#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c7i n HIS 3 N 0.00 0.00 -3.58 4.78 1.44 -1.26 -4.94 115.22 111.66 1c7i n HIS 3 Ca 0.00 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.49 1c7i n HIS 3 Cb 0.00 -0.04 0.07 0.00 0.12 0.00 0.00 29.99 30.15 1c7i n HIS 3 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1c7i n GLN 4 N -0.76 -7.05 -3.45 -1.40 1.13 -1.26 -4.53 117.38 100.06 1c7i n GLN 4 Ca 0.21 0.80 -0.38 0.00 -1.94 0.00 0.00 57.00 55.70 1c7i n GLN 4 Cb 0.19 -5.79 -0.08 0.00 0.11 0.00 0.00 30.24 24.67 1c7i n GLN 4 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1c7i s ILE 5 N -3.36 5.24 -0.04 5.09 1.01 -1.26 -1.39 121.20 126.50 1c7i s ILE 5 Ca 0.34 0.61 0.05 0.00 0.00 0.00 0.00 60.65 61.66 1c7i s ILE 5 Cb -0.15 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.63 1c7i s ILE 5 CO 0.75 0.29 -0.19 -0.69 0.00 0.00 0.00 174.94 175.10 1c7i s VAL 6 N 1.10 1.55 -0.29 2.92 1.01 0.36 -4.95 120.40 122.09 1c7i s VAL 6 Ca 0.17 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 1c7i s VAL 6 Cb -0.14 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.90 1c7i s VAL 6 CO 0.07 0.44 0.46 -0.89 0.00 0.00 0.00 175.10 175.18 1c7i s THR 7 N -0.12 5.09 0.47 3.92 2.01 -1.26 -0.46 115.64 125.29 1c7i s THR 7 Ca -0.01 0.62 0.07 0.00 0.31 0.00 0.00 61.69 62.67 1c7i s THR 7 Cb -0.11 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.61 1c7i s THR 7 CO 0.02 0.02 0.64 0.42 -0.69 0.00 0.00 174.62 175.03 1c7i s THR 8 N 2.25 2.83 -0.96 -0.82 -4.23 -0.20 -4.93 115.64 109.57 1c7i s THR 8 Ca 0.18 -0.92 0.07 0.00 -1.18 0.00 0.00 61.69 59.84 1c7i s THR 8 Cb -0.16 -2.90 0.06 0.00 1.34 0.00 0.00 72.50 70.84 1c7i s THR 8 CO 0.11 0.00 1.23 0.00 -0.54 0.00 0.00 174.62 175.42 1c7i n GLN 9 N -2.01 0.01 0.00 3.99 10.64 -1.26 -2.11 117.38 126.64 1c7i n GLN 9 Ca 0.09 0.40 0.03 0.00 -1.83 0.00 0.00 57.00 55.69 1c7i n GLN 9 Cb 0.59 -1.52 -0.00 0.00 -0.86 0.00 0.00 30.24 28.45 1c7i n GLN 9 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1c7i n TYR 10 N -1.54 0.00 0.00 2.61 4.01 -1.26 -5.02 117.16 115.96 1c7i n TYR 10 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1c7i n TYR 10 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 1c7i n TYR 10 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1c7i n GLY 11 N 0.77 2.57 3.78 2.72 0.00 -0.90 -0.85 105.19 113.29 1c7i n GLY 11 Ca 0.02 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 44.20 1c7i n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c7i s LYS 12 N -1.97 4.56 0.03 1.61 1.02 -1.26 -1.03 119.74 122.70 1c7i s LYS 12 Ca 0.00 1.33 0.05 0.00 0.02 0.00 0.00 55.97 57.36 1c7i s LYS 12 Cb 0.00 -2.76 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 1c7i s LYS 12 CO 0.00 0.25 -0.14 0.14 -0.92 0.00 0.00 175.35 174.69 1c7i s VAL 13 N -1.64 1.08 -0.21 3.17 -7.23 0.39 -1.75 120.40 114.20 1c7i s VAL 13 Ca 0.51 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.77 1c7i s VAL 13 Cb -0.18 -0.97 0.03 0.00 0.56 0.00 0.00 36.38 35.82 1c7i s VAL 13 CO 0.23 0.05 -0.14 -0.75 -0.31 0.00 0.00 175.10 174.18 1c7i s LYS 14 N -0.98 2.87 0.00 4.82 2.20 -0.04 -0.49 119.74 128.12 1c7i s LYS 14 Ca 0.02 -0.93 0.00 0.00 -0.36 0.00 0.00 55.97 54.70 1c7i s LYS 14 Cb -0.07 -2.75 0.00 0.00 -1.51 0.00 0.00 37.83 33.50 1c7i s LYS 14 CO 0.01 -0.31 0.00 0.41 -0.36 0.00 0.00 175.35 175.10 1c7i n GLY 15 N 4.61 1.63 3.52 5.54 0.00 -0.48 -1.83 105.19 118.18 1c7i n GLY 15 Ca -0.19 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 43.89 1c7i n GLY 15 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1c7i s THR 16 N 2.20 0.02 -0.11 2.61 -1.32 -0.21 -4.84 115.64 114.00 1c7i s THR 16 Ca 0.00 -1.20 0.01 0.00 -1.21 0.00 0.00 61.69 59.29 1c7i s THR 16 Cb 0.00 -1.93 0.02 0.00 -1.51 0.00 0.00 72.50 69.08 1c7i s THR 16 CO 0.00 -0.10 -0.13 -0.89 -2.21 0.00 0.00 174.62 171.28 1c7i s THR 17 N -3.96 1.37 -0.04 5.08 2.01 -1.26 0.03 115.64 118.87 1c7i s THR 17 Ca 0.17 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.62 1c7i s THR 17 Cb -0.00 -1.28 0.02 0.00 0.01 0.00 0.00 72.50 71.26 1c7i s THR 17 CO 0.03 0.42 -0.04 -1.61 -0.69 0.00 0.00 174.62 172.73 1c7i s GLU 18 N 1.08 0.80 -1.68 4.92 2.02 -0.42 -4.88 118.70 120.54 1c7i s GLU 18 Ca -0.05 -0.10 -0.14 0.00 0.02 0.00 0.00 54.97 54.70 1c7i s GLU 18 Cb -0.15 -0.81 0.13 0.00 0.10 0.00 0.00 34.13 33.41 1c7i s GLU 18 CO -0.02 -0.08 0.56 0.09 0.02 0.00 0.00 175.26 175.83 1c7i n ASN 19 N 4.01 -1.77 -0.23 -0.19 3.02 -1.26 -0.76 115.26 118.08 1c7i n ASN 19 Ca -0.26 -1.11 -0.03 0.00 -0.03 0.00 0.00 54.58 53.15 1c7i n ASN 19 Cb 0.51 -2.32 -0.01 0.00 -0.61 0.00 0.00 39.78 37.35 1c7i n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1c7i n GLY 20 N -1.60 0.51 2.73 7.41 0.00 -1.26 -5.01 105.19 107.97 1c7i n GLY 20 Ca -0.04 -0.92 -0.21 0.00 0.00 0.00 0.00 46.02 44.85 1c7i n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c7i s VAL 21 N -2.11 0.13 0.16 1.61 1.01 0.06 -0.78 120.40 120.48 1c7i s VAL 21 Ca 0.00 0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.94 1c7i s VAL 21 Cb 0.00 -0.34 -0.07 0.00 0.00 0.00 0.00 36.38 35.98 1c7i s VAL 21 CO 0.00 0.21 0.98 -1.00 0.00 0.00 0.00 175.10 175.29 1c7i s HIS 22 N 1.99 3.83 -0.01 5.22 3.76 0.20 -1.30 115.29 128.98 1c7i s HIS 22 Ca 0.04 1.81 0.01 0.00 -0.15 0.00 0.00 55.06 56.77 1c7i s HIS 22 Cb -0.12 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.51 1c7i s HIS 22 CO -0.04 0.16 -0.05 0.15 -0.85 0.00 0.00 174.74 174.12 1c7i s LYS 23 N -0.39 0.49 -0.12 1.40 1.02 0.10 -0.62 119.74 121.62 1c7i s LYS 23 Ca 0.46 -0.15 -0.01 0.00 0.02 0.00 0.00 55.97 56.28 1c7i s LYS 23 Cb -0.25 -0.50 0.04 0.00 -0.52 0.00 0.00 37.83 36.60 1c7i s LYS 23 CO 0.31 0.06 -0.02 -1.58 -0.92 0.00 0.00 175.35 173.20 1c7i s TRP 24 N 0.17 1.08 0.02 3.18 0.51 -0.50 -1.05 118.94 122.35 1c7i s TRP 24 Ca -0.02 -0.57 0.08 0.00 -2.12 0.00 0.00 56.10 53.48 1c7i s TRP 24 Cb -0.05 -1.02 -0.03 0.00 -0.81 0.00 0.00 33.47 31.56 1c7i s TRP 24 CO -0.00 -0.47 -0.23 0.15 -0.51 0.00 0.00 176.95 175.89 1c7i s LYS 25 N 1.84 2.00 -0.37 4.98 1.02 0.51 -0.30 119.74 129.43 1c7i s LYS 25 Ca 0.03 -1.00 -0.02 0.00 0.02 0.00 0.00 55.97 55.00 1c7i s LYS 25 Cb -0.14 -2.09 0.00 0.00 -0.52 0.00 0.00 37.83 35.09 1c7i s LYS 25 CO -0.07 0.54 0.32 0.41 -0.92 0.00 0.00 175.35 175.63 1c7i n GLY 26 N 1.90 0.47 3.66 -3.33 0.00 -1.19 -3.57 105.19 103.12 1c7i n GLY 26 Ca -0.17 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 1c7i n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c7i s ILE 27 N -3.09 5.03 0.20 -0.61 1.01 -0.41 -4.79 121.20 118.54 1c7i s ILE 27 Ca 0.13 1.16 -0.30 0.00 0.00 0.00 0.00 60.65 61.64 1c7i s ILE 27 Cb -0.06 -3.93 -0.09 0.00 0.01 0.00 0.00 42.46 38.39 1c7i s ILE 27 CO 0.20 0.12 1.40 -2.84 0.00 0.00 0.00 174.94 173.82 1c7i s PRO 28 N 1.88 4.31 0.00 2.79 0.02 -1.26 -0.75 135.00 141.99 1c7i s PRO 28 Ca 0.28 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1c7i s PRO 28 Cb -0.16 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.20 1c7i s PRO 28 CO 0.10 -0.38 0.21 2.48 -0.33 0.00 0.00 177.00 179.08 1c7i n TYR 29 N 2.83 0.00 -3.86 6.54 4.11 -1.11 -4.90 117.16 120.77 1c7i n TYR 29 Ca 0.08 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.89 1c7i n TYR 29 Cb 0.41 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.72 1c7i n TYR 29 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1c7i s ALA 30 N -0.54 -0.83 0.15 -3.48 0.00 -1.26 -4.49 121.76 111.31 1c7i s ALA 30 Ca 0.00 -0.45 -0.30 0.00 0.00 0.00 0.00 51.96 51.21 1c7i s ALA 30 Cb 0.00 0.92 -0.07 0.00 0.00 0.00 0.00 23.12 23.97 1c7i s ALA 30 CO 0.00 -0.90 1.09 0.21 0.00 0.00 0.00 175.76 176.15 1c7i s LYS 31 N -3.93 4.59 -0.27 0.00 2.20 0.15 -4.32 119.74 118.16 1c7i s LYS 31 Ca 0.14 1.67 -0.39 0.00 -0.36 0.00 0.00 55.97 57.03 1c7i s LYS 31 Cb -0.03 -3.31 -0.15 0.00 -1.51 0.00 0.00 37.83 32.84 1c7i s LYS 31 CO 0.04 0.06 1.79 -2.30 -0.36 0.00 0.00 175.35 174.58 1c7i n PRO 32 N 2.65 1.24 -1.12 4.03 -0.02 -1.26 -4.65 135.00 135.87 1c7i n PRO 32 Ca 0.03 0.45 -0.33 0.00 -2.02 0.00 0.00 63.50 61.63 1c7i n PRO 32 Cb 0.47 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.75 1c7i n PRO 32 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1c7i n PRO 33 N 5.70 2.99 -4.14 0.52 -0.04 -1.26 -4.87 135.00 133.91 1c7i n PRO 33 Ca 0.27 -1.94 -0.24 0.00 -0.04 0.00 0.00 63.50 61.55 1c7i n PRO 33 Cb 0.15 -2.71 -0.06 0.00 -0.04 0.00 0.00 33.50 30.84 1c7i n PRO 33 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1c7i s VAL 34 N 2.78 4.23 0.00 0.52 -7.23 -1.26 -3.95 120.40 115.48 1c7i s VAL 34 Ca 0.57 -1.35 0.00 0.00 -1.81 0.00 0.00 61.98 59.39 1c7i s VAL 34 Cb 0.15 -3.21 0.00 0.00 0.56 0.00 0.00 36.38 33.88 1c7i s VAL 34 CO -0.05 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 1c7i n GLY 35 N -0.68 3.44 0.21 2.32 0.00 -1.26 -1.41 105.19 107.81 1c7i n GLY 35 Ca -0.08 0.18 0.14 0.00 0.00 0.00 0.00 46.02 46.26 1c7i n GLY 35 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1c7i h GLN 36 N 0.00 0.00 -0.32 1.61 4.20 -1.95 -0.61 115.11 118.04 1c7i h GLN 36 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1c7i h GLN 36 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1c7i h GLN 36 CO 0.00 0.00 0.00 0.91 -0.67 0.00 0.00 178.83 179.07 1c7i n TRP 37 N -2.49 0.41 -2.49 2.96 8.01 -0.50 -4.85 117.44 118.48 1c7i n TRP 37 Ca -0.02 -0.20 -0.41 0.00 -1.31 0.00 0.00 57.50 55.56 1c7i n TRP 37 Cb 0.06 0.00 -0.04 0.00 -2.01 0.00 0.00 31.31 29.32 1c7i n TRP 37 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.69 177.18 1c7i s ARG 38 N -1.59 4.60 -0.42 -0.99 3.52 -0.24 -2.88 118.95 120.95 1c7i s ARG 38 Ca 0.36 1.77 0.00 0.00 -0.13 0.00 0.00 55.73 57.73 1c7i s ARG 38 Cb 0.21 -3.24 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 1c7i s ARG 38 CO 0.29 0.12 0.00 1.19 -0.81 0.00 0.00 175.30 176.09 1c7i n PHE 39 N 1.90 0.00 -4.36 5.12 3.72 -1.26 -4.98 117.46 117.60 1c7i n PHE 39 Ca 0.01 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.14 1c7i n PHE 39 Cb 0.45 -1.27 -0.11 0.00 -0.94 0.00 0.00 39.48 37.61 1c7i n PHE 39 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1c7i s LYS 40 N -1.70 1.69 0.64 -1.08 1.02 -1.14 -2.27 119.74 116.90 1c7i s LYS 40 Ca 0.00 -1.36 -0.18 0.00 0.02 0.00 0.00 55.97 54.45 1c7i s LYS 40 Cb 0.00 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 1c7i s LYS 40 CO 0.00 0.43 1.02 0.00 -0.92 0.00 0.00 175.35 175.88 1c7i n ALA 41 N 0.43 0.23 -1.83 5.17 0.00 -1.26 -4.90 120.51 118.34 1c7i n ALA 41 Ca -0.14 -0.05 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 1c7i n ALA 41 Cb 0.55 -2.15 -0.02 0.00 0.00 0.00 0.00 19.45 17.83 1c7i n ALA 41 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1c7i s PRO 42 N -3.02 4.33 0.27 0.00 0.04 -1.26 -5.04 135.00 130.33 1c7i s PRO 42 Ca 0.77 2.22 0.09 0.00 0.04 0.00 0.00 61.00 64.12 1c7i s PRO 42 Cb -0.39 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 31.01 1c7i s PRO 42 CO 0.46 -0.26 0.02 -1.21 0.04 0.00 0.00 177.00 176.05 1c7i s GLU 43 N -1.19 2.31 0.64 4.56 0.41 -1.26 -4.97 118.70 119.20 1c7i s GLU 43 Ca 0.53 -1.43 -0.18 0.00 -0.41 0.00 0.00 54.97 53.48 1c7i s GLU 43 Cb -0.40 -2.17 -0.01 0.00 -1.78 0.00 0.00 34.13 29.77 1c7i s GLU 43 CO 0.48 0.34 1.25 -2.14 -0.49 0.00 0.00 175.26 174.70 1c7i s PRO 44 N -3.70 2.64 0.57 0.39 0.02 -1.26 0.32 135.00 133.98 1c7i s PRO 44 Ca 0.32 1.94 -0.14 0.00 0.02 0.00 0.00 61.00 63.14 1c7i s PRO 44 Cb -0.06 -1.87 -0.06 0.00 0.02 0.00 0.00 34.50 32.53 1c7i s PRO 44 CO 0.20 -1.49 1.01 -1.25 -0.33 0.00 0.00 177.00 175.13 1c7i s PRO 45 N -3.44 3.78 0.28 5.54 0.04 -1.26 -3.83 135.00 136.11 1c7i s PRO 45 Ca 0.80 0.85 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 1c7i s PRO 45 Cb -0.34 -2.11 -0.10 0.00 0.04 0.00 0.00 34.50 31.99 1c7i s PRO 45 CO 0.38 -0.42 1.37 -1.21 0.04 0.00 0.00 177.00 177.17 1c7i s GLU 46 N -4.61 4.31 0.72 4.56 0.41 -1.26 -4.91 118.70 117.91 1c7i s GLU 46 Ca 0.57 2.24 -0.14 0.00 -0.41 0.00 0.00 54.97 57.23 1c7i s GLU 46 Cb -0.10 -3.10 0.03 0.00 -1.78 0.00 0.00 34.13 29.18 1c7i s GLU 46 CO 0.42 -0.31 1.14 0.14 -0.49 0.00 0.00 175.26 176.16 1c7i s VAL 47 N -0.47 2.88 -0.01 2.63 -7.23 -1.26 -5.02 120.40 111.91 1c7i s VAL 47 Ca 0.55 0.39 0.03 0.00 -1.81 0.00 0.00 61.98 61.13 1c7i s VAL 47 Cb -0.40 -2.88 -0.00 0.00 0.56 0.00 0.00 36.38 33.65 1c7i s VAL 47 CO 0.47 -0.27 -0.08 -1.66 -0.31 0.00 0.00 175.10 173.24 1c7i s TRP 48 N -2.33 0.79 -2.02 2.82 -2.14 -0.03 -5.04 118.94 110.99 1c7i s TRP 48 Ca 0.68 -0.16 0.17 0.00 2.66 0.00 0.00 56.10 59.45 1c7i s TRP 48 Cb -0.23 -0.53 0.19 0.00 -3.10 0.00 0.00 33.47 29.80 1c7i s TRP 48 CO 0.46 -0.03 1.09 -0.85 -2.66 0.00 0.00 176.95 174.96 1c7i n GLU 49 N 2.98 1.59 0.00 3.25 0.28 -1.26 -4.15 120.64 123.33 1c7i n GLU 49 Ca -0.15 -1.64 0.00 0.00 -0.16 0.00 0.00 57.16 55.21 1c7i n GLU 49 Cb 0.56 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 32.09 1c7i n GLU 49 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1c7i n ASP 50 N 0.97 0.00 -3.86 -1.84 5.75 -1.26 -4.92 116.55 111.40 1c7i n ASP 50 Ca 0.11 0.00 -0.30 0.00 -0.01 0.00 0.00 54.79 54.59 1c7i n ASP 50 Cb 0.44 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.38 1c7i n ASP 50 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1c7i s VAL 51 N 0.88 1.31 0.13 2.12 1.01 -1.26 -4.24 120.40 120.35 1c7i s VAL 51 Ca 0.00 -1.42 -0.31 0.00 0.00 0.00 0.00 61.98 60.26 1c7i s VAL 51 Cb 0.00 -1.82 -0.08 0.00 0.00 0.00 0.00 36.38 34.48 1c7i s VAL 51 CO 0.00 -0.42 1.33 -0.22 0.00 0.00 0.00 175.10 175.80 1c7i s LEU 52 N 1.44 4.38 -0.53 3.92 2.96 -0.72 -4.87 118.68 125.26 1c7i s LEU 52 Ca 0.03 2.30 -0.29 0.00 -0.22 0.00 0.00 54.13 55.95 1c7i s LEU 52 Cb -0.18 -3.59 0.03 0.00 0.50 0.00 0.00 46.19 42.95 1c7i s LEU 52 CO -0.14 -0.58 1.17 -0.62 -1.32 0.00 0.00 176.35 174.86 1c7i s ASP 53 N 0.86 6.53 -0.90 3.68 2.15 -1.26 -0.86 116.67 126.87 1c7i s ASP 53 Ca 0.61 0.27 -0.01 0.00 0.43 0.00 0.00 52.55 53.86 1c7i s ASP 53 Cb -0.35 -2.55 0.34 0.00 -0.30 0.00 0.00 42.92 40.05 1c7i s ASP 53 CO 0.32 -1.37 1.82 0.00 -0.17 0.00 0.00 175.17 175.77 1c7i n ALA 54 N 8.16 6.13 0.09 3.66 0.00 -0.76 -4.48 120.51 133.30 1c7i n ALA 54 Ca 0.10 -4.41 0.01 0.00 0.00 0.00 0.00 53.44 49.14 1c7i n ALA 54 Cb 0.49 -1.95 0.01 0.00 0.00 0.00 0.00 19.45 18.00 1c7i n ALA 54 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1c7i n THR 55 N -0.28 0.00 -4.46 0.00 -2.24 -1.23 -0.36 114.28 105.70 1c7i n THR 55 Ca 0.48 -0.50 -0.20 0.00 -2.27 0.00 0.00 64.05 61.57 1c7i n THR 55 Cb 0.28 1.04 -0.15 0.00 -2.10 0.00 0.00 70.33 69.40 1c7i n THR 55 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1c7i s VAL 56 N -0.25 0.85 0.50 2.28 1.01 -1.25 -4.83 120.40 118.70 1c7i s VAL 56 Ca 0.02 -0.46 -0.22 0.00 0.00 0.00 0.00 61.98 61.32 1c7i s VAL 56 Cb 0.02 -0.71 -0.06 0.00 0.00 0.00 0.00 36.38 35.63 1c7i s VAL 56 CO 0.03 0.24 1.25 -0.31 0.00 0.00 0.00 175.10 176.31 1c7i s TYR 57 N -0.25 2.62 0.94 5.22 2.02 -1.26 -3.36 117.35 123.28 1c7i s TYR 57 Ca 0.04 1.47 -0.15 0.00 -0.37 0.00 0.00 57.07 58.06 1c7i s TYR 57 Cb -0.04 -3.56 0.17 0.00 -0.40 0.00 0.00 41.96 38.12 1c7i s TYR 57 CO -0.00 -2.10 1.24 0.20 -1.57 0.00 0.00 175.55 173.31 1c7i s GLY 58 N -1.18 1.68 0.90 0.71 0.00 -1.26 -4.86 107.32 103.32 1c7i s GLY 58 Ca 0.67 -0.93 -0.11 0.00 0.00 0.00 0.00 44.72 44.35 1c7i s GLY 58 CO 0.40 -0.26 1.10 -4.14 0.00 0.00 0.00 173.10 170.21 1c7i s PRO 59 N -5.67 1.17 0.20 2.90 0.02 -1.26 -4.95 135.00 127.41 1c7i s PRO 59 Ca 0.69 1.13 0.05 0.00 0.02 0.00 0.00 61.00 62.89 1c7i s PRO 59 Cb -0.08 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.63 1c7i s PRO 59 CO 0.52 -2.39 0.19 0.14 -0.33 0.00 0.00 177.00 175.14 1c7i s VAL 60 N -2.78 4.63 0.32 3.83 -7.23 -0.48 -4.44 120.40 114.24 1c7i s VAL 60 Ca 0.64 -1.14 -0.29 0.00 -1.81 0.00 0.00 61.98 59.39 1c7i s VAL 60 Cb -0.20 -3.42 -0.11 0.00 0.56 0.00 0.00 36.38 33.21 1c7i s VAL 60 CO 0.58 -0.20 1.43 0.00 -0.31 0.00 0.00 175.10 176.59 1c7i n PRO 62 N 1.17 2.32 -3.57 0.00 -0.04 -1.26 -4.76 135.00 128.86 1c7i n PRO 62 Ca 0.03 0.82 -0.08 0.00 -0.04 0.00 0.00 63.50 64.22 1c7i n PRO 62 Cb 0.40 -2.47 -0.02 0.00 -0.04 0.00 0.00 33.50 31.38 1c7i n PRO 62 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1c7i s GLN 63 N -1.62 1.08 0.80 0.54 -2.07 -1.26 -4.87 119.66 112.27 1c7i s GLN 63 Ca 0.57 -0.47 -0.11 0.00 -1.82 0.00 0.00 55.36 53.53 1c7i s GLN 63 Cb -0.55 0.45 0.08 0.00 -1.09 0.00 0.00 33.01 31.90 1c7i s GLN 63 CO 0.60 -0.48 1.12 -1.25 -1.32 0.00 0.00 175.29 173.95 1c7i s PRO 64 N -3.36 1.92 0.00 9.60 0.04 -1.26 -4.86 135.00 137.07 1c7i s PRO 64 Ca 0.06 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.44 1c7i s PRO 64 Cb -0.01 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1c7i s PRO 64 CO -0.06 -1.92 0.85 0.43 0.04 0.00 0.00 177.00 176.33 1c7i n SER 65 N -3.60 0.26 -0.27 6.66 7.64 -1.26 -4.38 113.62 118.66 1c7i n SER 65 Ca 0.10 -1.95 0.05 0.00 1.01 0.00 0.00 58.87 58.09 1c7i n SER 65 Cb 0.52 -0.13 0.15 0.00 -1.01 0.00 0.00 64.21 63.74 1c7i n SER 65 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1c7i h ASP 66 N 0.01 -0.52 0.07 6.43 5.19 -2.01 -2.54 116.42 123.05 1c7i h ASP 66 Ca 0.00 0.22 -0.38 0.00 -0.62 0.00 0.00 57.03 56.26 1c7i h ASP 66 Cb 0.13 0.42 -0.04 0.00 0.18 0.00 0.00 39.33 40.01 1c7i h ASP 66 CO 0.00 -0.23 -2.24 -0.11 -3.12 0.00 0.00 179.24 173.54 1c7i n LEU 67 N -5.43 2.71 -0.15 1.55 7.94 -1.26 -4.46 117.00 117.89 1c7i n LEU 67 Ca 0.14 0.04 -0.03 0.00 -1.11 0.00 0.00 56.01 55.04 1c7i n LEU 67 Cb 0.48 -0.96 0.06 0.00 0.53 0.00 0.00 43.42 43.53 1c7i n LEU 67 CO 0.00 0.88 0.94 -0.07 -1.11 0.00 0.00 177.39 178.04 1c7i h LEU 68 N 0.03 0.12 0.00 -1.96 3.38 -1.82 0.86 115.31 115.92 1c7i h LEU 68 Ca -0.50 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1c7i h LEU 68 Cb 1.97 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.79 1c7i h LEU 68 CO 0.00 0.09 0.00 -1.54 0.09 0.00 0.00 178.44 177.08 1c7i n SER 69 N -5.04 0.00 -0.04 -0.43 3.41 -0.96 -1.37 113.62 109.18 1c7i n SER 69 Ca 0.05 0.30 -0.06 0.00 -0.26 0.00 0.00 58.87 58.90 1c7i n SER 69 Cb 0.21 -0.36 -0.05 0.00 -0.26 0.00 0.00 64.21 63.75 1c7i n SER 69 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1c7i n LEU 70 N -1.36 2.13 0.09 1.04 4.77 -0.43 -4.69 117.00 118.57 1c7i n LEU 70 Ca 0.02 -0.04 -0.06 0.00 -0.03 0.00 0.00 56.01 55.91 1c7i n LEU 70 Cb 0.06 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1c7i n LEU 70 CO 0.05 0.53 0.28 -1.28 -1.33 0.00 0.00 177.39 175.64 1c7i h SER 71 N 0.00 0.09 -3.59 -1.43 0.87 -0.64 -3.45 113.55 105.40 1c7i h SER 71 Ca -0.21 -0.07 -0.67 0.00 -1.23 0.00 0.00 61.79 59.61 1c7i h SER 71 Cb 1.37 -0.03 -0.16 0.00 -0.44 0.00 0.00 62.40 63.14 1c7i h SER 71 CO -0.02 0.89 -0.72 -0.31 -0.53 0.00 0.00 176.83 176.14 1c7i s TYR 72 N -3.15 2.80 -1.07 2.24 1.51 -0.47 -4.48 117.35 114.73 1c7i s TYR 72 Ca -0.01 -0.11 0.26 0.00 -1.01 0.00 0.00 57.07 56.20 1c7i s TYR 72 Cb 0.11 -1.50 0.76 0.00 -0.11 0.00 0.00 41.96 41.22 1c7i s TYR 72 CO 0.81 0.40 1.59 0.36 -1.11 0.00 0.00 175.55 177.60 1c7i n LYS 73 N 1.03 0.08 -3.54 -0.62 2.85 -1.26 -4.67 118.16 112.03 1c7i n LYS 73 Ca -0.14 -0.04 -0.28 0.00 -1.05 0.00 0.00 58.31 56.81 1c7i n LYS 73 Cb 0.52 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 33.25 1c7i n LYS 73 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1c7i s GLU 74 N -2.94 0.18 -0.26 -1.58 2.02 -1.26 -5.10 118.70 109.75 1c7i s GLU 74 Ca 0.14 -0.42 -0.40 0.00 0.02 0.00 0.00 54.97 54.30 1c7i s GLU 74 Cb 0.18 -1.24 -0.16 0.00 0.10 0.00 0.00 34.13 33.01 1c7i s GLU 74 CO 0.63 -0.96 1.73 -0.11 0.02 0.00 0.00 175.26 176.57 1c7i n LEU 75 N 5.26 2.36 -4.82 1.80 7.94 -1.26 -4.93 117.00 123.34 1c7i n LEU 75 Ca -0.06 1.08 -0.30 0.00 -1.11 0.00 0.00 56.01 55.61 1c7i n LEU 75 Cb 0.43 -1.14 0.07 0.00 0.53 0.00 0.00 43.42 43.31 1c7i n LEU 75 CO 0.05 -0.46 0.72 -2.16 -1.11 0.00 0.00 177.39 174.43 1c7i s PRO 76 N 3.41 2.59 0.41 1.96 0.04 -1.26 -5.02 135.00 137.13 1c7i s PRO 76 Ca 0.98 0.75 -0.24 0.00 0.04 0.00 0.00 61.00 62.53 1c7i s PRO 76 Cb -1.06 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 31.42 1c7i s PRO 76 CO 0.65 -1.29 1.08 -0.98 0.04 0.00 0.00 177.00 176.50 1c7i s ARG 77 N -5.14 4.09 0.10 4.56 1.70 -1.26 -4.93 118.95 118.07 1c7i s ARG 77 Ca 0.59 1.58 0.08 0.00 -0.47 0.00 0.00 55.73 57.51 1c7i s ARG 77 Cb -0.14 -2.53 -0.04 0.00 -0.57 0.00 0.00 34.95 31.67 1c7i s ARG 77 CO 0.54 -0.22 -0.16 -0.65 -1.08 0.00 0.00 175.30 173.73 1c7i s GLN 78 N -2.51 1.93 -0.29 3.89 -0.21 -1.26 -1.39 119.66 119.83 1c7i s GLN 78 Ca 0.59 -1.10 -0.28 0.00 0.02 0.00 0.00 55.36 54.59 1c7i s GLN 78 Cb -0.24 -2.18 0.19 0.00 1.00 0.00 0.00 33.01 31.78 1c7i s GLN 78 CO 0.30 0.50 1.38 0.45 -2.12 0.00 0.00 175.29 175.79 1c7i s SER 79 N -2.01 -0.06 0.60 5.90 0.15 -0.17 -4.86 113.70 113.25 1c7i s SER 79 Ca 0.18 0.08 0.40 0.00 0.70 0.00 0.00 55.95 57.31 1c7i s SER 79 Cb -0.11 0.07 2.10 0.00 -1.71 0.00 0.00 66.02 66.38 1c7i s SER 79 CO 0.10 -0.04 2.22 -0.33 1.20 0.00 0.00 173.24 176.39 1c7i h GLU 80 N 2.49 0.00 -5.44 5.44 5.08 -1.93 -3.17 114.58 117.05 1c7i h GLU 80 Ca -0.16 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.51 1c7i h GLU 80 Cb 1.19 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.31 1c7i h GLU 80 CO 0.21 0.00 1.68 0.34 -1.00 0.00 0.00 179.01 180.24 1c7i s ASP 81 N -5.06 6.85 0.00 1.42 -1.08 -1.26 -4.19 116.67 113.34 1c7i s ASP 81 Ca -0.04 -2.45 0.00 0.00 -0.52 0.00 0.00 52.55 49.55 1c7i s ASP 81 Cb 0.11 -2.50 0.00 0.00 -1.46 0.00 0.00 42.92 39.07 1c7i s ASP 81 CO 0.40 -1.07 0.33 0.00 0.52 0.00 0.00 175.17 175.35 1c7i s LEU 83 N -0.11 3.60 0.07 0.00 1.43 -1.26 -4.49 118.68 117.91 1c7i s LEU 83 Ca 0.00 -1.86 0.02 0.00 -1.03 0.00 0.00 54.13 51.26 1c7i s LEU 83 Cb 0.00 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1c7i s LEU 83 CO 0.00 -1.55 -0.07 -0.31 0.23 0.00 0.00 176.35 174.65 1c7i s TYR 84 N 5.39 0.76 0.25 0.29 1.51 -1.26 -2.74 117.35 121.54 1c7i s TYR 84 Ca 0.53 -0.70 0.11 0.00 -1.01 0.00 0.00 57.07 56.00 1c7i s TYR 84 Cb 0.01 -0.45 -0.05 0.00 -0.11 0.00 0.00 41.96 41.37 1c7i s TYR 84 CO 0.00 -0.12 -0.18 0.14 -1.11 0.00 0.00 175.55 174.28 1c7i s VAL 85 N -2.45 2.61 0.01 0.71 -7.23 0.07 -2.58 120.40 111.54 1c7i s VAL 85 Ca 0.00 -2.20 0.03 0.00 -1.81 0.00 0.00 61.98 58.01 1c7i s VAL 85 Cb -0.03 -2.34 -0.01 0.00 0.56 0.00 0.00 36.38 34.56 1c7i s VAL 85 CO -0.02 -0.30 -0.11 0.20 -0.31 0.00 0.00 175.10 174.56 1c7i s ASN 86 N -3.26 1.28 -0.07 4.85 0.01 -0.18 -1.29 114.94 116.28 1c7i s ASN 86 Ca 0.27 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 52.16 1c7i s ASN 86 Cb -0.06 -0.11 0.00 0.00 0.41 0.00 0.00 41.25 41.50 1c7i s ASN 86 CO 0.14 0.06 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.93 1c7i s VAL 87 N -0.52 1.55 -0.17 1.60 1.01 0.59 -1.52 120.40 122.93 1c7i s VAL 87 Ca 0.02 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.27 1c7i s VAL 87 Cb -0.06 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 34.99 1c7i s VAL 87 CO 0.00 0.45 -0.18 -0.36 0.00 0.00 0.00 175.10 175.01 1c7i s PHE 88 N 0.40 2.57 -0.03 5.22 0.40 0.15 -1.41 117.98 125.28 1c7i s PHE 88 Ca -0.14 -1.51 0.03 0.00 -0.60 0.00 0.00 56.93 54.72 1c7i s PHE 88 Cb -0.16 -1.80 0.00 0.00 0.51 0.00 0.00 43.02 41.57 1c7i s PHE 88 CO 0.05 -0.76 -0.11 0.00 0.70 0.00 0.00 175.22 175.10 1c7i s ALA 89 N 1.36 1.06 0.31 5.36 0.00 0.20 -0.70 121.76 129.35 1c7i s ALA 89 Ca 0.05 -0.43 -0.29 0.00 0.00 0.00 0.00 51.96 51.29 1c7i s ALA 89 Cb -0.13 -0.38 -0.10 0.00 0.00 0.00 0.00 23.12 22.51 1c7i s ALA 89 CO -0.12 0.17 1.24 -1.25 0.00 0.00 0.00 175.76 175.81 1c7i s PRO 90 N 0.18 4.45 -0.89 0.00 0.04 -1.26 0.61 135.00 138.12 1c7i s PRO 90 Ca -0.04 2.08 -0.25 0.00 0.04 0.00 0.00 61.00 62.84 1c7i s PRO 90 Cb -0.10 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.31 1c7i s PRO 90 CO 0.01 -0.07 1.79 0.34 0.04 0.00 0.00 177.00 179.11 1c7i s ASP 91 N -0.56 5.52 0.03 6.66 -1.08 0.04 -4.78 116.67 122.50 1c7i s ASP 91 Ca 0.48 -0.73 0.02 0.00 -0.52 0.00 0.00 52.55 51.80 1c7i s ASP 91 Cb -0.37 -2.56 -0.02 0.00 -1.46 0.00 0.00 42.92 38.51 1c7i s ASP 91 CO 0.48 -2.37 -0.07 -0.89 0.52 0.00 0.00 175.17 172.85 1c7i s THR 92 N 8.57 0.46 0.26 1.71 2.01 -1.26 -4.98 115.64 122.41 1c7i s THR 92 Ca 0.62 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1c7i s THR 92 Cb -0.06 -0.52 0.02 0.00 0.01 0.00 0.00 72.50 71.96 1c7i s THR 92 CO 0.00 -0.31 1.66 -0.65 -0.69 0.00 0.00 174.62 174.63 1c7i h PRO 93 N 4.79 0.37 -6.64 4.92 0.11 -2.05 -3.44 132.00 130.07 1c7i h PRO 93 Ca -0.34 -0.18 -0.56 0.00 0.11 0.00 0.00 66.00 65.03 1c7i h PRO 93 Cb 1.20 -0.00 0.08 0.00 0.11 0.00 0.00 31.00 32.39 1c7i h PRO 93 CO 0.42 0.72 0.78 0.43 -0.21 0.00 0.00 178.00 180.14 1c7i n SER 94 N -4.03 3.29 -3.88 -2.05 7.64 -1.26 -5.01 113.62 108.33 1c7i n SER 94 Ca -0.02 1.12 -0.14 0.00 1.01 0.00 0.00 58.87 60.85 1c7i n SER 94 Cb 0.49 -1.49 0.03 0.00 -1.01 0.00 0.00 64.21 62.23 1c7i n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1c7i n GLN 95 N 2.61 0.80 -3.96 1.43 1.13 -1.26 -4.71 117.38 113.41 1c7i n GLN 95 Ca 0.12 -2.06 -0.26 0.00 -1.94 0.00 0.00 57.00 52.86 1c7i n GLN 95 Cb 0.33 -0.06 -0.02 0.00 0.11 0.00 0.00 30.24 30.60 1c7i n GLN 95 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1c7i n ASN 96 N -2.40 -0.43 -4.81 1.08 4.13 -0.55 -4.95 115.26 107.33 1c7i n ASN 96 Ca 0.08 -1.02 -0.33 0.00 1.68 0.00 0.00 54.58 54.98 1c7i n ASN 96 Cb 0.39 -2.97 -0.05 0.00 -1.54 0.00 0.00 39.78 35.61 1c7i n ASN 96 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1c7i s LEU 97 N -6.97 3.86 0.73 3.41 1.43 -0.48 -4.29 118.68 116.37 1c7i s LEU 97 Ca 0.02 1.78 -0.15 0.00 -1.03 0.00 0.00 54.13 54.75 1c7i s LEU 97 Cb -0.01 -4.55 0.04 0.00 0.03 0.00 0.00 46.19 41.71 1c7i s LEU 97 CO 0.89 -0.58 1.22 -2.84 0.23 0.00 0.00 176.35 175.28 1c7i s PRO 98 N -3.30 2.11 -0.09 1.29 0.02 -1.26 -1.17 135.00 132.60 1c7i s PRO 98 Ca 0.64 1.80 0.04 0.00 0.02 0.00 0.00 61.00 63.50 1c7i s PRO 98 Cb -0.12 -1.82 -0.00 0.00 0.02 0.00 0.00 34.50 32.57 1c7i s PRO 98 CO 0.18 -1.87 -0.23 0.08 -0.33 0.00 0.00 177.00 174.83 1c7i s VAL 99 N -1.93 1.93 -0.23 3.83 1.01 -0.76 -0.83 120.40 123.41 1c7i s VAL 99 Ca 0.75 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 1c7i s VAL 99 Cb -0.30 -1.67 0.02 0.00 0.00 0.00 0.00 36.38 34.43 1c7i s VAL 99 CO 0.45 0.53 -0.09 -0.04 0.00 0.00 0.00 175.10 175.95 1c7i s MET 100 N 0.28 2.91 -0.31 2.72 -1.94 0.26 -0.22 119.30 123.00 1c7i s MET 100 Ca -0.15 -0.92 -0.09 0.00 -1.71 0.00 0.00 55.69 52.82 1c7i s MET 100 Cb -0.17 -2.89 -0.01 0.00 2.01 0.00 0.00 34.83 33.78 1c7i s MET 100 CO 0.07 -0.34 0.14 0.08 -0.01 0.00 0.00 175.02 174.97 1c7i s VAL 101 N 1.32 4.54 -0.07 -6.03 1.01 -0.12 -0.74 120.40 120.31 1c7i s VAL 101 Ca 0.01 -0.44 -0.22 0.00 0.00 0.00 0.00 61.98 61.34 1c7i s VAL 101 Cb -0.16 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1c7i s VAL 101 CO -0.06 0.08 0.62 0.86 0.00 0.00 0.00 175.10 176.60 1c7i s TRP 102 N 1.60 3.58 -0.30 5.22 -0.11 0.67 -1.13 118.94 128.46 1c7i s TRP 102 Ca 0.04 1.15 0.00 0.00 1.22 0.00 0.00 56.10 58.51 1c7i s TRP 102 Cb -0.17 -2.71 0.06 0.00 -1.50 0.00 0.00 33.47 29.16 1c7i s TRP 102 CO 0.06 0.15 -0.01 0.42 -4.62 0.00 0.00 176.95 172.95 1c7i s ILE 103 N 0.59 2.69 0.71 5.86 1.01 0.16 -4.03 121.20 128.19 1c7i s ILE 103 Ca 0.33 -1.64 -0.14 0.00 0.00 0.00 0.00 60.65 59.21 1c7i s ILE 103 Cb -0.17 -2.63 0.03 0.00 0.01 0.00 0.00 42.46 39.69 1c7i s ILE 103 CO 0.16 -0.19 1.14 -1.38 0.00 0.00 0.00 174.94 174.66 1c7i s HIS 104 N 1.16 2.37 0.00 3.97 -3.43 -1.26 -3.43 115.29 114.66 1c7i s HIS 104 Ca -0.03 1.58 0.00 0.00 -0.80 0.00 0.00 55.06 55.81 1c7i s HIS 104 Cb -0.20 -3.26 0.00 0.00 -1.43 0.00 0.00 32.58 27.69 1c7i s HIS 104 CO -0.03 -2.05 0.00 0.41 -2.00 0.00 0.00 174.74 171.06 1c7i n GLY 105 N -0.27 1.14 0.00 -1.38 0.00 -1.10 -3.25 105.19 100.33 1c7i n GLY 105 Ca 0.11 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1c7i n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c7i n GLY 106 N 5.00 0.93 2.83 -0.02 0.00 -1.26 -4.43 105.19 108.23 1c7i n GLY 106 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1c7i n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c7i n ALA 107 N 0.00 -0.95 -0.89 4.61 0.00 -1.26 -1.36 120.51 120.65 1c7i n ALA 107 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1c7i n ALA 107 Cb 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1c7i n ALA 107 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1c7i n PHE 108 N -3.26 0.00 -0.42 0.00 3.72 -1.26 -4.73 117.46 111.50 1c7i n PHE 108 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 1c7i n PHE 108 Cb 0.55 -0.88 0.00 0.00 -0.94 0.00 0.00 39.48 38.20 1c7i n PHE 108 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1c7i n TYR 109 N -2.29 0.00 -4.37 1.38 4.11 -0.88 -0.22 117.16 114.89 1c7i n TYR 109 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.90 57.71 1c7i n TYR 109 Cb 0.14 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.38 1c7i n TYR 109 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1c7i s LEU 110 N -0.21 2.40 0.00 -3.48 1.43 -0.47 -4.48 118.68 113.87 1c7i s LEU 110 Ca 0.00 -1.16 0.00 0.00 -1.03 0.00 0.00 54.13 51.94 1c7i s LEU 110 Cb 0.00 -0.50 0.00 0.00 0.03 0.00 0.00 46.19 45.72 1c7i s LEU 110 CO 0.00 -0.38 0.00 0.61 0.23 0.00 0.00 176.35 176.81 1c7i n GLY 111 N -0.47 0.93 3.57 -3.19 0.00 -1.26 -4.25 105.19 100.52 1c7i n GLY 111 Ca -0.06 -2.06 -0.13 0.00 0.00 0.00 0.00 46.02 43.77 1c7i n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c7i s ALA 112 N -1.54 -1.88 0.24 4.61 0.00 -1.26 -4.66 121.76 117.29 1c7i s ALA 112 Ca 0.00 1.57 0.34 0.00 0.00 0.00 0.00 51.96 53.87 1c7i s ALA 112 Cb 0.00 -0.61 1.51 0.00 0.00 0.00 0.00 23.12 24.02 1c7i s ALA 112 CO 0.00 -0.32 2.05 0.78 0.00 0.00 0.00 175.76 178.26 1c7i h GLY 113 N 3.09 0.00 -2.58 0.00 0.00 -1.91 -2.98 103.07 98.69 1c7i h GLY 113 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1c7i h GLY 113 CO 0.29 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.69 1c7i n SER 114 N -3.20 3.96 -4.76 0.19 3.41 -1.26 -4.56 113.62 107.40 1c7i n SER 114 Ca -0.00 -2.48 -0.39 0.00 -0.26 0.00 0.00 58.87 55.74 1c7i n SER 114 Cb 0.27 -0.56 0.01 0.00 -0.26 0.00 0.00 64.21 63.68 1c7i n SER 114 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1c7i s GLU 115 N -1.99 3.66 0.42 4.33 2.02 -1.13 -4.87 118.70 121.16 1c7i s GLU 115 Ca 0.38 2.20 0.18 0.00 0.02 0.00 0.00 54.97 57.75 1c7i s GLU 115 Cb 0.27 -2.56 1.10 0.00 0.10 0.00 0.00 34.13 33.03 1c7i s GLU 115 CO 0.15 -0.76 1.86 -1.35 0.02 0.00 0.00 175.26 175.18 1c7i h PRO 116 N 2.21 0.38 -0.43 0.39 0.11 -1.93 0.53 132.00 133.26 1c7i h PRO 116 Ca -0.50 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.68 1c7i h PRO 116 Cb 1.26 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1c7i h PRO 116 CO 0.61 0.25 0.30 1.25 -0.21 0.00 0.00 178.00 180.19 1c7i h LEU 117 N 0.39 0.13 -2.00 2.35 5.85 -1.89 -2.07 115.31 118.07 1c7i h LEU 117 Ca 0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.18 1c7i h LEU 117 Cb 1.16 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1c7i h LEU 117 CO -0.16 0.08 0.00 -1.22 -0.34 0.00 0.00 178.44 176.80 1c7i n TYR 118 N -4.45 0.71 -1.68 1.25 4.01 0.17 -4.79 117.16 112.39 1c7i n TYR 118 Ca 0.07 -0.35 -0.46 0.00 -0.16 0.00 0.00 57.90 56.99 1c7i n TYR 118 Cb 0.39 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.38 1c7i n TYR 118 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1c7i n ASP 119 N 1.10 3.60 -0.73 7.72 -0.08 -0.78 -4.85 116.55 122.53 1c7i n ASP 119 Ca 0.18 0.98 0.05 0.00 -1.51 0.00 0.00 54.79 54.50 1c7i n ASP 119 Cb 0.47 -1.43 0.16 0.00 2.34 0.00 0.00 41.12 42.66 1c7i n ASP 119 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1c7i n GLY 120 N 4.24 0.88 0.16 0.27 0.00 -1.26 -4.51 105.19 104.97 1c7i n GLY 120 Ca 0.21 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1c7i n GLY 120 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1c7i h SER 121 N 2.04 -0.32 -0.46 1.61 0.02 -1.92 -0.68 113.55 113.84 1c7i h SER 121 Ca 0.00 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 1c7i h SER 121 Cb 0.58 0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 1c7i h SER 121 CO 0.03 -0.18 0.13 0.11 -1.14 0.00 0.00 176.83 175.79 1c7i h LYS 122 N -0.24 0.73 -0.74 3.45 1.57 -1.82 -0.83 116.57 118.69 1c7i h LYS 122 Ca 0.01 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 1c7i h LYS 122 Cb 0.25 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 1c7i h LYS 122 CO -0.05 0.71 0.35 1.25 -0.57 0.00 0.00 179.45 181.14 1c7i h LEU 123 N 0.62 0.97 0.03 2.94 5.85 -1.66 0.15 115.31 124.20 1c7i h LEU 123 Ca 0.15 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1c7i h LEU 123 Cb 0.29 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1c7i h LEU 123 CO -0.00 0.84 -0.01 0.00 -0.34 0.00 0.00 178.44 178.92 1c7i h ALA 124 N 1.17 -0.04 -0.17 1.25 0.00 -0.91 -1.47 119.26 119.10 1c7i h ALA 124 Ca 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1c7i h ALA 124 Cb 0.13 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1c7i h ALA 124 CO -0.03 -0.38 0.07 0.00 0.00 0.00 0.00 179.25 178.91 1c7i h ALA 125 N 0.64 0.22 -0.04 0.00 0.00 -1.04 0.12 119.26 119.16 1c7i h ALA 125 Ca -0.00 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 1c7i h ALA 125 Cb 0.30 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1c7i h ALA 125 CO 0.01 -0.20 -0.60 1.96 0.00 0.00 0.00 179.25 180.42 1c7i h GLN 126 N 0.12 0.14 0.00 0.00 1.08 -1.01 -3.21 115.11 112.24 1c7i h GLN 126 Ca 0.06 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1c7i h GLN 126 Cb 0.16 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1c7i h GLN 126 CO -0.01 0.70 -1.14 0.41 -0.95 0.00 0.00 178.83 177.84 1c7i n GLY 127 N 0.22 -1.03 3.40 3.46 0.00 -0.55 -4.98 105.19 105.70 1c7i n GLY 127 Ca -0.02 -0.55 -0.17 0.00 0.00 0.00 0.00 46.02 45.28 1c7i n GLY 127 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1c7i n GLU 128 N -1.67 -5.53 -4.20 1.61 2.13 0.40 -4.96 120.64 108.42 1c7i n GLU 128 Ca 0.03 0.84 -0.12 0.00 0.66 0.00 0.00 57.16 58.57 1c7i n GLU 128 Cb 0.38 -5.82 -0.10 0.00 0.27 0.00 0.00 31.44 26.17 1c7i n GLU 128 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1c7i s VAL 129 N -3.38 0.53 0.03 6.31 -7.23 -1.07 -4.59 120.40 111.00 1c7i s VAL 129 Ca 0.11 -1.95 -0.17 0.00 -1.81 0.00 0.00 61.98 58.15 1c7i s VAL 129 Cb -0.01 -2.02 -0.06 0.00 0.56 0.00 0.00 36.38 34.84 1c7i s VAL 129 CO 0.74 -0.55 0.50 -0.63 -0.31 0.00 0.00 175.10 174.85 1c7i s ILE 130 N -3.75 4.88 -0.13 -0.62 1.01 -0.01 -4.37 121.20 118.21 1c7i s ILE 130 Ca 0.22 1.05 0.02 0.00 0.00 0.00 0.00 60.65 61.94 1c7i s ILE 130 Cb 0.06 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.71 1c7i s ILE 130 CO 0.02 0.55 -0.20 -0.69 0.00 0.00 0.00 174.94 174.62 1c7i s VAL 131 N -1.00 2.36 -0.11 2.92 1.01 0.12 -0.58 120.40 125.12 1c7i s VAL 131 Ca 0.27 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.38 1c7i s VAL 131 Cb -0.18 -1.95 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 1c7i s VAL 131 CO 0.16 0.54 -0.20 -0.69 0.00 0.00 0.00 175.10 174.91 1c7i s VAL 132 N 0.61 2.40 0.31 2.92 1.01 0.09 -0.67 120.40 127.05 1c7i s VAL 132 Ca -0.11 -0.90 0.11 0.00 0.00 0.00 0.00 61.98 61.08 1c7i s VAL 132 Cb -0.16 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1c7i s VAL 132 CO 0.03 0.55 -0.12 0.42 0.00 0.00 0.00 175.10 175.98 1c7i s THR 133 N 0.38 2.53 0.13 3.92 -4.23 -0.58 -0.24 115.64 117.55 1c7i s THR 133 Ca -0.16 -2.24 -0.25 0.00 -1.18 0.00 0.00 61.69 57.87 1c7i s THR 133 Cb -0.17 -2.53 0.07 0.00 1.34 0.00 0.00 72.50 71.21 1c7i s THR 133 CO 0.07 -0.31 0.85 -1.48 -0.54 0.00 0.00 174.62 173.21 1c7i s LEU 134 N -3.59 -0.30 0.13 4.79 0.05 -1.26 -1.01 118.68 117.50 1c7i s LEU 134 Ca 0.32 -0.26 0.08 0.00 0.05 0.00 0.00 54.13 54.31 1c7i s LEU 134 Cb -0.02 2.27 -0.04 0.00 -2.05 0.00 0.00 46.19 46.35 1c7i s LEU 134 CO 0.17 -0.90 -0.10 0.20 -0.55 0.00 0.00 176.35 175.17 1c7i s ASN 135 N -2.78 4.36 0.02 1.48 0.01 -1.06 -2.78 114.94 114.20 1c7i s ASN 135 Ca 0.08 -0.44 -0.01 0.00 -0.71 0.00 0.00 52.86 51.78 1c7i s ASN 135 Cb -0.02 -0.81 -0.02 0.00 0.41 0.00 0.00 41.25 40.81 1c7i s ASN 135 CO -0.03 0.15 -0.02 -0.72 -1.51 0.00 0.00 177.10 174.98 1c7i s TYR 136 N -1.36 0.25 0.26 2.20 1.13 -1.26 -4.51 117.35 114.06 1c7i s TYR 136 Ca 0.22 -0.51 -0.31 0.00 -1.41 0.00 0.00 57.07 55.07 1c7i s TYR 136 Cb -0.10 -0.18 -0.13 0.00 -1.10 0.00 0.00 41.96 40.44 1c7i s TYR 136 CO 0.14 -0.20 1.40 0.54 -2.51 0.00 0.00 175.55 174.92 1c7i n ARG 137 N 1.55 2.11 -4.37 -3.49 1.74 -1.26 -4.87 116.66 108.07 1c7i n ARG 137 Ca -0.24 0.75 -0.28 0.00 -0.77 0.00 0.00 57.85 57.31 1c7i n ARG 137 Cb 0.55 -2.40 -0.07 0.00 -1.02 0.00 0.00 32.46 29.52 1c7i n ARG 137 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1c7i s LEU 138 N -0.14 2.77 0.00 0.55 1.43 -1.26 -4.08 118.68 117.94 1c7i s LEU 138 Ca 0.65 -1.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 1c7i s LEU 138 Cb -0.62 -1.08 0.00 0.00 0.03 0.00 0.00 46.19 44.52 1c7i s LEU 138 CO 0.52 -0.70 0.00 0.61 0.23 0.00 0.00 176.35 177.01 1c7i n GLY 139 N -1.27 2.69 0.20 -3.19 0.00 0.69 -0.84 105.19 103.47 1c7i n GLY 139 Ca -0.07 0.09 0.14 0.00 0.00 0.00 0.00 46.02 46.19 1c7i n GLY 139 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c7i h PRO 140 N 0.00 0.00 0.00 1.61 0.13 -1.90 0.16 132.00 132.01 1c7i h PRO 140 Ca 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.92 1c7i h PRO 140 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1c7i h PRO 140 CO 0.00 0.00 -1.06 0.74 -0.23 0.00 0.00 178.00 177.45 1c7i h PHE 141 N 0.00 0.00 0.00 1.56 -1.00 -1.35 -3.37 116.94 112.78 1c7i h PHE 141 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1c7i h PHE 141 Cb 0.50 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.06 1c7i h PHE 141 CO 0.00 0.96 -0.94 0.41 -1.61 0.00 0.00 178.31 177.13 1c7i n GLY 142 N 1.37 0.00 1.88 -1.45 0.00 -0.61 -4.66 105.19 101.72 1c7i n GLY 142 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1c7i n GLY 142 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1c7i n PHE 143 N -1.42 1.54 -3.92 1.61 3.01 0.56 -1.40 117.46 117.44 1c7i n PHE 143 Ca 0.00 -1.87 -0.35 0.00 1.01 0.00 0.00 57.45 56.24 1c7i n PHE 143 Cb 0.01 -0.27 -0.14 0.00 -0.01 0.00 0.00 39.48 39.06 1c7i n PHE 143 CO 0.00 0.00 0.00 1.41 1.01 0.00 0.00 176.76 179.18 1c7i s MET 144 N -3.19 2.64 -0.51 -1.08 1.75 -1.24 -4.05 119.30 113.63 1c7i s MET 144 Ca 0.41 -1.12 -0.18 0.00 -1.25 0.00 0.00 55.69 53.55 1c7i s MET 144 Cb 0.38 -3.11 0.07 0.00 2.84 0.00 0.00 34.83 35.01 1c7i s MET 144 CO -0.02 -0.52 0.55 -1.01 -0.65 0.00 0.00 175.02 173.37 1c7i s HIS 145 N 1.30 3.12 -1.16 4.11 0.09 -1.26 -4.80 115.29 116.69 1c7i s HIS 145 Ca -0.03 -0.75 0.16 0.00 -0.00 0.00 0.00 55.06 54.44 1c7i s HIS 145 Cb -0.18 -3.49 0.51 0.00 -0.00 0.00 0.00 32.58 29.42 1c7i s HIS 145 CO -0.02 -0.99 1.43 1.28 -0.00 0.00 0.00 174.74 176.44 1c7i n LEU 146 N 5.83 3.72 -0.34 0.89 4.77 -1.26 -4.61 117.00 125.99 1c7i n LEU 146 Ca -0.09 -2.21 0.12 0.00 -0.03 0.00 0.00 56.01 53.80 1c7i n LEU 146 Cb 0.44 -0.41 0.33 0.00 -2.33 0.00 0.00 43.42 41.45 1c7i n LEU 146 CO 0.52 0.81 1.21 0.77 -1.33 0.00 0.00 177.39 179.38 1c7i h SER 147 N 3.05 0.77 0.20 -1.43 4.64 -1.79 0.14 113.55 119.14 1c7i h SER 147 Ca 0.00 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1c7i h SER 147 Cb 1.04 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1c7i h SER 147 CO 0.08 0.33 0.00 0.77 -0.87 0.00 0.00 176.83 177.13 1c7i h SER 148 N 0.78 0.00 0.18 4.97 4.64 -1.94 -1.28 113.55 120.90 1c7i h SER 148 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 1c7i h SER 148 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1c7i h SER 148 CO -0.31 0.00 -1.34 0.49 -0.87 0.00 0.00 176.83 174.79 1c7i n PHE 149 N -2.55 0.12 -3.31 4.77 3.01 0.47 -4.94 117.46 115.03 1c7i n PHE 149 Ca -0.01 0.04 0.03 0.00 1.01 0.00 0.00 57.45 58.51 1c7i n PHE 149 Cb 0.10 -0.35 -0.04 0.00 -0.01 0.00 0.00 39.48 39.18 1c7i n PHE 149 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1c7i s ASP 150 N -3.90 -0.29 0.23 4.37 -1.08 -0.49 -5.00 116.67 110.52 1c7i s ASP 150 Ca 0.01 0.40 0.17 0.00 -0.52 0.00 0.00 52.55 52.60 1c7i s ASP 150 Cb 0.15 1.31 0.88 0.00 -1.46 0.00 0.00 42.92 43.79 1c7i s ASP 150 CO 0.86 -0.06 1.51 -0.62 0.52 0.00 0.00 175.17 177.38 1c7i n GLU 151 N 4.62 0.11 0.17 4.34 -0.58 -1.23 -0.79 120.64 127.27 1c7i n GLU 151 Ca -0.08 0.58 0.03 0.00 -0.42 0.00 0.00 57.16 57.26 1c7i n GLU 151 Cb 0.54 -1.83 0.26 0.00 -0.57 0.00 0.00 31.44 29.84 1c7i n GLU 151 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1c7i h ALA 152 N 2.04 0.96 -2.29 0.62 0.00 -1.95 -3.44 119.26 115.20 1c7i h ALA 152 Ca 0.00 -0.42 -0.49 0.00 0.00 0.00 0.00 54.91 54.00 1c7i h ALA 152 Cb 0.04 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1c7i h ALA 152 CO 0.00 0.57 0.17 0.71 0.00 0.00 0.00 179.25 180.71 1c7i s TYR 153 N -3.55 3.47 0.00 0.00 2.02 0.03 -4.82 117.35 114.50 1c7i s TYR 153 Ca -0.00 1.14 0.07 0.00 -0.37 0.00 0.00 57.07 57.91 1c7i s TYR 153 Cb 0.11 -2.52 -0.03 0.00 -0.40 0.00 0.00 41.96 39.13 1c7i s TYR 153 CO 0.71 -0.16 -0.22 -1.12 -1.57 0.00 0.00 175.55 173.20 1c7i s SER 154 N -3.12 3.48 0.60 2.29 0.01 -0.96 -4.52 113.70 111.46 1c7i s SER 154 Ca 0.53 -0.42 -0.02 0.00 1.31 0.00 0.00 55.95 57.34 1c7i s SER 154 Cb -0.10 -0.51 0.04 0.00 0.21 0.00 0.00 66.02 65.66 1c7i s SER 154 CO 0.31 0.30 0.86 -1.81 0.41 0.00 0.00 173.24 173.30 1c7i s ASP 155 N -0.98 5.19 -1.54 2.44 1.01 -1.26 -4.38 116.67 117.15 1c7i s ASP 155 Ca 0.12 0.22 -0.13 0.00 0.71 0.00 0.00 52.55 53.48 1c7i s ASP 155 Cb -0.10 -1.07 0.09 0.00 1.01 0.00 0.00 42.92 42.85 1c7i s ASP 155 CO 0.02 -1.25 0.88 0.59 0.21 0.00 0.00 175.17 175.61 1c7i n ASN 156 N -2.53 -3.88 -0.23 0.27 3.02 -1.26 -4.86 115.26 105.79 1c7i n ASN 156 Ca 0.07 -0.84 0.01 0.00 -0.03 0.00 0.00 54.58 53.79 1c7i n ASN 156 Cb 0.60 -3.62 0.13 0.00 -0.61 0.00 0.00 39.78 36.27 1c7i n ASN 156 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1c7i h LEU 157 N -1.94 0.30 -1.54 3.41 3.38 -1.62 -1.03 115.31 116.28 1c7i h LEU 157 Ca -0.59 0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.47 1c7i h LEU 157 Cb 1.38 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.14 1c7i h LEU 157 CO 0.68 0.17 0.33 1.23 0.09 0.00 0.00 178.44 180.93 1c7i h GLY 158 N 0.47 0.67 1.62 0.83 0.00 -1.40 0.79 103.07 106.05 1c7i h GLY 158 Ca 0.34 -0.25 -0.18 0.00 0.00 0.00 0.00 47.33 47.24 1c7i h GLY 158 CO -0.31 0.23 -0.73 1.41 0.00 0.00 0.00 176.54 177.14 1c7i h LEU 159 N 0.63 0.45 -0.79 3.11 3.38 -1.50 -2.15 115.31 118.45 1c7i h LEU 159 Ca 0.18 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1c7i h LEU 159 Cb -0.03 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1c7i h LEU 159 CO -0.04 1.03 -0.45 -0.07 0.09 0.00 0.00 178.44 179.00 1c7i h LEU 160 N 0.25 0.37 -0.34 1.67 3.38 -0.47 -0.91 115.31 119.27 1c7i h LEU 160 Ca -0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1c7i h LEU 160 Cb 1.31 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1c7i h LEU 160 CO 0.12 0.78 0.13 0.44 0.09 0.00 0.00 178.44 180.00 1c7i h ASP 161 N 0.28 0.47 -0.51 -0.43 3.32 -0.72 0.29 116.42 119.12 1c7i h ASP 161 Ca 0.02 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 56.93 1c7i h ASP 161 Cb 0.91 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.31 1c7i h ASP 161 CO 0.08 0.51 0.30 1.56 -1.72 0.00 0.00 179.24 179.96 1c7i h GLN 162 N 0.40 0.57 -0.63 3.56 4.20 -1.08 -0.75 115.11 121.38 1c7i h GLN 162 Ca 0.11 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 1c7i h GLN 162 Cb 0.19 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 1c7i h GLN 162 CO -0.01 0.38 0.29 0.00 -0.67 0.00 0.00 178.83 178.82 1c7i h ALA 163 N 1.23 1.33 -0.40 3.87 0.00 -0.80 -1.18 119.26 123.32 1c7i h ALA 163 Ca 0.21 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1c7i h ALA 163 Cb 0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1c7i h ALA 163 CO -0.10 0.52 -0.25 0.00 0.00 0.00 0.00 179.25 179.42 1c7i h ALA 164 N 1.43 0.82 -0.53 0.00 0.00 -0.17 -0.88 119.26 119.92 1c7i h ALA 164 Ca 0.22 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1c7i h ALA 164 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1c7i h ALA 164 CO -0.03 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.87 1c7i h ALA 165 N 1.02 1.00 -0.18 0.00 0.00 -0.57 -0.82 119.26 119.71 1c7i h ALA 165 Ca 0.09 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1c7i h ALA 165 Cb 0.77 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1c7i h ALA 165 CO 0.06 0.61 -0.31 -0.07 0.00 0.00 0.00 179.25 179.54 1c7i h LEU 166 N 0.84 0.37 -0.51 0.00 3.38 -0.96 -0.93 115.31 117.50 1c7i h LEU 166 Ca 0.16 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 1c7i h LEU 166 Cb 0.49 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1c7i h LEU 166 CO 0.02 0.67 -0.29 0.50 0.09 0.00 0.00 178.44 179.43 1c7i h LYS 167 N 0.32 0.90 -0.82 1.13 3.64 -0.72 -1.56 116.57 119.46 1c7i h LYS 167 Ca 0.04 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1c7i h LYS 167 Cb 0.72 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.48 1c7i h LYS 167 CO 0.05 1.07 0.52 2.35 -2.27 0.00 0.00 179.45 181.17 1c7i h TRP 168 N 0.76 1.05 -0.50 1.91 7.01 -0.69 -0.30 115.95 125.19 1c7i h TRP 168 Ca 0.08 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.08 1c7i h TRP 168 Cb 0.86 -0.35 -0.02 0.00 -2.10 0.00 0.00 29.16 27.55 1c7i h TRP 168 CO 0.05 0.68 0.24 0.28 -2.79 0.00 0.00 178.44 176.90 1c7i h VAL 169 N 1.11 1.19 -0.65 2.65 2.07 -0.84 0.21 116.25 122.00 1c7i h VAL 169 Ca 0.30 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1c7i h VAL 169 Cb -0.09 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 1c7i h VAL 169 CO -0.06 0.22 0.29 -0.09 0.02 0.00 0.00 177.57 177.95 1c7i h ARG 170 N 0.67 0.94 0.00 1.57 2.43 -0.75 -0.54 114.38 118.69 1c7i h ARG 170 Ca 0.17 -0.15 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1c7i h ARG 170 Cb 0.12 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1c7i h ARG 170 CO -0.02 0.77 -0.46 0.93 -1.51 0.00 0.00 179.97 179.68 1c7i h GLU 171 N 0.90 0.00 0.00 0.20 4.39 -0.81 -3.41 114.58 115.85 1c7i h GLU 171 Ca 0.22 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.92 1c7i h GLU 171 Cb 0.15 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1c7i h GLU 171 CO -0.02 0.46 -1.03 0.09 -1.16 0.00 0.00 179.01 177.34 1c7i n ASN 172 N -3.23 4.87 0.00 1.42 3.02 0.70 -4.80 115.26 117.24 1c7i n ASN 172 Ca 0.02 0.00 0.21 0.00 -0.03 0.00 0.00 54.58 54.78 1c7i n ASN 172 Cb 0.71 0.80 0.70 0.00 -0.61 0.00 0.00 39.78 41.38 1c7i n ASN 172 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1c7i h ILE 173 N 0.00 0.69 0.00 2.41 6.09 -1.24 -0.06 117.51 125.40 1c7i h ILE 173 Ca -0.01 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.48 1c7i h ILE 173 Cb 0.47 0.72 -0.00 0.00 0.47 0.00 0.00 36.82 38.48 1c7i h ILE 173 CO 0.00 0.00 -0.01 0.77 -3.07 0.00 0.00 178.15 175.84 1c7i h SER 174 N 0.00 0.00 1.08 2.19 4.64 -1.80 0.10 113.55 119.76 1c7i h SER 174 Ca 0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 1c7i h SER 174 Cb 1.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1c7i h SER 174 CO -0.00 0.01 -0.07 0.00 -0.87 0.00 0.00 176.83 175.90 1c7i h ALA 175 N 1.99 1.01 -0.37 5.18 0.00 -1.29 -2.49 119.26 123.28 1c7i h ALA 175 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1c7i h ALA 175 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1c7i h ALA 175 CO 0.00 0.09 0.00 1.19 0.00 0.00 0.00 179.25 180.53 1c7i n PHE 176 N -3.18 0.48 -0.08 0.00 3.01 0.20 -4.91 117.46 112.98 1c7i n PHE 176 Ca 0.01 -0.24 0.00 0.00 1.01 0.00 0.00 57.45 58.23 1c7i n PHE 176 Cb 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 1c7i n PHE 176 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1c7i n GLY 177 N 1.46 0.96 4.00 1.37 0.00 -0.94 -4.95 105.19 107.08 1c7i n GLY 177 Ca 0.19 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 1c7i n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c7i s GLY 178 N -2.01 1.74 -0.37 -0.02 0.00 -0.27 -1.38 107.32 105.01 1c7i s GLY 178 Ca 0.00 -1.54 -0.10 0.00 0.00 0.00 0.00 44.72 43.08 1c7i s GLY 178 CO 0.00 -1.42 0.19 -0.35 0.00 0.00 0.00 173.10 171.52 1c7i s ASP 179 N -4.24 5.66 0.00 1.64 -1.08 -0.31 -3.62 116.67 114.71 1c7i s ASP 179 Ca 0.49 -1.06 0.12 0.00 -0.52 0.00 0.00 52.55 51.58 1c7i s ASP 179 Cb -0.10 -1.99 0.50 0.00 -1.46 0.00 0.00 42.92 39.87 1c7i s ASP 179 CO 0.32 -0.39 1.37 -0.81 0.52 0.00 0.00 175.17 176.18 1c7i n PRO 180 N 4.96 0.01 -0.24 4.34 -0.04 -1.26 -1.91 135.00 140.86 1c7i n PRO 180 Ca -0.12 0.29 0.11 0.00 -0.04 0.00 0.00 63.50 63.75 1c7i n PRO 180 Cb 0.46 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.65 1c7i n PRO 180 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1c7i n ASP 181 N -1.49 3.56 -3.18 3.54 8.00 -1.26 -4.44 116.55 121.29 1c7i n ASP 181 Ca 0.03 -1.98 -0.22 0.00 0.71 0.00 0.00 54.79 53.33 1c7i n ASP 181 Cb 0.13 -0.31 -0.05 0.00 -0.02 0.00 0.00 41.12 40.87 1c7i n ASP 181 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1c7i n ASN 182 N 1.48 1.32 -4.62 -2.24 4.05 -0.80 -4.85 115.26 109.59 1c7i n ASN 182 Ca 0.20 -3.03 -0.35 0.00 0.45 0.00 0.00 54.58 51.85 1c7i n ASN 182 Cb 0.60 -0.62 -0.10 0.00 1.23 0.00 0.00 39.78 40.88 1c7i n ASN 182 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1c7i s VAL 183 N -2.30 4.86 -0.18 3.44 1.01 -1.26 -1.83 120.40 124.14 1c7i s VAL 183 Ca 0.40 -0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 1c7i s VAL 183 Cb 0.27 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 1c7i s VAL 183 CO -0.09 0.42 -0.10 -0.89 0.00 0.00 0.00 175.10 174.44 1c7i s THR 184 N 0.65 3.02 -0.11 3.92 2.01 0.69 -0.36 115.64 125.46 1c7i s THR 184 Ca 0.04 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.31 1c7i s THR 184 Cb -0.13 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 1c7i s THR 184 CO 0.01 0.48 0.22 0.54 -0.69 0.00 0.00 174.62 175.18 1c7i s VAL 185 N 1.01 5.37 0.01 3.82 0.11 -0.57 -0.95 120.40 129.20 1c7i s VAL 185 Ca -0.01 0.38 -0.03 0.00 -2.93 0.00 0.00 61.98 59.40 1c7i s VAL 185 Cb -0.15 -3.50 -0.01 0.00 -1.53 0.00 0.00 36.38 31.19 1c7i s VAL 185 CO -0.01 0.56 0.04 0.72 -3.33 0.00 0.00 175.10 173.08 1c7i s PHE 186 N -0.71 0.13 0.05 1.54 -0.71 -0.29 -0.70 117.98 117.30 1c7i s PHE 186 Ca 0.16 -0.28 -0.27 0.00 -1.04 0.00 0.00 56.93 55.50 1c7i s PHE 186 Cb -0.13 -0.11 0.09 0.00 -1.21 0.00 0.00 43.02 41.66 1c7i s PHE 186 CO 0.05 -0.20 0.87 0.20 -1.34 0.00 0.00 175.22 174.81 1c7i s GLY 187 N -1.21 -0.42 0.10 1.99 0.00 -0.93 -0.66 107.32 106.19 1c7i s GLY 187 Ca -0.13 0.72 0.07 0.00 0.00 0.00 0.00 44.72 45.37 1c7i s GLY 187 CO 0.00 0.23 -0.17 1.85 0.00 0.00 0.00 173.10 175.01 1c7i s GLU 188 N -3.24 0.99 7.69 2.90 -6.30 -1.22 -1.21 118.70 118.31 1c7i s GLU 188 Ca 0.06 -1.12 0.00 0.00 -2.50 0.00 0.00 54.97 51.42 1c7i s GLU 188 Cb -0.01 -1.06 0.00 0.00 0.00 0.00 0.00 34.13 33.06 1c7i s GLU 188 CO -0.06 0.23 0.00 0.45 0.02 0.00 0.00 175.26 175.90 1c7i n SER 189 N 0.98 0.00 0.24 -1.70 2.88 -0.65 -0.72 113.62 114.66 1c7i n SER 189 Ca -0.19 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.52 1c7i n SER 189 Cb 0.55 0.00 0.87 0.00 -0.75 0.00 0.00 64.21 64.88 1c7i n SER 189 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1c7i h ALA 190 N -0.96 1.68 -0.10 -1.46 0.00 -1.84 -0.04 119.26 116.54 1c7i h ALA 190 Ca 0.00 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1c7i h ALA 190 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1c7i h ALA 190 CO 0.00 -0.21 -0.65 0.78 0.00 0.00 0.00 179.25 179.17 1c7i h GLY 191 N 0.00 0.43 1.34 0.00 0.00 -0.90 0.09 103.07 104.04 1c7i h GLY 191 Ca 0.06 -0.57 -0.19 0.00 0.00 0.00 0.00 47.33 46.63 1c7i h GLY 191 CO -0.00 0.51 -0.64 -1.33 0.00 0.00 0.00 176.54 175.08 1c7i h GLY 192 N 1.28 0.74 1.65 4.60 0.00 -1.07 -1.91 103.07 108.36 1c7i h GLY 192 Ca -0.01 -0.94 -0.12 0.00 0.00 0.00 0.00 47.33 46.26 1c7i h GLY 192 CO 0.11 0.84 -0.39 -0.33 0.00 0.00 0.00 176.54 176.77 1c7i h MET 193 N 0.50 0.40 -0.47 4.80 2.86 -1.30 -1.94 114.93 119.77 1c7i h MET 193 Ca -0.01 -0.19 -0.12 0.00 -2.06 0.00 0.00 59.70 57.32 1c7i h MET 193 Cb 1.23 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.87 1c7i h MET 193 CO 0.13 0.73 -0.18 0.77 1.06 0.00 0.00 176.91 179.41 1c7i h SER 194 N 0.33 0.94 0.01 1.22 0.02 -0.87 -2.56 113.55 112.65 1c7i h SER 194 Ca 0.03 -0.33 -0.09 0.00 -0.84 0.00 0.00 61.79 60.56 1c7i h SER 194 Cb 0.84 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1c7i h SER 194 CO 0.07 1.10 -0.26 0.40 -1.14 0.00 0.00 176.83 177.00 1c7i h ILE 195 N 0.81 1.26 -0.38 3.27 2.04 -1.11 0.21 117.51 123.60 1c7i h ILE 195 Ca 0.11 -1.23 0.01 0.00 1.00 0.00 0.00 64.86 64.76 1c7i h ILE 195 Cb 0.73 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1c7i h ILE 195 CO 0.06 0.38 0.24 0.00 0.00 0.00 0.00 178.15 178.84 1c7i h ALA 196 N 1.39 0.49 -0.33 1.87 0.00 -1.04 -0.91 119.26 120.72 1c7i h ALA 196 Ca 0.05 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1c7i h ALA 196 Cb 0.64 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1c7i h ALA 196 CO 0.05 -0.08 -0.09 0.00 0.00 0.00 0.00 179.25 179.13 1c7i h ALA 197 N 1.15 0.46 -0.36 0.00 0.00 -1.03 -2.95 119.26 116.52 1c7i h ALA 197 Ca 0.14 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1c7i h ALA 197 Cb -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1c7i h ALA 197 CO -0.04 0.30 0.23 -0.07 0.00 0.00 0.00 179.25 179.67 1c7i h LEU 198 N 0.42 0.42 -2.02 0.00 3.38 -0.33 0.13 115.31 117.31 1c7i h LEU 198 Ca 0.08 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1c7i h LEU 198 Cb 0.59 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1c7i h LEU 198 CO 0.03 0.31 -0.02 -0.07 0.09 0.00 0.00 178.44 178.78 1c7i h LEU 199 N 0.49 0.00 -2.79 1.67 3.38 -1.00 -2.86 115.31 114.20 1c7i h LEU 199 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1c7i h LEU 199 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1c7i h LEU 199 CO -0.03 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.53 1c7i n ALA 200 N -2.12 2.15 -2.59 1.53 0.00 0.29 -4.43 120.51 115.34 1c7i n ALA 200 Ca -0.01 -1.05 -0.38 0.00 0.00 0.00 0.00 53.44 52.00 1c7i n ALA 200 Cb 0.22 -0.29 -0.11 0.00 0.00 0.00 0.00 19.45 19.28 1c7i n ALA 200 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1c7i s MET 201 N -0.97 3.95 0.26 0.00 -1.94 -0.26 -4.72 119.30 115.62 1c7i s MET 201 Ca 0.15 -0.30 -0.03 0.00 -1.71 0.00 0.00 55.69 53.80 1c7i s MET 201 Cb 0.08 -3.66 0.53 0.00 2.01 0.00 0.00 34.83 33.79 1c7i s MET 201 CO 0.10 -0.18 1.69 -1.35 -0.01 0.00 0.00 175.02 175.27 1c7i h PRO 202 N 8.36 0.29 -0.05 2.03 0.11 -1.89 0.34 132.00 141.19 1c7i h PRO 202 Ca -0.35 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1c7i h PRO 202 Cb 1.19 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1c7i h PRO 202 CO 0.56 0.19 0.00 0.00 -0.21 0.00 0.00 178.00 178.54 1c7i n ALA 203 N -2.63 2.13 -0.11 -0.75 0.00 -1.26 -1.98 120.51 115.90 1c7i n ALA 203 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1c7i n ALA 203 Cb 0.51 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1c7i n ALA 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c7i n ALA 204 N -0.44 2.12 -1.68 0.00 0.00 0.11 -4.98 120.51 115.62 1c7i n ALA 204 Ca 0.00 -0.61 -0.45 0.00 0.00 0.00 0.00 53.44 52.38 1c7i n ALA 204 Cb 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 1c7i n ALA 204 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1c7i n LYS 205 N -0.15 2.23 -1.06 0.00 4.76 -0.84 -2.13 118.16 120.97 1c7i n LYS 205 Ca 0.00 0.80 -0.02 0.00 -2.87 0.00 0.00 58.31 56.22 1c7i n LYS 205 Cb 0.11 -2.56 -0.01 0.00 -1.84 0.00 0.00 35.03 30.73 1c7i n LYS 205 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1c7i n GLY 206 N 3.18 0.45 0.07 0.72 0.00 -1.26 -4.89 105.19 103.45 1c7i n GLY 206 Ca 0.15 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.19 1c7i n GLY 206 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1c7i n LEU 207 N -0.25 0.45 -3.51 0.99 4.77 -0.90 -4.89 117.00 113.66 1c7i n LEU 207 Ca -0.02 0.08 -0.15 0.00 -0.03 0.00 0.00 56.01 55.89 1c7i n LEU 207 Cb 0.27 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 41.05 1c7i n LEU 207 CO 0.03 0.09 0.51 0.72 -1.33 0.00 0.00 177.39 177.41 1c7i s PHE 208 N -2.77 -0.56 -0.46 -1.77 -0.12 -1.26 -4.89 117.98 106.15 1c7i s PHE 208 Ca 0.19 0.80 0.13 0.00 -0.05 0.00 0.00 56.93 58.00 1c7i s PHE 208 Cb 0.19 0.46 -0.15 0.00 -0.63 0.00 0.00 43.02 42.89 1c7i s PHE 208 CO 0.57 -0.61 0.48 1.04 -0.05 0.00 0.00 175.22 176.64 1c7i n GLN 209 N 0.51 2.26 -3.94 1.99 3.00 0.52 -4.98 117.38 116.74 1c7i n GLN 209 Ca -0.16 -0.03 -0.09 0.00 -0.01 0.00 0.00 57.00 56.71 1c7i n GLN 209 Cb 0.59 -1.15 -0.09 0.00 0.00 0.00 0.00 30.24 29.60 1c7i n GLN 209 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1c7i s LYS 210 N -2.36 0.71 -0.04 -1.09 1.02 -0.98 -4.03 119.74 112.97 1c7i s LYS 210 Ca 0.03 -0.96 -0.08 0.00 0.02 0.00 0.00 55.97 54.98 1c7i s LYS 210 Cb 0.09 0.28 0.01 0.00 -0.52 0.00 0.00 37.83 37.69 1c7i s LYS 210 CO 0.52 -0.19 0.18 0.00 -0.92 0.00 0.00 175.35 174.94 1c7i s ALA 211 N -3.48 -0.44 -0.15 5.17 0.00 -0.75 -1.51 121.76 120.60 1c7i s ALA 211 Ca 0.02 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.23 1c7i s ALA 211 Cb 0.04 -0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.08 1c7i s ALA 211 CO -0.09 -0.15 -0.09 0.42 0.00 0.00 0.00 175.76 175.85 1c7i s ILE 212 N -0.62 1.29 -0.34 0.00 1.01 0.12 -1.27 121.20 121.39 1c7i s ILE 212 Ca -0.07 -0.59 -0.00 0.00 0.00 0.00 0.00 60.65 59.99 1c7i s ILE 212 Cb -0.04 -1.33 0.08 0.00 0.01 0.00 0.00 42.46 41.18 1c7i s ILE 212 CO 0.01 0.30 0.06 -0.04 0.00 0.00 0.00 174.94 175.27 1c7i s MET 213 N 1.58 2.05 -0.25 2.79 -1.94 0.01 -2.20 119.30 121.35 1c7i s MET 213 Ca 0.03 -1.59 -0.13 0.00 -1.71 0.00 0.00 55.69 52.29 1c7i s MET 213 Cb -0.14 -3.28 -0.04 0.00 2.01 0.00 0.00 34.83 33.38 1c7i s MET 213 CO -0.09 -0.83 0.28 -1.21 -0.01 0.00 0.00 175.02 173.16 1c7i s GLU 214 N 1.12 4.05 -1.27 2.03 2.02 -0.35 -2.27 118.70 124.04 1c7i s GLU 214 Ca 0.02 -0.09 -0.24 0.00 0.02 0.00 0.00 54.97 54.68 1c7i s GLU 214 Cb -0.21 -3.59 0.02 0.00 0.10 0.00 0.00 34.13 30.45 1c7i s GLU 214 CO -0.04 -0.10 0.58 0.43 0.02 0.00 0.00 175.26 176.15 1c7i n SER 215 N 4.77 -3.26 0.00 -0.19 7.64 -0.33 -1.64 113.62 120.61 1c7i n SER 215 Ca -0.12 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.55 1c7i n SER 215 Cb 0.51 -2.13 0.00 0.00 -1.01 0.00 0.00 64.21 61.59 1c7i n SER 215 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c7i n GLY 216 N -2.08 1.21 0.00 0.23 0.00 -1.26 -2.48 105.19 100.81 1c7i n GLY 216 Ca -0.16 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1c7i n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c7i n ALA 217 N 0.00 0.00 -1.68 4.61 0.00 -1.26 -3.91 120.51 118.27 1c7i n ALA 217 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.98 1c7i n ALA 217 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1c7i n ALA 217 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1c7i n SER 218 N 0.00 3.42 -3.42 0.00 2.88 -1.26 -4.16 113.62 111.07 1c7i n SER 218 Ca 0.00 1.02 -0.09 0.00 -1.33 0.00 0.00 58.87 58.46 1c7i n SER 218 Cb 0.00 -1.42 -0.09 0.00 -0.75 0.00 0.00 64.21 61.95 1c7i n SER 218 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1c7i s ARG 219 N 2.64 0.33 0.13 -1.46 6.06 -1.26 -4.99 118.95 120.41 1c7i s ARG 219 Ca 0.86 0.63 -0.14 0.00 -2.50 0.00 0.00 55.73 54.58 1c7i s ARG 219 Cb -0.65 -0.32 0.02 0.00 0.06 0.00 0.00 34.95 34.06 1c7i s ARG 219 CO 0.44 -0.56 0.37 0.95 -2.50 0.00 0.00 175.30 174.00 1c7i s THR 220 N 2.55 0.08 0.21 4.11 -4.23 -1.26 -4.35 115.64 112.74 1c7i s THR 220 Ca 0.10 -0.82 0.10 0.00 -1.18 0.00 0.00 61.69 59.89 1c7i s THR 220 Cb -0.15 -1.34 -0.04 0.00 1.34 0.00 0.00 72.50 72.31 1c7i s THR 220 CO -0.15 -0.35 -0.12 0.00 -0.54 0.00 0.00 174.62 173.46 1c7i s MET 221 N -3.84 1.94 0.90 3.99 0.23 -0.30 -4.98 119.30 117.24 1c7i s MET 221 Ca 0.06 -1.39 -0.11 0.00 -1.03 0.00 0.00 55.69 53.21 1c7i s MET 221 Cb 0.02 -2.05 0.13 0.00 -1.53 0.00 0.00 34.83 31.40 1c7i s MET 221 CO -0.09 0.41 1.09 0.95 -2.03 0.00 0.00 175.02 175.35 1c7i s THR 222 N -1.87 2.63 0.28 3.16 -4.23 -1.26 -1.88 115.64 112.47 1c7i s THR 222 Ca 0.25 0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 60.96 1c7i s THR 222 Cb -0.08 -2.59 0.15 0.00 1.34 0.00 0.00 72.50 71.32 1c7i s THR 222 CO 0.15 -0.27 1.82 0.50 -0.54 0.00 0.00 174.62 176.27 1c7i h LYS 223 N -1.62 0.82 0.06 3.99 3.64 -1.94 -2.05 116.57 119.46 1c7i h LYS 223 Ca -0.49 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 58.71 1c7i h LYS 223 Cb 1.28 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1c7i h LYS 223 CO 0.52 0.75 -0.03 0.93 -2.27 0.00 0.00 179.45 179.35 1c7i h GLU 224 N 0.79 -0.08 -0.80 1.90 3.07 -1.91 -2.24 114.58 115.31 1c7i h GLU 224 Ca 0.17 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 59.06 1c7i h GLU 224 Cb 0.32 0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 28.20 1c7i h GLU 224 CO 0.00 0.02 0.52 0.37 -1.40 0.00 0.00 179.01 178.53 1c7i h GLN 225 N -0.16 1.00 -0.56 2.33 5.75 -1.88 -0.73 115.11 120.86 1c7i h GLN 225 Ca -0.01 -0.06 0.05 0.00 -0.15 0.00 0.00 58.65 58.48 1c7i h GLN 225 Cb 0.14 -0.23 -0.05 0.00 1.07 0.00 0.00 27.48 28.41 1c7i h GLN 225 CO 0.01 0.66 0.29 0.00 -2.65 0.00 0.00 178.83 177.15 1c7i h ALA 226 N 1.32 0.73 -0.54 3.38 0.00 -1.18 0.22 119.26 123.20 1c7i h ALA 226 Ca 0.31 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 1c7i h ALA 226 Cb -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1c7i h ALA 226 CO -0.10 -0.05 -0.08 0.00 0.00 0.00 0.00 179.25 179.03 1c7i h ALA 227 N 1.30 0.83 -0.43 0.00 0.00 -0.92 -1.19 119.26 118.85 1c7i h ALA 227 Ca 0.25 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1c7i h ALA 227 Cb 0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1c7i h ALA 227 CO -0.17 0.66 0.15 1.03 0.00 0.00 0.00 179.25 180.93 1c7i h SER 228 N 0.89 0.61 0.42 0.00 0.87 -0.36 -1.71 113.55 114.28 1c7i h SER 228 Ca 0.15 -0.19 -0.12 0.00 -1.23 0.00 0.00 61.79 60.40 1c7i h SER 228 Cb 0.63 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 1c7i h SER 228 CO 0.04 0.64 -0.52 0.74 -0.53 0.00 0.00 176.83 177.20 1c7i h THR 229 N 0.55 1.37 -0.25 2.23 2.02 -0.49 -2.17 112.91 116.17 1c7i h THR 229 Ca 0.14 -1.78 -0.08 0.00 0.77 0.00 0.00 66.41 65.46 1c7i h THR 229 Cb 0.23 1.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.55 1c7i h THR 229 CO -0.01 0.52 -0.15 0.00 0.37 0.00 0.00 175.52 176.25 1c7i h ALA 230 N 1.39 0.35 -0.30 6.16 0.00 -0.96 -0.78 119.26 125.12 1c7i h ALA 230 Ca -0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1c7i h ALA 230 Cb 0.95 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1c7i h ALA 230 CO 0.07 0.24 0.12 0.00 0.00 0.00 0.00 179.25 179.68 1c7i h ALA 231 N 0.71 0.39 -0.56 0.00 0.00 -1.26 0.01 119.26 118.56 1c7i h ALA 231 Ca 0.05 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1c7i h ALA 231 Cb 0.67 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1c7i h ALA 231 CO 0.04 -0.01 0.37 0.00 0.00 0.00 0.00 179.25 179.65 1c7i h ALA 232 N 0.96 1.68 -0.13 0.00 0.00 -1.35 -1.36 119.26 119.06 1c7i h ALA 232 Ca 0.10 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1c7i h ALA 232 Cb 0.19 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1c7i h ALA 232 CO -0.01 0.28 -0.16 0.35 0.00 0.00 0.00 179.25 179.71 1c7i h PHE 233 N 0.68 0.40 -0.91 0.00 3.57 -0.59 -2.98 116.94 117.12 1c7i h PHE 233 Ca 0.22 -0.13 0.05 0.00 3.53 0.00 0.00 57.97 61.63 1c7i h PHE 233 Cb 0.03 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.63 1c7i h PHE 233 CO -0.00 0.76 0.59 -0.07 -2.23 0.00 0.00 178.31 177.36 1c7i h LEU 234 N -0.07 0.95 0.21 0.59 4.07 -0.40 -2.56 115.31 118.11 1c7i h LEU 234 Ca 0.02 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 1c7i h LEU 234 Cb 0.71 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 1c7i h LEU 234 CO 0.04 0.64 -0.16 1.56 -1.08 0.00 0.00 178.44 179.43 1c7i h GLN 235 N 1.09 -0.37 -0.37 1.13 1.08 -1.24 -0.89 115.11 115.55 1c7i h GLN 235 Ca 0.37 0.03 0.11 0.00 -1.45 0.00 0.00 58.65 57.70 1c7i h GLN 235 Cb 0.09 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 1c7i h GLN 235 CO -0.12 -0.25 0.46 0.28 -0.95 0.00 0.00 178.83 178.24 1c7i h VAL 236 N -0.38 0.31 -0.00 -0.54 2.07 -1.31 0.80 116.25 117.19 1c7i h VAL 236 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1c7i h VAL 236 Cb 0.34 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1c7i h VAL 236 CO -0.01 0.00 -0.53 0.18 0.02 0.00 0.00 177.57 177.23 1c7i n LEU 237 N -3.58 0.90 -0.63 2.57 4.77 -0.47 -4.94 117.00 115.62 1c7i n LEU 237 Ca 0.06 -0.25 -0.07 0.00 -0.03 0.00 0.00 56.01 55.73 1c7i n LEU 237 Cb 0.62 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1c7i n LEU 237 CO 0.25 0.19 -0.08 0.61 -1.33 0.00 0.00 177.39 177.04 1c7i n GLY 238 N 1.45 0.76 3.76 -0.72 0.00 0.28 -5.02 105.19 105.71 1c7i n GLY 238 Ca 0.07 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 1c7i n GLY 238 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c7i s ILE 239 N -2.29 4.77 0.36 -0.61 1.01 -0.46 -5.02 121.20 118.96 1c7i s ILE 239 Ca 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.57 1c7i s ILE 239 Cb 0.00 -3.06 -0.05 0.00 0.01 0.00 0.00 42.46 39.36 1c7i s ILE 239 CO 0.00 0.58 0.07 0.54 0.00 0.00 0.00 174.94 176.12 1c7i s ASN 240 N -1.05 2.62 0.56 3.58 2.20 -1.26 -4.13 114.94 117.45 1c7i s ASN 240 Ca 0.15 -1.46 0.48 0.00 -0.94 0.00 0.00 52.86 51.10 1c7i s ASN 240 Cb -0.12 0.07 1.70 0.00 -2.00 0.00 0.00 41.25 40.90 1c7i s ASN 240 CO 0.04 -0.69 1.59 -0.08 -2.94 0.00 0.00 177.10 175.03 1c7i h GLU 241 N 1.99 0.00 -0.18 3.55 4.22 -1.99 0.27 114.58 122.42 1c7i h GLU 241 Ca -0.40 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.04 1c7i h GLU 241 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1c7i h GLU 241 CO 0.67 0.00 0.00 -1.13 -2.18 0.00 0.00 179.01 176.37 1c7i n SER 242 N -3.94 3.04 -0.61 1.04 3.41 -1.26 -4.36 113.62 110.95 1c7i n SER 242 Ca 0.42 -1.92 0.05 0.00 -0.26 0.00 0.00 58.87 57.15 1c7i n SER 242 Cb 1.92 -0.11 0.20 0.00 -0.26 0.00 0.00 64.21 65.96 1c7i n SER 242 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c7i n GLN 243 N 1.28 1.62 0.00 4.33 6.02 0.93 -4.76 117.38 126.79 1c7i n GLN 243 Ca 0.15 -3.15 0.00 0.00 -0.01 0.00 0.00 57.00 53.99 1c7i n GLN 243 Cb 0.55 -1.64 0.00 0.00 1.02 0.00 0.00 30.24 30.17 1c7i n GLN 243 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1c7i n LEU 244 N -1.16 0.00 -0.04 1.08 4.77 -1.23 -2.38 117.00 118.05 1c7i n LEU 244 Ca 0.21 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.06 1c7i n LEU 244 Cb 0.74 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.75 1c7i n LEU 244 CO 0.01 0.00 0.61 0.44 -1.33 0.00 0.00 177.39 177.13 1c7i h ASP 245 N 0.00 0.23 -0.01 -1.43 3.32 -1.92 -3.14 116.42 113.46 1c7i h ASP 245 Ca 0.00 -0.49 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1c7i h ASP 245 Cb 0.00 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 1c7i h ASP 245 CO 0.00 0.67 0.19 -0.09 -1.72 0.00 0.00 179.24 178.29 1c7i h ARG 246 N -0.20 0.00 0.00 3.56 2.43 -1.90 -0.51 114.38 117.76 1c7i h ARG 246 Ca 0.01 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1c7i h ARG 246 Cb 0.61 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1c7i h ARG 246 CO 0.02 0.00 -0.16 -0.07 -1.51 0.00 0.00 179.97 178.25 1c7i h LEU 247 N 0.00 0.00 -2.30 3.80 3.38 -1.75 0.49 115.31 118.93 1c7i h LEU 247 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1c7i h LEU 247 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1c7i h LEU 247 CO -0.00 0.16 0.00 1.41 0.09 0.00 0.00 178.44 180.10 1c7i n HIS 248 N -4.32 0.49 0.00 1.13 8.25 -0.20 -4.40 115.22 116.17 1c7i n HIS 248 Ca -0.02 -0.25 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 1c7i n HIS 248 Cb 0.23 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.34 1c7i n HIS 248 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1c7i n THR 249 N 1.48 0.00 -2.04 1.59 -2.24 -0.88 -4.21 114.28 107.98 1c7i n THR 249 Ca 0.19 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.58 1c7i n THR 249 Cb 0.61 -0.01 -0.00 0.00 -2.10 0.00 0.00 70.33 68.82 1c7i n THR 249 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1c7i s VAL 250 N -1.69 2.58 0.46 2.28 0.11 0.11 -4.96 120.40 119.29 1c7i s VAL 250 Ca 0.00 0.53 -0.24 0.00 -2.93 0.00 0.00 61.98 59.33 1c7i s VAL 250 Cb 0.00 -3.31 -0.07 0.00 -1.53 0.00 0.00 36.38 31.46 1c7i s VAL 250 CO 0.00 0.08 1.29 0.00 -3.33 0.00 0.00 175.10 173.14 1c7i s ALA 251 N -1.24 3.08 0.35 1.54 0.00 -1.26 -4.91 121.76 119.32 1c7i s ALA 251 Ca 0.56 1.20 0.06 0.00 0.00 0.00 0.00 51.96 53.79 1c7i s ALA 251 Cb -0.39 -3.49 0.74 0.00 0.00 0.00 0.00 23.12 19.98 1c7i s ALA 251 CO 0.50 -0.95 1.93 0.00 0.00 0.00 0.00 175.76 177.24 1c7i h ALA 252 N 2.19 1.72 -0.18 0.00 0.00 -1.99 0.19 119.26 121.19 1c7i h ALA 252 Ca -0.50 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1c7i h ALA 252 Cb 1.26 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1c7i h ALA 252 CO 0.61 0.13 0.10 1.49 0.00 0.00 0.00 179.25 181.57 1c7i h GLU 253 N 0.77 0.24 0.00 0.00 4.57 -2.01 -1.25 114.58 116.90 1c7i h GLU 253 Ca 0.36 -0.02 -0.10 0.00 -1.18 0.00 0.00 59.36 58.42 1c7i h GLU 253 Cb 0.38 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1c7i h GLU 253 CO -0.13 0.18 -0.49 -0.44 -1.18 0.00 0.00 179.01 176.94 1c7i h ASP 254 N 0.24 0.00 0.15 1.04 3.32 -1.33 -2.89 116.42 116.96 1c7i h ASP 254 Ca 0.06 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.96 1c7i h ASP 254 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1c7i h ASP 254 CO -0.01 0.49 -0.58 -0.07 -1.72 0.00 0.00 179.24 177.34 1c7i h LEU 255 N 0.00 0.49 -0.55 1.55 3.38 -0.95 -1.71 115.31 117.53 1c7i h LEU 255 Ca -0.00 -0.27 -0.14 0.00 0.09 0.00 0.00 57.88 57.56 1c7i h LEU 255 Cb 1.26 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1c7i h LEU 255 CO 0.06 0.97 -0.30 -0.07 0.09 0.00 0.00 178.44 179.19 1c7i h LEU 256 N 0.33 0.88 -0.33 1.67 3.38 -1.38 -1.58 115.31 118.28 1c7i h LEU 256 Ca -0.00 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.56 1c7i h LEU 256 Cb 1.11 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1c7i h LEU 256 CO 0.10 1.11 0.02 0.11 0.09 0.00 0.00 178.44 179.88 1c7i h LYS 257 N 0.72 0.57 -0.82 1.13 1.57 -1.42 -1.76 116.57 116.56 1c7i h LYS 257 Ca 0.08 -0.17 0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1c7i h LYS 257 Cb 0.85 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 33.05 1c7i h LYS 257 CO 0.07 0.68 0.53 0.00 -0.57 0.00 0.00 179.45 180.17 1c7i h ALA 258 N 0.87 1.09 -0.22 3.86 0.00 -1.21 -0.69 119.26 122.95 1c7i h ALA 258 Ca 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1c7i h ALA 258 Cb 0.41 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1c7i h ALA 258 CO 0.01 0.35 0.13 0.00 0.00 0.00 0.00 179.25 179.74 1c7i h ALA 259 N 1.34 0.28 -0.44 0.00 0.00 -1.03 0.12 119.26 119.52 1c7i h ALA 259 Ca 0.33 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 1c7i h ALA 259 Cb 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1c7i h ALA 259 CO -0.12 -0.21 0.02 -0.44 0.00 0.00 0.00 179.25 178.51 1c7i h ASP 260 N 0.25 0.67 -0.57 0.00 3.32 -0.89 0.13 116.42 119.33 1c7i h ASP 260 Ca 0.08 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 1c7i h ASP 260 Cb 0.04 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1c7i h ASP 260 CO -0.01 0.73 0.06 1.56 -1.72 0.00 0.00 179.24 179.85 1c7i h GLN 261 N 0.67 0.96 -0.42 3.56 4.20 -0.85 -1.41 115.11 121.81 1c7i h GLN 261 Ca 0.14 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1c7i h GLN 261 Cb 0.39 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1c7i h GLN 261 CO 0.01 0.94 0.24 1.25 -0.67 0.00 0.00 178.83 180.59 1c7i h LEU 262 N 0.85 0.53 -0.40 1.46 5.85 -0.40 0.65 115.31 123.85 1c7i h LEU 262 Ca 0.17 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1c7i h LEU 262 Cb 0.46 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.28 1c7i h LEU 262 CO 0.02 0.46 -0.09 -0.09 -0.34 0.00 0.00 178.44 178.39 1c7i h ARG 263 N 0.55 0.00 -0.20 1.25 9.65 -0.38 -0.06 114.38 125.20 1c7i h ARG 263 Ca 0.15 -0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 58.95 1c7i h ARG 263 Cb 0.05 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.62 1c7i h ARG 263 CO -0.02 0.00 -0.20 0.82 2.80 0.00 0.00 179.97 183.37 1c7i h ILE 264 N 0.01 1.33 0.06 1.20 2.04 -0.76 -0.68 117.51 120.70 1c7i h ILE 264 Ca 0.19 -1.36 0.02 0.00 1.00 0.00 0.00 64.86 64.70 1c7i h ILE 264 Cb 0.29 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1c7i h ILE 264 CO -0.41 0.42 -0.15 0.00 0.00 0.00 0.00 178.15 178.01 1c7i h ALA 265 N 0.65 -0.22 -0.27 1.87 0.00 0.72 -2.44 119.26 119.56 1c7i h ALA 265 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1c7i h ALA 265 Cb 0.75 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1c7i h ALA 265 CO 0.05 -0.66 0.00 0.39 0.00 0.00 0.00 179.25 179.03 1c7i n GLU 266 N -5.27 1.96 -3.79 0.00 4.71 -0.07 -4.95 120.64 113.23 1c7i n GLU 266 Ca -0.06 -1.11 -0.31 0.00 -0.01 0.00 0.00 57.16 55.66 1c7i n GLU 266 Cb 0.19 -1.42 0.02 0.00 -1.01 0.00 0.00 31.44 29.22 1c7i n GLU 266 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1c7i n LYS 267 N 0.32 -1.03 -2.08 3.49 5.02 -0.92 -4.88 118.16 118.09 1c7i n LYS 267 Ca 0.10 0.54 -0.41 0.00 -2.02 0.00 0.00 58.31 56.52 1c7i n LYS 267 Cb 0.37 -3.11 -0.02 0.00 -0.02 0.00 0.00 35.03 32.25 1c7i n LYS 267 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1c7i s GLU 268 N -5.80 4.32 0.23 1.97 2.12 -0.31 -5.04 118.70 116.20 1c7i s GLU 268 Ca 0.27 2.23 0.06 0.00 0.36 0.00 0.00 54.97 57.90 1c7i s GLU 268 Cb -0.13 -3.11 -0.05 0.00 0.26 0.00 0.00 34.13 31.10 1c7i s GLU 268 CO 0.90 -0.32 -0.09 0.54 -0.54 0.00 0.00 175.26 175.75 1c7i s ASN 269 N 0.10 2.49 0.57 -1.70 4.22 -1.26 -5.01 114.94 114.34 1c7i s ASN 269 Ca 0.56 -1.11 0.28 0.00 -2.14 0.00 0.00 52.86 50.44 1c7i s ASN 269 Cb -0.40 -0.12 1.51 0.00 1.28 0.00 0.00 41.25 43.52 1c7i s ASN 269 CO 0.45 -0.30 1.99 0.40 -2.04 0.00 0.00 177.10 177.61 1c7i h ILE 270 N 2.45 0.52 0.00 0.54 2.04 -2.01 -2.18 117.51 118.87 1c7i h ILE 270 Ca -0.39 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1c7i h ILE 270 Cb 1.22 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1c7i h ILE 270 CO 0.64 0.00 0.00 0.49 0.00 0.00 0.00 178.15 179.28 1c7i n PHE 271 N -3.96 0.70 -3.06 1.37 3.01 -1.26 -4.30 117.46 109.96 1c7i n PHE 271 Ca 0.07 0.23 -0.17 0.00 1.01 0.00 0.00 57.45 58.59 1c7i n PHE 271 Cb 0.54 -0.88 -0.04 0.00 -0.01 0.00 0.00 39.48 39.09 1c7i n PHE 271 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1c7i n GLN 272 N -2.10 0.55 -1.59 -1.08 6.02 -0.82 -4.98 117.38 113.39 1c7i n GLN 272 Ca 0.04 -2.65 -0.38 0.00 -0.01 0.00 0.00 57.00 54.00 1c7i n GLN 272 Cb 0.33 -1.44 0.05 0.00 1.02 0.00 0.00 30.24 30.19 1c7i n GLN 272 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1c7i n LEU 273 N 2.13 3.09 0.08 1.08 4.77 -1.25 -4.48 117.00 122.42 1c7i n LEU 273 Ca 0.20 0.81 -0.03 0.00 -0.03 0.00 0.00 56.01 56.96 1c7i n LEU 273 Cb 0.55 -1.35 -0.07 0.00 -2.33 0.00 0.00 43.42 40.22 1c7i n LEU 273 CO 0.08 -2.05 0.19 -0.26 -1.33 0.00 0.00 177.39 174.03 1c7i h PHE 274 N 0.51 0.00 -3.75 -1.77 -1.00 -1.96 -3.42 116.94 105.56 1c7i h PHE 274 Ca -0.48 0.00 -0.68 0.00 2.81 0.00 0.00 57.97 59.63 1c7i h PHE 274 Cb 1.37 0.00 -0.34 0.00 3.61 0.00 0.00 35.95 40.59 1c7i h PHE 274 CO 0.36 0.80 -0.75 -0.06 -1.61 0.00 0.00 178.31 177.06 1c7i s PHE 275 N -2.80 3.22 0.23 -0.55 0.40 -1.26 -4.97 117.98 112.24 1c7i s PHE 275 Ca 0.01 -1.97 -0.22 0.00 -0.60 0.00 0.00 56.93 54.15 1c7i s PHE 275 Cb 0.09 -2.04 0.05 0.00 0.51 0.00 0.00 43.02 41.63 1c7i s PHE 275 CO 0.79 -0.82 0.88 1.14 0.70 0.00 0.00 175.22 177.91 1c7i s GLN 276 N 1.21 1.53 0.73 0.44 -2.07 -1.26 -4.71 119.66 115.54 1c7i s GLN 276 Ca -0.05 -0.89 -0.16 0.00 -1.82 0.00 0.00 55.36 52.44 1c7i s GLN 276 Cb -0.19 0.49 0.02 0.00 -1.09 0.00 0.00 33.01 32.24 1c7i s GLN 276 CO -0.03 -0.71 1.06 -2.30 -1.32 0.00 0.00 175.29 172.00 1c7i n PRO 277 N -0.51 0.51 -4.03 9.60 -0.02 -1.26 -4.80 135.00 134.49 1c7i n PRO 277 Ca -0.05 0.24 -0.11 0.00 -2.02 0.00 0.00 63.50 61.55 1c7i n PRO 277 Cb 0.60 -2.31 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 1c7i n PRO 277 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1c7i s ALA 278 N -1.83 0.36 0.37 3.55 0.00 -1.26 -1.15 121.76 121.80 1c7i s ALA 278 Ca 0.74 -0.66 -0.27 0.00 0.00 0.00 0.00 51.96 51.77 1c7i s ALA 278 Cb -0.34 0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.77 1c7i s ALA 278 CO 0.49 -0.08 1.29 -0.51 0.00 0.00 0.00 175.76 176.95 1c7i s LEU 279 N -1.46 4.31 -0.30 0.00 1.43 -0.79 -4.59 118.68 117.29 1c7i s LEU 279 Ca -0.12 2.63 -0.14 0.00 -1.03 0.00 0.00 54.13 55.47 1c7i s LEU 279 Cb -0.10 -3.80 0.14 0.00 0.03 0.00 0.00 46.19 42.46 1c7i s LEU 279 CO -0.00 -0.68 0.85 -0.62 0.23 0.00 0.00 176.35 176.12 1c7i s ASP 280 N -0.67 -0.78 0.28 2.29 3.68 0.06 -4.13 116.67 117.39 1c7i s ASP 280 Ca 0.53 1.12 0.03 0.00 2.13 0.00 0.00 52.55 56.36 1c7i s ASP 280 Cb -0.38 1.72 0.68 0.00 -1.45 0.00 0.00 42.92 43.49 1c7i s ASP 280 CO 0.49 -0.16 1.72 -0.65 0.13 0.00 0.00 175.17 176.70 1c7i h PRO 281 N 7.29 0.47 0.00 4.34 0.11 -1.84 0.07 132.00 142.43 1c7i h PRO 281 Ca -0.21 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.85 1c7i h PRO 281 Cb 1.14 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1c7i h PRO 281 CO 0.12 0.31 -0.10 0.87 -0.21 0.00 0.00 178.00 178.99 1c7i h LYS 282 N 0.48 0.00 0.00 1.05 1.57 -1.97 -3.39 116.57 114.31 1c7i h LYS 282 Ca 0.54 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 1c7i h LYS 282 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1c7i h LYS 282 CO -0.47 0.10 -0.56 0.25 -0.57 0.00 0.00 179.45 178.19 1c7i n THR 283 N -3.17 0.21 -3.66 -0.16 -2.24 -0.86 -4.95 114.28 99.45 1c7i n THR 283 Ca 0.02 0.07 -0.28 0.00 -2.27 0.00 0.00 64.05 61.59 1c7i n THR 283 Cb 0.45 -1.25 -0.11 0.00 -2.10 0.00 0.00 70.33 67.32 1c7i n THR 283 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1c7i s LEU 284 N -6.03 3.16 0.32 3.22 2.96 -0.04 -4.47 118.68 117.80 1c7i s LEU 284 Ca 0.00 -3.43 0.10 0.00 -0.22 0.00 0.00 54.13 50.58 1c7i s LEU 284 Cb 0.00 -1.06 0.92 0.00 0.50 0.00 0.00 46.19 46.55 1c7i s LEU 284 CO 0.00 -0.13 1.69 -0.65 -1.32 0.00 0.00 176.35 175.94 1c7i h PRO 285 N 5.59 0.40 -3.29 0.98 0.11 -1.61 0.19 132.00 134.37 1c7i h PRO 285 Ca 0.19 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.29 1c7i h PRO 285 Cb 0.83 -0.09 -0.07 0.00 0.11 0.00 0.00 31.00 31.79 1c7i h PRO 285 CO 0.55 0.27 0.08 -1.83 -0.21 0.00 0.00 178.00 176.85 1c7i s GLU 286 N -5.77 1.70 -0.03 1.05 -1.05 -1.26 -4.60 118.70 108.75 1c7i s GLU 286 Ca -0.11 -1.12 -0.37 0.00 -0.15 0.00 0.00 54.97 53.23 1c7i s GLU 286 Cb 0.28 0.55 -0.15 0.00 -0.44 0.00 0.00 34.13 34.37 1c7i s GLU 286 CO 0.79 -0.75 1.58 0.39 0.95 0.00 0.00 175.26 178.22 1c7i n GLU 287 N -0.43 1.51 -0.23 -4.83 1.02 -1.26 -4.80 120.64 111.62 1c7i n GLU 287 Ca -0.03 0.55 0.03 0.00 -0.02 0.00 0.00 57.16 57.69 1c7i n GLU 287 Cb 0.60 -2.26 0.13 0.00 -0.02 0.00 0.00 31.44 29.90 1c7i n GLU 287 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1c7i h PRO 288 N 6.28 0.12 -0.98 3.49 0.11 -1.94 -0.53 132.00 138.56 1c7i h PRO 288 Ca -0.47 -0.01 0.14 0.00 0.11 0.00 0.00 66.00 65.77 1c7i h PRO 288 Cb 1.30 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.30 1c7i h PRO 288 CO 0.88 0.08 0.60 1.49 -0.21 0.00 0.00 178.00 180.84 1c7i h GLU 289 N 0.12 0.88 -0.12 1.05 4.81 -1.89 0.09 114.58 119.52 1c7i h GLU 289 Ca 0.37 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.52 1c7i h GLU 289 Cb 0.63 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1c7i h GLU 289 CO -0.59 0.58 -0.04 -0.22 -0.73 0.00 0.00 179.01 178.01 1c7i h LYS 290 N 0.90 0.24 -0.51 1.92 1.63 -1.48 -2.44 116.57 116.84 1c7i h LYS 290 Ca 0.51 -0.09 0.02 0.00 -0.85 0.00 0.00 60.65 60.24 1c7i h LYS 290 Cb 0.58 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.16 1c7i h LYS 290 CO -0.30 0.55 0.30 0.77 -3.45 0.00 0.00 179.45 177.32 1c7i h SER 291 N -0.09 0.48 -0.48 4.20 0.02 -0.67 -2.30 113.55 114.72 1c7i h SER 291 Ca 0.03 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 1c7i h SER 291 Cb 0.47 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 1c7i h SER 291 CO 0.01 0.34 0.22 0.40 -1.14 0.00 0.00 176.83 176.66 1c7i h ILE 292 N 0.59 1.19 0.00 3.27 5.03 -1.01 -0.40 117.51 126.18 1c7i h ILE 292 Ca 0.20 -0.57 0.00 0.00 -0.12 0.00 0.00 64.86 64.38 1c7i h ILE 292 Cb 0.03 0.56 0.00 0.00 -3.03 0.00 0.00 36.82 34.37 1c7i h ILE 292 CO -0.10 0.23 0.00 0.00 -0.68 0.00 0.00 178.15 177.60 1c7i h ALA 293 N 1.51 1.00 -0.02 1.87 0.00 -0.91 -0.32 119.26 122.39 1c7i h ALA 293 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1c7i h ALA 293 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1c7i h ALA 293 CO -0.02 0.00 -0.11 0.39 0.00 0.00 0.00 179.25 179.52 1c7i n GLU 294 N -2.76 1.49 -0.48 0.00 -0.58 -0.21 -4.94 120.64 113.17 1c7i n GLU 294 Ca 0.00 -0.97 0.00 0.00 -0.42 0.00 0.00 57.16 55.78 1c7i n GLU 294 Cb 0.23 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.62 1c7i n GLU 294 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1c7i n GLY 295 N 1.26 0.75 0.36 0.62 0.00 -0.13 -4.96 105.19 103.09 1c7i n GLY 295 Ca 0.16 -0.12 0.19 0.00 0.00 0.00 0.00 46.02 46.24 1c7i n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c7i h ALA 296 N 0.00 1.86 -0.64 4.61 0.00 -1.57 -1.20 119.26 122.32 1c7i h ALA 296 Ca 0.00 -0.01 -0.45 0.00 0.00 0.00 0.00 54.91 54.45 1c7i h ALA 296 Cb 0.00 0.02 -0.31 0.00 0.00 0.00 0.00 17.79 17.50 1c7i h ALA 296 CO 0.00 -0.47 -0.43 0.00 0.00 0.00 0.00 179.25 178.35 1c7i n ALA 297 N -2.26 4.96 -1.75 0.00 0.00 -1.26 -4.93 120.51 115.26 1c7i n ALA 297 Ca 0.04 -3.60 -0.42 0.00 0.00 0.00 0.00 53.44 49.46 1c7i n ALA 297 Cb 0.47 -0.60 -0.01 0.00 0.00 0.00 0.00 19.45 19.32 1c7i n ALA 297 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1c7i n SER 298 N -0.85 3.69 0.00 0.00 2.88 -0.46 -2.46 113.62 116.42 1c7i n SER 298 Ca 0.42 1.19 0.00 0.00 -1.33 0.00 0.00 58.87 59.15 1c7i n SER 298 Cb 0.90 -1.59 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 1c7i n SER 298 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1c7i n GLY 299 N 1.24 0.83 3.42 0.46 0.00 -0.12 -5.00 105.19 106.02 1c7i n GLY 299 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1c7i n GLY 299 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c7i s ILE 300 N -3.47 5.02 0.45 -0.61 1.01 -1.03 -4.94 121.20 117.63 1c7i s ILE 300 Ca 0.00 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.61 1c7i s ILE 300 Cb 0.00 -3.83 -0.09 0.00 0.01 0.00 0.00 42.46 38.56 1c7i s ILE 300 CO 0.00 -0.32 1.44 -2.65 0.00 0.00 0.00 174.94 173.41 1c7i n PRO 301 N 5.11 2.29 -4.27 2.79 -0.02 -1.26 -4.62 135.00 135.03 1c7i n PRO 301 Ca -0.11 0.82 -0.22 0.00 -2.02 0.00 0.00 63.50 61.96 1c7i n PRO 301 Cb 0.46 -2.64 -0.17 0.00 -0.02 0.00 0.00 33.50 31.13 1c7i n PRO 301 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1c7i s LEU 302 N -2.66 1.39 -0.24 2.45 2.96 -0.48 -1.82 118.68 120.28 1c7i s LEU 302 Ca 0.61 -0.20 -0.05 0.00 -0.22 0.00 0.00 54.13 54.27 1c7i s LEU 302 Cb -0.45 -0.60 -0.01 0.00 0.50 0.00 0.00 46.19 45.63 1c7i s LEU 302 CO 0.58 -0.04 0.01 -0.22 -1.32 0.00 0.00 176.35 175.36 1c7i s LEU 303 N 0.94 3.22 -0.01 -0.68 2.96 -0.40 -0.51 118.68 124.20 1c7i s LEU 303 Ca -0.10 -0.39 -0.04 0.00 -0.22 0.00 0.00 54.13 53.37 1c7i s LEU 303 Cb -0.15 -1.82 -0.00 0.00 0.50 0.00 0.00 46.19 44.73 1c7i s LEU 303 CO 0.00 -0.05 0.08 -0.51 -1.32 0.00 0.00 176.35 174.55 1c7i s ILE 304 N 1.52 0.06 0.05 6.68 2.07 0.01 -0.81 121.20 130.78 1c7i s ILE 304 Ca 0.05 -0.52 -0.06 0.00 -1.41 0.00 0.00 60.65 58.71 1c7i s ILE 304 Cb -0.15 -0.29 0.02 0.00 0.13 0.00 0.00 42.46 42.17 1c7i s ILE 304 CO -0.00 -0.29 0.28 0.61 -1.91 0.00 0.00 174.94 173.63 1c7i n GLY 305 N 2.01 1.09 3.53 1.50 0.00 -0.96 -2.04 105.19 110.31 1c7i n GLY 305 Ca -0.20 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 1c7i n GLY 305 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1c7i s THR 306 N -2.42 0.00 0.05 2.61 -4.23 -1.17 -1.19 115.64 109.29 1c7i s THR 306 Ca 0.06 -1.51 -0.00 0.00 -1.18 0.00 0.00 61.69 59.06 1c7i s THR 306 Cb -0.01 -2.45 -0.04 0.00 1.34 0.00 0.00 72.50 71.35 1c7i s THR 306 CO 0.01 0.00 0.20 0.42 -0.54 0.00 0.00 174.62 174.72 1c7i s THR 307 N -3.54 5.38 0.28 3.99 -4.23 -1.26 -0.90 115.64 115.35 1c7i s THR 307 Ca 0.27 -0.36 -0.03 0.00 -1.18 0.00 0.00 61.69 60.39 1c7i s THR 307 Cb -0.00 -3.60 0.27 0.00 1.34 0.00 0.00 72.50 70.50 1c7i s THR 307 CO 0.14 0.17 1.92 -0.09 -0.54 0.00 0.00 174.62 176.22 1c7i h ARG 308 N 3.21 1.15 -0.80 3.99 2.43 -1.06 -3.16 114.38 120.14 1c7i h ARG 308 Ca -0.46 -0.07 -0.57 0.00 -0.81 0.00 0.00 59.98 58.07 1c7i h ARG 308 Cb 1.16 -0.26 -0.39 0.00 -0.42 0.00 0.00 29.97 30.07 1c7i h ARG 308 CO 0.75 0.76 -0.40 -0.25 -1.51 0.00 0.00 179.97 179.31 1c7i n ASP 309 N -4.44 5.55 -0.21 -3.80 8.00 0.78 -4.90 116.55 117.52 1c7i n ASP 309 Ca 0.13 -3.76 -0.06 0.00 0.71 0.00 0.00 54.79 51.81 1c7i n ASP 309 Cb 0.10 -0.50 -0.05 0.00 -0.02 0.00 0.00 41.12 40.65 1c7i n ASP 309 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1c7i n GLU 310 N -0.77 -0.22 -0.37 -1.24 -0.58 -1.17 -1.76 120.64 114.53 1c7i n GLU 310 Ca 0.48 0.93 0.30 0.00 -0.42 0.00 0.00 57.16 58.45 1c7i n GLU 310 Cb 0.90 -1.37 0.61 0.00 -0.57 0.00 0.00 31.44 31.00 1c7i n GLU 310 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1c7i h GLY 311 N 0.00 0.94 1.48 0.62 0.00 -1.88 -2.38 103.07 101.85 1c7i h GLY 311 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1c7i h GLY 311 CO -0.47 -0.17 0.00 -1.72 0.00 0.00 0.00 176.54 174.17 1c7i n TYR 312 N -4.53 0.00 0.05 5.60 4.02 -0.72 -1.03 117.16 120.56 1c7i n TYR 312 Ca 0.29 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 58.17 1c7i n TYR 312 Cb 1.14 -0.24 -0.07 0.00 -0.02 0.00 0.00 39.34 40.16 1c7i n TYR 312 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 1c7i h PHE 313 N 0.00 0.00 0.00 -0.72 3.57 -1.65 -3.37 116.94 114.77 1c7i h PHE 313 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1c7i h PHE 313 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1c7i h PHE 313 CO 0.00 0.67 -1.17 1.19 -2.23 0.00 0.00 178.31 176.76 1c7i n PHE 314 N -3.04 0.46 -4.03 0.41 3.01 -0.20 -4.92 117.46 109.15 1c7i n PHE 314 Ca -0.07 0.13 -0.19 0.00 1.01 0.00 0.00 57.45 58.33 1c7i n PHE 314 Cb 0.86 -0.62 -0.16 0.00 -0.01 0.00 0.00 39.48 39.54 1c7i n PHE 314 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1c7i s PHE 315 N -3.31 0.60 0.53 1.38 0.40 -1.22 -5.11 117.98 111.25 1c7i s PHE 315 Ca 0.00 -0.13 -0.03 0.00 -0.60 0.00 0.00 56.93 56.17 1c7i s PHE 315 Cb 0.13 -0.60 0.01 0.00 0.51 0.00 0.00 43.02 43.06 1c7i s PHE 315 CO 0.81 -0.19 0.79 0.95 0.70 0.00 0.00 175.22 178.28 1c7i s THR 316 N 1.10 3.71 -0.43 0.64 -4.23 -1.26 -4.80 115.64 110.37 1c7i s THR 316 Ca -0.08 -0.28 0.14 0.00 -1.18 0.00 0.00 61.69 60.28 1c7i s THR 316 Cb -0.14 -3.42 0.14 0.00 1.34 0.00 0.00 72.50 70.42 1c7i s THR 316 CO -0.01 -0.36 1.41 -2.65 -0.54 0.00 0.00 174.62 172.46 1c7i n PRO 317 N -2.34 0.09 -0.37 3.99 -0.02 -1.26 -1.06 135.00 134.03 1c7i n PRO 317 Ca 0.03 0.58 0.07 0.00 -2.02 0.00 0.00 63.50 62.17 1c7i n PRO 317 Cb 0.58 -1.83 0.23 0.00 -0.02 0.00 0.00 33.50 32.46 1c7i n PRO 317 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1c7i n ASP 318 N -1.98 3.64 -4.76 2.55 8.00 -1.26 -5.01 116.55 117.72 1c7i n ASP 318 Ca -0.01 -2.54 -0.40 0.00 0.71 0.00 0.00 54.79 52.55 1c7i n ASP 318 Cb 0.05 -0.42 -0.05 0.00 -0.02 0.00 0.00 41.12 40.68 1c7i n ASP 318 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1c7i s SER 319 N -1.42 7.38 0.54 -2.24 0.01 -0.23 -5.00 113.70 112.74 1c7i s SER 319 Ca 0.36 2.13 -0.22 0.00 1.31 0.00 0.00 55.95 59.53 1c7i s SER 319 Cb 0.25 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.82 1c7i s SER 319 CO 0.13 -0.05 1.37 -1.81 0.41 0.00 0.00 173.24 173.29 1c7i s ASP 320 N -1.05 5.26 -0.25 2.44 1.11 -1.26 -4.97 116.67 117.95 1c7i s ASP 320 Ca 0.44 2.80 -0.11 0.00 0.18 0.00 0.00 52.55 55.86 1c7i s ASP 320 Cb -0.29 -2.64 -0.05 0.00 1.07 0.00 0.00 42.92 41.01 1c7i s ASP 320 CO 0.37 -1.58 0.17 -0.69 1.18 0.00 0.00 175.17 174.61 1c7i s VAL 321 N -1.29 5.34 0.57 -1.27 1.01 -1.26 -5.03 120.40 118.48 1c7i s VAL 321 Ca 0.71 0.18 -0.19 0.00 0.00 0.00 0.00 61.98 62.68 1c7i s VAL 321 Cb -0.41 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.40 1c7i s VAL 321 CO 0.49 0.32 0.90 -1.22 0.00 0.00 0.00 175.10 175.59 1c7i n TYR 322 N 4.47 0.62 -1.41 5.22 0.53 -1.26 -4.98 117.16 120.35 1c7i n TYR 322 Ca -0.15 0.45 -0.30 0.00 -1.02 0.00 0.00 57.90 56.89 1c7i n TYR 322 Cb 0.52 -2.12 0.11 0.00 -1.03 0.00 0.00 39.34 36.82 1c7i n TYR 322 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 1c7i s SER 323 N -1.17 4.00 0.19 7.72 1.04 -1.26 -4.82 113.70 119.40 1c7i s SER 323 Ca 0.73 1.36 -0.11 0.00 0.48 0.00 0.00 55.95 58.40 1c7i s SER 323 Cb -0.44 -2.06 0.10 0.00 0.10 0.00 0.00 66.02 63.73 1c7i s SER 323 CO 0.50 -2.29 1.79 1.56 0.98 0.00 0.00 173.24 175.77 1c7i h GLN 324 N -1.31 0.92 -0.35 4.02 1.08 -1.98 -0.62 115.11 116.88 1c7i h GLN 324 Ca -0.48 -0.12 0.08 0.00 -1.45 0.00 0.00 58.65 56.67 1c7i h GLN 324 Cb 1.28 -0.17 -0.08 0.00 -0.05 0.00 0.00 27.48 28.46 1c7i h GLN 324 CO 0.58 0.71 -0.18 1.49 -0.95 0.00 0.00 178.83 180.48 1c7i h GLU 325 N 0.89 -0.12 -0.29 1.46 4.57 -1.99 0.26 114.58 119.35 1c7i h GLU 325 Ca 0.23 0.01 -0.14 0.00 -1.18 0.00 0.00 59.36 58.28 1c7i h GLU 325 Cb 0.08 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1c7i h GLU 325 CO -0.03 -0.08 -0.39 1.79 -1.18 0.00 0.00 179.01 179.12 1c7i h THR 326 N -0.13 1.29 -0.26 0.32 1.35 -1.87 -2.47 112.91 111.14 1c7i h THR 326 Ca 0.18 -1.55 -0.04 0.00 -0.55 0.00 0.00 66.41 64.45 1c7i h THR 326 Cb 0.40 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.29 1c7i h THR 326 CO -0.43 0.50 0.01 0.25 -0.25 0.00 0.00 175.52 175.60 1c7i h LEU 327 N 0.56 0.45 -0.66 3.87 5.85 -0.42 -1.58 115.31 123.38 1c7i h LEU 327 Ca 0.05 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1c7i h LEU 327 Cb 0.91 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 1c7i h LEU 327 CO 0.08 0.64 0.33 0.44 -0.34 0.00 0.00 178.44 179.58 1c7i h ASP 328 N 0.24 0.86 -0.49 1.25 3.32 -0.52 -0.92 116.42 120.15 1c7i h ASP 328 Ca 0.07 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1c7i h ASP 328 Cb 0.41 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1c7i h ASP 328 CO 0.01 0.74 0.30 0.00 -1.72 0.00 0.00 179.24 178.57 1c7i h ALA 329 N 1.15 1.56 0.20 3.45 0.00 -1.32 -0.73 119.26 123.58 1c7i h ALA 329 Ca 0.23 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1c7i h ALA 329 Cb 0.10 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1c7i h ALA 329 CO -0.03 0.38 -0.10 0.00 0.00 0.00 0.00 179.25 179.50 1c7i h ALA 330 N 1.63 -0.27 -0.95 0.00 0.00 -0.59 -1.68 119.26 117.39 1c7i h ALA 330 Ca 0.18 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1c7i h ALA 330 Cb -0.01 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1c7i h ALA 330 CO -0.03 -0.39 0.60 -0.07 0.00 0.00 0.00 179.25 179.35 1c7i h LEU 331 N -0.79 0.90 -0.58 0.00 3.38 -1.04 0.37 115.31 117.57 1c7i h LEU 331 Ca -0.03 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1c7i h LEU 331 Cb 0.51 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1c7i h LEU 331 CO 0.05 0.53 -0.10 -0.08 0.09 0.00 0.00 178.44 178.92 1c7i h GLU 332 N 1.01 1.03 -0.33 1.13 4.81 -1.16 0.48 114.58 121.55 1c7i h GLU 332 Ca 0.45 -0.38 -0.13 0.00 -0.13 0.00 0.00 59.36 59.18 1c7i h GLU 332 Cb 0.34 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1c7i h GLU 332 CO -0.23 1.07 -0.31 -0.92 -0.73 0.00 0.00 179.01 177.90 1c7i h TYR 333 N 0.92 0.81 0.13 0.92 3.20 -0.39 0.23 116.97 122.79 1c7i h TYR 333 Ca 0.14 -0.21 -0.20 0.00 3.14 0.00 0.00 58.73 61.60 1c7i h TYR 333 Cb 0.67 -0.19 0.02 0.00 1.54 0.00 0.00 36.73 38.78 1c7i h TYR 333 CO 0.05 0.92 -0.88 -0.07 -1.64 0.00 0.00 178.16 176.54 1c7i h LEU 334 N 0.60 0.55 0.00 2.82 3.38 -0.82 -3.39 115.31 118.45 1c7i h LEU 334 Ca 0.07 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1c7i h LEU 334 Cb 0.82 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1c7i h LEU 334 CO 0.07 1.41 -0.53 0.18 0.09 0.00 0.00 178.44 179.66 1c7i n LEU 335 N -4.08 0.52 0.00 1.67 4.77 0.15 -5.10 117.00 114.93 1c7i n LEU 335 Ca -0.14 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 1c7i n LEU 335 Cb 0.84 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.93 1c7i n LEU 335 CO 0.50 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1c7i n GLY 336 N 1.26 -0.57 0.40 -0.72 0.00 0.82 -4.25 105.19 102.13 1c7i n GLY 336 Ca 0.02 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.44 1c7i n GLY 336 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1c7i h LYS 337 N 0.00 -0.15 0.30 1.61 1.57 -1.90 0.73 116.57 118.73 1c7i h LYS 337 Ca 0.00 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1c7i h LYS 337 Cb 0.00 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1c7i h LYS 337 CO 0.00 -0.10 -0.41 -1.35 -0.57 0.00 0.00 179.45 177.02 1c7i h PRO 338 N -0.15 -0.71 -0.66 3.15 0.11 -1.96 -1.84 132.00 129.94 1c7i h PRO 338 Ca 0.20 0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.33 1c7i h PRO 338 Cb 0.54 0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.78 1c7i h PRO 338 CO -0.79 -0.48 0.29 1.25 -0.21 0.00 0.00 178.00 178.07 1c7i h LEU 339 N -0.74 0.87 -0.48 2.35 6.46 -1.71 -1.94 115.31 120.12 1c7i h LEU 339 Ca -0.04 -0.10 0.07 0.00 -0.12 0.00 0.00 57.88 57.69 1c7i h LEU 339 Cb 0.67 -0.22 -0.06 0.00 -0.73 0.00 0.00 40.66 40.32 1c7i h LEU 339 CO -0.11 0.75 0.13 0.00 -0.62 0.00 0.00 178.44 178.59 1c7i h ALA 340 N 1.38 0.56 -0.31 1.25 0.00 -0.70 0.16 119.26 121.59 1c7i h ALA 340 Ca 0.23 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1c7i h ALA 340 Cb 0.14 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1c7i h ALA 340 CO -0.03 -0.27 0.02 0.93 0.00 0.00 0.00 179.25 179.90 1c7i h GLU 341 N 0.28 0.53 -0.93 0.00 5.08 -0.91 0.25 114.58 118.87 1c7i h GLU 341 Ca 0.24 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1c7i h GLU 341 Cb 0.28 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.42 1c7i h GLU 341 CO -0.28 0.65 0.60 0.87 -1.00 0.00 0.00 179.01 179.85 1c7i h LYS 342 N 0.33 1.11 0.00 2.33 1.57 -0.69 -2.61 116.57 118.61 1c7i h LYS 342 Ca 0.09 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1c7i h LYS 342 Cb 0.40 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1c7i h LYS 342 CO 0.01 0.73 -0.64 0.28 -0.57 0.00 0.00 179.45 179.26 1c7i n VAL 343 N -4.52 0.20 -0.45 0.50 0.31 0.50 -4.14 118.33 110.73 1c7i n VAL 343 Ca 0.13 -0.17 0.37 0.00 -0.01 0.00 0.00 64.34 64.66 1c7i n VAL 343 Cb 0.12 0.05 0.65 0.00 -0.91 0.00 0.00 33.84 33.76 1c7i n VAL 343 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1c7i h ALA 344 N 2.69 2.75 -0.63 3.52 0.00 -0.10 0.96 119.26 128.45 1c7i h ALA 344 Ca 0.00 0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.10 1c7i h ALA 344 Cb 0.66 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 1c7i h ALA 344 CO 0.00 -1.39 0.29 0.22 0.00 0.00 0.00 179.25 178.38 1c7i h ASP 345 N 0.08 0.37 -0.11 0.00 -0.00 -1.75 -2.49 116.42 112.52 1c7i h ASP 345 Ca 0.82 0.06 0.01 0.00 -0.00 0.00 0.00 57.03 57.92 1c7i h ASP 345 Cb 2.60 -0.01 -0.01 0.00 -0.00 0.00 0.00 39.33 41.92 1c7i h ASP 345 CO -0.42 0.23 0.08 -0.07 -0.00 0.00 0.00 179.24 179.06 1c7i h LEU 346 N 0.53 0.10 -6.41 2.28 3.38 0.68 -3.34 115.31 112.54 1c7i h LEU 346 Ca 0.30 -0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.65 1c7i h LEU 346 Cb 0.30 -0.03 -0.41 0.00 0.09 0.00 0.00 40.66 40.61 1c7i h LEU 346 CO -0.25 0.07 -0.48 -1.22 0.09 0.00 0.00 178.44 176.65 1c7i n TYR 347 N -4.52 3.53 -2.23 1.13 4.02 -0.94 -4.97 117.16 113.19 1c7i n TYR 347 Ca -0.01 -4.08 -0.42 0.00 -0.01 0.00 0.00 57.90 53.37 1c7i n TYR 347 Cb 0.11 -0.63 -0.03 0.00 -0.02 0.00 0.00 39.34 38.77 1c7i n TYR 347 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1c7i s PRO 348 N -2.32 4.27 0.02 -0.72 0.04 -1.26 -4.86 135.00 130.16 1c7i s PRO 348 Ca 0.37 1.95 -0.14 0.00 0.04 0.00 0.00 61.00 63.21 1c7i s PRO 348 Cb 0.11 -3.65 -0.07 0.00 0.04 0.00 0.00 34.50 30.93 1c7i s PRO 348 CO -0.03 -0.62 0.36 -2.13 0.04 0.00 0.00 177.00 174.62 1c7i n ARG 349 N 5.74 0.00 0.00 4.56 0.63 -1.26 -4.55 116.66 121.78 1c7i n ARG 349 Ca 0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 1c7i n ARG 349 Cb 0.44 -0.53 0.00 0.00 0.45 0.00 0.00 32.46 32.82 1c7i n ARG 349 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1c7i n SER 350 N 0.61 0.00 -0.26 6.15 3.41 -1.26 -4.92 113.62 117.36 1c7i n SER 350 Ca 0.07 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.62 1c7i n SER 350 Cb 0.04 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.04 1c7i n SER 350 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1c7i h LEU 351 N 0.00 0.93 0.16 1.04 5.85 -1.94 -2.03 115.31 119.32 1c7i h LEU 351 Ca 0.00 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1c7i h LEU 351 Cb 0.00 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 1c7i h LEU 351 CO 0.00 0.80 -0.42 -0.08 -0.34 0.00 0.00 178.44 178.41 1c7i h GLU 352 N 0.99 -0.66 -1.00 1.25 4.81 -1.94 -0.77 114.58 117.27 1c7i h GLU 352 Ca 0.24 0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.54 1c7i h GLU 352 Cb 0.12 0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.60 1c7i h GLU 352 CO -0.03 -0.44 0.66 0.77 -0.73 0.00 0.00 179.01 179.24 1c7i h SER 353 N -0.68 1.12 -0.07 1.04 0.02 -1.78 0.14 113.55 113.34 1c7i h SER 353 Ca 0.01 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.97 1c7i h SER 353 Cb 0.69 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.93 1c7i h SER 353 CO -0.22 0.79 -0.13 -0.61 -1.14 0.00 0.00 176.83 175.53 1c7i h GLN 354 N 1.31 -0.17 -0.49 3.45 4.15 -0.87 0.28 115.11 122.76 1c7i h GLN 354 Ca 0.38 0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.78 1c7i h GLN 354 Cb -0.08 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 1c7i h GLN 354 CO -0.10 -0.12 0.16 0.82 -1.93 0.00 0.00 178.83 177.66 1c7i h ILE 355 N -0.18 1.22 0.00 2.39 2.04 -0.69 -2.37 117.51 119.93 1c7i h ILE 355 Ca 0.07 -0.74 -0.03 0.00 1.00 0.00 0.00 64.86 65.15 1c7i h ILE 355 Cb 0.28 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1c7i h ILE 355 CO -0.18 0.27 -0.15 0.45 0.00 0.00 0.00 178.15 178.54 1c7i h HIS 356 N 0.66 0.00 -0.20 1.37 3.86 -0.55 -1.47 115.15 118.82 1c7i h HIS 356 Ca 0.16 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.23 1c7i h HIS 356 Cb 0.26 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 1c7i h HIS 356 CO 0.01 0.15 -0.46 0.52 0.86 0.00 0.00 177.93 179.01 1c7i h MET 357 N 0.00 0.51 0.49 2.45 2.86 0.05 0.16 114.93 121.45 1c7i h MET 357 Ca -0.00 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.33 1c7i h MET 357 Cb 0.39 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1c7i h MET 357 CO 0.02 0.87 -0.24 0.28 1.06 0.00 0.00 176.91 178.90 1c7i h VAL 358 N 0.41 0.35 -0.38 -2.22 2.07 -0.96 -0.58 116.25 114.94 1c7i h VAL 358 Ca 0.03 -0.46 0.05 0.00 0.82 0.00 0.00 66.70 67.14 1c7i h VAL 358 Cb 0.97 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1c7i h VAL 358 CO 0.09 0.06 0.12 0.74 0.02 0.00 0.00 177.57 178.59 1c7i h THR 359 N -0.99 0.86 -0.05 2.57 2.02 -1.39 -0.24 112.91 115.70 1c7i h THR 359 Ca -0.07 -0.09 -0.15 0.00 0.77 0.00 0.00 66.41 66.87 1c7i h THR 359 Cb 0.60 0.58 0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1c7i h THR 359 CO 0.11 0.05 -0.56 0.44 0.37 0.00 0.00 175.52 175.93 1c7i h ASP 360 N 0.26 0.57 0.07 4.18 3.32 -1.02 0.13 116.42 123.93 1c7i h ASP 360 Ca 0.18 -0.70 -0.22 0.00 0.02 0.00 0.00 57.03 56.30 1c7i h ASP 360 Cb 0.17 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1c7i h ASP 360 CO -0.19 1.19 -2.16 0.18 -1.72 0.00 0.00 179.24 176.54 1c7i n LEU 361 N -4.22 0.08 0.07 1.55 4.77 -0.23 -0.67 117.00 118.36 1c7i n LEU 361 Ca -0.09 0.04 0.10 0.00 -0.03 0.00 0.00 56.01 56.02 1c7i n LEU 361 Cb 0.64 0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 41.97 1c7i n LEU 361 CO 0.46 0.29 -0.18 0.18 -1.33 0.00 0.00 177.39 176.82 1c7i n LEU 362 N -2.59 0.68 0.08 2.23 4.32 -0.11 -4.53 117.00 117.06 1c7i n LEU 362 Ca -0.21 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 1c7i n LEU 362 Cb 0.92 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.70 1c7i n LEU 362 CO 0.44 -0.11 -0.05 0.49 -1.22 0.00 0.00 177.39 176.94 1c7i n PHE 363 N -2.62 -1.01 0.08 -1.77 3.01 -1.12 -4.81 117.46 109.22 1c7i n PHE 363 Ca -0.02 0.18 -0.13 0.00 1.01 0.00 0.00 57.45 58.49 1c7i n PHE 363 Cb 0.59 0.28 -0.08 0.00 -0.01 0.00 0.00 39.48 40.26 1c7i n PHE 363 CO 0.00 0.00 0.00 2.35 1.01 0.00 0.00 176.76 180.12 1c7i h TRP 364 N 0.00 -0.14 -0.57 1.38 7.01 -0.82 -1.69 115.95 121.12 1c7i h TRP 364 Ca 0.00 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.98 1c7i h TRP 364 Cb 0.10 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.19 1c7i h TRP 364 CO 0.00 0.05 0.30 -0.09 -2.79 0.00 0.00 178.44 175.90 1c7i h ARG 365 N -0.32 0.80 -0.44 2.65 2.43 -1.13 -1.25 114.38 117.14 1c7i h ARG 365 Ca -0.02 -0.10 -0.06 0.00 -0.81 0.00 0.00 59.98 58.99 1c7i h ARG 365 Cb 0.26 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1c7i h ARG 365 CO 0.03 0.63 0.01 -1.35 -1.51 0.00 0.00 179.97 177.78 1c7i h PRO 366 N 0.77 0.70 -0.12 0.20 0.11 -1.79 -1.19 132.00 130.68 1c7i h PRO 366 Ca 0.20 -0.17 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1c7i h PRO 366 Cb 0.08 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1c7i h PRO 366 CO -0.03 0.71 0.03 0.00 -0.21 0.00 0.00 178.00 178.51 1c7i h ALA 367 N 1.35 0.16 -0.56 -0.75 0.00 -0.89 -0.29 119.26 118.29 1c7i h ALA 367 Ca 0.14 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1c7i h ALA 367 Cb 0.40 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1c7i h ALA 367 CO 0.01 -0.22 0.05 0.28 0.00 0.00 0.00 179.25 179.38 1c7i h VAL 368 N 0.01 1.25 -0.67 0.00 2.07 -1.15 0.24 116.25 118.00 1c7i h VAL 368 Ca 0.04 -1.00 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 1c7i h VAL 368 Cb 0.24 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1c7i h VAL 368 CO -0.00 0.36 0.12 0.00 0.02 0.00 0.00 177.57 178.07 1c7i h ALA 369 N 1.19 0.94 -0.08 1.67 0.00 -1.06 0.24 119.26 122.16 1c7i h ALA 369 Ca 0.17 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 1c7i h ALA 369 Cb 0.43 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1c7i h ALA 369 CO 0.02 0.66 -0.35 0.35 0.00 0.00 0.00 179.25 179.93 1c7i h PHE 370 N 1.03 0.51 -0.45 0.00 3.57 -0.69 -2.41 116.94 118.50 1c7i h PHE 370 Ca 0.21 -0.22 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 1c7i h PHE 370 Cb 0.42 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1c7i h PHE 370 CO 0.03 0.96 0.26 0.00 -2.23 0.00 0.00 178.31 177.33 1c7i h ALA 371 N 0.45 0.57 -0.37 2.41 0.00 -0.90 -1.18 119.26 120.24 1c7i h ALA 371 Ca -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1c7i h ALA 371 Cb 0.99 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1c7i h ALA 371 CO 0.07 0.07 0.23 0.77 0.00 0.00 0.00 179.25 180.40 1c7i h SER 372 N 0.59 0.39 -0.31 0.00 0.02 -0.99 -1.01 113.55 112.24 1c7i h SER 372 Ca 0.16 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1c7i h SER 372 Cb 0.02 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1c7i h SER 372 CO -0.03 0.28 0.11 0.00 -1.14 0.00 0.00 176.83 176.05 1c7i h ALA 373 N 1.15 0.40 0.00 3.77 0.00 -1.25 -2.93 119.26 120.41 1c7i h ALA 373 Ca 0.14 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1c7i h ALA 373 Cb -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1c7i h ALA 373 CO -0.05 0.02 -0.22 0.37 0.00 0.00 0.00 179.25 179.37 1c7i h GLN 374 N 0.34 0.00 0.00 0.00 5.75 -1.03 -3.08 115.11 117.09 1c7i h GLN 374 Ca 0.10 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 1c7i h GLN 374 Cb 0.22 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.77 1c7i h GLN 374 CO -0.01 0.22 0.00 -1.13 -2.65 0.00 0.00 178.83 175.27 1c7i n SER 375 N -3.57 0.22 -0.79 -0.69 3.41 -0.40 -1.12 113.62 110.69 1c7i n SER 375 Ca -0.01 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.32 1c7i n SER 375 Cb 0.37 -0.63 0.28 0.00 -0.26 0.00 0.00 64.21 63.97 1c7i n SER 375 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1c7i n HIS 376 N -1.79 0.07 -0.18 7.33 8.25 -1.16 -4.38 115.22 123.36 1c7i n HIS 376 Ca -0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1c7i n HIS 376 Cb 0.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.14 1c7i n HIS 376 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1c7i n TYR 377 N 0.88 0.00 -3.77 4.41 4.02 -0.27 -5.08 117.16 117.35 1c7i n TYR 377 Ca 0.16 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 58.01 1c7i n TYR 377 Cb 0.50 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.80 1c7i n TYR 377 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1c7i s ALA 378 N -0.13 -1.53 0.26 -0.72 0.00 -0.70 -0.95 121.76 117.99 1c7i s ALA 378 Ca 0.00 0.03 -0.29 0.00 0.00 0.00 0.00 51.96 51.69 1c7i s ALA 378 Cb 0.00 0.70 -0.09 0.00 0.00 0.00 0.00 23.12 23.73 1c7i s ALA 378 CO 0.00 -1.03 1.20 -2.14 0.00 0.00 0.00 175.76 173.80 1c7i s PRO 379 N -3.48 4.50 -0.02 0.00 0.02 -1.26 -4.34 135.00 130.41 1c7i s PRO 379 Ca 0.11 1.96 0.04 0.00 0.02 0.00 0.00 61.00 63.13 1c7i s PRO 379 Cb -0.03 -3.17 -0.01 0.00 0.02 0.00 0.00 34.50 31.32 1c7i s PRO 379 CO 0.03 -0.02 -0.14 0.08 -0.33 0.00 0.00 177.00 176.62 1c7i s VAL 380 N -0.73 1.13 -0.08 3.83 1.01 -1.26 -1.38 120.40 122.91 1c7i s VAL 380 Ca 0.49 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1c7i s VAL 380 Cb -0.35 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.09 1c7i s VAL 380 CO 0.43 0.33 -0.10 0.26 0.00 0.00 0.00 175.10 176.01 1c7i s TRP 381 N -0.10 1.46 0.11 5.22 0.52 0.33 -0.32 118.94 126.16 1c7i s TRP 381 Ca 0.01 -0.62 0.10 0.00 0.02 0.00 0.00 56.10 55.61 1c7i s TRP 381 Cb -0.08 -1.13 -0.04 0.00 -1.15 0.00 0.00 33.47 31.08 1c7i s TRP 381 CO 0.00 -0.37 -0.26 1.41 0.02 0.00 0.00 176.95 177.76 1c7i s MET 382 N 1.07 1.45 0.16 4.98 1.75 -1.26 -0.81 119.30 126.64 1c7i s MET 382 Ca -0.07 -1.27 -0.02 0.00 -1.25 0.00 0.00 55.69 53.08 1c7i s MET 382 Cb -0.15 -1.84 -0.04 0.00 2.84 0.00 0.00 34.83 35.65 1c7i s MET 382 CO -0.01 0.45 0.11 1.52 -0.65 0.00 0.00 175.02 176.44 1c7i s TYR 383 N -1.01 0.91 -0.03 4.11 -0.85 -0.86 -1.53 117.35 118.08 1c7i s TYR 383 Ca 0.12 -1.23 -0.00 0.00 -0.52 0.00 0.00 57.07 55.44 1c7i s TYR 383 Cb -0.10 -0.45 0.03 0.00 0.38 0.00 0.00 41.96 41.82 1c7i s TYR 383 CO 0.05 -0.59 0.02 0.50 -1.52 0.00 0.00 175.55 174.01 1c7i s ARG 384 N -4.08 0.16 -0.39 -3.49 3.52 -0.26 -3.05 118.95 111.36 1c7i s ARG 384 Ca 0.29 0.17 -0.19 0.00 -0.13 0.00 0.00 55.73 55.86 1c7i s ARG 384 Cb 0.07 -0.48 0.01 0.00 -1.56 0.00 0.00 34.95 32.99 1c7i s ARG 384 CO 0.05 -0.20 0.57 0.12 -0.81 0.00 0.00 175.30 175.03 1c7i s PHE 385 N 1.37 3.13 -0.36 5.12 5.36 -0.08 -1.22 117.98 131.31 1c7i s PHE 385 Ca -0.05 0.06 0.19 0.00 -0.96 0.00 0.00 56.93 56.17 1c7i s PHE 385 Cb -0.13 -3.11 -0.26 0.00 -0.34 0.00 0.00 43.02 39.17 1c7i s PHE 385 CO -0.03 -0.69 0.57 -0.25 -1.46 0.00 0.00 175.22 173.36 1c7i n ASP 386 N 5.97 0.69 -4.68 6.13 9.92 -0.51 -0.83 116.55 133.24 1c7i n ASP 386 Ca -0.03 -0.37 -0.41 0.00 -0.53 0.00 0.00 54.79 53.45 1c7i n ASP 386 Cb 0.48 1.54 0.01 0.00 -0.64 0.00 0.00 41.12 42.52 1c7i n ASP 386 CO 0.00 0.00 0.00 1.87 0.13 0.00 0.00 177.20 179.20 1c7i n TRP 387 N -1.89 1.86 -3.61 1.24 -0.00 -1.22 -4.49 117.44 109.34 1c7i n TRP 387 Ca -0.01 0.51 -0.06 0.00 -0.00 0.00 0.00 57.50 57.95 1c7i n TRP 387 Cb 0.42 -2.33 -0.04 0.00 -0.00 0.00 0.00 31.31 29.36 1c7i n TRP 387 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 1c7i s HIS 388 N -1.23 -0.18 0.61 5.87 -3.43 -1.26 -4.17 115.29 111.51 1c7i s HIS 388 Ca 0.62 0.27 -0.19 0.00 -0.80 0.00 0.00 55.06 54.97 1c7i s HIS 388 Cb -0.52 0.48 -0.03 0.00 -1.43 0.00 0.00 32.58 31.08 1c7i s HIS 388 CO 0.57 -0.18 1.16 -2.30 -2.00 0.00 0.00 174.74 171.99 1c7i n PRO 389 N 0.49 1.11 0.02 -0.38 -0.02 -1.24 -4.89 135.00 130.08 1c7i n PRO 389 Ca -0.04 0.43 -0.19 0.00 -2.02 0.00 0.00 63.50 61.68 1c7i n PRO 389 Cb 0.58 -2.38 -0.12 0.00 -0.02 0.00 0.00 33.50 31.57 1c7i n PRO 389 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1c7i h GLU 390 N 0.65 0.45 -6.82 -0.52 4.81 -1.95 -3.33 114.58 107.87 1c7i h GLU 390 Ca -0.50 -0.53 -0.48 0.00 -0.13 0.00 0.00 59.36 57.73 1c7i h GLU 390 Cb 1.35 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.86 1c7i h GLU 390 CO 0.53 1.18 0.25 0.21 -0.73 0.00 0.00 179.01 180.45 1c7i s LYS 391 N -3.10 4.34 1.15 1.92 2.36 -1.26 -4.73 119.74 120.42 1c7i s LYS 391 Ca -0.12 1.08 -0.13 0.00 -2.55 0.00 0.00 55.97 54.25 1c7i s LYS 391 Cb 0.04 -2.63 0.28 0.00 -1.05 0.00 0.00 37.83 34.46 1c7i s LYS 391 CO 0.85 0.22 1.04 -2.14 1.55 0.00 0.00 175.35 176.86 1c7i s PRO 392 N -2.41 -0.81 0.00 4.03 0.02 -1.26 -3.90 135.00 130.67 1c7i s PRO 392 Ca 0.52 0.91 0.27 0.00 0.02 0.00 0.00 61.00 62.71 1c7i s PRO 392 Cb -0.15 -1.56 0.86 0.00 0.02 0.00 0.00 34.50 33.67 1c7i s PRO 392 CO 0.20 -3.67 1.64 -0.35 -0.33 0.00 0.00 177.00 174.49 1c7i n PRO 393 N -4.89 1.81 -1.21 5.54 -0.04 -1.26 -4.83 135.00 130.12 1c7i n PRO 393 Ca 0.04 -1.18 -0.24 0.00 -0.04 0.00 0.00 63.50 62.08 1c7i n PRO 393 Cb 0.54 -1.47 0.17 0.00 -0.04 0.00 0.00 33.50 32.70 1c7i n PRO 393 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1c7i n TYR 394 N 0.43 3.03 -1.89 0.54 4.02 -1.26 -4.78 117.16 117.25 1c7i n TYR 394 Ca 0.18 -1.88 -0.39 0.00 -0.01 0.00 0.00 57.90 55.79 1c7i n TYR 394 Cb 0.40 -0.96 -0.01 0.00 -0.02 0.00 0.00 39.34 38.75 1c7i n TYR 394 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1c7i n ASN 395 N -1.11 8.10 -3.73 7.72 6.94 -1.25 -3.71 115.26 128.21 1c7i n ASN 395 Ca 0.59 -3.07 -0.13 0.00 -0.02 0.00 0.00 54.58 51.95 1c7i n ASN 395 Cb 1.61 -1.38 -0.10 0.00 -2.36 0.00 0.00 39.78 37.55 1c7i n ASN 395 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1c7i s LYS 396 N -0.77 0.46 -1.32 -3.83 -0.14 -1.26 -4.95 119.74 107.92 1c7i s LYS 396 Ca 0.56 0.59 -0.16 0.00 -1.36 0.00 0.00 55.97 55.60 1c7i s LYS 396 Cb 0.19 0.19 0.08 0.00 -1.68 0.00 0.00 37.83 36.62 1c7i s LYS 396 CO -0.09 -0.07 1.81 0.00 -0.76 0.00 0.00 175.35 176.24 1c7i n ALA 397 N 3.06 4.12 -2.23 5.17 0.00 -1.26 -4.77 120.51 124.60 1c7i n ALA 397 Ca -0.15 -3.94 -0.27 0.00 0.00 0.00 0.00 53.44 49.09 1c7i n ALA 397 Cb 0.57 -3.49 0.01 0.00 0.00 0.00 0.00 19.45 16.54 1c7i n ALA 397 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1c7i s PHE 398 N 3.44 3.43 0.09 0.00 -0.12 -1.25 -0.15 117.98 123.41 1c7i s PHE 398 Ca 0.50 0.68 -0.36 0.00 -0.05 0.00 0.00 56.93 57.70 1c7i s PHE 398 Cb 0.06 -2.42 -0.17 0.00 -0.63 0.00 0.00 43.02 39.85 1c7i s PHE 398 CO 0.03 -0.44 1.22 1.58 -0.05 0.00 0.00 175.22 177.57 1c7i n HIS 399 N -2.32 1.24 0.00 3.49 -0.00 -1.03 -1.49 115.22 115.10 1c7i n HIS 399 Ca 0.02 0.74 0.00 0.00 -0.00 0.00 0.00 57.72 58.47 1c7i n HIS 399 Cb 0.56 -2.26 0.00 0.00 -0.00 0.00 0.00 29.99 28.29 1c7i n HIS 399 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 1c7i n THR 400 N 2.02 0.00 0.23 3.57 -1.04 -1.26 -4.87 114.28 112.94 1c7i n THR 400 Ca 0.18 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.33 1c7i n THR 400 Cb 0.18 0.00 0.79 0.00 -1.82 0.00 0.00 70.33 69.48 1c7i n THR 400 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1c7i h LEU 401 N 0.00 0.00 -0.05 -4.42 5.85 -1.65 -2.08 115.31 112.96 1c7i h LEU 401 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1c7i h LEU 401 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1c7i h LEU 401 CO 0.00 0.00 0.00 1.05 -0.34 0.00 0.00 178.44 179.15 1c7i h GLU 402 N 0.00 0.00 -0.52 1.25 9.09 -1.92 -3.36 114.58 119.12 1c7i h GLU 402 Ca 0.05 0.00 0.09 0.00 0.05 0.00 0.00 59.36 59.54 1c7i h GLU 402 Cb 0.22 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 27.25 1c7i h GLU 402 CO -0.00 0.00 0.12 -0.07 0.05 0.00 0.00 179.01 179.11 1c7i h LEU 403 N 0.00 0.03 -1.56 3.06 3.38 -1.79 -1.56 115.31 116.87 1c7i h LEU 403 Ca 0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1c7i h LEU 403 Cb 0.73 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1c7i h LEU 403 CO 0.00 0.04 0.29 -0.65 0.09 0.00 0.00 178.44 178.22 1c7i h PRO 404 N 0.26 0.59 -0.31 1.13 0.11 -1.79 -2.06 132.00 129.93 1c7i h PRO 404 Ca 0.26 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.24 1c7i h PRO 404 Cb 0.35 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1c7i h PRO 404 CO -0.33 0.39 -0.17 0.74 -0.21 0.00 0.00 178.00 178.42 1c7i h PHE 405 N 0.60 0.77 0.10 0.65 -1.00 -1.56 0.14 116.94 116.64 1c7i h PHE 405 Ca 0.16 -0.20 -0.00 0.00 2.81 0.00 0.00 57.97 60.74 1c7i h PHE 405 Cb -0.07 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.31 1c7i h PHE 405 CO 0.00 0.90 -0.06 0.28 -1.61 0.00 0.00 178.31 177.82 1c7i h VAL 406 N 0.42 0.88 0.00 -0.55 2.07 -0.89 -2.98 116.25 115.20 1c7i h VAL 406 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1c7i h VAL 406 Cb 0.70 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1c7i h VAL 406 CO 0.05 0.00 -0.10 0.49 0.02 0.00 0.00 177.57 178.03 1c7i n PHE 407 N -5.16 0.61 -1.03 1.57 3.01 -0.82 -4.60 117.46 111.04 1c7i n PHE 407 Ca -0.08 0.18 -0.01 0.00 1.01 0.00 0.00 57.45 58.55 1c7i n PHE 407 Cb 0.09 -0.76 -0.00 0.00 -0.01 0.00 0.00 39.48 38.79 1c7i n PHE 407 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1c7i n GLY 408 N 1.37 0.45 2.95 1.37 0.00 0.47 -3.95 105.19 107.85 1c7i n GLY 408 Ca 0.06 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1c7i n GLY 408 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c7i n ASN 409 N -0.04 5.88 0.11 1.61 3.02 -1.02 -4.83 115.26 119.99 1c7i n ASN 409 Ca -0.01 -3.29 0.09 0.00 -0.03 0.00 0.00 54.58 51.34 1c7i n ASN 409 Cb 0.15 -1.36 0.42 0.00 -0.61 0.00 0.00 39.78 38.38 1c7i n ASN 409 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1c7i n LEU 410 N 2.37 0.42 0.26 3.41 4.77 -1.26 -2.00 117.00 124.96 1c7i n LEU 410 Ca 0.32 0.66 0.13 0.00 -0.03 0.00 0.00 56.01 57.09 1c7i n LEU 410 Cb 0.34 -0.68 0.67 0.00 -2.33 0.00 0.00 43.42 41.42 1c7i n LEU 410 CO 0.76 -0.71 0.93 0.44 -1.33 0.00 0.00 177.39 177.49 1c7i h ASP 411 N 0.00 0.00 0.68 -1.43 3.32 -1.95 -2.17 116.42 114.87 1c7i h ASP 411 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1c7i h ASP 411 Cb 0.10 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1c7i h ASP 411 CO 0.00 0.13 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.25 1c7i h GLU 412 N 0.00 0.00 0.00 3.56 4.39 -1.82 -2.64 114.58 118.08 1c7i h GLU 412 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1c7i h GLU 412 Cb 0.48 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1c7i h GLU 412 CO 0.02 0.07 0.00 -0.07 -1.16 0.00 0.00 179.01 177.87 1c7i h LEU 413 N 0.00 0.00 -0.02 1.33 3.38 -1.60 -1.99 115.31 116.41 1c7i h LEU 413 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1c7i h LEU 413 Cb 0.43 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 1c7i h LEU 413 CO 0.01 0.00 -0.02 -0.33 0.09 0.00 0.00 178.44 178.19 1c7i h GLU 414 N 0.00 0.05 0.01 1.13 5.08 -1.62 -1.65 114.58 117.58 1c7i h GLU 414 Ca 0.00 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 58.14 1c7i h GLU 414 Cb 0.18 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1c7i h GLU 414 CO 0.00 0.53 -0.88 0.07 -1.00 0.00 0.00 179.01 177.73 1c7i h ARG 415 N -0.42 0.11 0.01 2.33 0.11 -1.65 -0.77 114.38 114.10 1c7i h ARG 415 Ca 0.00 -0.13 -0.27 0.00 0.10 0.00 0.00 59.98 59.69 1c7i h ARG 415 Cb 0.52 0.04 0.02 0.00 1.11 0.00 0.00 29.97 31.66 1c7i h ARG 415 CO 0.01 0.92 -1.06 0.52 0.10 0.00 0.00 179.97 180.45 1c7i h MET 416 N 0.06 0.67 0.00 0.08 2.86 -1.43 -3.41 114.93 113.76 1c7i h MET 416 Ca -0.03 -0.74 -0.03 0.00 -2.06 0.00 0.00 59.70 56.84 1c7i h MET 416 Cb 1.52 0.21 -0.05 0.00 0.06 0.00 0.00 31.60 33.34 1c7i h MET 416 CO 0.13 1.32 -0.36 0.00 1.06 0.00 0.00 176.91 179.05 1c7i n ALA 417 N -2.64 2.18 -4.48 6.32 0.00 -0.69 -5.01 120.51 116.19 1c7i n ALA 417 Ca -0.11 -0.75 -0.40 0.00 0.00 0.00 0.00 53.44 52.18 1c7i n ALA 417 Cb 0.89 -0.33 -0.08 0.00 0.00 0.00 0.00 19.45 19.93 1c7i n ALA 417 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1c7i n LYS 418 N 0.05 -0.84 -4.07 0.00 5.02 -0.30 -4.86 118.16 113.16 1c7i n LYS 418 Ca -0.02 0.13 -0.35 0.00 -2.02 0.00 0.00 58.31 56.05 1c7i n LYS 418 Cb 0.67 -4.43 -0.09 0.00 -0.02 0.00 0.00 35.03 31.17 1c7i n LYS 418 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1c7i s ALA 419 N -3.56 3.51 0.49 7.82 0.00 -0.92 -4.95 121.76 124.15 1c7i s ALA 419 Ca 0.61 -0.73 -0.16 0.00 0.00 0.00 0.00 51.96 51.68 1c7i s ALA 419 Cb -0.36 -1.81 -0.08 0.00 0.00 0.00 0.00 23.12 20.88 1c7i s ALA 419 CO 1.02 0.43 0.95 -1.21 0.00 0.00 0.00 175.76 176.94 1c7i s GLU 420 N -0.41 3.96 -1.06 0.00 2.02 -1.26 -4.12 118.70 117.83 1c7i s GLU 420 Ca 0.10 0.90 -0.21 0.00 0.02 0.00 0.00 54.97 55.77 1c7i s GLU 420 Cb -0.12 -2.18 0.07 0.00 0.10 0.00 0.00 34.13 32.00 1c7i s GLU 420 CO 0.02 -0.21 1.45 0.42 0.02 0.00 0.00 175.26 176.96 1c7i s ILE 421 N -2.53 4.13 0.68 -1.63 1.01 -1.26 -4.88 121.20 116.72 1c7i s ILE 421 Ca 0.58 -1.17 -0.04 0.00 0.00 0.00 0.00 60.65 60.01 1c7i s ILE 421 Cb -0.10 -5.03 0.07 0.00 0.01 0.00 0.00 42.46 37.41 1c7i s ILE 421 CO 0.29 -1.87 0.96 0.42 0.00 0.00 0.00 174.94 174.74 1c7i s THR 422 N 4.34 2.35 0.38 2.92 -4.23 -1.26 -4.88 115.64 115.26 1c7i s THR 422 Ca 0.45 -0.40 0.25 0.00 -1.18 0.00 0.00 61.69 60.81 1c7i s THR 422 Cb -0.00 -2.95 0.26 0.00 1.34 0.00 0.00 72.50 71.15 1c7i s THR 422 CO -0.06 0.00 2.02 0.44 -0.54 0.00 0.00 174.62 176.47 1c7i h ASP 423 N -0.47 0.00 -0.17 3.99 3.32 -1.98 -0.73 116.42 120.39 1c7i h ASP 423 Ca -0.43 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.60 1c7i h ASP 423 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.85 1c7i h ASP 423 CO 0.55 0.16 0.02 -0.08 -1.72 0.00 0.00 179.24 178.17 1c7i h GLU 424 N 0.00 0.28 -0.15 3.56 4.81 -1.97 -0.06 114.58 121.05 1c7i h GLU 424 Ca -0.00 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1c7i h GLU 424 Cb 0.41 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1c7i h GLU 424 CO 0.02 0.47 0.05 0.28 -0.73 0.00 0.00 179.01 179.10 1c7i h VAL 425 N 0.05 1.18 -0.20 0.32 2.07 -1.67 -1.66 116.25 116.35 1c7i h VAL 425 Ca 0.05 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 1c7i h VAL 425 Cb 0.33 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1c7i h VAL 425 CO 0.00 0.17 0.03 0.11 0.02 0.00 0.00 177.57 177.90 1c7i h LYS 426 N 0.07 0.28 -0.20 1.57 1.57 -1.11 -1.43 116.57 117.31 1c7i h LYS 426 Ca 0.05 -0.04 -0.21 0.00 -1.87 0.00 0.00 60.65 58.59 1c7i h LYS 426 Cb 0.21 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.48 1c7i h LYS 426 CO -0.00 0.28 -0.68 0.37 -0.57 0.00 0.00 179.45 178.85 1c7i h GLN 427 N 0.28 0.82 -0.57 3.15 5.75 -0.75 -1.82 115.11 121.98 1c7i h GLN 427 Ca 0.07 -0.61 -0.10 0.00 -0.15 0.00 0.00 58.65 57.86 1c7i h GLN 427 Cb 0.14 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1c7i h GLN 427 CO -0.00 1.23 -0.03 1.25 -2.65 0.00 0.00 178.83 178.62 1c7i h LEU 428 N 0.57 1.02 -0.67 -2.39 5.85 -0.90 -1.70 115.31 117.09 1c7i h LEU 428 Ca -0.03 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1c7i h LEU 428 Cb 1.30 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 1c7i h LEU 428 CO 0.14 1.09 0.29 -1.28 -0.34 0.00 0.00 178.44 178.35 1c7i h SER 429 N 0.92 0.90 -0.48 1.25 0.87 -1.25 -0.85 113.55 114.91 1c7i h SER 429 Ca 0.16 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1c7i h SER 429 Cb 0.59 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 1c7i h SER 429 CO 0.04 0.80 0.26 -0.74 -0.53 0.00 0.00 176.83 176.66 1c7i h HIS 430 N 0.93 0.66 -0.66 2.24 -0.00 -1.10 0.47 115.15 117.69 1c7i h HIS 430 Ca 0.22 -0.02 -0.08 0.00 -0.00 0.00 0.00 60.37 60.50 1c7i h HIS 430 Cb 0.17 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.34 1c7i h HIS 430 CO 0.01 0.49 0.09 1.15 -0.00 0.00 0.00 177.93 179.67 1c7i h THR 431 N 0.63 1.26 -0.10 6.26 2.02 -1.03 -0.87 112.91 121.09 1c7i h THR 431 Ca 0.17 -1.05 -0.04 0.00 0.77 0.00 0.00 66.41 66.26 1c7i h THR 431 Cb 0.05 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1c7i h THR 431 CO -0.03 0.39 -0.09 0.40 0.37 0.00 0.00 175.52 176.57 1c7i h ILE 432 N 1.02 1.36 -0.71 3.11 2.04 -0.90 -1.90 117.51 121.52 1c7i h ILE 432 Ca 0.20 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.81 1c7i h ILE 432 Cb 0.46 1.95 -0.03 0.00 -0.74 0.00 0.00 36.82 38.46 1c7i h ILE 432 CO 0.02 0.35 0.36 1.56 0.00 0.00 0.00 178.15 180.43 1c7i h GLN 433 N -0.17 0.99 -0.65 2.37 4.20 -0.89 -0.31 115.11 120.66 1c7i h GLN 433 Ca 0.02 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 1c7i h GLN 433 Cb 0.60 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 1c7i h GLN 433 CO 0.02 0.75 0.23 1.03 -0.67 0.00 0.00 178.83 180.19 1c7i h SER 434 N 1.00 0.92 -0.23 1.46 0.87 -1.12 -1.27 113.55 115.18 1c7i h SER 434 Ca 0.25 -0.19 -0.20 0.00 -1.23 0.00 0.00 61.79 60.42 1c7i h SER 434 Cb 0.07 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.79 1c7i h SER 434 CO -0.04 0.87 -0.63 0.00 -0.53 0.00 0.00 176.83 176.50 1c7i h ALA 435 N 1.09 0.42 -0.50 6.23 0.00 -0.79 -1.51 119.26 124.20 1c7i h ALA 435 Ca 0.21 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1c7i h ALA 435 Cb 0.26 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1c7i h ALA 435 CO -0.01 0.68 0.11 -1.49 0.00 0.00 0.00 179.25 178.54 1c7i h TRP 436 N 0.63 0.85 0.00 0.00 -0.00 -0.96 -0.60 115.95 115.87 1c7i h TRP 436 Ca -0.01 -0.11 -0.18 0.00 -0.00 0.00 0.00 58.89 58.59 1c7i h TRP 436 Cb 1.25 -0.24 -0.02 0.00 -0.00 0.00 0.00 29.16 30.15 1c7i h TRP 436 CO 0.08 0.76 -0.84 1.79 -0.00 0.00 0.00 178.44 180.23 1c7i h THR 437 N 0.69 1.55 -0.14 1.49 1.35 -1.27 -1.85 112.91 114.73 1c7i h THR 437 Ca 0.16 -2.73 -0.16 0.00 -0.55 0.00 0.00 66.41 63.13 1c7i h THR 437 Cb 0.35 2.49 -0.01 0.00 -1.73 0.00 0.00 68.15 69.25 1c7i h THR 437 CO 0.00 0.78 -0.59 0.74 -0.25 0.00 0.00 175.52 176.21 1c7i h THR 438 N 0.04 1.34 -0.30 6.82 2.02 -1.18 -1.76 112.91 119.89 1c7i h THR 438 Ca -0.02 -1.88 -0.03 0.00 0.77 0.00 0.00 66.41 65.25 1c7i h THR 438 Cb 1.47 1.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.74 1c7i h THR 438 CO 0.12 0.57 0.07 0.15 0.37 0.00 0.00 175.52 176.80 1c7i h PHE 439 N 0.35 0.51 -0.08 3.16 3.57 -1.02 0.18 116.94 123.61 1c7i h PHE 439 Ca -0.00 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 1c7i h PHE 439 Cb 1.12 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 1c7i h PHE 439 CO 0.04 0.55 -0.01 0.00 -2.23 0.00 0.00 178.31 176.66 1c7i h ALA 440 N 0.90 1.85 0.15 2.41 0.00 -1.17 0.76 119.26 124.16 1c7i h ALA 440 Ca 0.09 -0.06 -0.31 0.00 0.00 0.00 0.00 54.91 54.64 1c7i h ALA 440 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1c7i h ALA 440 CO 0.00 0.12 -1.50 0.87 0.00 0.00 0.00 179.25 178.74 1c7i h LYS 441 N 0.11 0.32 0.00 0.00 1.57 -0.85 -3.43 116.57 114.29 1c7i h LYS 441 Ca 0.03 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1c7i h LYS 441 Cb 0.09 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1c7i h LYS 441 CO 0.00 1.21 -0.36 0.25 -0.57 0.00 0.00 179.45 179.99 1c7i n THR 442 N -3.53 0.00 -0.70 -0.16 -2.24 0.58 -5.01 114.28 103.22 1c7i n THR 442 Ca -0.16 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1c7i n THR 442 Cb 1.05 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 70.00 1c7i n THR 442 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c7i n GLY 443 N 1.31 0.65 2.72 3.38 0.00 0.26 -5.02 105.19 108.50 1c7i n GLY 443 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 1c7i n GLY 443 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1c7i s ASN 444 N -2.01 0.98 0.00 1.61 3.84 -1.26 -4.90 114.94 113.20 1c7i s ASN 444 Ca 0.00 0.03 0.08 0.00 0.21 0.00 0.00 52.86 53.18 1c7i s ASN 444 Cb 0.00 -0.19 0.33 0.00 -0.55 0.00 0.00 41.25 40.83 1c7i s ASN 444 CO 0.00 -0.20 1.23 -0.81 -2.79 0.00 0.00 177.10 174.53 1c7i n PRO 445 N 4.97 1.27 -2.09 0.43 -0.04 -1.26 -3.35 135.00 134.92 1c7i n PRO 445 Ca -0.10 -0.41 -0.41 0.00 -0.04 0.00 0.00 63.50 62.54 1c7i n PRO 445 Cb 0.50 -1.15 -0.02 0.00 -0.04 0.00 0.00 33.50 32.79 1c7i n PRO 445 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1c7i s SER 446 N -1.15 6.74 0.18 3.54 0.01 -1.26 -4.50 113.70 117.27 1c7i s SER 446 Ca 0.13 2.60 -0.05 0.00 1.31 0.00 0.00 55.95 59.94 1c7i s SER 446 Cb 0.07 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.65 1c7i s SER 446 CO 0.10 -0.62 0.22 0.42 0.41 0.00 0.00 173.24 173.76 1c7i s THR 447 N -0.22 0.04 0.50 1.44 -4.23 0.74 -4.96 115.64 108.94 1c7i s THR 447 Ca 0.56 -1.70 0.32 0.00 -1.18 0.00 0.00 61.69 59.69 1c7i s THR 447 Cb -0.40 -2.15 0.51 0.00 1.34 0.00 0.00 72.50 71.80 1c7i s THR 447 CO 0.44 -0.19 1.78 1.05 -0.54 0.00 0.00 174.62 177.15 1c7i h GLU 448 N 2.59 0.11 0.00 3.99 4.11 -1.99 0.53 114.58 123.92 1c7i h GLU 448 Ca -0.33 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 58.98 1c7i h GLU 448 Cb 1.23 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1c7i h GLU 448 CO 0.50 0.07 -0.53 0.00 0.07 0.00 0.00 179.01 179.12 1c7i h ALA 449 N 1.47 0.81 -2.53 1.06 0.00 -1.96 -3.45 119.26 114.65 1c7i h ALA 449 Ca 0.60 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1c7i h ALA 449 Cb 2.12 -0.09 -0.25 0.00 0.00 0.00 0.00 17.79 19.57 1c7i h ALA 449 CO -0.11 0.67 -0.24 0.08 0.00 0.00 0.00 179.25 179.65 1c7i s VAL 450 N -3.30 -0.02 -0.68 0.00 1.01 0.19 -4.97 120.40 112.63 1c7i s VAL 450 Ca 0.01 0.07 -0.15 0.00 0.00 0.00 0.00 61.98 61.91 1c7i s VAL 450 Cb 0.10 -0.68 0.17 0.00 0.00 0.00 0.00 36.38 35.97 1c7i s VAL 450 CO 0.73 0.03 0.63 0.21 0.00 0.00 0.00 175.10 176.70 1c7i s ASN 451 N 1.36 6.46 -0.18 3.32 2.47 -1.26 -0.19 114.94 126.92 1c7i s ASN 451 Ca -0.09 -2.21 -0.29 0.00 0.42 0.00 0.00 52.86 50.69 1c7i s ASN 451 Cb -0.07 -2.21 -0.02 0.00 -1.45 0.00 0.00 41.25 37.49 1c7i s ASN 451 CO -0.13 -0.73 1.45 0.86 -3.72 0.00 0.00 177.10 174.83 1c7i s TRP 452 N 0.95 2.43 0.33 0.43 -0.11 -1.26 -5.02 118.94 116.69 1c7i s TRP 452 Ca 0.10 0.68 -0.26 0.00 1.22 0.00 0.00 56.10 57.84 1c7i s TRP 452 Cb -0.21 -3.79 -0.10 0.00 -1.50 0.00 0.00 33.47 27.87 1c7i s TRP 452 CO -0.03 -2.50 0.94 -1.25 -4.62 0.00 0.00 176.95 169.50 1c7i s PRO 453 N 4.05 4.57 0.25 5.86 0.04 -1.26 -4.83 135.00 143.68 1c7i s PRO 453 Ca 0.63 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 1c7i s PRO 453 Cb -0.24 -2.77 -0.09 0.00 0.04 0.00 0.00 34.50 31.43 1c7i s PRO 453 CO 0.23 0.27 1.32 0.00 0.04 0.00 0.00 177.00 178.86 1c7i s ALA 454 N -1.64 3.53 -0.20 8.56 0.00 -1.26 -4.70 121.76 126.04 1c7i s ALA 454 Ca 0.51 1.18 -0.20 0.00 0.00 0.00 0.00 51.96 53.45 1c7i s ALA 454 Cb -0.18 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 1c7i s ALA 454 CO 0.23 -0.58 0.57 -0.47 0.00 0.00 0.00 175.76 175.52 1c7i s TYR 455 N -0.34 3.37 0.04 0.00 5.04 0.56 -4.58 117.35 121.43 1c7i s TYR 455 Ca 0.54 0.84 -0.09 0.00 -2.44 0.00 0.00 57.07 55.93 1c7i s TYR 455 Cb -0.38 -2.74 0.00 0.00 0.35 0.00 0.00 41.96 39.19 1c7i s TYR 455 CO 0.43 -0.15 0.18 -3.38 -1.34 0.00 0.00 175.55 171.29 1c7i s HIS 456 N 1.81 0.08 0.59 4.97 -3.43 -1.26 -4.43 115.29 113.62 1c7i s HIS 456 Ca 0.26 -0.32 0.37 0.00 -0.80 0.00 0.00 55.06 54.57 1c7i s HIS 456 Cb -0.16 -0.05 2.01 0.00 -1.43 0.00 0.00 32.58 32.95 1c7i s HIS 456 CO 0.10 -0.42 2.13 0.93 -2.00 0.00 0.00 174.74 175.47 1c7i h GLU 457 N 3.47 0.00 -0.14 -0.38 5.08 -1.94 0.22 114.58 120.89 1c7i h GLU 457 Ca -0.32 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.86 1c7i h GLU 457 Cb 1.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 1c7i h GLU 457 CO 0.49 0.00 -0.64 0.93 -1.00 0.00 0.00 179.01 178.79 1c7i h GLU 458 N 0.00 0.51 0.00 2.33 5.08 -2.00 -3.39 114.58 117.11 1c7i h GLU 458 Ca 0.00 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1c7i h GLU 458 Cb 0.27 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1c7i h GLU 458 CO 0.00 0.99 -0.74 -1.13 -1.00 0.00 0.00 179.01 177.13 1c7i n SER 459 N -3.91 3.69 -3.91 1.42 3.41 -1.03 -5.06 113.62 108.24 1c7i n SER 459 Ca -0.04 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.32 1c7i n SER 459 Cb 0.66 0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 65.14 1c7i n SER 459 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1c7i n ARG 460 N -1.37 -3.62 -2.23 4.33 1.74 0.74 -2.51 116.66 113.74 1c7i n ARG 460 Ca 0.00 0.45 -0.42 0.00 -0.77 0.00 0.00 57.85 57.11 1c7i n ARG 460 Cb 0.19 -4.67 -0.03 0.00 -1.02 0.00 0.00 32.46 26.93 1c7i n ARG 460 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1c7i s GLU 461 N -6.45 4.37 -0.04 5.56 2.02 -1.26 -1.37 118.70 121.53 1c7i s GLU 461 Ca 0.02 2.03 0.03 0.00 0.02 0.00 0.00 54.97 57.07 1c7i s GLU 461 Cb -0.01 -3.23 0.00 0.00 0.10 0.00 0.00 34.13 30.99 1c7i s GLU 461 CO 0.87 -0.31 -0.12 0.99 0.02 0.00 0.00 175.26 176.72 1c7i s THR 462 N 0.53 1.03 -0.05 3.63 2.01 0.41 -4.53 115.64 118.68 1c7i s THR 462 Ca 0.59 -0.48 -0.23 0.00 0.31 0.00 0.00 61.69 61.88 1c7i s THR 462 Cb -0.36 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1c7i s THR 462 CO 0.35 0.32 0.71 -0.69 -0.69 0.00 0.00 174.62 174.61 1c7i s VAL 463 N 0.28 4.99 -0.35 3.82 1.01 -0.58 -0.67 120.40 128.90 1c7i s VAL 463 Ca -0.06 1.46 -0.12 0.00 0.00 0.00 0.00 61.98 63.26 1c7i s VAL 463 Cb -0.11 -4.05 -0.00 0.00 0.00 0.00 0.00 36.38 32.22 1c7i s VAL 463 CO 0.02 0.28 0.22 -0.63 0.00 0.00 0.00 175.10 174.98 1c7i s ILE 464 N 0.61 4.96 -0.19 2.22 -1.09 0.13 -1.10 121.20 126.73 1c7i s ILE 464 Ca 0.37 -0.46 -0.22 0.00 -2.23 0.00 0.00 60.65 58.11 1c7i s ILE 464 Cb -0.18 -3.62 -0.02 0.00 -1.58 0.00 0.00 42.46 37.06 1c7i s ILE 464 CO 0.19 -0.08 0.68 -0.76 -1.23 0.00 0.00 174.94 173.74 1c7i s LEU 465 N 1.65 4.15 0.00 2.97 1.43 -0.35 -2.64 118.68 125.89 1c7i s LEU 465 Ca 0.05 0.92 -0.25 0.00 -1.03 0.00 0.00 54.13 53.83 1c7i s LEU 465 Cb -0.18 -2.98 0.08 0.00 0.03 0.00 0.00 46.19 43.14 1c7i s LEU 465 CO 0.09 -0.31 1.14 -0.67 0.23 0.00 0.00 176.35 176.83 1c7i n ASP 466 N 5.09 -1.50 -0.35 2.29 2.03 -1.26 -1.43 116.55 121.43 1c7i n ASP 466 Ca 0.00 -1.62 0.28 0.00 0.52 0.00 0.00 54.79 53.97 1c7i n ASP 466 Cb 0.49 2.40 0.58 0.00 -0.72 0.00 0.00 41.12 43.87 1c7i n ASP 466 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1c7i h SER 467 N 1.98 0.33 -3.23 1.67 0.02 -1.94 -3.32 113.55 109.05 1c7i h SER 467 Ca -0.25 0.08 -0.65 0.00 -0.84 0.00 0.00 61.79 60.14 1c7i h SER 467 Cb 1.19 0.03 -0.34 0.00 0.14 0.00 0.00 62.40 63.42 1c7i h SER 467 CO 0.34 0.02 -0.86 -1.61 -1.14 0.00 0.00 176.83 173.58 1c7i s GLU 468 N -5.35 2.76 0.12 3.45 0.41 -1.26 -4.93 118.70 113.90 1c7i s GLU 468 Ca -0.08 -0.76 -0.30 0.00 -0.41 0.00 0.00 54.97 53.42 1c7i s GLU 468 Cb 0.26 -2.24 -0.06 0.00 -1.78 0.00 0.00 34.13 30.31 1c7i s GLU 468 CO 0.80 -0.01 0.98 0.42 -0.49 0.00 0.00 175.26 176.96 1c7i s ILE 469 N 0.83 4.42 0.17 -1.63 -1.09 -1.25 -4.84 121.20 117.80 1c7i s ILE 469 Ca -0.08 2.03 -0.02 0.00 -2.23 0.00 0.00 60.65 60.35 1c7i s ILE 469 Cb -0.16 -4.29 -0.04 0.00 -1.58 0.00 0.00 42.46 36.39 1c7i s ILE 469 CO -0.01 0.32 0.12 0.42 -1.23 0.00 0.00 174.94 174.56 1c7i s THR 470 N -0.06 0.05 -0.06 2.92 -4.23 -1.08 -5.00 115.64 108.16 1c7i s THR 470 Ca 0.47 -1.91 0.03 0.00 -1.18 0.00 0.00 61.69 59.11 1c7i s THR 470 Cb -0.24 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.34 1c7i s THR 470 CO 0.30 -0.21 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.39 1c7i s ILE 471 N -4.10 1.40 -0.05 2.99 1.01 -1.26 0.17 121.20 121.37 1c7i s ILE 471 Ca 0.31 -0.66 0.06 0.00 0.00 0.00 0.00 60.65 60.36 1c7i s ILE 471 Cb 0.07 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 1c7i s ILE 471 CO 0.07 0.41 -0.24 -1.61 0.00 0.00 0.00 174.94 173.57 1c7i s GLU 472 N 0.38 2.47 -0.25 2.79 2.02 0.15 -4.95 118.70 121.31 1c7i s GLU 472 Ca -0.12 -0.89 -0.14 0.00 0.02 0.00 0.00 54.97 53.85 1c7i s GLU 472 Cb -0.15 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 31.87 1c7i s GLU 472 CO 0.04 0.44 0.31 -0.80 0.02 0.00 0.00 175.26 175.27 1c7i s ASN 473 N -0.30 6.22 -1.18 -0.19 0.01 -1.26 -0.44 114.94 117.80 1c7i s ASN 473 Ca 0.01 0.25 -0.15 0.00 -0.71 0.00 0.00 52.86 52.25 1c7i s ASN 473 Cb -0.13 -2.18 -0.01 0.00 0.41 0.00 0.00 41.25 39.34 1c7i s ASN 473 CO 0.02 -0.09 0.76 -0.67 -1.51 0.00 0.00 177.10 175.61 1c7i n ASP 474 N 4.92 -4.48 -4.73 -1.22 2.03 -0.47 -4.89 116.55 107.71 1c7i n ASP 474 Ca -0.11 -0.97 -0.40 0.00 0.52 0.00 0.00 54.79 53.83 1c7i n ASP 474 Cb 0.51 -3.59 0.02 0.00 -0.72 0.00 0.00 41.12 37.34 1c7i n ASP 474 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1c7i n PRO 475 N -4.13 2.00 -3.76 -0.67 -0.04 -1.26 -2.94 135.00 124.21 1c7i n PRO 475 Ca -0.14 0.72 -0.24 0.00 -0.04 0.00 0.00 63.50 63.80 1c7i n PRO 475 Cb 0.61 -2.49 0.02 0.00 -0.04 0.00 0.00 33.50 31.60 1c7i n PRO 475 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1c7i n GLU 476 N -0.19 -3.83 -0.13 0.54 1.02 -1.26 -4.85 120.64 111.94 1c7i n GLU 476 Ca 0.07 0.54 -0.05 0.00 -0.02 0.00 0.00 57.16 57.70 1c7i n GLU 476 Cb 0.41 -4.86 0.04 0.00 -0.02 0.00 0.00 31.44 27.01 1c7i n GLU 476 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1c7i h SER 477 N -1.83 0.15 0.07 1.62 0.02 -1.90 -1.58 113.55 110.10 1c7i h SER 477 Ca -0.62 0.05 0.02 0.00 -0.84 0.00 0.00 61.79 60.40 1c7i h SER 477 Cb 1.36 0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.89 1c7i h SER 477 CO 0.57 0.12 -0.44 -0.33 -1.14 0.00 0.00 176.83 175.61 1c7i h GLU 478 N 0.31 -0.62 -0.33 3.45 5.08 -1.90 0.01 114.58 120.57 1c7i h GLU 478 Ca 0.20 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.64 1c7i h GLU 478 Cb 0.20 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 1c7i h GLU 478 CO -0.21 -0.41 0.12 -0.22 -1.00 0.00 0.00 179.01 177.28 1c7i h LYS 479 N -0.64 0.25 -0.14 2.33 3.64 -1.91 -0.47 116.57 119.63 1c7i h LYS 479 Ca 0.03 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 1c7i h LYS 479 Cb 0.68 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.39 1c7i h LYS 479 CO -0.28 0.17 -0.21 -0.09 -2.27 0.00 0.00 179.45 176.77 1c7i h ARG 480 N 0.26 -0.25 -0.06 1.90 2.43 -0.93 0.46 114.38 118.18 1c7i h ARG 480 Ca 0.15 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1c7i h ARG 480 Cb 0.12 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1c7i h ARG 480 CO -0.15 -0.17 0.04 1.96 -1.51 0.00 0.00 179.97 180.14 1c7i h GLN 481 N -0.26 0.07 -0.06 0.20 4.20 -0.60 0.23 115.11 118.89 1c7i h GLN 481 Ca 0.10 -0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.75 1c7i h GLN 481 Cb 0.42 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1c7i h GLN 481 CO -0.30 0.04 -0.19 0.87 -0.67 0.00 0.00 178.83 178.59 1c7i h LYS 482 N 0.07 0.23 0.00 1.46 1.57 0.74 -3.27 116.57 117.37 1c7i h LYS 482 Ca 0.03 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1c7i h LYS 482 Cb 0.02 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1c7i h LYS 482 CO -0.00 0.80 0.00 -0.07 -0.57 0.00 0.00 179.45 179.60 1c7i h LEU 483 N -0.29 0.00 -0.92 2.94 3.38 0.41 -3.48 115.31 117.34 1c7i h LEU 483 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1c7i h LEU 483 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1c7i h LEU 483 CO 0.04 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.06