#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hin s VAL 2 N 0.00 4.71 -0.07 6.31 1.01 -1.26 -3.31 120.40 127.78 1hin s VAL 2 Ca 0.00 0.90 -0.03 0.00 0.00 0.00 0.00 61.98 62.85 1hin s VAL 2 Cb 0.00 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.80 1hin s VAL 2 CO 0.00 -0.14 0.15 -1.58 0.00 0.00 0.00 175.10 173.53 1hin s GLN 3 N -2.89 0.05 -0.12 2.72 2.00 -1.22 -4.88 119.66 115.32 1hin s GLN 3 Ca 0.52 0.48 0.02 0.00 -2.00 0.00 0.00 55.36 54.39 1hin s GLN 3 Cb -0.11 -0.25 0.01 0.00 0.80 0.00 0.00 33.01 33.47 1hin s GLN 3 CO 0.18 -0.25 -0.19 -0.51 -0.50 0.00 0.00 175.29 174.02 1hin s LEU 4 N 1.86 1.91 -0.14 3.68 1.43 -1.18 -1.69 118.68 124.54 1hin s LEU 4 Ca -0.02 -0.51 -0.02 0.00 -1.03 0.00 0.00 54.13 52.56 1hin s LEU 4 Cb -0.12 -1.25 0.04 0.00 0.03 0.00 0.00 46.19 44.89 1hin s LEU 4 CO -0.06 0.06 -0.01 -0.69 0.23 0.00 0.00 176.35 175.89 1hin s VAL 5 N 0.82 0.68 0.20 -1.59 1.01 -0.88 -3.99 120.40 116.65 1hin s VAL 5 Ca -0.09 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 1hin s VAL 5 Cb -0.16 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 1hin s VAL 5 CO -0.00 0.07 0.42 -1.61 0.00 0.00 0.00 175.10 173.97 1hin s GLU 6 N 1.82 3.58 0.11 2.72 8.01 -1.26 -1.01 118.70 132.66 1hin s GLU 6 Ca 0.02 -0.18 -0.13 0.00 0.01 0.00 0.00 54.97 54.68 1hin s GLU 6 Cb -0.15 -2.80 0.02 0.00 -4.31 0.00 0.00 34.13 26.89 1hin s GLU 6 CO -0.07 0.38 0.32 0.45 0.01 0.00 0.00 175.26 176.35 1hin s SER 7 N -2.92 -0.09 0.00 -0.19 0.15 -0.62 -4.85 113.70 105.17 1hin s SER 7 Ca 0.40 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.61 1hin s SER 7 Cb -0.11 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1hin s SER 7 CO 0.28 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.52 1hin n GLY 8 N -0.15 2.01 3.56 9.45 0.00 -1.26 -0.17 105.19 118.63 1hin n GLY 8 Ca -0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1hin n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hin s GLY 9 N -1.96 0.03 0.36 -0.02 0.00 -1.26 -4.57 107.32 99.90 1hin s GLY 9 Ca 0.00 -1.43 0.04 0.00 0.00 0.00 0.00 44.72 43.33 1hin s GLY 9 CO 0.00 3.60 0.35 1.34 0.00 0.00 0.00 173.10 178.39 1hin n ASP 10 N 14.67 1.88 -4.36 1.64 2.03 -1.25 -4.46 116.55 126.70 1hin n ASP 10 Ca 0.41 -2.15 -0.45 0.00 0.52 0.00 0.00 54.79 53.12 1hin n ASP 10 Cb 0.46 -0.11 -0.04 0.00 -0.72 0.00 0.00 41.12 40.71 1hin n ASP 10 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1hin s LEU 11 N 0.00 5.76 0.12 -2.67 2.96 -1.24 -2.28 118.68 121.33 1hin s LEU 11 Ca 0.27 -1.72 0.08 0.00 -0.22 0.00 0.00 54.13 52.53 1hin s LEU 11 Cb -0.02 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 1hin s LEU 11 CO 0.17 -0.98 -0.12 0.54 -1.32 0.00 0.00 176.35 174.64 1hin s VAL 12 N 2.08 3.18 0.55 1.68 0.11 -0.55 -4.96 120.40 122.50 1hin s VAL 12 Ca 0.11 -1.40 -0.20 0.00 -2.93 0.00 0.00 61.98 57.56 1hin s VAL 12 Cb -0.23 -2.49 -0.05 0.00 -1.53 0.00 0.00 36.38 32.08 1hin s VAL 12 CO 0.03 0.07 1.23 -1.59 -3.33 0.00 0.00 175.10 171.51 1hin s LYS 13 N -2.28 3.19 0.64 1.54 0.00 -1.25 -2.17 119.74 119.42 1hin s LYS 13 Ca 0.21 1.90 -0.17 0.00 0.00 0.00 0.00 55.97 57.91 1hin s LYS 13 Cb -0.11 -2.11 -0.01 0.00 0.00 0.00 0.00 37.83 35.61 1hin s LYS 13 CO 0.13 -1.05 1.18 -2.14 0.00 0.00 0.00 175.35 173.47 1hin s PRO 14 N -3.09 2.71 0.00 1.78 0.02 -1.26 -1.27 135.00 133.89 1hin s PRO 14 Ca 0.73 1.71 0.00 0.00 0.02 0.00 0.00 61.00 63.46 1hin s PRO 14 Cb -0.32 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.29 1hin s PRO 14 CO 0.36 -1.38 0.00 0.41 -0.33 0.00 0.00 177.00 176.06 1hin n GLY 15 N 0.25 2.95 1.30 0.52 0.00 0.13 -4.87 105.19 105.47 1hin n GLY 15 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 1hin n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hin n GLY 16 N -2.00 -1.12 3.31 -0.02 0.00 -0.39 -4.24 105.19 100.73 1hin n GLY 16 Ca 0.00 -1.70 -0.18 0.00 0.00 0.00 0.00 46.02 44.14 1hin n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hin s SER 17 N -2.62 2.37 -0.07 1.61 0.01 -1.26 -1.39 113.70 112.35 1hin s SER 17 Ca 0.25 -0.97 -0.09 0.00 1.31 0.00 0.00 55.95 56.45 1hin s SER 17 Cb -0.01 -0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.14 1hin s SER 17 CO 0.18 -0.18 0.24 -0.22 0.41 0.00 0.00 173.24 173.67 1hin s LEU 18 N -3.10 1.10 0.00 2.44 2.96 -0.22 -5.00 118.68 116.87 1hin s LEU 18 Ca 0.19 0.35 0.05 0.00 -0.22 0.00 0.00 54.13 54.49 1hin s LEU 18 Cb -0.01 0.88 -0.03 0.00 0.50 0.00 0.00 46.19 47.53 1hin s LEU 18 CO 0.05 -0.17 -0.12 -0.75 -1.32 0.00 0.00 176.35 174.04 1hin s LYS 19 N -0.27 2.38 0.01 1.98 2.20 -1.26 -0.49 119.74 124.29 1hin s LYS 19 Ca -0.04 -0.80 0.06 0.00 -0.36 0.00 0.00 55.97 54.83 1hin s LYS 19 Cb -0.03 -2.37 -0.02 0.00 -1.51 0.00 0.00 37.83 33.90 1hin s LYS 19 CO 0.01 0.59 -0.19 -0.51 -0.36 0.00 0.00 175.35 174.88 1hin s LEU 20 N -1.26 2.09 0.28 5.43 1.43 -0.12 -4.22 118.68 122.31 1hin s LEU 20 Ca 0.15 -0.41 0.09 0.00 -1.03 0.00 0.00 54.13 52.92 1hin s LEU 20 Cb -0.11 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.12 1hin s LEU 20 CO 0.05 0.20 0.09 -0.44 0.23 0.00 0.00 176.35 176.48 1hin s SER 21 N -0.75 4.85 -0.14 2.29 0.01 0.76 -1.90 113.70 118.82 1hin s SER 21 Ca 0.07 -0.56 -0.05 0.00 1.31 0.00 0.00 55.95 56.72 1hin s SER 21 Cb -0.08 -0.97 0.07 0.00 0.21 0.00 0.00 66.02 65.25 1hin s SER 21 CO 0.00 -0.08 0.27 0.00 0.41 0.00 0.00 173.24 173.84 1hin s ALA 23 N 2.43 3.62 -0.05 0.00 0.00 -0.18 -0.80 121.76 126.78 1hin s ALA 23 Ca 0.01 -0.12 0.06 0.00 0.00 0.00 0.00 51.96 51.91 1hin s ALA 23 Cb -0.12 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.47 1hin s ALA 23 CO -0.09 0.37 -0.23 0.00 0.00 0.00 0.00 175.76 175.81 1hin s ALA 24 N -0.80 1.99 0.34 0.00 0.00 -1.19 -2.07 121.76 120.04 1hin s ALA 24 Ca 0.26 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.30 1hin s ALA 24 Cb -0.17 -0.60 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 1hin s ALA 24 CO 0.15 0.40 0.18 -1.12 0.00 0.00 0.00 175.76 175.37 1hin s SER 25 N -0.20 1.93 -0.05 0.00 0.01 -0.68 -4.89 113.70 109.82 1hin s SER 25 Ca -0.01 -1.64 0.00 0.00 1.31 0.00 0.00 55.95 55.61 1hin s SER 25 Cb -0.12 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1hin s SER 25 CO 0.02 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.34 1hin n GLY 26 N -0.69 0.28 3.78 3.44 0.00 -1.21 -3.43 105.19 107.37 1hin n GLY 26 Ca 0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 1hin n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1hin s PHE 27 N -1.52 -0.13 -0.43 1.61 -0.71 -1.26 -4.67 117.98 110.87 1hin s PHE 27 Ca 0.00 -0.23 -0.18 0.00 -1.04 0.00 0.00 56.93 55.49 1hin s PHE 27 Cb 0.00 0.66 0.03 0.00 -1.21 0.00 0.00 43.02 42.50 1hin s PHE 27 CO 0.00 -0.93 0.46 -1.54 -1.34 0.00 0.00 175.22 171.87 1hin s SER 28 N -2.96 6.20 0.19 1.98 1.04 -1.26 -4.95 113.70 113.94 1hin s SER 28 Ca 0.13 -0.71 -0.14 0.00 0.48 0.00 0.00 55.95 55.71 1hin s SER 28 Cb -0.02 -2.23 0.20 0.00 0.10 0.00 0.00 66.02 64.06 1hin s SER 28 CO 0.04 -0.62 1.67 0.15 0.98 0.00 0.00 173.24 175.45 1hin h PHE 29 N 8.76 -0.12 0.00 5.02 3.57 -1.92 -0.98 116.94 131.27 1hin h PHE 29 Ca -0.26 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.28 1hin h PHE 29 Cb 1.11 0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1hin h PHE 29 CO 0.64 -0.16 0.76 0.77 -2.23 0.00 0.00 178.31 178.09 1hin h SER 30 N 0.07 0.00 0.41 0.41 0.02 -1.90 -1.54 113.55 111.02 1hin h SER 30 Ca 0.26 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.10 1hin h SER 30 Cb 0.41 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.93 1hin h SER 30 CO -0.48 0.00 -1.70 -0.24 -1.14 0.00 0.00 176.83 173.27 1hin n SER 31 N -2.37 0.43 -4.54 3.07 2.88 -0.37 -4.57 113.62 108.15 1hin n SER 31 Ca -0.00 0.18 -0.24 0.00 -1.33 0.00 0.00 58.87 57.47 1hin n SER 31 Cb 0.77 0.96 -0.09 0.00 -0.75 0.00 0.00 64.21 65.10 1hin n SER 31 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1hin s TYR 32 N -3.12 2.47 -0.00 0.66 2.02 -0.58 -4.88 117.35 113.90 1hin s TYR 32 Ca -0.05 -0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.38 1hin s TYR 32 Cb 0.10 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.51 1hin s TYR 32 CO 0.84 0.64 -0.02 0.20 -1.57 0.00 0.00 175.55 175.64 1hin s GLY 33 N -3.38 1.83 0.10 0.71 0.00 -1.26 -3.89 107.32 101.43 1hin s GLY 33 Ca 0.29 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 44.05 1hin s GLY 33 CO 0.16 -0.82 0.24 1.06 0.00 0.00 0.00 173.10 173.74 1hin s MET 34 N -1.47 3.44 0.18 2.90 -1.94 -1.26 -0.01 119.30 121.14 1hin s MET 34 Ca 0.18 -0.51 0.07 0.00 -1.71 0.00 0.00 55.69 53.72 1hin s MET 34 Cb -0.11 -3.01 -0.05 0.00 2.01 0.00 0.00 34.83 33.67 1hin s MET 34 CO 0.09 0.57 -0.14 -1.12 -0.01 0.00 0.00 175.02 174.41 1hin s SER 35 N -2.84 2.34 -0.06 3.03 0.01 -1.16 -0.14 113.70 114.88 1hin s SER 35 Ca 0.35 -0.99 0.03 0.00 1.31 0.00 0.00 55.95 56.64 1hin s SER 35 Cb -0.12 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 65.98 1hin s SER 35 CO 0.28 -0.20 -0.14 0.26 0.41 0.00 0.00 173.24 173.86 1hin s TRP 36 N -2.93 2.73 -0.02 2.43 0.52 -0.43 -2.67 118.94 118.57 1hin s TRP 36 Ca 0.20 -0.22 0.00 0.00 0.02 0.00 0.00 56.10 56.10 1hin s TRP 36 Cb -0.01 -1.67 0.02 0.00 -1.15 0.00 0.00 33.47 30.67 1hin s TRP 36 CO 0.05 0.14 0.01 0.08 0.02 0.00 0.00 176.95 177.25 1hin s VAL 37 N -0.58 0.02 0.05 4.03 1.01 0.73 -1.26 120.40 124.40 1hin s VAL 37 Ca 0.08 0.13 0.05 0.00 0.00 0.00 0.00 61.98 62.24 1hin s VAL 37 Cb -0.11 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 1hin s VAL 37 CO 0.01 0.09 -0.07 0.00 0.00 0.00 0.00 175.10 175.13 1hin s ARG 38 N 0.84 2.41 -0.22 2.72 1.70 -0.53 -0.10 118.95 125.77 1hin s ARG 38 Ca -0.07 -0.84 -0.03 0.00 -0.47 0.00 0.00 55.73 54.32 1hin s ARG 38 Cb -0.11 -2.44 0.00 0.00 -0.57 0.00 0.00 34.95 31.83 1hin s ARG 38 CO -0.02 0.56 -0.07 -1.14 -1.08 0.00 0.00 175.30 173.55 1hin s GLN 39 N -1.82 3.21 0.67 3.89 0.74 -0.29 0.07 119.66 126.12 1hin s GLN 39 Ca 0.20 -0.73 -0.11 0.00 0.05 0.00 0.00 55.36 54.77 1hin s GLN 39 Cb -0.11 -2.94 -0.01 0.00 1.10 0.00 0.00 33.01 31.05 1hin s GLN 39 CO 0.11 -0.24 1.06 0.95 -0.55 0.00 0.00 175.29 176.62 1hin s THR 40 N 1.42 4.10 0.42 -0.34 -4.23 -0.04 -0.76 115.64 116.21 1hin s THR 40 Ca 0.05 0.68 0.21 0.00 -1.18 0.00 0.00 61.69 61.45 1hin s THR 40 Cb -0.15 -3.64 0.41 0.00 1.34 0.00 0.00 72.50 70.47 1hin s THR 40 CO -0.05 -0.89 1.78 -0.65 -0.54 0.00 0.00 174.62 174.26 1hin h PRO 41 N -0.52 0.33 -0.21 3.99 0.11 -1.89 0.67 132.00 134.48 1hin h PRO 41 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1hin h PRO 41 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1hin h PRO 41 CO 0.62 0.22 0.00 -0.40 -0.21 0.00 0.00 178.00 178.23 1hin n ASP 42 N -4.57 1.12 -1.30 -2.05 5.75 -1.26 -4.94 116.55 109.29 1hin n ASP 42 Ca 0.25 -1.98 -0.13 0.00 -0.01 0.00 0.00 54.79 52.92 1hin n ASP 42 Cb 0.92 -0.14 -0.03 0.00 -1.03 0.00 0.00 41.12 40.85 1hin n ASP 42 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1hin n LYS 43 N 0.10 -1.00 -3.18 0.11 5.02 0.23 -5.03 118.16 114.41 1hin n LYS 43 Ca 0.07 0.78 -0.39 0.00 -2.02 0.00 0.00 58.31 56.76 1hin n LYS 43 Cb 0.18 -4.95 -0.06 0.00 -0.02 0.00 0.00 35.03 30.18 1hin n LYS 43 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1hin s ARG 44 N -4.00 4.31 0.01 1.97 1.70 -1.25 -4.74 118.95 116.94 1hin s ARG 44 Ca 0.00 0.86 0.02 0.00 -0.47 0.00 0.00 55.73 56.15 1hin s ARG 44 Cb 0.00 -3.22 -0.04 0.00 -0.57 0.00 0.00 34.95 31.13 1hin s ARG 44 CO 0.00 0.60 -0.02 -0.51 -1.08 0.00 0.00 175.30 174.29 1hin s LEU 45 N -1.20 3.38 -0.03 -1.89 1.02 -1.26 -0.86 118.68 117.84 1hin s LEU 45 Ca 0.32 -0.08 -0.01 0.00 0.02 0.00 0.00 54.13 54.38 1hin s LEU 45 Cb -0.20 -1.95 0.03 0.00 0.02 0.00 0.00 46.19 44.09 1hin s LEU 45 CO 0.21 0.27 0.06 -1.83 0.02 0.00 0.00 176.35 175.09 1hin s GLU 46 N -1.58 -0.01 -0.06 1.70 -1.05 0.11 -4.95 118.70 112.86 1hin s GLU 46 Ca 0.19 0.26 -0.29 0.00 -0.15 0.00 0.00 54.97 54.97 1hin s GLU 46 Cb -0.11 -0.25 -0.06 0.00 -0.44 0.00 0.00 34.13 33.26 1hin s GLU 46 CO 0.10 -0.18 1.86 -0.46 0.95 0.00 0.00 175.26 177.52 1hin s TRP 47 N 1.20 1.59 -0.03 4.83 -0.00 -1.26 -1.45 118.94 123.82 1hin s TRP 47 Ca -0.08 0.02 -0.19 0.00 -0.00 0.00 0.00 56.10 55.85 1hin s TRP 47 Cb -0.13 -4.07 -0.33 0.00 -0.00 0.00 0.00 33.47 28.95 1hin s TRP 47 CO -0.04 -4.47 0.90 0.28 -0.00 0.00 0.00 176.95 173.62 1hin h VAL 48 N 5.91 1.39 -1.46 5.86 2.07 -1.53 -3.42 116.25 125.06 1hin h VAL 48 Ca -0.43 -2.58 0.11 0.00 0.82 0.00 0.00 66.70 64.62 1hin h VAL 48 Cb 1.21 3.11 -0.25 0.00 -1.52 0.00 0.00 31.29 33.84 1hin h VAL 48 CO 0.96 0.75 0.61 0.00 0.02 0.00 0.00 177.57 179.91 1hin s ALA 49 N -2.49 -1.98 -0.02 1.67 0.00 -1.23 -3.92 121.76 113.79 1hin s ALA 49 Ca -0.13 1.68 0.03 0.00 0.00 0.00 0.00 51.96 53.54 1hin s ALA 49 Cb 0.02 -1.00 -0.00 0.00 0.00 0.00 0.00 23.12 22.14 1hin s ALA 49 CO 0.87 -0.28 -0.09 0.99 0.00 0.00 0.00 175.76 177.25 1hin s THR 50 N -0.84 0.72 0.10 0.00 2.01 0.84 -1.31 115.64 117.15 1hin s THR 50 Ca 0.01 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 61.66 1hin s THR 50 Cb -0.01 -0.63 0.00 0.00 0.01 0.00 0.00 72.50 71.88 1hin s THR 50 CO -0.02 0.22 0.04 0.00 -0.69 0.00 0.00 174.62 174.17 1hin n ILE 51 N 3.08 0.00 -4.08 1.82 3.06 0.80 0.41 119.36 124.44 1hin n ILE 51 Ca -0.16 -0.41 -0.23 0.00 -2.50 0.00 0.00 62.75 59.46 1hin n ILE 51 Cb 0.56 -0.20 -0.02 0.00 0.54 0.00 0.00 39.64 40.52 1hin n ILE 51 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 1hin n SER 52 N -1.58 2.66 0.00 9.51 3.41 -1.06 -4.24 113.62 122.33 1hin n SER 52 Ca -0.02 -2.62 0.11 0.00 -0.26 0.00 0.00 58.87 56.08 1hin n SER 52 Cb 0.11 0.08 0.67 0.00 -0.26 0.00 0.00 64.21 64.81 1hin n SER 52 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1hin n ASN 52 N -1.66 0.00 0.00 4.04 0.23 -1.25 -3.73 115.26 112.89 1hin n ASN 52 Ca -0.07 -0.69 0.00 0.00 -0.53 0.00 0.00 54.58 53.29 1hin n ASN 52 Cb 0.51 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.21 1hin n ASN 52 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hin n GLY 53 N 0.41 0.00 0.00 4.83 0.00 -1.26 -4.32 105.19 104.84 1hin n GLY 53 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1hin n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hin n GLY 54 N 0.02 0.69 4.03 -0.02 0.00 -1.24 -4.97 105.19 103.70 1hin n GLY 54 Ca 0.00 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.90 1hin n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hin n GLY 55 N 0.00 1.61 3.49 -0.02 0.00 -1.26 -4.72 105.19 104.29 1hin n GLY 55 Ca 0.00 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 1hin n GLY 55 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1hin n TYR 56 N 0.00 1.17 -5.04 1.61 4.01 -1.26 -4.94 117.16 112.72 1hin n TYR 56 Ca 0.00 0.29 -0.32 0.00 -0.16 0.00 0.00 57.90 57.70 1hin n TYR 56 Cb 0.00 -2.50 -0.15 0.00 -0.31 0.00 0.00 39.34 36.37 1hin n TYR 56 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1hin s THR 57 N 9.37 2.54 -0.00 -0.72 -1.32 -1.26 -2.57 115.64 121.68 1hin s THR 57 Ca 1.15 -0.87 0.03 0.00 -1.21 0.00 0.00 61.69 60.79 1hin s THR 57 Cb -0.81 -2.00 -0.01 0.00 -1.51 0.00 0.00 72.50 68.17 1hin s THR 57 CO 0.43 0.56 -0.09 -0.31 -2.21 0.00 0.00 174.62 172.99 1hin s TYR 58 N -0.00 0.84 0.21 9.09 1.51 0.17 -4.98 117.35 124.18 1hin s TYR 58 Ca -0.06 -0.17 -0.08 0.00 -1.01 0.00 0.00 57.07 55.75 1hin s TYR 58 Cb -0.15 -0.54 -0.02 0.00 -0.11 0.00 0.00 41.96 41.15 1hin s TYR 58 CO 0.05 -0.01 0.31 0.71 -1.11 0.00 0.00 175.55 175.50 1hin s TYR 59 N -0.26 0.62 0.61 2.71 1.51 -1.26 -0.11 117.35 121.16 1hin s TYR 59 Ca 0.03 -0.94 0.01 0.00 -1.01 0.00 0.00 57.07 55.16 1hin s TYR 59 Cb -0.04 -0.11 0.07 0.00 -0.11 0.00 0.00 41.96 41.77 1hin s TYR 59 CO -0.00 -0.81 0.85 -2.14 -1.11 0.00 0.00 175.55 172.34 1hin s PRO 60 N -4.05 2.23 0.50 -1.71 0.02 -1.25 -4.94 135.00 125.80 1hin s PRO 60 Ca 0.26 -0.96 0.29 0.00 0.02 0.00 0.00 61.00 60.60 1hin s PRO 60 Cb 0.03 -2.45 1.14 0.00 0.02 0.00 0.00 34.50 33.24 1hin s PRO 60 CO 0.07 -0.97 1.91 0.22 -0.33 0.00 0.00 177.00 177.90 1hin h ASP 61 N -0.12 0.00 0.15 2.53 1.82 -1.95 -1.82 116.42 117.03 1hin h ASP 61 Ca -0.39 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.25 1hin h ASP 61 Cb 1.29 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.30 1hin h ASP 61 CO 0.47 0.11 0.00 -1.20 -1.61 0.00 0.00 179.24 177.01 1hin n SER 62 N -3.26 0.57 0.00 2.28 7.64 -1.26 -4.09 113.62 115.51 1hin n SER 62 Ca 0.00 0.74 0.00 0.00 1.01 0.00 0.00 58.87 60.62 1hin n SER 62 Cb 0.37 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 1hin n SER 62 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1hin n VAL 63 N -2.24 0.00 -1.52 0.44 0.31 -0.91 -4.95 118.33 109.45 1hin n VAL 63 Ca -0.01 0.00 -0.50 0.00 -0.01 0.00 0.00 64.34 63.82 1hin n VAL 63 Cb 0.07 -0.35 -0.04 0.00 -0.91 0.00 0.00 33.84 32.62 1hin n VAL 63 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1hin n LYS 64 N -1.96 0.70 0.00 5.55 5.02 -0.73 -1.24 118.16 125.51 1hin n LYS 64 Ca 0.00 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1hin n LYS 64 Cb 0.29 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 1hin n LYS 64 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1hin n GLY 65 N 1.85 2.93 0.09 0.72 0.00 -1.26 -4.71 105.19 104.81 1hin n GLY 65 Ca 0.16 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 45.27 1hin n GLY 65 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1hin h ARG 66 N 0.00 0.00 -5.97 1.61 3.08 -1.74 -3.48 114.38 107.88 1hin h ARG 66 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1hin h ARG 66 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1hin h ARG 66 CO 0.00 0.64 -0.42 -0.06 -1.07 0.00 0.00 179.97 179.06 1hin s PHE 67 N -2.30 3.53 -0.02 3.04 0.08 -0.37 -4.57 117.98 117.36 1hin s PHE 67 Ca -0.23 0.43 0.01 0.00 0.12 0.00 0.00 56.93 57.26 1hin s PHE 67 Cb 0.04 -1.89 0.01 0.00 -0.57 0.00 0.00 43.02 40.61 1hin s PHE 67 CO 0.45 0.56 -0.04 0.99 -0.10 0.00 0.00 175.22 177.08 1hin s THR 68 N -1.48 0.43 -0.12 0.64 2.01 0.00 -4.64 115.64 112.48 1hin s THR 68 Ca 0.34 -0.13 -0.06 0.00 0.31 0.00 0.00 61.69 62.15 1hin s THR 68 Cb -0.13 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.91 1hin s THR 68 CO 0.23 0.17 0.10 -0.51 -0.69 0.00 0.00 174.62 173.92 1hin s ILE 69 N 0.51 5.19 0.32 1.82 2.07 -1.26 -0.22 121.20 129.62 1hin s ILE 69 Ca -0.06 0.09 0.03 0.00 -1.41 0.00 0.00 60.65 59.30 1hin s ILE 69 Cb -0.09 -3.26 -0.01 0.00 0.13 0.00 0.00 42.46 39.23 1hin s ILE 69 CO -0.00 0.59 0.09 -1.20 -1.91 0.00 0.00 174.94 172.51 1hin n SER 70 N 2.24 1.43 -3.87 4.50 7.64 0.10 -4.98 113.62 120.69 1hin n SER 70 Ca -0.19 -2.63 -0.09 0.00 1.01 0.00 0.00 58.87 56.96 1hin n SER 70 Cb 0.54 0.70 -0.06 0.00 -1.01 0.00 0.00 64.21 64.38 1hin n SER 70 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1hin s ARG 71 N -3.19 1.12 -0.29 1.43 6.06 -1.26 -3.47 118.95 119.35 1hin s ARG 71 Ca 0.13 -1.03 0.01 0.00 -2.50 0.00 0.00 55.73 52.35 1hin s ARG 71 Cb 0.01 0.40 0.18 0.00 0.06 0.00 0.00 34.95 35.60 1hin s ARG 71 CO 0.09 -0.42 0.55 0.34 -2.50 0.00 0.00 175.30 173.37 1hin s ASP 72 N -2.91 -1.08 0.23 -2.12 -1.08 -0.60 -4.93 116.67 104.18 1hin s ASP 72 Ca 0.12 0.44 0.23 0.00 -0.52 0.00 0.00 52.55 52.82 1hin s ASP 72 Cb 0.03 1.89 0.14 0.00 -1.46 0.00 0.00 42.92 43.51 1hin s ASP 72 CO -0.04 -0.29 1.21 0.78 0.52 0.00 0.00 175.17 177.35 1hin h ASN 73 N 8.04 0.00 0.03 -0.34 4.21 -1.93 0.40 115.58 125.99 1hin h ASN 73 Ca -0.14 -0.04 -0.26 0.00 1.21 0.00 0.00 56.30 57.06 1hin h ASN 73 Cb 1.16 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.34 1hin h ASN 73 CO 0.23 0.02 -1.43 0.00 -1.29 0.00 0.00 177.43 174.95 1hin h ALA 74 N 2.11 0.30 0.00 -0.83 0.00 -1.97 -3.20 119.26 115.68 1hin h ALA 74 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.66 1hin h ALA 74 Cb 0.94 0.72 0.00 0.00 0.00 0.00 0.00 17.79 19.45 1hin h ALA 74 CO 0.00 0.85 0.00 1.63 0.00 0.00 0.00 179.25 181.73 1hin n LYS 75 N -4.19 0.02 -4.12 0.00 4.76 -1.25 -4.84 118.16 108.53 1hin n LYS 75 Ca -0.32 0.26 -0.32 0.00 -2.87 0.00 0.00 58.31 55.07 1hin n LYS 75 Cb 0.78 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 32.44 1hin n LYS 75 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1hin n ASN 76 N -1.48 -2.30 -4.17 4.39 5.15 0.11 -4.93 115.26 112.04 1hin n ASN 76 Ca 0.03 -1.00 -0.23 0.00 -0.60 0.00 0.00 54.58 52.79 1hin n ASN 76 Cb 0.15 -2.90 -0.14 0.00 -0.53 0.00 0.00 39.78 36.36 1hin n ASN 76 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1hin s THR 77 N -3.54 1.29 -0.15 -0.44 -4.23 0.45 -3.16 115.64 105.85 1hin s THR 77 Ca 0.47 -0.93 -0.07 0.00 -1.18 0.00 0.00 61.69 59.99 1hin s THR 77 Cb -0.26 -1.12 -0.04 0.00 1.34 0.00 0.00 72.50 72.42 1hin s THR 77 CO 0.91 0.18 0.08 -0.22 -0.54 0.00 0.00 174.62 175.03 1hin s LEU 78 N -0.87 3.99 -0.03 4.79 2.96 0.02 -1.55 118.68 127.99 1hin s LEU 78 Ca 0.05 0.21 0.05 0.00 -0.22 0.00 0.00 54.13 54.22 1hin s LEU 78 Cb -0.07 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.62 1hin s LEU 78 CO 0.01 0.27 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.83 1hin s TYR 79 N -0.18 1.59 -0.29 5.38 2.02 -1.23 0.51 117.35 125.16 1hin s TYR 79 Ca 0.08 -0.38 -0.09 0.00 -0.37 0.00 0.00 57.07 56.31 1hin s TYR 79 Cb -0.12 -1.05 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 1hin s TYR 79 CO 0.01 -0.10 0.14 -1.17 -1.57 0.00 0.00 175.55 172.86 1hin s LEU 80 N -0.15 3.96 -0.27 -1.29 2.96 -0.80 -0.72 118.68 122.37 1hin s LEU 80 Ca 0.01 -0.40 -0.25 0.00 -0.22 0.00 0.00 54.13 53.27 1hin s LEU 80 Cb -0.09 -2.00 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 1hin s LEU 80 CO 0.01 -0.14 0.85 -1.58 -1.32 0.00 0.00 176.35 174.16 1hin s GLN 81 N 1.63 4.11 0.33 1.98 -0.44 0.69 -0.94 119.66 127.02 1hin s GLN 81 Ca 0.05 0.86 0.08 0.00 -2.50 0.00 0.00 55.36 53.86 1hin s GLN 81 Cb -0.17 -3.68 -0.04 0.00 -1.64 0.00 0.00 33.01 27.49 1hin s GLN 81 CO 0.06 -0.61 0.18 -1.64 0.50 0.00 0.00 175.29 173.79 1hin s MET 82 N 2.97 2.49 -0.01 1.67 -1.94 0.36 -0.82 119.30 124.02 1hin s MET 82 Ca 0.35 -1.45 -0.01 0.00 -1.71 0.00 0.00 55.69 52.88 1hin s MET 82 Cb -0.15 -2.28 0.00 0.00 2.01 0.00 0.00 34.83 34.42 1hin s MET 82 CO 0.10 0.13 0.01 0.43 -0.01 0.00 0.00 175.02 175.68 1hin n SER 82 N -1.20 -0.10 -4.65 3.03 7.64 -0.70 -1.05 113.62 116.59 1hin n SER 82 Ca -0.03 -0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.45 1hin n SER 82 Cb 0.61 -0.03 -0.07 0.00 -1.01 0.00 0.00 64.21 63.70 1hin n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1hin s LEU 82 N -0.20 4.11 0.50 -3.43 1.43 -0.48 -4.79 118.68 115.82 1hin s LEU 82 Ca 0.01 0.60 -0.06 0.00 -1.03 0.00 0.00 54.13 53.64 1hin s LEU 82 Cb -0.00 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 1hin s LEU 82 CO 0.02 -0.21 0.83 -1.59 0.23 0.00 0.00 176.35 175.63 1hin s LYS 83 N 1.85 3.56 0.24 1.70 -2.85 -1.26 0.20 119.74 123.19 1hin s LYS 83 Ca 0.22 0.31 0.02 0.00 -1.00 0.00 0.00 55.97 55.53 1hin s LYS 83 Cb -0.15 -2.32 0.27 0.00 -2.06 0.00 0.00 37.83 33.57 1hin s LYS 83 CO 0.09 -0.27 1.60 0.66 0.10 0.00 0.00 175.35 177.53 1hin h SER 84 N 0.17 0.41 0.17 0.03 4.64 -1.97 -3.07 113.55 113.92 1hin h SER 84 Ca -0.46 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 60.66 1hin h SER 84 Cb 1.20 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1hin h SER 84 CO 0.62 0.84 0.00 -1.84 -0.87 0.00 0.00 176.83 175.57 1hin n GLU 85 N -3.97 0.02 0.25 4.77 0.00 -1.26 -0.54 120.64 119.92 1hin n GLU 85 Ca -0.02 0.45 0.12 0.00 0.00 0.00 0.00 57.16 57.71 1hin n GLU 85 Cb 0.55 -1.57 0.65 0.00 0.00 0.00 0.00 31.44 31.07 1hin n GLU 85 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1hin h ASP 86 N 0.00 0.00 -1.72 -1.84 3.32 -1.93 -3.45 116.42 110.80 1hin h ASP 86 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1hin h ASP 86 Cb 0.08 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.64 1hin h ASP 86 CO 0.00 0.15 1.10 -1.20 -1.72 0.00 0.00 179.24 177.57 1hin n SER 87 N -3.49 2.91 -3.68 6.45 7.64 0.30 -4.85 113.62 118.90 1hin n SER 87 Ca -0.01 0.89 -0.01 0.00 1.01 0.00 0.00 58.87 60.75 1hin n SER 87 Cb 0.31 -1.29 -0.01 0.00 -1.01 0.00 0.00 64.21 62.21 1hin n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hin s ALA 88 N 4.58 -1.93 -0.01 -0.43 0.00 0.56 -4.48 121.76 120.04 1hin s ALA 88 Ca 0.98 0.46 -0.21 0.00 0.00 0.00 0.00 51.96 53.18 1hin s ALA 88 Cb -0.83 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 1hin s ALA 88 CO 0.55 -1.02 0.63 1.41 0.00 0.00 0.00 175.76 177.33 1hin s MET 89 N -2.87 4.36 -0.24 0.00 -2.45 0.06 0.62 119.30 118.79 1hin s MET 89 Ca 0.13 0.78 -0.04 0.00 -1.25 0.00 0.00 55.69 55.30 1hin s MET 89 Cb 0.01 -3.36 -0.01 0.00 1.25 0.00 0.00 34.83 32.73 1hin s MET 89 CO -0.01 0.31 -0.01 0.71 1.05 0.00 0.00 175.02 177.07 1hin s TYR 90 N -0.02 3.01 -0.04 4.11 1.51 0.87 -1.14 117.35 125.65 1hin s TYR 90 Ca 0.33 -0.93 -0.02 0.00 -1.01 0.00 0.00 57.07 55.43 1hin s TYR 90 Cb -0.18 -2.14 -0.04 0.00 -0.11 0.00 0.00 41.96 39.49 1hin s TYR 90 CO 0.18 -0.54 0.08 0.71 -1.11 0.00 0.00 175.55 174.87 1hin s TYR 91 N 1.49 3.34 -0.36 2.71 2.02 0.85 -1.44 117.35 125.96 1hin s TYR 91 Ca 0.05 0.27 -0.08 0.00 -0.37 0.00 0.00 57.07 56.94 1hin s TYR 91 Cb -0.15 -1.79 0.04 0.00 -0.40 0.00 0.00 41.96 39.67 1hin s TYR 91 CO -0.02 0.58 0.15 0.00 -1.57 0.00 0.00 175.55 174.69 1hin n ALA 93 N 4.86 0.20 -2.24 0.00 0.00 -1.09 -1.08 120.51 121.16 1hin n ALA 93 Ca -0.12 -0.46 -0.08 0.00 0.00 0.00 0.00 53.44 52.78 1hin n ALA 93 Cb 0.45 0.11 -0.09 0.00 0.00 0.00 0.00 19.45 19.91 1hin n ALA 93 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1hin s ARG 94 N -2.72 0.74 -0.26 0.00 1.70 -1.16 -2.99 118.95 114.25 1hin s ARG 94 Ca 0.14 -1.18 -0.17 0.00 -0.47 0.00 0.00 55.73 54.05 1hin s ARG 94 Cb -0.01 0.26 -0.03 0.00 -0.57 0.00 0.00 34.95 34.59 1hin s ARG 94 CO 0.09 -0.18 0.47 1.03 -1.08 0.00 0.00 175.30 175.63 1hin s ARG 95 N -3.92 4.05 -0.80 3.89 1.81 0.98 -4.34 118.95 120.62 1hin s ARG 95 Ca 0.09 0.23 -0.21 0.00 -1.72 0.00 0.00 55.73 54.13 1hin s ARG 95 Cb 0.07 -3.65 0.10 0.00 -0.45 0.00 0.00 34.95 31.01 1hin s ARG 95 CO -0.08 -0.32 1.06 -1.21 -0.68 0.00 0.00 175.30 174.06 1hin s GLU 96 N 2.22 3.35 0.03 3.54 0.41 -1.17 -4.05 118.70 123.03 1hin s GLU 96 Ca 0.19 -1.27 -0.09 0.00 -0.41 0.00 0.00 54.97 53.39 1hin s GLU 96 Cb -0.16 -4.60 -0.03 0.00 -1.78 0.00 0.00 34.13 27.56 1hin s GLU 96 CO 0.09 -1.82 1.14 -0.09 -0.49 0.00 0.00 175.26 174.10 1hin h ARG 97 N 9.25 -0.15 0.01 1.61 1.12 -1.93 0.57 114.38 124.87 1hin h ARG 97 Ca -0.06 0.01 -0.22 0.00 -1.11 0.00 0.00 59.98 58.60 1hin h ARG 97 Cb 1.05 0.03 -0.00 0.00 -0.01 0.00 0.00 29.97 31.04 1hin h ARG 97 CO 1.16 -0.10 -0.94 1.88 -3.11 0.00 0.00 179.97 178.86 1hin h TYR 98 N -0.16 0.46 0.01 2.20 -1.99 -1.95 -3.38 116.97 112.17 1hin h TYR 98 Ca 0.01 -0.26 -0.40 0.00 2.00 0.00 0.00 58.73 60.08 1hin h TYR 98 Cb 0.18 -0.05 -0.06 0.00 2.00 0.00 0.00 36.73 38.80 1hin h TYR 98 CO -0.46 1.09 -2.32 -0.25 -0.00 0.00 0.00 178.16 176.22 1hin n ASP 99 N -3.69 1.97 -1.52 3.88 9.92 -1.21 -5.07 116.55 120.84 1hin n ASP 99 Ca -0.05 0.17 -0.00 0.00 -0.53 0.00 0.00 54.79 54.37 1hin n ASP 99 Cb 0.84 -0.70 0.00 0.00 -0.64 0.00 0.00 41.12 40.62 1hin n ASP 99 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1hin n GLU 100 N -3.84 -0.06 -2.46 -1.24 1.02 0.20 -5.04 120.64 109.22 1hin n GLU 100 Ca -0.47 0.54 -0.03 0.00 -0.02 0.00 0.00 57.16 57.18 1hin n GLU 100 Cb 0.92 -1.31 0.08 0.00 -0.02 0.00 0.00 31.44 31.11 1hin n GLU 100 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1hin n ASN 100 N -0.22 -1.26 0.00 1.62 2.04 -1.26 -5.08 115.26 111.10 1hin n ASN 100 Ca 0.00 -1.96 0.00 0.00 -0.44 0.00 0.00 54.58 52.18 1hin n ASN 100 Cb 0.00 0.71 0.00 0.00 -2.53 0.00 0.00 39.78 37.96 1hin n ASN 100 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1hin n GLY 100 N -0.83 -0.30 2.95 4.83 0.00 -1.26 -4.23 105.19 106.35 1hin n GLY 100 Ca -0.12 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.38 1hin n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hin s PHE 100 N 0.00 3.55 -1.37 1.61 0.08 -1.26 -3.04 117.98 117.54 1hin s PHE 100 Ca 0.00 -3.23 0.26 0.00 0.12 0.00 0.00 56.93 54.08 1hin s PHE 100 Cb 0.00 -2.84 0.77 0.00 -0.57 0.00 0.00 43.02 40.37 1hin s PHE 100 CO 0.00 -0.63 1.58 0.00 -0.10 0.00 0.00 175.22 176.07 1hin n ALA 101 N 2.31 3.16 -3.76 5.36 0.00 -1.26 -4.74 120.51 121.58 1hin n ALA 101 Ca 0.17 -0.34 -0.30 0.00 0.00 0.00 0.00 53.44 52.97 1hin n ALA 101 Cb 0.35 -1.19 -0.15 0.00 0.00 0.00 0.00 19.45 18.47 1hin n ALA 101 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1hin s TYR 102 N -2.74 2.00 -0.13 0.00 1.51 -1.26 -5.07 117.35 111.65 1hin s TYR 102 Ca 0.19 -1.99 -0.04 0.00 -1.01 0.00 0.00 57.07 54.22 1hin s TYR 102 Cb 0.19 -1.89 -0.03 0.00 -0.11 0.00 0.00 41.96 40.12 1hin s TYR 102 CO 0.59 -0.87 0.00 -1.58 -1.11 0.00 0.00 175.55 172.58 1hin s TRP 103 N 1.35 3.14 0.87 2.71 0.52 -1.26 -3.00 118.94 123.27 1hin s TRP 103 Ca 0.11 0.01 -0.15 0.00 0.02 0.00 0.00 56.10 56.10 1hin s TRP 103 Cb -0.18 -1.91 0.22 0.00 -1.15 0.00 0.00 33.47 30.45 1hin s TRP 103 CO -0.19 0.24 0.61 0.41 0.02 0.00 0.00 176.95 178.04 1hin n GLY 104 N 2.90 -3.35 2.73 0.98 0.00 -0.24 -4.82 105.19 103.39 1hin n GLY 104 Ca -0.18 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 1hin n GLY 104 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1hin n GLN 105 N -4.08 3.56 -1.28 1.61 7.27 -1.26 -4.73 117.38 118.48 1hin n GLN 105 Ca 0.09 -4.30 0.12 0.00 0.07 0.00 0.00 57.00 52.98 1hin n GLN 105 Cb 0.38 -2.29 -0.07 0.00 2.41 0.00 0.00 30.24 30.67 1hin n GLN 105 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1hin n GLY 106 N -0.38 -2.68 2.67 1.69 0.00 -1.26 -4.96 105.19 100.28 1hin n GLY 106 Ca 0.44 -0.77 -0.23 0.00 0.00 0.00 0.00 46.02 45.46 1hin n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1hin s THR 107 N -4.59 -0.21 -0.22 2.61 -1.32 -0.52 -4.70 115.64 106.69 1hin s THR 107 Ca 0.00 -0.25 -0.29 0.00 -1.21 0.00 0.00 61.69 59.94 1hin s THR 107 Cb 0.00 -0.70 -0.04 0.00 -1.51 0.00 0.00 72.50 70.25 1hin s THR 107 CO 0.00 -0.33 1.84 -0.22 -2.21 0.00 0.00 174.62 173.70 1hin s LEU 108 N 2.23 3.75 -0.26 9.08 2.96 -1.26 -0.09 118.68 135.08 1hin s LEU 108 Ca 0.05 1.71 -0.11 0.00 -0.22 0.00 0.00 54.13 55.57 1hin s LEU 108 Cb -0.16 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 1hin s LEU 108 CO -0.16 -1.51 0.17 -0.69 -1.32 0.00 0.00 176.35 172.85 1hin s VAL 109 N 6.24 5.29 -0.17 1.68 1.01 0.20 -3.95 120.40 130.70 1hin s VAL 109 Ca 0.82 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.96 1hin s VAL 109 Cb -0.28 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.63 1hin s VAL 109 CO 0.33 0.29 -0.11 -0.89 0.00 0.00 0.00 175.10 174.72 1hin s THR 110 N 1.51 1.50 -0.24 3.92 2.01 -0.96 -0.33 115.64 123.06 1hin s THR 110 Ca 0.07 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.29 1hin s THR 110 Cb -0.15 -1.52 0.02 0.00 0.01 0.00 0.00 72.50 70.86 1hin s THR 110 CO 0.09 0.29 -0.09 0.54 -0.69 0.00 0.00 174.62 174.76 1hin s VAL 111 N 1.48 2.73 -0.08 3.82 0.11 -1.26 -1.49 120.40 125.73 1hin s VAL 111 Ca 0.02 -1.01 -0.11 0.00 -2.93 0.00 0.00 61.98 57.95 1hin s VAL 111 Cb -0.15 -2.36 0.02 0.00 -1.53 0.00 0.00 36.38 32.37 1hin s VAL 111 CO -0.09 0.26 0.28 -0.44 -3.33 0.00 0.00 175.10 171.77 1hin s SER 112 N 1.32 -0.24 0.00 3.54 0.01 -0.92 -4.62 113.70 112.79 1hin s SER 112 Ca 0.01 0.39 0.28 0.00 1.31 0.00 0.00 55.95 57.94 1hin s SER 112 Cb -0.16 0.49 1.12 0.00 0.21 0.00 0.00 66.02 67.68 1hin s SER 112 CO -0.06 -0.21 1.79 0.00 0.41 0.00 0.00 173.24 175.17 1hin n ALA 113 N 2.39 2.76 -1.48 1.44 0.00 -1.26 -3.81 120.51 120.55 1hin n ALA 113 Ca -0.16 -0.36 -0.33 0.00 0.00 0.00 0.00 53.44 52.59 1hin n ALA 113 Cb 0.57 -1.24 0.05 0.00 0.00 0.00 0.00 19.45 18.83 1hin n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hin s ALA 114 N -2.25 2.46 0.26 0.00 0.00 -1.26 -5.05 121.76 115.92 1hin s ALA 114 Ca 0.33 0.49 0.09 0.00 0.00 0.00 0.00 51.96 52.87 1hin s ALA 114 Cb 0.20 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.97 1hin s ALA 114 CO 0.42 -1.32 -0.13 -1.59 0.00 0.00 0.00 175.76 173.14 1hin s LYS 115 N -4.23 1.52 -0.42 0.00 -2.85 -1.26 -5.04 119.74 107.47 1hin s LYS 115 Ca 0.66 -1.72 -0.28 0.00 -1.00 0.00 0.00 55.97 53.62 1hin s LYS 115 Cb -0.20 -1.33 -0.00 0.00 -2.06 0.00 0.00 37.83 34.24 1hin s LYS 115 CO 0.44 0.17 1.60 0.99 0.10 0.00 0.00 175.35 178.64 1hin s THR 116 N -2.85 3.68 -0.09 3.79 2.01 -1.26 -4.61 115.64 116.31 1hin s THR 116 Ca 0.27 0.66 0.01 0.00 0.31 0.00 0.00 61.69 62.95 1hin s THR 116 Cb 0.00 -4.00 -0.02 0.00 0.01 0.00 0.00 72.50 68.48 1hin s THR 116 CO 0.11 -0.70 -0.13 0.42 -0.69 0.00 0.00 174.62 173.64 1hin s THR 117 N 6.39 3.15 1.03 -0.82 -4.23 -0.90 -4.91 115.64 115.35 1hin s THR 117 Ca 0.67 -0.66 -0.14 0.00 -1.18 0.00 0.00 61.69 60.39 1hin s THR 117 Cb -0.16 -2.28 0.20 0.00 1.34 0.00 0.00 72.50 71.60 1hin s THR 117 CO 0.31 0.56 1.10 0.00 -0.54 0.00 0.00 174.62 176.05 1hin s ALA 118 N -0.24 0.97 0.92 3.99 0.00 -1.26 -0.36 121.76 125.78 1hin s ALA 118 Ca 0.01 -0.50 -0.15 0.00 0.00 0.00 0.00 51.96 51.32 1hin s ALA 118 Cb -0.13 -3.06 0.17 0.00 0.00 0.00 0.00 23.12 20.10 1hin s ALA 118 CO 0.03 -2.92 1.28 -1.25 0.00 0.00 0.00 175.76 172.90 1hin s PRO 119 N -5.09 0.98 -0.24 0.00 0.04 -1.26 -3.87 135.00 125.56 1hin s PRO 119 Ca 0.66 -0.26 0.01 0.00 0.04 0.00 0.00 61.00 61.46 1hin s PRO 119 Cb -0.17 -1.87 0.06 0.00 0.04 0.00 0.00 34.50 32.57 1hin s PRO 119 CO 0.57 -2.21 -0.04 -1.12 0.04 0.00 0.00 177.00 174.24 1hin s SER 120 N -4.78 3.92 -0.38 6.66 0.01 0.11 -4.92 113.70 114.32 1hin s SER 120 Ca 0.71 -1.25 -0.15 0.00 1.31 0.00 0.00 55.95 56.57 1hin s SER 120 Cb -0.06 -1.20 0.00 0.00 0.21 0.00 0.00 66.02 64.97 1hin s SER 120 CO 0.52 -0.25 0.32 -0.69 0.41 0.00 0.00 173.24 173.55 1hin s VAL 121 N 1.37 5.22 -0.21 3.43 1.01 -1.26 -1.62 120.40 128.34 1hin s VAL 121 Ca -0.04 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.56 1hin s VAL 121 Cb -0.19 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1hin s VAL 121 CO -0.07 -0.19 0.01 -0.31 0.00 0.00 0.00 175.10 174.54 1hin s TYR 122 N 1.84 3.05 -0.14 5.22 2.02 0.07 -4.99 117.35 124.41 1hin s TYR 122 Ca 0.08 -0.46 -0.29 0.00 -0.37 0.00 0.00 57.07 56.02 1hin s TYR 122 Cb -0.18 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.24 1hin s TYR 122 CO 0.11 -0.27 1.39 -1.25 -1.57 0.00 0.00 175.55 173.96 1hin s PRO 123 N 1.14 4.19 -0.58 -1.71 0.04 -1.26 -2.70 135.00 134.11 1hin s PRO 123 Ca 0.03 1.79 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 1hin s PRO 123 Cb -0.14 -3.84 0.15 0.00 0.04 0.00 0.00 34.50 30.70 1hin s PRO 123 CO 0.02 -0.79 0.39 -0.51 0.04 0.00 0.00 177.00 176.15 1hin s LEU 124 N 3.76 5.18 0.04 -3.56 1.43 0.25 -4.98 118.68 120.79 1hin s LEU 124 Ca 0.61 -2.72 -0.03 0.00 -1.03 0.00 0.00 54.13 50.95 1hin s LEU 124 Cb -0.25 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1hin s LEU 124 CO 0.20 -0.39 0.24 0.00 0.23 0.00 0.00 176.35 176.63 1hin s ALA 125 N 0.13 3.92 0.73 4.21 0.00 -1.26 -1.21 121.76 128.27 1hin s ALA 125 Ca 0.15 -0.70 -0.11 0.00 0.00 0.00 0.00 51.96 51.30 1hin s ALA 125 Cb -0.21 -1.96 0.03 0.00 0.00 0.00 0.00 23.12 20.98 1hin s ALA 125 CO -0.03 0.73 1.09 -1.25 0.00 0.00 0.00 175.76 176.29 1hin s PRO 126 N -2.15 2.62 -1.37 0.00 0.04 -1.26 -4.86 135.00 128.01 1hin s PRO 126 Ca 0.32 0.62 -0.11 0.00 0.04 0.00 0.00 61.00 61.87 1hin s PRO 126 Cb -0.13 -1.98 0.10 0.00 0.04 0.00 0.00 34.50 32.53 1hin s PRO 126 CO 0.21 -1.24 2.11 1.55 0.04 0.00 0.00 177.00 179.68 1hin n VAL 127 N -3.17 4.12 -1.52 -0.36 3.14 -1.26 -4.65 118.33 114.62 1hin n VAL 127 Ca 0.07 -3.80 0.00 0.00 -2.96 0.00 0.00 64.34 57.65 1hin n VAL 127 Cb 0.56 -2.44 0.00 0.00 -1.06 0.00 0.00 33.84 30.90 1hin n VAL 127 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1hin s GLY 129 N -0.27 1.77 -0.07 0.00 0.00 -1.26 -5.05 107.32 102.44 1hin s GLY 129 Ca 0.00 -1.64 -0.29 0.00 0.00 0.00 0.00 44.72 42.78 1hin s GLY 129 CO 0.00 0.69 1.79 0.51 0.00 0.00 0.00 173.10 176.09 1hin s ASP 130 N 1.37 6.44 0.00 1.64 1.47 -1.25 -3.57 116.67 122.77 1hin s ASP 130 Ca -0.01 2.23 0.00 0.00 1.18 0.00 0.00 52.55 55.94 1hin s ASP 130 Cb -0.19 -2.53 0.00 0.00 -0.34 0.00 0.00 42.92 39.86 1hin s ASP 130 CO 0.01 -1.12 0.00 0.35 0.68 0.00 0.00 175.17 175.09 1hin n THR 133 N 5.87 0.00 -2.86 2.11 -2.24 -0.59 -4.77 114.28 111.80 1hin n THR 133 Ca 0.19 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.71 1hin n THR 133 Cb 0.43 -0.04 -0.00 0.00 -2.10 0.00 0.00 70.33 68.61 1hin n THR 133 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1hin s THR 134 N 0.02 4.86 0.00 4.28 -4.23 -1.26 -4.73 115.64 114.57 1hin s THR 134 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 1hin s THR 134 Cb 0.00 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 70.02 1hin s THR 134 CO 0.00 -0.72 0.00 0.61 -0.54 0.00 0.00 174.62 173.97 1hin n GLY 135 N -2.13 2.84 2.72 3.99 0.00 -1.26 0.17 105.19 111.52 1hin n GLY 135 Ca -0.01 0.31 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 1hin n GLY 135 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hin s SER 136 N -4.00 3.92 0.00 1.61 0.15 -1.26 -5.11 113.70 109.01 1hin s SER 136 Ca 0.00 -1.83 0.00 0.00 0.70 0.00 0.00 55.95 54.82 1hin s SER 136 Cb 0.00 -0.87 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 1hin s SER 136 CO 0.00 -0.39 0.00 -1.54 1.20 0.00 0.00 173.24 172.51 1hin n SER 137 N 4.59 1.53 -3.66 5.45 3.41 0.45 -2.81 113.62 122.57 1hin n SER 137 Ca 0.00 -0.96 -0.06 0.00 -0.26 0.00 0.00 58.87 57.59 1hin n SER 137 Cb 0.40 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.28 1hin n SER 137 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1hin s VAL 138 N -0.45 -0.50 -0.04 -3.33 -7.23 0.89 -1.54 120.40 108.21 1hin s VAL 138 Ca 0.00 0.07 -0.25 0.00 -1.81 0.00 0.00 61.98 59.99 1hin s VAL 138 Cb 0.00 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 1hin s VAL 138 CO 0.00 0.03 0.76 -0.89 -0.31 0.00 0.00 175.10 174.69 1hin s THR 139 N 2.27 4.96 0.47 5.32 2.01 -1.23 -2.81 115.64 126.63 1hin s THR 139 Ca -0.06 1.58 0.05 0.00 0.31 0.00 0.00 61.69 63.57 1hin s THR 139 Cb -0.10 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.28 1hin s THR 139 CO -0.16 0.26 0.16 -0.76 -0.69 0.00 0.00 174.62 173.42 1hin s LEU 140 N 0.68 2.78 -0.15 4.42 1.43 -0.60 -4.41 118.68 122.84 1hin s LEU 140 Ca 0.40 -1.30 -0.33 0.00 -1.03 0.00 0.00 54.13 51.87 1hin s LEU 140 Cb -0.19 -1.13 0.13 0.00 0.03 0.00 0.00 46.19 45.03 1hin s LEU 140 CO 0.21 -0.73 1.13 -0.83 0.23 0.00 0.00 176.35 176.36 1hin s GLY 141 N -3.95 -0.31 -0.05 -3.19 0.00 -0.35 -2.62 107.32 96.86 1hin s GLY 141 Ca 0.30 1.58 -0.06 0.00 0.00 0.00 0.00 44.72 46.54 1hin s GLY 141 CO 0.17 0.56 0.15 0.00 0.00 0.00 0.00 173.10 173.98 1hin s LEU 143 N -0.19 1.60 -0.31 0.00 2.96 -1.10 -1.59 118.68 120.06 1hin s LEU 143 Ca -0.03 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.60 1hin s LEU 143 Cb -0.02 -0.86 0.08 0.00 0.50 0.00 0.00 46.19 45.89 1hin s LEU 143 CO 0.00 0.01 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.36 1hin s VAL 144 N 0.84 2.07 -0.09 1.68 1.01 0.08 -0.75 120.40 125.23 1hin s VAL 144 Ca -0.11 -1.97 -0.07 0.00 0.00 0.00 0.00 61.98 59.83 1hin s VAL 144 Cb -0.15 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 1hin s VAL 144 CO 0.02 -0.40 0.17 -0.54 0.00 0.00 0.00 175.10 174.35 1hin s LYS 145 N 1.06 3.47 -0.52 2.72 -0.14 -0.64 -1.63 119.74 124.06 1hin s LYS 145 Ca 0.04 -0.12 -0.01 0.00 -1.36 0.00 0.00 55.97 54.52 1hin s LYS 145 Cb -0.19 -3.18 0.00 0.00 -1.68 0.00 0.00 37.83 32.78 1hin s LYS 145 CO -0.08 0.76 0.11 0.41 -0.76 0.00 0.00 175.35 175.78 1hin n GLY 146 N 1.81 0.21 3.78 -3.33 0.00 -0.29 -0.72 105.19 106.66 1hin n GLY 146 Ca -0.18 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 1hin n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1hin s TYR 147 N -2.55 3.28 -0.07 1.61 -0.85 -1.23 -4.34 117.35 113.21 1hin s TYR 147 Ca 0.05 0.20 -0.07 0.00 -0.52 0.00 0.00 57.07 56.73 1hin s TYR 147 Cb -0.02 -1.73 0.02 0.00 0.38 0.00 0.00 41.96 40.61 1hin s TYR 147 CO 0.06 0.55 0.20 0.12 -1.52 0.00 0.00 175.55 174.96 1hin s PHE 148 N -1.22 -0.19 0.00 -3.49 5.36 0.51 -0.72 117.98 118.24 1hin s PHE 148 Ca 0.24 0.46 0.00 0.00 -0.96 0.00 0.00 56.93 56.67 1hin s PHE 148 Cb -0.12 0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.62 1hin s PHE 148 CO 0.15 -0.13 0.00 -0.35 -1.46 0.00 0.00 175.22 173.43 1hin n PRO 149 N 2.77 0.00 -3.65 10.12 -0.04 -1.26 -2.12 135.00 140.82 1hin n PRO 149 Ca -0.14 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.21 1hin n PRO 149 Cb 0.58 -0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.99 1hin n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1hin s GLU 150 N 0.00 1.00 0.53 0.54 0.41 -1.26 -4.83 118.70 115.09 1hin s GLU 150 Ca 0.00 -0.59 0.07 0.00 -0.41 0.00 0.00 54.97 54.04 1hin s GLU 150 Cb 0.00 0.44 0.04 0.00 -1.78 0.00 0.00 34.13 32.84 1hin s GLU 150 CO 0.00 -0.37 0.51 -1.25 -0.49 0.00 0.00 175.26 173.66 1hin s PRO 151 N -3.32 2.32 0.53 0.39 0.04 -1.26 -4.77 135.00 128.92 1hin s PRO 151 Ca -0.00 -1.84 0.07 0.00 0.04 0.00 0.00 61.00 59.28 1hin s PRO 151 Cb 0.01 -2.30 0.04 0.00 0.04 0.00 0.00 34.50 32.29 1hin s PRO 151 CO -0.08 -0.62 0.52 0.14 0.04 0.00 0.00 177.00 177.00 1hin s VAL 152 N -2.69 2.02 -0.08 -0.36 -7.23 -1.26 -3.99 120.40 106.80 1hin s VAL 152 Ca 0.44 -1.30 -0.04 0.00 -1.81 0.00 0.00 61.98 59.27 1hin s VAL 152 Cb -0.03 -2.32 0.04 0.00 0.56 0.00 0.00 36.38 34.62 1hin s VAL 152 CO 0.27 0.00 0.19 -0.89 -0.31 0.00 0.00 175.10 174.36 1hin s THR 153 N -2.67 -0.04 -0.31 5.32 2.01 0.43 -4.97 115.64 115.40 1hin s THR 153 Ca 0.46 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.63 1hin s THR 153 Cb -0.04 -0.30 0.09 0.00 0.01 0.00 0.00 72.50 72.27 1hin s THR 153 CO 0.28 0.06 0.04 -0.22 -0.69 0.00 0.00 174.62 174.09 1hin s LEU 154 N 1.14 3.79 0.44 4.42 2.96 -1.26 -1.63 118.68 128.53 1hin s LEU 154 Ca -0.09 -1.85 0.07 0.00 -0.22 0.00 0.00 54.13 52.05 1hin s LEU 154 Cb -0.10 -1.38 -0.01 0.00 0.50 0.00 0.00 46.19 45.19 1hin s LEU 154 CO -0.07 -0.36 0.37 0.42 -1.32 0.00 0.00 176.35 175.40 1hin s THR 156 N 1.15 2.48 -0.09 3.68 -4.23 -0.83 -4.93 115.64 112.87 1hin s THR 156 Ca 0.07 -1.39 0.03 0.00 -1.18 0.00 0.00 61.69 59.22 1hin s THR 156 Cb -0.19 -2.87 0.01 0.00 1.34 0.00 0.00 72.50 70.79 1hin s THR 156 CO -0.12 0.00 -0.19 0.26 -0.54 0.00 0.00 174.62 174.03 1hin s TRP 157 N -2.53 2.16 -1.44 3.99 0.52 -1.26 -0.51 118.94 119.87 1hin s TRP 157 Ca 0.46 -0.89 -0.11 0.00 0.02 0.00 0.00 56.10 55.58 1hin s TRP 157 Cb -0.02 -1.49 0.02 0.00 -1.15 0.00 0.00 33.47 30.83 1hin s TRP 157 CO 0.27 -0.39 0.21 0.09 0.02 0.00 0.00 176.95 177.14 1hin n ASN 162 N 3.71 -0.59 -2.82 2.95 3.02 -0.50 -1.46 115.26 119.58 1hin n ASN 162 Ca -0.20 -1.28 -0.22 0.00 -0.03 0.00 0.00 54.58 52.85 1hin n ASN 162 Cb 0.52 -1.58 0.02 0.00 -0.61 0.00 0.00 39.78 38.13 1hin n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1hin n SER 163 N -2.63 -5.85 0.00 6.41 7.64 -1.26 0.13 113.62 118.05 1hin n SER 163 Ca -0.26 -0.19 0.00 0.00 1.01 0.00 0.00 58.87 59.43 1hin n SER 163 Cb 0.65 -4.79 0.00 0.00 -1.01 0.00 0.00 64.21 59.06 1hin n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hin n GLY 164 N -1.32 2.37 0.29 0.23 0.00 -0.53 -4.81 105.19 101.42 1hin n GLY 164 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.86 1hin n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1hin h SER 165 N 0.00 0.62 -3.42 1.61 0.02 -0.29 -3.26 113.55 108.83 1hin h SER 165 Ca 0.00 -0.11 -0.70 0.00 -0.84 0.00 0.00 61.79 60.14 1hin h SER 165 Cb 0.00 -0.16 -0.20 0.00 0.14 0.00 0.00 62.40 62.18 1hin h SER 165 CO 0.00 0.63 -0.21 -0.22 -1.14 0.00 0.00 176.83 175.90 1hin s LEU 166 N -9.21 5.08 -0.08 5.07 0.20 -0.83 -4.75 118.68 114.15 1hin s LEU 166 Ca -0.09 -0.89 0.10 0.00 0.69 0.00 0.00 54.13 53.94 1hin s LEU 166 Cb 0.16 -2.33 -0.14 0.00 -0.43 0.00 0.00 46.19 43.45 1hin s LEU 166 CO 0.78 -0.64 0.09 -1.20 -0.29 0.00 0.00 176.35 175.09 1hin n SER 167 N 5.58 2.49 -4.92 3.68 7.64 -1.23 -4.12 113.62 122.74 1hin n SER 167 Ca -0.09 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.53 1hin n SER 167 Cb 0.46 0.97 -0.00 0.00 -1.01 0.00 0.00 64.21 64.63 1hin n SER 167 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1hin s SER 168 N -3.97 6.20 0.00 6.43 0.01 -1.26 -4.05 113.70 117.06 1hin s SER 168 Ca -0.05 0.77 0.00 0.00 1.31 0.00 0.00 55.95 57.98 1hin s SER 168 Cb 0.04 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 64.15 1hin s SER 168 CO 0.43 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 174.13 1hin n GLY 169 N -2.17 2.48 3.73 3.44 0.00 -1.26 -4.25 105.19 107.16 1hin n GLY 169 Ca -0.00 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 1hin n GLY 169 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hin s VAL 171 N -0.20 4.39 -0.00 1.61 0.11 -1.23 -3.93 120.40 121.16 1hin s VAL 171 Ca 0.00 1.92 0.02 0.00 -2.93 0.00 0.00 61.98 60.99 1hin s VAL 171 Cb 0.00 -4.23 -0.04 0.00 -1.53 0.00 0.00 36.38 30.59 1hin s VAL 171 CO 0.00 0.26 -0.02 -1.00 -3.33 0.00 0.00 175.10 171.02 1hin s HIS 172 N 0.22 3.02 -0.15 1.54 3.76 -1.08 -4.96 115.29 117.65 1hin s HIS 172 Ca 0.49 0.05 -0.01 0.00 -0.15 0.00 0.00 55.06 55.44 1hin s HIS 172 Cb -0.25 -1.65 0.04 0.00 1.11 0.00 0.00 32.58 31.83 1hin s HIS 172 CO 0.31 0.44 -0.03 0.99 -0.85 0.00 0.00 174.74 175.59 1hin s THR 173 N -1.06 0.85 0.18 1.30 2.01 -1.26 -1.82 115.64 115.83 1hin s THR 173 Ca 0.19 -0.43 -0.30 0.00 0.31 0.00 0.00 61.69 61.46 1hin s THR 173 Cb -0.11 -1.06 -0.08 0.00 0.01 0.00 0.00 72.50 71.25 1hin s THR 173 CO 0.09 0.12 1.27 -0.36 -0.69 0.00 0.00 174.62 175.06 1hin s PHE 174 N 1.75 3.32 0.96 4.92 0.08 0.55 -4.99 117.98 124.57 1hin s PHE 174 Ca 0.02 1.26 -0.13 0.00 0.12 0.00 0.00 56.93 58.20 1hin s PHE 174 Cb -0.15 -3.54 0.05 0.00 -0.57 0.00 0.00 43.02 38.80 1hin s PHE 174 CO -0.07 -1.68 0.41 -0.35 -0.10 0.00 0.00 175.22 173.43 1hin n PRO 175 N 2.81 -0.38 -2.00 0.24 -0.04 -1.26 -3.62 135.00 130.75 1hin n PRO 175 Ca 0.06 -0.07 -0.37 0.00 -0.04 0.00 0.00 63.50 63.08 1hin n PRO 175 Cb 0.44 -1.87 0.03 0.00 -0.04 0.00 0.00 33.50 32.06 1hin n PRO 175 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hin s ALA 176 N -2.40 2.69 0.16 0.55 0.00 -1.25 -4.50 121.76 117.01 1hin s ALA 176 Ca 0.57 1.08 -0.13 0.00 0.00 0.00 0.00 51.96 53.48 1hin s ALA 176 Cb -0.21 -3.47 0.01 0.00 0.00 0.00 0.00 23.12 19.46 1hin s ALA 176 CO 0.67 -1.12 0.38 0.08 0.00 0.00 0.00 175.76 175.77 1hin s VAL 177 N -1.51 0.06 -0.19 0.00 1.01 -0.40 -4.95 120.40 114.42 1hin s VAL 177 Ca 0.73 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.71 1hin s VAL 177 Cb -0.33 -1.57 0.05 0.00 0.00 0.00 0.00 36.38 34.53 1hin s VAL 177 CO 0.37 -0.28 -0.07 -0.22 0.00 0.00 0.00 175.10 174.90 1hin s LEU 178 N -2.89 2.02 0.00 3.92 2.96 -1.26 0.14 118.68 123.57 1hin s LEU 178 Ca 0.10 -0.85 0.00 0.00 -0.22 0.00 0.00 54.13 53.16 1hin s LEU 178 Cb 0.02 -1.07 0.00 0.00 0.50 0.00 0.00 46.19 45.64 1hin s LEU 178 CO -0.04 -0.19 0.00 0.00 -1.32 0.00 0.00 176.35 174.80 1hin n GLN 179 N 4.77 0.00 -0.75 1.98 -0.00 0.12 -4.70 117.38 118.81 1hin n GLN 179 Ca -0.13 0.00 -0.27 0.00 -0.00 0.00 0.00 57.00 56.60 1hin n GLN 179 Cb 0.47 0.00 -0.08 0.00 -0.00 0.00 0.00 30.24 30.63 1hin n GLN 179 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1hin n SER 180 N 0.00 0.31 -1.39 2.61 7.64 -1.26 -3.68 113.62 117.86 1hin n SER 180 Ca 0.00 -1.86 0.00 0.00 1.01 0.00 0.00 58.87 58.02 1hin n SER 180 Cb 0.00 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 1hin n SER 180 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1hin n ASP 183 N 8.04 -0.40 -4.44 6.43 5.68 -1.26 -4.93 116.55 125.67 1hin n ASP 183 Ca 0.31 0.20 -0.21 0.00 -0.50 0.00 0.00 54.79 54.58 1hin n ASP 183 Cb 0.38 -0.55 -0.10 0.00 -1.14 0.00 0.00 41.12 39.70 1hin n ASP 183 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1hin s LEU 184 N -2.61 2.39 0.48 -2.12 1.43 -1.24 -4.93 118.68 112.08 1hin s LEU 184 Ca 0.00 -1.26 0.08 0.00 -1.03 0.00 0.00 54.13 51.92 1hin s LEU 184 Cb 0.00 -0.54 0.02 0.00 0.03 0.00 0.00 46.19 45.69 1hin s LEU 184 CO 0.00 -0.44 0.49 -0.31 0.23 0.00 0.00 176.35 176.32 1hin s TYR 185 N -3.11 2.19 -0.09 0.29 1.51 0.11 0.15 117.35 118.39 1hin s TYR 185 Ca 0.32 -0.62 -0.08 0.00 -1.01 0.00 0.00 57.07 55.69 1hin s TYR 185 Cb 0.06 -2.14 0.03 0.00 -0.11 0.00 0.00 41.96 39.79 1hin s TYR 185 CO 0.13 -0.45 0.23 0.99 -1.11 0.00 0.00 175.55 175.34 1hin s THR 186 N -2.57 -0.01 0.03 -0.71 2.01 0.12 -1.14 115.64 113.37 1hin s THR 186 Ca 0.48 0.02 -0.02 0.00 0.31 0.00 0.00 61.69 62.48 1hin s THR 186 Cb -0.04 -0.33 -0.02 0.00 0.01 0.00 0.00 72.50 72.12 1hin s THR 186 CO 0.29 0.01 0.01 -0.22 -0.69 0.00 0.00 174.62 174.01 1hin s LEU 187 N 0.26 2.16 0.05 4.42 2.96 -0.65 -1.28 118.68 126.59 1hin s LEU 187 Ca -0.01 -0.58 -0.16 0.00 -0.22 0.00 0.00 54.13 53.15 1hin s LEU 187 Cb -0.03 0.26 0.03 0.00 0.50 0.00 0.00 46.19 46.95 1hin s LEU 187 CO -0.01 -0.40 0.37 -0.94 -1.32 0.00 0.00 176.35 174.05 1hin s SER 188 N -1.87 -0.22 0.07 3.68 1.04 -1.24 -0.74 113.70 114.43 1hin s SER 188 Ca -0.09 -0.09 -0.09 0.00 0.48 0.00 0.00 55.95 56.16 1hin s SER 188 Cb -0.05 0.40 -0.00 0.00 0.10 0.00 0.00 66.02 66.47 1hin s SER 188 CO -0.03 -0.65 0.18 -0.94 0.98 0.00 0.00 173.24 172.78 1hin s SER 189 N -2.04 0.10 -0.34 7.02 1.04 -0.62 -0.33 113.70 118.52 1hin s SER 189 Ca -0.05 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 55.85 1hin s SER 189 Cb -0.01 0.31 0.10 0.00 0.10 0.00 0.00 66.02 66.52 1hin s SER 189 CO -0.03 -0.65 0.06 -0.94 0.98 0.00 0.00 173.24 172.66 1hin s SER 190 N -2.55 4.84 0.06 7.02 1.04 -0.76 -1.71 113.70 121.65 1hin s SER 190 Ca 0.01 -2.00 -0.29 0.00 0.48 0.00 0.00 55.95 54.14 1hin s SER 190 Cb 0.03 -1.67 -0.05 0.00 0.10 0.00 0.00 66.02 64.43 1hin s SER 190 CO -0.08 -0.39 0.94 0.54 0.98 0.00 0.00 173.24 175.23 1hin s VAL 191 N 0.99 4.66 -0.06 5.02 0.11 -1.08 -2.62 120.40 127.42 1hin s VAL 191 Ca 0.07 2.01 0.06 0.00 -2.93 0.00 0.00 61.98 61.19 1hin s VAL 191 Cb -0.20 -4.29 -0.01 0.00 -1.53 0.00 0.00 36.38 30.35 1hin s VAL 191 CO -0.07 0.27 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.84 1hin s THR 192 N 0.35 2.08 0.12 5.04 2.01 -1.25 -1.55 115.64 122.43 1hin s THR 192 Ca 0.47 -1.05 0.03 0.00 0.31 0.00 0.00 61.69 61.45 1hin s THR 192 Cb -0.22 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 1hin s THR 192 CO 0.28 0.57 -0.09 0.68 -0.69 0.00 0.00 174.62 175.37 1hin s VAL 193 N -0.10 0.95 -0.36 3.82 -7.23 -1.12 -4.01 120.40 112.34 1hin s VAL 193 Ca -0.06 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 57.86 1hin s VAL 193 Cb -0.14 -1.73 0.02 0.00 0.56 0.00 0.00 36.38 35.09 1hin s VAL 193 CO 0.04 -0.78 1.09 0.42 -0.31 0.00 0.00 175.10 175.56 1hin s THR 194 N -3.37 4.43 0.00 5.32 -4.23 -1.26 -0.08 115.64 116.45 1hin s THR 194 Ca 0.14 1.59 0.00 0.00 -1.18 0.00 0.00 61.69 62.24 1hin s THR 194 Cb 0.03 -4.47 0.00 0.00 1.34 0.00 0.00 72.50 69.41 1hin s THR 194 CO -0.02 -0.62 0.00 -1.20 -0.54 0.00 0.00 174.62 172.24 1hin n SER 195 N 7.13 0.00 -0.04 3.99 7.64 -1.12 -2.41 113.62 128.80 1hin n SER 195 Ca 0.12 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.04 1hin n SER 195 Cb 0.48 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.75 1hin n SER 195 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1hin n SER 196 N 0.00 0.03 -0.04 6.43 3.41 -1.26 0.74 113.62 122.93 1hin n SER 196 Ca 0.00 0.22 -0.10 0.00 -0.26 0.00 0.00 58.87 58.73 1hin n SER 196 Cb 0.00 -0.10 -0.07 0.00 -0.26 0.00 0.00 64.21 63.78 1hin n SER 196 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1hin h THR 198 N 0.00 0.00 -3.06 6.66 2.02 -1.83 -3.26 112.91 113.45 1hin h THR 198 Ca 0.11 0.00 -0.61 0.00 0.77 0.00 0.00 66.41 66.68 1hin h THR 198 Cb 0.27 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.61 1hin h THR 198 CO -0.11 0.00 -0.25 0.86 0.37 0.00 0.00 175.52 176.39 1hin s TRP 199 N -4.81 3.64 -1.75 3.16 -0.00 0.23 0.70 118.94 120.10 1hin s TRP 199 Ca -0.10 0.85 0.08 0.00 -0.00 0.00 0.00 56.10 56.93 1hin s TRP 199 Cb 0.05 -2.29 0.26 0.00 -0.00 0.00 0.00 33.47 31.49 1hin s TRP 199 CO 0.41 0.52 1.16 -2.30 -0.00 0.00 0.00 176.95 176.75 1hin n PRO 200 N 2.39 1.81 -0.01 5.86 -0.02 -1.26 -4.66 135.00 139.10 1hin n PRO 200 Ca -0.13 -1.04 -0.10 0.00 -2.02 0.00 0.00 63.50 60.20 1hin n PRO 200 Cb 0.52 -1.33 -0.08 0.00 -0.02 0.00 0.00 33.50 32.59 1hin n PRO 200 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1hin h SER 202 N 1.61 -0.08 -3.29 2.55 0.02 -1.07 -3.44 113.55 109.85 1hin h SER 202 Ca 0.00 -0.53 -0.57 0.00 -0.84 0.00 0.00 61.79 59.85 1hin h SER 202 Cb 0.51 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.01 1hin h SER 202 CO 0.04 0.62 -0.05 -1.58 -1.14 0.00 0.00 176.83 174.71 1hin s GLN 203 N -2.77 4.30 0.28 3.45 -0.44 0.22 -5.05 119.66 119.65 1hin s GLN 203 Ca -0.13 0.64 -0.30 0.00 -2.50 0.00 0.00 55.36 53.07 1hin s GLN 203 Cb -0.01 -3.36 -0.13 0.00 -1.64 0.00 0.00 33.01 27.87 1hin s GLN 203 CO 0.49 0.32 1.43 0.45 0.50 0.00 0.00 175.29 178.47 1hin n SER 204 N 2.97 3.07 -3.90 6.67 2.88 -1.26 -4.26 113.62 119.79 1hin n SER 204 Ca -0.07 1.16 -0.19 0.00 -1.33 0.00 0.00 58.87 58.44 1hin n SER 204 Cb 0.51 -1.49 -0.16 0.00 -0.75 0.00 0.00 64.21 62.32 1hin n SER 204 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1hin s ILE 205 N -0.35 0.50 -0.06 2.46 1.09 -1.26 -4.99 121.20 118.59 1hin s ILE 205 Ca 0.63 -0.13 -0.04 0.00 -1.10 0.00 0.00 60.65 60.02 1hin s ILE 205 Cb -0.58 -0.52 0.02 0.00 -1.06 0.00 0.00 42.46 40.32 1hin s ILE 205 CO 0.53 0.21 0.14 -0.89 -0.10 0.00 0.00 174.94 174.83 1hin s THR 206 N 0.78 -0.02 -0.32 2.92 2.01 -1.26 -2.71 115.64 117.04 1hin s THR 206 Ca -0.10 0.08 -0.20 0.00 0.31 0.00 0.00 61.69 61.78 1hin s THR 206 Cb -0.13 -0.22 -0.01 0.00 0.01 0.00 0.00 72.50 72.16 1hin s THR 206 CO 0.00 0.03 0.62 0.00 -0.69 0.00 0.00 174.62 174.58 1hin s ASN 209 N 1.70 5.59 -0.03 0.00 -0.87 0.33 0.66 114.94 122.33 1hin s ASN 209 Ca 0.24 0.17 0.00 0.00 -1.57 0.00 0.00 52.86 51.70 1hin s ASN 209 Cb -0.15 -1.61 0.03 0.00 -0.02 0.00 0.00 41.25 39.50 1hin s ASN 209 CO 0.13 0.32 0.02 -0.69 -2.57 0.00 0.00 177.10 174.30 1hin s VAL 210 N -1.08 0.07 -0.18 1.60 1.01 0.14 -1.96 120.40 119.99 1hin s VAL 210 Ca 0.19 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.31 1hin s VAL 210 Cb -0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 36.38 36.06 1hin s VAL 210 CO 0.09 0.13 -0.09 0.00 0.00 0.00 0.00 175.10 175.23 1hin s ALA 211 N 1.12 2.70 -0.41 5.51 0.00 -0.64 -0.44 121.76 129.59 1hin s ALA 211 Ca -0.09 -1.07 0.04 0.00 0.00 0.00 0.00 51.96 50.84 1hin s ALA 211 Cb -0.13 -1.47 0.11 0.00 0.00 0.00 0.00 23.12 21.62 1hin s ALA 211 CO -0.02 -0.17 0.13 -1.58 0.00 0.00 0.00 175.76 174.11 1hin s HIS 212 N 1.04 3.49 0.57 0.00 2.46 0.13 -0.43 115.29 122.55 1hin s HIS 212 Ca -0.00 -3.04 0.29 0.00 0.47 0.00 0.00 55.06 52.78 1hin s HIS 212 Cb -0.15 -2.85 1.76 0.00 -0.13 0.00 0.00 32.58 31.21 1hin s HIS 212 CO -0.01 -0.87 2.23 -1.00 -2.47 0.00 0.00 174.74 172.62 1hin h PRO 213 N 7.20 0.00 0.00 2.88 0.13 -1.78 0.66 132.00 141.08 1hin h PRO 213 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1hin h PRO 213 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1hin h PRO 213 CO 0.58 0.02 0.00 0.00 -0.23 0.00 0.00 178.00 178.37 1hin n ALA 214 N -2.33 2.28 0.30 -0.56 0.00 -1.26 -3.39 120.51 115.55 1hin n ALA 214 Ca -0.03 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.41 1hin n ALA 214 Cb 0.10 -1.47 0.02 0.00 0.00 0.00 0.00 19.45 18.11 1hin n ALA 214 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1hin n SER 215 N -2.15 1.44 -2.25 0.00 3.41 -1.20 -5.00 113.62 107.88 1hin n SER 215 Ca 0.06 -1.22 -0.13 0.00 -0.26 0.00 0.00 58.87 57.32 1hin n SER 215 Cb 0.41 0.12 0.05 0.00 -0.26 0.00 0.00 64.21 64.53 1hin n SER 215 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1hin n SER 216 N 0.22 -4.14 -4.23 4.04 7.64 -1.08 -5.00 113.62 111.07 1hin n SER 216 Ca 0.04 -0.31 -0.36 0.00 1.01 0.00 0.00 58.87 59.25 1hin n SER 216 Cb 0.17 -3.04 -0.13 0.00 -1.01 0.00 0.00 64.21 60.20 1hin n SER 216 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1hin s THR 217 N -3.18 3.34 -0.03 0.44 -4.23 0.20 -4.98 115.64 107.21 1hin s THR 217 Ca 0.29 -1.19 -0.03 0.00 -1.18 0.00 0.00 61.69 59.58 1hin s THR 217 Cb -0.13 -2.87 -0.04 0.00 1.34 0.00 0.00 72.50 70.81 1hin s THR 217 CO 0.41 -0.08 0.16 -0.54 -0.54 0.00 0.00 174.62 174.03 1hin s LYS 218 N 1.34 3.37 0.05 3.99 3.01 -1.26 0.20 119.74 130.44 1hin s LYS 218 Ca -0.03 -0.32 -0.17 0.00 -1.01 0.00 0.00 55.97 54.44 1hin s LYS 218 Cb -0.19 -3.07 0.03 0.00 -1.01 0.00 0.00 37.83 33.60 1hin s LYS 218 CO 0.00 0.69 0.39 0.08 0.51 0.00 0.00 175.35 177.02 1hin s VAL 219 N -1.26 0.06 -0.05 3.17 1.01 0.41 -4.99 120.40 118.77 1hin s VAL 219 Ca 0.25 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 1hin s VAL 219 Cb -0.12 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1hin s VAL 219 CO 0.16 -0.28 0.12 -1.81 0.00 0.00 0.00 175.10 173.28 1hin s ASP 220 N -2.09 -0.11 -0.11 3.32 1.11 -1.26 0.24 116.67 117.77 1hin s ASP 220 Ca -0.04 0.23 -0.00 0.00 0.18 0.00 0.00 52.55 52.92 1hin s ASP 220 Cb -0.01 0.22 0.02 0.00 1.07 0.00 0.00 42.92 44.23 1hin s ASP 220 CO -0.03 -0.06 -0.08 -0.54 1.18 0.00 0.00 175.17 175.64 1hin s LYS 221 N 0.23 1.51 -0.12 8.23 -0.14 0.21 -4.93 119.74 124.73 1hin s LYS 221 Ca -0.01 -0.25 -0.29 0.00 -1.36 0.00 0.00 55.97 54.05 1hin s LYS 221 Cb -0.02 -1.55 -0.01 0.00 -1.68 0.00 0.00 37.83 34.57 1hin s LYS 221 CO -0.01 -0.24 1.03 0.21 -0.76 0.00 0.00 175.35 175.58 1hin s LYS 222 N 1.63 4.39 0.26 1.68 2.20 -1.26 -0.22 119.74 128.42 1hin s LYS 222 Ca 0.03 1.42 -0.29 0.00 -0.36 0.00 0.00 55.97 56.77 1hin s LYS 222 Cb -0.13 -3.56 -0.09 0.00 -1.51 0.00 0.00 37.83 32.54 1hin s LYS 222 CO -0.07 -0.38 0.97 0.42 -0.36 0.00 0.00 175.35 175.92 1hin s ILE 223 N 2.23 3.99 -0.28 5.43 1.01 -1.10 -4.89 121.20 127.60 1hin s ILE 223 Ca 0.48 1.95 -0.22 0.00 0.00 0.00 0.00 60.65 62.86 1hin s ILE 223 Cb -0.18 -4.21 0.11 0.00 0.01 0.00 0.00 42.46 38.18 1hin s ILE 223 CO 0.16 0.42 0.89 -0.70 0.00 0.00 0.00 174.94 175.71 1hin s GLU 226 N -1.37 0.61 0.00 2.79 2.56 -1.26 -4.71 118.70 117.32 1hin s GLU 226 Ca 0.43 0.81 0.00 0.00 0.00 0.00 0.00 54.97 56.21 1hin s GLU 226 Cb -0.26 0.25 0.00 0.00 2.00 0.00 0.00 34.13 36.12 1hin s GLU 226 CO 0.32 -0.09 0.01 -2.30 -0.56 0.00 0.00 175.26 172.64 1hin n PRO 227 N 2.88 0.00 0.00 4.30 -0.02 -1.26 -4.86 135.00 136.03 1hin n PRO 227 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1hin n PRO 227 Cb 0.56 -0.18 0.00 0.00 -0.02 0.00 0.00 33.50 33.86 1hin n PRO 227 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37