 121.20 114.87 1a4s s ILE 459 Ca 0.00 1.08 0.06 0.00 -2.23 0.00 0.00 60.65 59.56 1a4s s ILE 459 Cb 0.00 -3.56 0.21 0.00 -1.58 0.00 0.00 42.46 37.53 1a4s s ILE 459 CO 0.00 0.00 0.47 -1.20 -1.23 0.00 0.00 174.94 172.98 1a4s n SER 460 N -0.24 0.67 -4.74 3.58 7.64 -1.26 -5.11 113.62 114.16 1a4s n SER 460 Ca 0.06 -2.71 -0.41 0.00 1.01 0.00 0.00 58.87 56.81 1a4s n SER 460 Cb 0.49 -0.62 -0.03 0.00 -1.01 0.00 0.00 64.21 63.03 1a4s n SER 460 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1a4s s PRO 461 N -0.86 4.44 0.58 1.43 0.05 -1.26 -4.92 135.00 134.45 1a4s s PRO 461 Ca 0.33 1.99 0.33 0.00 0.05 0.00 0.00 61.00 63.71 1a4s s PRO 461 Cb 0.09 -3.20 1.76 0.00 0.05 0.00 0.00 34.50 33.20 1a4s s PRO 461 CO -0.14 -0.16 2.17 -0.39 0.05 0.00 0.00 177.00 178.53 1a4s h VAL 462 N 3.64 0.36 0.00 -0.36 -1.51 -1.98 -3.20 116.25 113.20 1a4s h VAL 462 Ca -0.45 -0.30 -0.02 0.00 -1.23 0.00 0.00 66.70 64.70 1a4s h VAL 462 Cb 1.22 1.21 -0.00 0.00 -2.13 0.00 0.00 31.29 31.58 1a4s h VAL 462 CO 0.75 0.05 -0.10 -0.33 -1.23 0.00 0.00 177.57 176.71 1a4s h GLU 463 N 0.00 0.00 -6.24 5.19 3.07 -1.95 -0.30 114.58 114.36 1a4s h GLU 463 Ca -0.00 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.28 1a4s h GLU 463 Cb 0.21 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 27.93 1a4s h GLU 463 CO 0.01 0.10 -0.81 0.14 -1.40 0.00 0.00 179.01 177.05 1a4s s VAL 464 N -3.79 2.01 0.62 3.13 -7.23 -1.21 -4.38 120.40 109.55 1a4s s VAL 464 Ca -0.00 -1.91 -0.15 0.00 -1.81 0.00 0.00 61.98 58.12 1a4s s VAL 464 Cb 0.10 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 35.11 1a4s s VAL 464 CO 0.57 -0.20 1.06 -2.84 -0.31 0.00 0.00 175.10 173.38 1a4s s PRO 465 N -2.62 3.19 -0.04 4.82 0.02 -1.25 -2.97 135.00 136.15 1a4s s PRO 465 Ca 0.16 1.16 -0.02 0.00 0.02 0.00 0.00 61.00 62.33 1a4s s PRO 465 Cb -0.07 -2.02 0.03 0.00 0.02 0.00 0.00 34.50 32.46 1a4s s PRO 465 CO 0.07 -0.91 0.09 0.12 -0.33 0.00 0.00 177.00 176.04 1a4s s PHE 466 N -2.58 -0.07 0.00 6.54 5.36 0.56 -4.96 117.98 122.84 1a4s s PHE 466 Ca 0.63 0.30 0.00 0.00 -0.96 0.00 0.00 56.93 56.90 1a4s s PHE 466 Cb -0.16 -0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.37 1a4s s PHE 466 CO 0.41 -0.12 0.00 0.41 -1.46 0.00 0.00 175.22 174.46 1a4s n GLY 467 N 4.12 -0.41 3.91 13.12 0.00 -1.26 -1.45 105.19 123.22 1a4s n GLY 467 Ca -0.26 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.53 1a4s n GLY 467 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4s s GLY 468 N 0.00 1.54 0.40 -0.02 0.00 -1.26 -4.04 107.32 103.94 1a4s s GLY 468 Ca 0.00 -0.61 0.08 0.00 0.00 0.00 0.00 44.72 44.19 1a4s s GLY 468 CO 0.00 -0.41 0.37 -0.19 0.00 0.00 0.00 173.10 172.87 1a4s s TYR 469 N -2.81 2.74 0.00 1.90 1.51 -0.33 -4.46 117.35 115.91 1a4s s TYR 469 Ca 0.49 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 56.10 1a4s s TYR 469 Cb -0.10 -2.11 0.00 0.00 -0.11 0.00 0.00 41.96 39.63 1a4s s TYR 469 CO 0.44 -0.08 0.00 1.63 -1.11 0.00 0.00 175.55 176.44 1a4s n LYS 470 N -1.53 0.00 -0.02 -0.62 5.02 -1.26 -1.55 118.16 118.20 1a4s n LYS 470 Ca 0.03 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.34 1a4s n LYS 470 Cb 0.61 0.00 0.13 0.00 -0.02 0.00 0.00 35.03 35.75 1a4s n LYS 470 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1a4s n MET 471 N 14.00 1.11 -0.08 1.97 2.81 0.02 -3.04 117.12 133.92 1a4s n MET 471 Ca 0.00 -0.18 0.11 0.00 -1.81 0.00 0.00 57.70 55.82 1a4s n MET 471 Cb 0.00 -1.09 0.38 0.00 -0.71 0.00 0.00 33.22 31.80 1a4s n MET 471 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1a4s n SER 472 N -0.41 1.69 0.00 7.83 7.64 -0.60 -4.79 113.62 124.99 1a4s n SER 472 Ca 0.04 -1.70 0.00 0.00 1.01 0.00 0.00 58.87 58.22 1a4s n SER 472 Cb 0.05 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1a4s n SER 472 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a4s n GLY 473 N 1.14 -0.29 3.50 0.23 0.00 -1.17 -0.26 105.19 108.35 1a4s n GLY 473 Ca 0.16 -2.23 -0.09 0.00 0.00 0.00 0.00 46.02 43.86 1a4s n GLY 473 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1a4s s PHE 474 N 0.00 0.16 0.00 1.61 -0.12 -0.22 -4.02 117.98 115.39 1a4s s PHE 474 Ca 0.00 -0.52 0.00 0.00 -0.05 0.00 0.00 56.93 56.36 1a4s s PHE 474 Cb 0.00 0.22 0.00 0.00 -0.63 0.00 0.00 43.02 42.61 1a4s s PHE 474 CO 0.00 -0.90 0.00 0.41 -0.05 0.00 0.00 175.22 174.68 1a4s n GLY 475 N -0.32 0.55 3.16 1.99 0.00 -1.26 -1.31 105.19 107.99 1a4s n GLY 475 Ca -0.07 -1.78 -0.12 0.00 0.00 0.00 0.00 46.02 44.05 1a4s n GLY 475 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a4s s ARG 476 N -2.71 0.81 0.11 1.61 1.81 -1.26 -4.35 118.95 114.96 1a4s s ARG 476 Ca 0.00 -1.20 0.08 0.00 -1.72 0.00 0.00 55.73 52.89 1a4s s ARG 476 Cb 0.00 -0.35 -0.04 0.00 -0.45 0.00 0.00 34.95 34.11 1a4s s ARG 476 CO 0.00 0.03 -0.20 -1.21 -0.68 0.00 0.00 175.30 173.24 1a4s s GLU 477 N -3.17 1.12 0.29 3.54 8.01 -0.53 -4.61 118.70 123.35 1a4s s GLU 477 Ca 0.07 -1.17 0.00 0.00 0.01 0.00 0.00 54.97 53.88 1a4s s GLU 477 Cb 0.00 -1.35 0.00 0.00 -4.31 0.00 0.00 34.13 28.48 1a4s s GLU 477 CO -0.02 0.31 0.00 0.09 0.01 0.00 0.00 175.26 175.65 1a4s n ASN 478 N 1.03 -4.05 -0.53 -0.19 3.02 -1.26 -0.32 115.26 112.96 1a4s n ASN 478 Ca -0.19 0.66 0.07 0.00 -0.03 0.00 0.00 54.58 55.09 1a4s n ASN 478 Cb 0.54 -2.44 -0.02 0.00 -0.61 0.00 0.00 39.78 37.26 1a4s n ASN 478 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4s n GLY 479 N -3.25 -1.52 0.19 7.41 0.00 -0.12 -3.93 105.19 103.97 1a4s n GLY 479 Ca -0.04 -1.40 0.10 0.00 0.00 0.00 0.00 46.02 44.68 1a4s n GLY 479 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1a4s h GLN 480 N -0.49 0.00 -0.45 1.61 4.20 -1.88 -3.32 115.11 114.78 1a4s h GLN 480 Ca 0.01 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 1a4s h GLN 480 Cb 0.48 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1a4s h GLN 480 CO 0.00 0.10 0.10 0.00 -0.67 0.00 0.00 178.83 178.37 1a4s h ALA 481 N 1.89 1.33 -0.05 3.87 0.00 -1.97 -2.54 119.26 121.79 1a4s h ALA 481 Ca -0.01 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1a4s h ALA 481 Cb 1.09 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1a4s h ALA 481 CO 0.01 0.47 0.04 1.15 0.00 0.00 0.00 179.25 180.93 1a4s h THR 482 N 0.66 0.64 -0.38 0.00 2.02 -1.70 -2.28 112.91 111.88 1a4s h THR 482 Ca 0.15 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.35 1a4s h THR 482 Cb 0.27 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1a4s h THR 482 CO -0.00 0.00 0.25 -0.37 0.37 0.00 0.00 175.52 175.77 1a4s h VAL 483 N 0.00 1.06 0.00 3.16 -1.51 -1.69 -2.28 116.25 114.99 1a4s h VAL 483 Ca 0.02 -0.15 -0.02 0.00 -1.23 0.00 0.00 66.70 65.32 1a4s h VAL 483 Cb 0.11 0.57 -0.00 0.00 -2.13 0.00 0.00 31.29 29.84 1a4s h VAL 483 CO -0.00 0.08 -0.09 0.44 -1.23 0.00 0.00 177.57 176.77 1a4s h ASP 484 N 0.45 0.00 -0.02 4.19 3.32 -1.62 -2.25 116.42 120.48 1a4s h ASP 484 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1a4s h ASP 484 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1a4s h ASP 484 CO -0.03 0.09 0.00 -1.22 -1.72 0.00 0.00 179.24 176.36 1a4s n TYR 485 N -3.57 0.01 -0.42 4.55 4.01 -0.86 -4.06 117.16 116.82 1a4s n TYR 485 Ca -0.02 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1a4s n TYR 485 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 1a4s n TYR 485 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1a4s n TYR 486 N -0.01 0.00 -4.04 -0.72 4.01 -0.99 -5.05 117.16 110.37 1a4s n TYR 486 Ca 0.20 -0.29 -0.10 0.00 -0.16 0.00 0.00 57.90 57.54 1a4s n TYR 486 Cb 0.31 -0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 39.24 1a4s n TYR 486 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1a4s s SER 487 N -0.58 0.05 -0.06 7.72 1.04 -0.88 -4.06 113.70 116.92 1a4s s SER 487 Ca 0.00 -1.02 -0.09 0.00 0.48 0.00 0.00 55.95 55.32 1a4s s SER 487 Cb 0.00 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.59 1a4s s SER 487 CO 0.00 -0.94 0.22 0.00 0.98 0.00 0.00 173.24 173.50 1a4s s GLN 488 N -4.03 0.36 -0.07 4.02 -2.07 0.12 -4.76 119.66 113.24 1a4s s GLN 488 Ca 0.24 0.11 -0.17 0.00 -1.82 0.00 0.00 55.36 53.71 1a4s s GLN 488 Cb 0.03 0.16 -0.05 0.00 -1.09 0.00 0.00 33.01 32.07 1a4s s GLN 488 CO 0.05 -0.07 0.46 -0.51 -1.32 0.00 0.00 175.29 173.91 1a4s s LEU 489 N -0.36 4.35 -0.18 2.60 1.43 -1.26 -0.79 118.68 124.48 1a4s s LEU 489 Ca -0.05 0.89 -0.04 0.00 -1.03 0.00 0.00 54.13 53.90 1a4s s LEU 489 Cb -0.03 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 1a4s s LEU 489 CO 0.01 0.12 -0.02 -0.75 0.23 0.00 0.00 176.35 175.94 1a4s s LYS 490 N -0.02 3.64 -0.21 1.70 2.20 -0.48 -4.93 119.74 121.64 1a4s s LYS 490 Ca 0.25 -0.52 -0.15 0.00 -0.36 0.00 0.00 55.97 55.19 1a4s s LYS 490 Cb -0.16 -3.01 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 1a4s s LYS 490 CO 0.12 0.11 0.35 0.99 -0.36 0.00 0.00 175.35 176.56 1a4s s THR 491 N 0.72 5.23 -0.19 3.43 2.01 -1.26 -1.63 115.64 123.94 1a4s s THR 491 Ca -0.01 0.60 0.00 0.00 0.31 0.00 0.00 61.69 62.59 1a4s s THR 491 Cb -0.14 -3.68 0.02 0.00 0.01 0.00 0.00 72.50 68.70 1a4s s THR 491 CO 0.02 0.26 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.36 1a4s s VAL 492 N 1.33 2.36 -0.25 3.82 1.01 -0.34 -5.00 120.40 123.33 1a4s s VAL 492 Ca 0.17 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.21 1a4s s VAL 492 Cb -0.15 -2.04 -0.00 0.00 0.00 0.00 0.00 36.38 34.19 1a4s s VAL 492 CO 0.07 0.48 0.02 -0.63 0.00 0.00 0.00 175.10 175.04 1a4s s ILE 493 N 1.32 3.70 -0.24 2.22 1.01 -1.26 -1.07 121.20 126.88 1a4s s ILE 493 Ca 0.04 -0.52 -0.05 0.00 0.00 0.00 0.00 60.65 60.12 1a4s s ILE 493 Cb -0.14 -2.78 -0.01 0.00 0.01 0.00 0.00 42.46 39.54 1a4s s ILE 493 CO -0.10 0.29 0.01 0.54 0.00 0.00 0.00 174.94 175.68 1a4s s VAL 494 N 1.50 3.75 -0.22 2.92 0.11 0.78 -5.00 120.40 124.24 1a4s s VAL 494 Ca 0.05 -0.44 -0.24 0.00 -2.93 0.00 0.00 61.98 58.41 1a4s s VAL 494 Cb -0.15 -2.77 -0.01 0.00 -1.53 0.00 0.00 36.38 31.92 1a4s s VAL 494 CO -0.00 0.33 0.82 -0.70 -3.33 0.00 0.00 175.10 172.22 1a4s s GLU 495 N 1.52 4.21 0.05 1.54 2.56 -1.26 -2.19 118.70 125.13 1a4s s GLU 495 Ca 0.05 0.94 0.24 0.00 0.00 0.00 0.00 54.97 56.20 1a4s s GLU 495 Cb -0.15 -3.63 0.23 0.00 2.00 0.00 0.00 34.13 32.58 1a4s s GLU 495 CO -0.00 -0.46 1.20 -1.33 -0.56 0.00 0.00 175.26 174.11 1a4s n MET 496 N 5.78 0.19 0.00 4.30 2.81 -1.26 -4.93 117.12 124.01 1a4s n MET 496 Ca 0.05 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 1a4s n MET 496 Cb 0.48 -1.58 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 1a4s n MET 496 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a4s n GLY 497 N 1.41 4.01 3.93 3.03 0.00 -1.26 -5.07 105.19 111.24 1a4s n GLY 497 Ca 0.03 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 45.15 1a4s n GLY 497 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a4s s ASP 498 N 1.00 6.19 0.23 1.61 1.01 -1.26 -5.06 116.67 120.39 1a4s s ASP 498 Ca 0.00 0.55 -0.29 0.00 0.71 0.00 0.00 52.55 53.51 1a4s s ASP 498 Cb 0.00 -1.99 -0.09 0.00 1.01 0.00 0.00 42.92 41.85 1a4s s ASP 498 CO 0.00 -0.46 0.92 -0.69 0.21 0.00 0.00 175.17 175.15 1a4s s VAL 499 N -2.48 4.10 -0.34 -1.27 1.01 -1.26 -5.02 120.40 115.14 1a4s s VAL 499 Ca 0.44 2.05 -0.26 0.00 0.00 0.00 0.00 61.98 64.20 1a4s s VAL 499 Cb -0.10 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 31.98 1a4s s VAL 499 CO 0.39 0.50 0.94 -1.81 0.00 0.00 0.00 175.10 175.12 1a4s s ASP 500 N -1.17 6.75 0.02 3.32 1.01 -1.26 -5.02 116.67 120.31 1a4s s ASP 500 Ca 0.40 0.74 0.06 0.00 0.71 0.00 0.00 52.55 54.47 1a4s s ASP 500 Cb -0.26 -2.48 -0.02 0.00 1.01 0.00 0.00 42.92 41.18 1a4s s ASP 500 CO 0.31 -0.81 -0.18 -0.55 0.21 0.00 0.00 175.17 174.16 1a4s s SER 501 N 1.75 2.09 0.00 0.27 0.15 -1.26 -5.01 113.70 111.69 1a4s s SER 501 Ca 0.39 -0.42 0.26 0.00 0.70 0.00 0.00 55.95 56.88 1a4s s SER 501 Cb -0.12 -0.19 0.73 0.00 -1.71 0.00 0.00 66.02 64.72 1a4s s SER 501 CO 0.16 0.15 1.55 0.18 1.20 0.00 0.00 173.24 176.48 1a4s n LEU 502 N 2.19 1.42 0.00 3.45 4.77 -1.26 -5.34 117.00 122.23 1a4s n LEU 502 Ca -0.16 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1a4s n LEU 502 Cb 0.54 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1a4s n LEU 502 CO 0.23 0.25 0.12 0.49 -1.33 0.00 0.00 177.39 177.15