#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bhy n SER 118 N 0.00 0.00 -3.34 1.61 2.88 -1.26 -5.07 113.62 108.44 1bhy n SER 118 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 1bhy n SER 118 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 1bhy n SER 118 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bhy s ALA 119 N -1.00 -0.88 -0.05 -1.46 0.00 -1.26 -5.07 121.76 112.03 1bhy s ALA 119 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.78 1bhy s ALA 119 Cb 0.00 -1.98 0.02 0.00 0.00 0.00 0.00 23.12 21.16 1bhy s ALA 119 CO 0.00 -1.77 0.27 0.34 0.00 0.00 0.00 175.76 174.60 1bhy s ASP 120 N 2.40 -0.20 -0.12 0.00 -1.08 -1.19 0.13 116.67 116.61 1bhy s ASP 120 Ca 0.10 0.26 -0.21 0.00 -0.52 0.00 0.00 52.55 52.18 1bhy s ASP 120 Cb -0.13 0.42 0.05 0.00 -1.46 0.00 0.00 42.92 41.80 1bhy s ASP 120 CO -0.30 -0.27 0.52 0.00 0.52 0.00 0.00 175.17 175.64 1bhy s ALA 121 N -0.65 -1.31 -0.14 3.66 0.00 0.14 -4.87 121.76 118.59 1bhy s ALA 121 Ca -0.07 1.19 -0.01 0.00 0.00 0.00 0.00 51.96 53.06 1bhy s ALA 121 Cb -0.04 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 1bhy s ALA 121 CO 0.02 -0.28 -0.09 -2.00 0.00 0.00 0.00 175.76 173.40 1bhy s GLU 122 N -0.45 3.46 0.03 0.00 2.56 -1.26 0.22 118.70 123.27 1bhy s GLU 122 Ca -0.06 -0.61 -0.06 0.00 0.00 0.00 0.00 54.97 54.24 1bhy s GLU 122 Cb -0.03 -2.74 -0.01 0.00 2.00 0.00 0.00 34.13 33.35 1bhy s GLU 122 CO 0.04 0.25 0.10 0.71 -0.56 0.00 0.00 175.26 175.80 1bhy s TYR 123 N 0.28 0.18 0.06 5.30 1.51 0.39 -4.91 117.35 120.16 1bhy s TYR 123 Ca -0.07 -0.47 -0.34 0.00 -1.01 0.00 0.00 57.07 55.19 1bhy s TYR 123 Cb -0.15 -0.13 -0.19 0.00 -0.11 0.00 0.00 41.96 41.38 1bhy s TYR 123 CO 0.04 -0.36 1.53 -0.44 -1.11 0.00 0.00 175.55 175.22 1bhy h ASP 124 N 3.72 -0.89 -3.84 2.29 3.32 -1.50 0.61 116.42 120.13 1bhy h ASP 124 Ca -0.32 0.02 -0.40 0.00 0.02 0.00 0.00 57.03 56.35 1bhy h ASP 124 Cb 1.19 0.23 -0.30 0.00 0.22 0.00 0.00 39.33 40.66 1bhy h ASP 124 CO 0.49 -0.61 -0.78 -0.69 -1.72 0.00 0.00 179.24 175.94 1bhy s VAL 125 N -5.82 0.67 -0.18 -1.35 1.01 -0.96 0.14 120.40 113.91 1bhy s VAL 125 Ca -0.18 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.49 1bhy s VAL 125 Cb 0.03 -0.59 0.04 0.00 0.00 0.00 0.00 36.38 35.85 1bhy s VAL 125 CO 0.59 0.21 -0.09 -0.69 0.00 0.00 0.00 175.10 175.12 1bhy s VAL 126 N 0.13 1.44 -0.25 2.92 1.01 -0.81 -0.36 120.40 124.48 1bhy s VAL 126 Ca -0.02 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 1bhy s VAL 126 Cb -0.07 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1bhy s VAL 126 CO 0.00 0.19 0.11 0.54 0.00 0.00 0.00 175.10 175.94 1bhy s VAL 127 N 1.49 4.71 -0.85 2.92 0.11 0.15 -0.95 120.40 127.97 1bhy s VAL 127 Ca 0.00 -0.04 -0.22 0.00 -2.93 0.00 0.00 61.98 58.79 1bhy s VAL 127 Cb -0.15 -3.21 0.08 0.00 -1.53 0.00 0.00 36.38 31.56 1bhy s VAL 127 CO -0.08 0.32 1.19 -0.22 -3.33 0.00 0.00 175.10 172.98 1bhy s LEU 128 N 1.53 4.16 0.00 2.54 2.96 -0.78 -0.53 118.68 128.57 1bhy s LEU 128 Ca 0.06 -1.35 0.00 0.00 -0.22 0.00 0.00 54.13 52.63 1bhy s LEU 128 Cb -0.15 -2.48 0.00 0.00 0.50 0.00 0.00 46.19 44.06 1bhy s LEU 128 CO 0.06 -1.41 0.00 0.61 -1.32 0.00 0.00 176.35 174.29 1bhy n GLY 129 N 5.80 3.98 0.51 7.98 0.00 0.37 -1.63 105.19 122.21 1bhy n GLY 129 Ca 0.15 -1.29 0.07 0.00 0.00 0.00 0.00 46.02 44.95 1bhy n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bhy n GLY 130 N -0.38 4.79 0.00 -0.02 0.00 -1.26 -4.40 105.19 103.92 1bhy n GLY 130 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1bhy n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bhy n GLY 131 N -1.15 -3.25 0.31 -0.02 0.00 -1.26 0.13 105.19 99.95 1bhy n GLY 131 Ca 0.20 -1.31 -0.02 0.00 0.00 0.00 0.00 46.02 44.90 1bhy n GLY 131 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bhy h PRO 132 N 0.00 0.96 0.00 1.61 0.11 -1.92 0.23 132.00 133.00 1bhy h PRO 132 Ca 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1bhy h PRO 132 Cb 0.00 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 30.89 1bhy h PRO 132 CO 0.00 0.64 0.00 0.41 -0.21 0.00 0.00 178.00 178.84 1bhy n GLY 133 N -1.32 -2.82 0.34 -0.55 0.00 -1.26 -2.81 105.19 96.77 1bhy n GLY 133 Ca 0.10 0.09 0.02 0.00 0.00 0.00 0.00 46.02 46.22 1bhy n GLY 133 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bhy h GLY 134 N 0.00 0.43 2.00 -0.02 0.00 -1.75 0.15 103.07 103.88 1bhy h GLY 134 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1bhy h GLY 134 CO 0.00 -0.29 0.00 0.10 0.00 0.00 0.00 176.54 176.35 1bhy h TYR 135 N -0.02 0.00 0.08 5.60 -0.00 -0.65 0.74 116.97 122.71 1bhy h TYR 135 Ca 0.38 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 59.11 1bhy h TYR 135 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.35 1bhy h TYR 135 CO -0.72 0.00 -0.04 0.77 -0.00 0.00 0.00 178.16 178.17 1bhy h SER 136 N 0.00 -0.09 0.03 0.10 0.02 -0.98 0.65 113.55 113.28 1bhy h SER 136 Ca 0.00 -0.51 0.03 0.00 -0.84 0.00 0.00 61.79 60.47 1bhy h SER 136 Cb 0.76 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 63.27 1bhy h SER 136 CO 0.00 0.56 -0.37 0.00 -1.14 0.00 0.00 176.83 175.88 1bhy h ALA 137 N -0.13 -0.59 -0.36 3.77 0.00 -0.63 0.40 119.26 121.72 1bhy h ALA 137 Ca -0.01 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.94 1bhy h ALA 137 Cb 0.60 0.64 -0.08 0.00 0.00 0.00 0.00 17.79 18.95 1bhy h ALA 137 CO 0.02 -0.90 -0.18 0.00 0.00 0.00 0.00 179.25 178.19 1bhy h ALA 138 N 0.07 0.09 0.00 0.00 0.00 0.48 -0.59 119.26 119.31 1bhy h ALA 138 Ca 0.05 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1bhy h ALA 138 Cb 0.62 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1bhy h ALA 138 CO -0.27 -0.56 -0.18 0.74 0.00 0.00 0.00 179.25 178.98 1bhy h PHE 139 N -0.12 0.00 0.29 0.00 -1.00 -0.45 -1.81 116.94 113.85 1bhy h PHE 139 Ca 0.18 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.95 1bhy h PHE 139 Cb 0.40 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.96 1bhy h PHE 139 CO -0.40 0.18 -0.14 0.00 -1.61 0.00 0.00 178.31 176.34 1bhy h ALA 140 N 1.82 -0.39 -0.51 2.45 0.00 0.57 -0.16 119.26 123.04 1bhy h ALA 140 Ca -0.00 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.81 1bhy h ALA 140 Cb 0.59 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.45 1bhy h ALA 140 CO 0.02 -0.47 0.08 0.00 0.00 0.00 0.00 179.25 178.87 1bhy h ALA 141 N -0.43 0.55 -0.43 0.00 0.00 -1.29 0.29 119.26 117.95 1bhy h ALA 141 Ca -0.04 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1bhy h ALA 141 Cb 0.52 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 1bhy h ALA 141 CO 0.07 -0.33 0.11 0.00 0.00 0.00 0.00 179.25 179.09 1bhy h ALA 142 N 1.42 0.49 -0.42 0.00 0.00 -1.38 0.26 119.26 119.62 1bhy h ALA 142 Ca 0.26 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.28 1bhy h ALA 142 Cb 0.37 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1bhy h ALA 142 CO -0.36 -0.29 0.28 -0.44 0.00 0.00 0.00 179.25 178.44 1bhy h ASP 143 N 0.25 0.37 0.00 0.00 5.19 0.12 0.17 116.42 122.52 1bhy h ASP 143 Ca 0.21 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 1bhy h ASP 143 Cb 0.24 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.67 1bhy h ASP 143 CO -0.25 0.25 0.00 -0.62 -3.12 0.00 0.00 179.24 175.50 1bhy n GLU 144 N -4.48 0.62 -0.71 3.56 -0.58 0.83 -4.82 120.64 115.06 1bhy n GLU 144 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1bhy n GLU 144 Cb 0.18 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1bhy n GLU 144 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1bhy n GLY 145 N 0.17 0.81 3.81 0.62 0.00 0.59 -5.03 105.19 106.16 1bhy n GLY 145 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1bhy n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bhy s LEU 146 N 0.00 3.92 -0.41 0.99 1.02 -0.71 -5.01 118.68 118.48 1bhy s LEU 146 Ca 0.00 1.76 -0.20 0.00 0.02 0.00 0.00 54.13 55.71 1bhy s LEU 146 Cb 0.00 -4.54 0.02 0.00 0.02 0.00 0.00 46.19 41.69 1bhy s LEU 146 CO 0.00 -0.48 0.63 -0.75 0.02 0.00 0.00 176.35 175.78 1bhy s LYS 147 N -3.18 3.41 0.24 1.70 2.20 -1.26 -4.31 119.74 118.54 1bhy s LYS 147 Ca 0.63 -0.25 0.12 0.00 -0.36 0.00 0.00 55.97 56.11 1bhy s LYS 147 Cb -0.11 -3.90 -0.05 0.00 -1.51 0.00 0.00 37.83 32.26 1bhy s LYS 147 CO 0.15 -0.91 -0.21 0.08 -0.36 0.00 0.00 175.35 174.09 1bhy s VAL 148 N 2.76 2.39 0.01 4.02 1.01 -1.25 -1.35 120.40 127.99 1bhy s VAL 148 Ca 0.23 -2.24 0.00 0.00 0.00 0.00 0.00 61.98 59.97 1bhy s VAL 148 Cb -0.14 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 1bhy s VAL 148 CO 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 175.10 174.97 1bhy s ALA 149 N -2.18 0.07 -0.19 5.51 0.00 0.51 -2.07 121.76 123.41 1bhy s ALA 149 Ca 0.26 -0.17 -0.05 0.00 0.00 0.00 0.00 51.96 51.99 1bhy s ALA 149 Cb -0.06 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 1bhy s ALA 149 CO 0.13 -0.03 0.01 0.42 0.00 0.00 0.00 175.76 176.28 1bhy s ILE 150 N -0.38 4.10 -0.36 0.00 1.01 0.14 0.29 121.20 126.01 1bhy s ILE 150 Ca -0.04 -0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.25 1bhy s ILE 150 Cb -0.03 -2.85 0.03 0.00 0.01 0.00 0.00 42.46 39.62 1bhy s ILE 150 CO -0.00 0.44 0.17 -0.69 0.00 0.00 0.00 174.94 174.86 1bhy s VAL 151 N 0.84 4.36 -0.11 2.92 1.01 0.31 0.91 120.40 130.64 1bhy s VAL 151 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1bhy s VAL 151 Cb -0.14 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.84 1bhy s VAL 151 CO 0.02 -0.19 -0.11 -0.70 0.00 0.00 0.00 175.10 174.12 1bhy s GLU 152 N 1.52 1.84 0.00 2.72 2.56 -0.94 0.14 118.70 126.54 1bhy s GLU 152 Ca 0.01 -0.39 0.18 0.00 0.00 0.00 0.00 54.97 54.77 1bhy s GLU 152 Cb -0.19 -1.73 0.89 0.00 2.00 0.00 0.00 34.13 35.10 1bhy s GLU 152 CO 0.06 -0.19 1.57 2.89 -0.56 0.00 0.00 175.26 179.03 1bhy n ARG 153 N 4.63 0.19 -4.25 4.30 1.85 -1.19 -1.43 116.66 120.74 1bhy n ARG 153 Ca -0.16 0.13 -0.29 0.00 -1.00 0.00 0.00 57.85 56.53 1bhy n ARG 153 Cb 0.50 -1.50 -0.04 0.00 -1.05 0.00 0.00 32.46 30.37 1bhy n ARG 153 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1bhy n TYR 154 N -1.35 0.51 0.96 2.89 4.01 -1.26 -4.59 117.16 118.32 1bhy n TYR 154 Ca 0.07 -2.32 0.11 0.00 -0.16 0.00 0.00 57.90 55.60 1bhy n TYR 154 Cb 0.17 -0.36 -0.01 0.00 -0.31 0.00 0.00 39.34 38.83 1bhy n TYR 154 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 1bhy n LYS 155 N -1.39 0.03 -3.88 -0.72 2.85 -1.26 -4.81 118.16 108.98 1bhy n LYS 155 Ca -0.14 -0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.76 1bhy n LYS 155 Cb 0.61 -1.51 -0.07 0.00 -0.65 0.00 0.00 35.03 33.41 1bhy n LYS 155 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1bhy s THR 156 N -3.02 5.38 0.72 0.58 -4.23 -1.26 -5.06 115.64 108.75 1bhy s THR 156 Ca 0.08 0.17 -0.07 0.00 -1.18 0.00 0.00 61.69 60.69 1bhy s THR 156 Cb 0.16 -3.37 0.07 0.00 1.34 0.00 0.00 72.50 70.70 1bhy s THR 156 CO 0.82 0.56 1.04 -0.76 -0.54 0.00 0.00 174.62 175.74 1bhy s LEU 157 N -0.59 2.79 0.00 4.79 1.43 -1.26 -4.43 118.68 121.41 1bhy s LEU 157 Ca 0.12 0.46 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 1bhy s LEU 157 Cb -0.12 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 43.04 1bhy s LEU 157 CO 0.02 -1.67 0.00 0.61 0.23 0.00 0.00 176.35 175.54 1bhy n GLY 158 N -2.98 2.62 7.00 -3.19 0.00 0.12 -4.80 105.19 103.95 1bhy n GLY 158 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1bhy n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bhy n GLY 159 N -0.71 0.95 0.29 -0.02 0.00 -1.22 -1.88 105.19 102.60 1bhy n GLY 159 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 1bhy n GLY 159 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1bhy h VAL 160 N 0.00 0.44 -0.60 1.61 2.07 -1.95 -2.69 116.25 115.13 1bhy h VAL 160 Ca 0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 1bhy h VAL 160 Cb 0.00 0.44 -0.10 0.00 -1.52 0.00 0.00 31.29 30.10 1bhy h VAL 160 CO 0.00 0.00 -0.47 0.00 0.02 0.00 0.00 177.57 177.12 1bhy h LEU 162 N -0.24 0.83 0.09 0.00 5.85 -1.25 -0.99 115.31 119.60 1bhy h LEU 162 Ca 0.16 -0.55 -0.24 0.00 0.84 0.00 0.00 57.88 58.09 1bhy h LEU 162 Cb 0.56 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1bhy h LEU 162 CO -0.70 1.22 -1.23 0.78 -0.34 0.00 0.00 178.44 178.17 1bhy h ASN 163 N 0.47 0.29 -0.42 1.25 2.35 -1.17 -3.40 115.58 114.96 1bhy h ASN 163 Ca 0.01 -0.82 -0.25 0.00 -0.55 0.00 0.00 56.30 54.68 1bhy h ASN 163 Cb 1.09 -0.10 -0.40 0.00 0.05 0.00 0.00 38.32 38.96 1bhy h ASN 163 CO 0.11 1.53 -1.09 1.33 -1.65 0.00 0.00 177.43 177.65 1bhy n VAL 164 N -4.07 1.26 0.00 2.81 0.24 0.27 -4.88 118.33 113.95 1bhy n VAL 164 Ca -0.24 -2.87 0.00 0.00 -2.04 0.00 0.00 64.34 59.19 1bhy n VAL 164 Cb 0.83 1.14 0.00 0.00 -1.47 0.00 0.00 33.84 34.34 1bhy n VAL 164 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bhy n GLY 165 N -0.53 1.83 0.00 7.63 0.00 -0.55 -4.71 105.19 108.85 1bhy n GLY 165 Ca 0.09 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1bhy n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bhy h ILE 167 N 0.00 0.99 -0.41 0.00 5.03 -1.69 -0.33 117.51 121.10 1bhy h ILE 167 Ca 0.00 -0.03 -0.10 0.00 -0.12 0.00 0.00 64.86 64.61 1bhy h ILE 167 Cb 0.00 0.88 -0.01 0.00 -3.03 0.00 0.00 36.82 34.66 1bhy h ILE 167 CO 0.00 0.02 -0.13 1.55 -0.68 0.00 0.00 178.15 178.91 1bhy h PRO 168 N 0.10 0.82 -0.48 2.37 0.13 -1.75 -1.37 132.00 131.82 1bhy h PRO 168 Ca 0.04 -0.33 0.05 0.00 -0.87 0.00 0.00 66.00 64.90 1bhy h PRO 168 Cb 0.01 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 31.06 1bhy h PRO 168 CO -0.04 0.95 0.21 0.66 -0.23 0.00 0.00 178.00 179.56 1bhy h SER 169 N 0.64 0.27 0.52 1.44 4.64 -0.88 -2.13 113.55 118.04 1bhy h SER 169 Ca 0.10 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.37 1bhy h SER 169 Cb 0.67 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1bhy h SER 169 CO 0.05 0.19 -0.45 0.11 -0.87 0.00 0.00 176.83 175.86 1bhy h LYS 170 N 0.41 0.00 -0.48 4.77 6.56 -0.90 0.10 116.57 127.04 1bhy h LYS 170 Ca 0.22 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.71 1bhy h LYS 170 Cb 0.17 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.81 1bhy h LYS 170 CO -0.18 0.45 -0.11 0.00 -2.06 0.00 0.00 179.45 177.55 1bhy h ALA 171 N 1.55 0.91 -0.01 3.86 0.00 -0.80 -1.59 119.26 123.18 1bhy h ALA 171 Ca -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1bhy h ALA 171 Cb 0.83 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1bhy h ALA 171 CO 0.06 0.63 -0.01 -0.07 0.00 0.00 0.00 179.25 179.86 1bhy h LEU 172 N 0.79 0.03 -2.06 0.00 4.07 -1.25 -2.63 115.31 114.25 1bhy h LEU 172 Ca 0.13 -0.50 -0.01 0.00 0.08 0.00 0.00 57.88 57.58 1bhy h LEU 172 Cb 0.62 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.35 1bhy h LEU 172 CO 0.04 0.52 -0.04 -0.07 -1.08 0.00 0.00 178.44 177.81 1bhy h LEU 173 N -0.47 0.00 -0.33 1.67 4.07 -0.66 -1.03 115.31 118.56 1bhy h LEU 173 Ca 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.78 1bhy h LEU 173 Cb 0.51 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 1bhy h LEU 173 CO 0.00 0.04 -0.84 -0.74 -1.08 0.00 0.00 178.44 175.82 1bhy h HIS 174 N 0.00 0.06 -0.03 1.13 2.76 -1.15 -1.89 115.15 116.03 1bhy h HIS 174 Ca -0.00 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.10 1bhy h HIS 174 Cb 0.08 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.03 1bhy h HIS 174 CO 0.00 0.86 -0.13 -0.91 -1.30 0.00 0.00 177.93 176.45 1bhy h ASN 175 N 0.02 0.17 -0.30 3.26 4.21 -0.92 -2.59 115.58 119.43 1bhy h ASN 175 Ca -0.02 -0.65 0.07 0.00 1.21 0.00 0.00 56.30 56.92 1bhy h ASN 175 Cb 1.48 -0.05 -0.08 0.00 -1.12 0.00 0.00 38.32 38.55 1bhy h ASN 175 CO 0.11 0.79 -0.25 0.00 -1.29 0.00 0.00 177.43 176.79 1bhy h ALA 176 N 0.39 -0.11 -0.60 -0.83 0.00 -1.28 -0.79 119.26 116.04 1bhy h ALA 176 Ca -0.01 0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.11 1bhy h ALA 176 Cb 0.78 0.55 -0.09 0.00 0.00 0.00 0.00 17.79 19.03 1bhy h ALA 176 CO 0.03 -0.67 0.12 0.00 0.00 0.00 0.00 179.25 178.73 1bhy h ALA 177 N 0.84 0.70 -0.61 0.00 0.00 -1.34 0.15 119.26 119.00 1bhy h ALA 177 Ca 0.15 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1bhy h ALA 177 Cb 0.48 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1bhy h ALA 177 CO -0.43 -0.32 0.24 0.28 0.00 0.00 0.00 179.25 179.02 1bhy h VAL 178 N 0.24 1.22 -0.30 0.00 2.07 -0.93 -0.57 116.25 117.98 1bhy h VAL 178 Ca 0.31 -0.68 -0.16 0.00 0.82 0.00 0.00 66.70 66.99 1bhy h VAL 178 Cb 0.47 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1bhy h VAL 178 CO -0.41 0.27 -0.45 0.16 0.02 0.00 0.00 177.57 177.16 1bhy h ILE 179 N 0.88 1.29 -0.18 4.57 3.07 0.60 -1.81 117.51 125.92 1bhy h ILE 179 Ca 0.21 -1.63 -0.02 0.00 1.55 0.00 0.00 64.86 64.97 1bhy h ILE 179 Cb 0.18 1.53 -0.01 0.00 -0.27 0.00 0.00 36.82 38.24 1bhy h ILE 179 CO -0.02 0.53 0.04 0.44 -1.05 0.00 0.00 178.15 178.09 1bhy h ASP 180 N 0.63 0.23 0.33 2.16 3.32 -0.48 -2.50 116.42 120.11 1bhy h ASP 180 Ca 0.04 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 56.93 1bhy h ASP 180 Cb 1.02 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1bhy h ASP 180 CO 0.10 0.25 -0.55 -0.33 -1.72 0.00 0.00 179.24 176.98 1bhy h GLU 181 N 0.26 0.24 0.00 3.56 5.08 -0.48 -1.86 114.58 121.37 1bhy h GLU 181 Ca 0.06 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1bhy h GLU 181 Cb 0.12 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1bhy h GLU 181 CO -0.00 0.73 -0.14 -0.39 -1.00 0.00 0.00 179.01 178.21 1bhy h VAL 182 N 0.18 0.62 -0.40 3.13 -1.51 -0.90 0.12 116.25 117.50 1bhy h VAL 182 Ca 0.00 -0.61 -0.02 0.00 -1.23 0.00 0.00 66.70 64.84 1bhy h VAL 182 Cb 1.03 1.39 -0.02 0.00 -2.13 0.00 0.00 31.29 31.57 1bhy h VAL 182 CO 0.09 0.14 0.18 0.03 -1.23 0.00 0.00 177.57 176.77 1bhy h ARG 183 N 0.00 0.58 0.32 5.19 2.47 -1.19 -3.23 114.38 118.52 1bhy h ARG 183 Ca -0.00 -0.09 -0.02 0.00 -1.26 0.00 0.00 59.98 58.61 1bhy h ARG 183 Cb 0.38 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.60 1bhy h ARG 183 CO 0.02 0.52 -0.16 0.45 0.56 0.00 0.00 179.97 181.37 1bhy h HIS 184 N 0.50 -0.40 0.00 3.04 3.86 -0.43 -3.29 115.15 118.43 1bhy h HIS 184 Ca 0.13 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1bhy h HIS 184 Cb 0.14 0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.75 1bhy h HIS 184 CO -0.01 -0.12 0.27 1.28 0.86 0.00 0.00 177.93 180.22 1bhy n LEU 185 N -5.19 0.00 0.10 2.43 4.32 -0.52 -1.90 117.00 116.24 1bhy n LEU 185 Ca -0.10 0.15 -0.13 0.00 -0.02 0.00 0.00 56.01 55.90 1bhy n LEU 185 Cb 0.25 -0.15 -0.08 0.00 -1.62 0.00 0.00 43.42 41.82 1bhy n LEU 185 CO 0.33 -0.15 0.77 0.00 -1.22 0.00 0.00 177.39 177.12 1bhy h ALA 186 N 0.70 -0.20 0.00 -1.18 0.00 -1.46 0.48 119.26 117.59 1bhy h ALA 186 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bhy h ALA 186 Cb 0.55 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1bhy h ALA 186 CO 0.00 -0.56 0.16 0.00 0.00 0.00 0.00 179.25 178.85 1bhy h ALA 187 N 0.54 1.16 -0.50 0.00 0.00 -1.63 4.57 119.26 123.40 1bhy h ALA 187 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1bhy h ALA 187 Cb 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1bhy h ALA 187 CO 0.03 -0.16 0.03 0.09 0.00 0.00 0.00 179.25 179.25 1bhy n ASN 188 N -2.93 4.88 -0.96 0.00 5.03 -0.11 -4.86 115.26 116.30 1bhy n ASN 188 Ca -0.02 -2.81 -0.09 0.00 0.87 0.00 0.00 54.58 52.52 1bhy n ASN 188 Cb 0.22 -0.66 -0.02 0.00 -1.02 0.00 0.00 39.78 38.30 1bhy n ASN 188 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bhy n GLY 189 N 0.44 0.33 3.21 7.41 0.00 1.50 -4.99 105.19 113.09 1bhy n GLY 189 Ca 0.25 -0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 1bhy n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bhy s ILE 190 N -2.43 3.20 -0.16 -0.61 1.01 0.15 -4.98 121.20 117.38 1bhy s ILE 190 Ca 0.00 -1.20 -0.01 0.00 0.00 0.00 0.00 60.65 59.44 1bhy s ILE 190 Cb 0.00 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1bhy s ILE 190 CO 0.00 -0.04 -0.12 -0.54 0.00 0.00 0.00 174.94 174.24 1bhy s LYS 191 N 1.32 3.30 0.09 2.79 1.02 -1.26 -1.97 119.74 125.03 1bhy s LYS 191 Ca -0.03 -0.70 0.06 0.00 0.02 0.00 0.00 55.97 55.32 1bhy s LYS 191 Cb -0.19 -2.71 -0.03 0.00 -0.52 0.00 0.00 37.83 34.37 1bhy s LYS 191 CO -0.01 0.02 -0.15 0.71 -0.92 0.00 0.00 175.35 175.01 1bhy s TYR 192 N 0.83 1.35 0.82 3.18 1.51 -1.26 -5.11 117.35 118.68 1bhy s TYR 192 Ca -0.04 -0.49 -0.08 0.00 -1.01 0.00 0.00 57.07 55.46 1bhy s TYR 192 Cb -0.15 -0.74 0.15 0.00 -0.11 0.00 0.00 41.96 41.11 1bhy s TYR 192 CO 0.00 0.11 1.13 -1.25 -1.11 0.00 0.00 175.55 174.43 1bhy s PRO 193 N -2.07 1.29 0.86 -1.71 0.04 -1.26 -5.01 135.00 127.13 1bhy s PRO 193 Ca 0.03 -0.74 -0.13 0.00 0.04 0.00 0.00 61.00 60.20 1bhy s PRO 193 Cb -0.08 -2.11 0.08 0.00 0.04 0.00 0.00 34.50 32.42 1bhy s PRO 193 CO 0.03 -1.84 0.96 0.39 0.04 0.00 0.00 177.00 176.58 1bhy n GLU 194 N -3.23 -0.06 -2.45 4.56 -0.58 -1.26 -4.95 120.64 112.67 1bhy n GLU 194 Ca 0.14 0.05 -0.29 0.00 -0.42 0.00 0.00 57.16 56.64 1bhy n GLU 194 Cb 0.60 -2.24 -0.00 0.00 -0.57 0.00 0.00 31.44 29.23 1bhy n GLU 194 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1bhy s PRO 195 N -4.00 3.61 -0.08 3.49 0.04 -1.26 -5.02 135.00 131.78 1bhy s PRO 195 Ca 0.68 0.43 -0.25 0.00 0.04 0.00 0.00 61.00 61.90 1bhy s PRO 195 Cb -0.27 -2.29 -0.03 0.00 0.04 0.00 0.00 34.50 31.96 1bhy s PRO 195 CO 0.57 -0.28 0.76 -1.21 0.04 0.00 0.00 177.00 176.87 1bhy s GLU 196 N -4.69 4.42 -0.39 4.56 2.02 -1.26 -5.03 118.70 118.33 1bhy s GLU 196 Ca 0.51 0.97 -0.18 0.00 0.02 0.00 0.00 54.97 56.28 1bhy s GLU 196 Cb -0.10 -3.47 0.01 0.00 0.10 0.00 0.00 34.13 30.66 1bhy s GLU 196 CO 0.45 -0.03 0.51 -0.51 0.02 0.00 0.00 175.26 175.70 1bhy s LEU 197 N 1.09 4.54 -0.57 1.80 1.43 -1.26 -5.06 118.68 120.66 1bhy s LEU 197 Ca 0.39 -0.31 -0.14 0.00 -1.03 0.00 0.00 54.13 53.04 1bhy s LEU 197 Cb -0.18 -2.54 0.14 0.00 0.03 0.00 0.00 46.19 43.65 1bhy s LEU 197 CO 0.18 -0.57 0.51 -0.62 0.23 0.00 0.00 176.35 176.08 1bhy s ASP 198 N 1.83 6.15 0.47 2.29 -1.08 -1.26 -4.94 116.67 120.14 1bhy s ASP 198 Ca 0.17 -1.98 0.26 0.00 -0.52 0.00 0.00 52.55 50.48 1bhy s ASP 198 Cb -0.16 -2.16 1.08 0.00 -1.46 0.00 0.00 42.92 40.23 1bhy s ASP 198 CO 0.15 -0.77 1.89 0.16 0.52 0.00 0.00 175.17 177.12 1bhy h ILE 199 N 5.76 0.45 -0.88 4.11 -2.65 -1.97 0.13 117.51 122.46 1bhy h ILE 199 Ca -0.21 -0.93 0.00 0.00 1.03 0.00 0.00 64.86 64.75 1bhy h ILE 199 Cb 1.08 1.66 -0.04 0.00 -2.05 0.00 0.00 36.82 37.47 1bhy h ILE 199 CO 0.95 0.17 0.55 0.44 0.03 0.00 0.00 178.15 180.29 1bhy h ASP 200 N 0.00 1.05 1.01 2.16 3.32 -1.93 -0.18 116.42 121.84 1bhy h ASP 200 Ca -0.00 -0.05 -0.20 0.00 0.02 0.00 0.00 57.03 56.80 1bhy h ASP 200 Cb 0.65 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 1bhy h ASP 200 CO 0.02 0.79 -0.95 0.24 -1.72 0.00 0.00 179.24 177.62 1bhy h MET 201 N 1.21 0.00 0.92 3.56 2.86 -1.86 -1.64 114.93 119.98 1bhy h MET 201 Ca 0.32 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.91 1bhy h MET 201 Cb -0.08 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.59 1bhy h MET 201 CO -0.06 0.95 -0.44 1.25 1.06 0.00 0.00 176.91 179.67 1bhy h LEU 202 N 0.00 -1.05 -1.00 1.22 5.85 -0.42 0.39 115.31 120.30 1bhy h LEU 202 Ca -0.01 0.04 0.18 0.00 0.84 0.00 0.00 57.88 58.92 1bhy h LEU 202 Cb 1.71 0.27 -0.17 0.00 0.37 0.00 0.00 40.66 42.84 1bhy h LEU 202 CO 0.12 -0.74 -0.32 -0.09 -0.34 0.00 0.00 178.44 177.07 1bhy h ARG 203 N -1.26 -0.00 0.00 1.25 2.43 -1.11 1.18 114.38 116.87 1bhy h ARG 203 Ca -0.13 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 58.99 1bhy h ARG 203 Cb 0.95 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 1bhy h ARG 203 CO 0.21 -0.00 -0.27 0.00 -1.51 0.00 0.00 179.97 178.40 1bhy h ALA 204 N 1.68 1.09 -0.33 2.80 0.00 -1.22 -0.48 119.26 122.80 1bhy h ALA 204 Ca 0.41 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1bhy h ALA 204 Cb 0.66 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1bhy h ALA 204 CO -1.01 0.33 -0.12 -0.92 0.00 0.00 0.00 179.25 177.53 1bhy h TYR 205 N 0.00 0.75 0.47 0.00 3.20 0.36 0.45 116.97 122.21 1bhy h TYR 205 Ca -0.00 -0.17 -0.02 0.00 3.14 0.00 0.00 58.73 61.68 1bhy h TYR 205 Cb 0.71 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.79 1bhy h TYR 205 CO 0.00 0.85 -0.28 -0.22 -1.64 0.00 0.00 178.16 176.87 1bhy h LYS 206 N 0.43 -0.69 -0.98 1.82 3.64 -1.00 -1.11 116.57 118.69 1bhy h LYS 206 Ca 0.08 0.05 0.26 0.00 -1.27 0.00 0.00 60.65 59.77 1bhy h LYS 206 Cb 0.63 0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.55 1bhy h LYS 206 CO 0.04 -0.46 0.68 -0.44 -2.27 0.00 0.00 179.45 177.00 1bhy h ASP 207 N -0.71 0.17 -0.07 4.20 3.32 -0.99 0.14 116.42 122.47 1bhy h ASP 207 Ca -0.05 0.03 -0.15 0.00 0.02 0.00 0.00 57.03 56.87 1bhy h ASP 207 Cb 0.58 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1bhy h ASP 207 CO 0.06 0.05 -0.48 1.23 -1.72 0.00 0.00 179.24 178.38 1bhy h GLY 208 N 0.16 0.69 0.57 2.75 0.00 0.32 -0.75 103.07 106.81 1bhy h GLY 208 Ca 0.49 -0.75 -0.00 0.00 0.00 0.00 0.00 47.33 47.07 1bhy h GLY 208 CO -0.10 0.68 -0.01 -0.39 0.00 0.00 0.00 176.54 176.72 1bhy h VAL 209 N 0.50 1.30 -0.18 4.60 -1.51 0.03 -2.23 116.25 118.77 1bhy h VAL 209 Ca 0.03 -0.99 0.05 0.00 -1.23 0.00 0.00 66.70 64.56 1bhy h VAL 209 Cb 1.02 1.97 -0.06 0.00 -2.13 0.00 0.00 31.29 32.09 1bhy h VAL 209 CO 0.10 0.25 -0.26 0.58 -1.23 0.00 0.00 177.57 177.01 1bhy h VAL 210 N -0.45 0.38 -0.13 7.19 2.07 -1.24 -1.02 116.25 123.05 1bhy h VAL 210 Ca -0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 1bhy h VAL 210 Cb 0.43 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1bhy h VAL 210 CO 0.00 0.00 -0.25 0.77 0.02 0.00 0.00 177.57 178.12 1bhy h SER 211 N -0.30 0.23 -0.15 0.57 4.64 -1.17 0.16 113.55 117.53 1bhy h SER 211 Ca 0.12 -0.07 0.04 0.00 -0.47 0.00 0.00 61.79 61.41 1bhy h SER 211 Cb 0.48 -0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 62.46 1bhy h SER 211 CO -0.35 0.48 -0.12 -0.09 -0.87 0.00 0.00 176.83 175.88 1bhy h ARG 212 N 0.21 -0.13 0.39 4.77 9.65 -0.63 0.81 114.38 129.46 1bhy h ARG 212 Ca 0.03 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 1bhy h ARG 212 Cb 0.56 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.16 1bhy h ARG 212 CO 0.04 -0.09 -0.26 -0.07 2.80 0.00 0.00 179.97 182.39 1bhy h LEU 213 N -0.14 -0.67 -1.34 3.80 3.38 -0.60 -1.85 115.31 117.88 1bhy h LEU 213 Ca 0.10 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1bhy h LEU 213 Cb 0.28 0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1bhy h LEU 213 CO -0.24 -0.41 0.46 0.71 0.09 0.00 0.00 178.44 179.05 1bhy h THR 214 N -0.64 1.13 -0.52 0.22 1.35 -0.43 0.33 112.91 114.35 1bhy h THR 214 Ca -0.04 -0.30 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 1bhy h THR 214 Cb 0.54 0.17 -0.02 0.00 -1.73 0.00 0.00 68.15 67.11 1bhy h THR 214 CO 0.03 0.16 0.28 1.23 -0.25 0.00 0.00 175.52 176.96 1bhy h GLY 215 N 0.88 0.78 1.09 5.82 0.00 0.83 -2.35 103.07 110.12 1bhy h GLY 215 Ca 0.27 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 1bhy h GLY 215 CO -0.07 0.34 0.07 -1.33 0.00 0.00 0.00 176.54 175.56 1bhy h GLY 216 N 0.69 1.19 0.40 4.60 0.00 -0.14 -2.32 103.07 107.48 1bhy h GLY 216 Ca 0.18 -0.82 0.02 0.00 0.00 0.00 0.00 47.33 46.72 1bhy h GLY 216 CO -0.03 0.76 -0.32 1.41 0.00 0.00 0.00 176.54 178.36 1bhy h LEU 217 N 1.02 -0.93 -0.83 3.11 4.07 -0.99 0.69 115.31 121.46 1bhy h LEU 217 Ca 0.19 0.11 0.11 0.00 0.08 0.00 0.00 57.88 58.37 1bhy h LEU 217 Cb 0.48 0.36 -0.13 0.00 1.08 0.00 0.00 40.66 42.46 1bhy h LEU 217 CO 0.02 -0.40 -0.48 0.00 -1.08 0.00 0.00 178.44 176.50 1bhy h ALA 218 N 0.15 -0.28 -0.86 1.53 0.00 -1.34 0.90 119.26 119.37 1bhy h ALA 218 Ca 0.04 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.16 1bhy h ALA 218 Cb 0.57 1.12 -0.06 0.00 0.00 0.00 0.00 17.79 19.41 1bhy h ALA 218 CO -0.21 -0.82 0.53 0.78 0.00 0.00 0.00 179.25 179.53 1bhy h GLY 219 N -0.10 1.28 1.34 0.00 0.00 -0.80 -0.94 103.07 103.86 1bhy h GLY 219 Ca 0.22 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1bhy h GLY 219 CO -0.85 0.27 0.14 -0.33 0.00 0.00 0.00 176.54 175.77 1bhy h MET 220 N 0.98 0.83 -0.40 4.80 2.07 0.69 -1.81 114.93 122.10 1bhy h MET 220 Ca 0.37 -0.17 -0.02 0.00 -2.07 0.00 0.00 59.70 57.81 1bhy h MET 220 Cb 0.15 -0.13 -0.02 0.00 -1.87 0.00 0.00 31.60 29.74 1bhy h MET 220 CO -0.17 0.75 0.17 0.00 1.07 0.00 0.00 176.91 178.73 1bhy h ALA 221 N 1.35 0.51 0.34 6.32 0.00 0.21 -0.05 119.26 127.93 1bhy h ALA 221 Ca 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1bhy h ALA 221 Cb 0.28 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1bhy h ALA 221 CO -0.00 0.10 -0.49 -0.22 0.00 0.00 0.00 179.25 178.63 1bhy h LYS 222 N 0.50 -0.84 -0.99 0.00 3.64 -0.86 0.16 116.57 118.17 1bhy h LYS 222 Ca 0.13 0.06 0.17 0.00 -1.27 0.00 0.00 60.65 59.74 1bhy h LYS 222 Cb 0.16 0.19 -0.10 0.00 -0.41 0.00 0.00 32.23 32.07 1bhy h LYS 222 CO -0.01 -0.56 0.62 1.03 -2.27 0.00 0.00 179.45 178.25 1bhy h SER 223 N -0.87 0.78 -0.05 4.20 0.87 -1.28 0.77 113.55 117.97 1bhy h SER 223 Ca -0.04 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1bhy h SER 223 Cb 0.79 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1bhy h SER 223 CO -0.14 0.33 0.00 0.54 -0.53 0.00 0.00 176.83 177.02 1bhy n ARG 224 N -4.69 1.21 -2.98 2.24 1.74 -0.04 -4.89 116.66 109.26 1bhy n ARG 224 Ca 0.22 -0.32 -0.21 0.00 -0.77 0.00 0.00 57.85 56.76 1bhy n ARG 224 Cb 0.52 -1.29 0.01 0.00 -1.02 0.00 0.00 32.46 30.68 1bhy n ARG 224 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1bhy n LYS 225 N -0.44 -3.74 -3.32 5.56 4.01 0.27 -4.94 118.16 115.56 1bhy n LYS 225 Ca 0.13 0.75 -0.35 0.00 -0.51 0.00 0.00 58.31 58.33 1bhy n LYS 225 Cb 0.13 -5.51 -0.06 0.00 -0.51 0.00 0.00 35.03 29.09 1bhy n LYS 225 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1bhy s VAL 226 N -3.01 4.82 -0.22 -0.18 1.01 0.32 -4.78 120.40 118.36 1bhy s VAL 226 Ca 0.26 0.88 -0.15 0.00 0.00 0.00 0.00 61.98 62.97 1bhy s VAL 226 Cb -0.12 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1bhy s VAL 226 CO 0.32 0.22 0.35 -1.81 0.00 0.00 0.00 175.10 174.18 1bhy s ASP 227 N -1.74 6.34 -0.08 3.32 1.01 -0.88 -4.58 116.67 120.06 1bhy s ASP 227 Ca 0.39 0.40 -0.23 0.00 0.71 0.00 0.00 52.55 53.82 1bhy s ASP 227 Cb -0.15 -2.20 -0.03 0.00 1.01 0.00 0.00 42.92 41.54 1bhy s ASP 227 CO 0.19 -0.07 0.70 -0.69 0.21 0.00 0.00 175.17 175.51 1bhy s VAL 228 N 1.40 5.04 -0.27 -1.27 1.01 -1.26 0.28 120.40 125.34 1bhy s VAL 228 Ca 0.16 1.43 -0.07 0.00 0.00 0.00 0.00 61.98 63.50 1bhy s VAL 228 Cb -0.15 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 1bhy s VAL 228 CO 0.08 0.23 0.07 -0.63 0.00 0.00 0.00 175.10 174.85 1bhy s ILE 229 N 0.93 4.07 -0.45 2.22 1.01 0.26 -4.90 121.20 124.34 1bhy s ILE 229 Ca 0.37 -0.45 -0.26 0.00 0.00 0.00 0.00 60.65 60.30 1bhy s ILE 229 Cb -0.17 -3.00 0.03 0.00 0.01 0.00 0.00 42.46 39.33 1bhy s ILE 229 CO 0.17 0.22 0.97 -1.58 0.00 0.00 0.00 174.94 174.72 1bhy s GLN 230 N 1.55 3.63 0.00 2.79 0.74 -1.26 -2.21 119.66 124.91 1bhy s GLN 230 Ca 0.05 0.32 0.00 0.00 0.05 0.00 0.00 55.36 55.78 1bhy s GLN 230 Cb -0.16 -3.90 0.00 0.00 1.10 0.00 0.00 33.01 30.05 1bhy s GLN 230 CO 0.02 -1.21 0.00 0.41 -0.55 0.00 0.00 175.29 173.96 1bhy n GLY 231 N 4.82 1.07 3.72 2.59 0.00 -0.52 -2.71 105.19 114.16 1bhy n GLY 231 Ca 0.08 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 1bhy n GLY 231 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bhy s ASP 232 N 0.00 7.33 -0.06 1.61 -1.08 -0.72 -3.20 116.67 120.54 1bhy s ASP 232 Ca 0.00 1.89 -0.03 0.00 -0.52 0.00 0.00 52.55 53.88 1bhy s ASP 232 Cb 0.00 -2.59 -0.04 0.00 -1.46 0.00 0.00 42.92 38.84 1bhy s ASP 232 CO 0.00 -0.23 0.10 -0.83 0.52 0.00 0.00 175.17 174.73 1bhy s GLY 233 N 0.41 2.06 -0.00 2.66 0.00 -1.26 -0.55 107.32 110.63 1bhy s GLY 233 Ca 0.51 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1bhy s GLY 233 CO 0.31 -0.57 -0.00 1.62 0.00 0.00 0.00 173.10 174.45 1bhy s GLN 234 N -1.35 0.05 0.12 2.90 2.00 -0.55 -4.84 119.66 118.00 1bhy s GLN 234 Ca 0.19 0.00 -0.31 0.00 -2.00 0.00 0.00 55.36 53.24 1bhy s GLN 234 Cb -0.12 -0.09 -0.07 0.00 0.80 0.00 0.00 33.01 33.53 1bhy s GLN 234 CO 0.09 -0.01 1.32 -0.06 -0.50 0.00 0.00 175.29 176.13 1bhy s PHE 235 N 0.14 3.30 -0.18 1.67 0.08 -0.17 0.17 117.98 122.99 1bhy s PHE 235 Ca -0.01 1.10 -0.21 0.00 0.12 0.00 0.00 56.93 57.92 1bhy s PHE 235 Cb -0.02 -3.59 -0.19 0.00 -0.57 0.00 0.00 43.02 38.65 1bhy s PHE 235 CO -0.00 -1.98 0.30 1.25 -0.10 0.00 0.00 175.22 174.68 1bhy h LEU 236 N 6.51 0.00 -7.25 -0.37 5.85 0.34 -3.43 115.31 116.97 1bhy h LEU 236 Ca -0.42 -0.56 0.03 0.00 0.84 0.00 0.00 57.88 57.77 1bhy h LEU 236 Cb 1.21 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.13 1bhy h LEU 236 CO 0.83 1.29 0.27 1.51 -0.34 0.00 0.00 178.44 182.00 1bhy s ASP 237 N -6.57 -0.45 0.00 1.25 1.47 -1.10 -4.83 116.67 106.44 1bhy s ASP 237 Ca -0.24 -0.15 0.00 0.00 1.18 0.00 0.00 52.55 53.33 1bhy s ASP 237 Cb 0.03 0.59 0.00 0.00 -0.34 0.00 0.00 42.92 43.20 1bhy s ASP 237 CO 0.56 -0.99 0.40 -0.81 0.68 0.00 0.00 175.17 175.01 1bhy n PRO 238 N -0.38 0.00 -0.05 2.11 -0.04 -1.01 0.11 135.00 135.74 1bhy n PRO 238 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1bhy n PRO 238 Cb 0.63 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 1bhy n PRO 238 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1bhy n HIS 239 N -0.90 0.00 -4.15 0.54 8.25 -1.26 -5.00 115.22 112.70 1bhy n HIS 239 Ca 0.00 -0.05 -0.19 0.00 -0.26 0.00 0.00 57.72 57.23 1bhy n HIS 239 Cb 0.40 -0.01 -0.16 0.00 1.12 0.00 0.00 29.99 31.34 1bhy n HIS 239 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1bhy s HIS 240 N -0.10 0.64 -0.19 4.41 3.76 0.31 -1.83 115.29 122.30 1bhy s HIS 240 Ca 0.00 -0.15 -0.07 0.00 -0.15 0.00 0.00 55.06 54.69 1bhy s HIS 240 Cb 0.00 -0.56 -0.04 0.00 1.11 0.00 0.00 32.58 33.10 1bhy s HIS 240 CO 0.00 -0.14 0.06 -1.17 -0.85 0.00 0.00 174.74 172.64 1bhy s LEU 241 N 0.67 3.76 -0.35 0.89 2.96 0.65 0.26 118.68 127.52 1bhy s LEU 241 Ca -0.09 0.05 -0.17 0.00 -0.22 0.00 0.00 54.13 53.71 1bhy s LEU 241 Cb -0.12 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 1bhy s LEU 241 CO -0.00 0.16 0.43 -0.70 -1.32 0.00 0.00 176.35 174.92 1bhy s GLU 242 N 0.47 3.57 -0.47 1.98 2.12 0.46 -0.82 118.70 126.01 1bhy s GLU 242 Ca 0.03 -0.32 -0.17 0.00 0.36 0.00 0.00 54.97 54.86 1bhy s GLU 242 Cb -0.13 -3.81 0.05 0.00 0.26 0.00 0.00 34.13 30.50 1bhy s GLU 242 CO 0.01 -0.59 0.49 0.08 -0.54 0.00 0.00 175.26 174.70 1bhy s VAL 243 N 2.19 5.06 -0.81 3.70 1.01 0.28 -1.48 120.40 130.35 1bhy s VAL 243 Ca 0.15 -0.62 -0.26 0.00 0.00 0.00 0.00 61.98 61.25 1bhy s VAL 243 Cb -0.16 -4.16 0.02 0.00 0.00 0.00 0.00 36.38 32.09 1bhy s VAL 243 CO 0.12 -0.60 1.44 -0.44 0.00 0.00 0.00 175.10 175.62 1bhy s SER 244 N 2.36 6.08 0.47 3.32 0.01 0.29 -1.62 113.70 124.60 1bhy s SER 244 Ca 0.11 -0.64 -0.20 0.00 1.31 0.00 0.00 55.95 56.53 1bhy s SER 244 Cb -0.20 -2.56 -0.14 0.00 0.21 0.00 0.00 66.02 63.33 1bhy s SER 244 CO 0.11 -1.87 0.17 0.18 0.41 0.00 0.00 173.24 172.24 1bhy n LEU 245 N 9.95 -2.03 -4.12 2.44 4.77 -0.71 -1.75 117.00 125.55 1bhy n LEU 245 Ca 0.16 0.76 -0.15 0.00 -0.03 0.00 0.00 56.01 56.75 1bhy n LEU 245 Cb 0.50 -0.96 -0.11 0.00 -2.33 0.00 0.00 43.42 40.51 1bhy n LEU 245 CO 0.69 -3.98 -0.42 0.28 -1.33 0.00 0.00 177.39 172.63 1bhy s THR 246 N -1.76 0.78 0.03 -5.08 -1.32 -1.10 -0.58 115.64 106.61 1bhy s THR 246 Ca 0.61 -1.28 0.01 0.00 -1.21 0.00 0.00 61.69 59.82 1bhy s THR 246 Cb -0.55 -0.92 -0.02 0.00 -1.51 0.00 0.00 72.50 69.50 1bhy s THR 246 CO 0.62 -0.39 -0.06 0.00 -2.21 0.00 0.00 174.62 172.58 1bhy s ALA 247 N -1.62 0.38 0.00 11.08 0.00 2.91 -4.74 121.76 129.77 1bhy s ALA 247 Ca -0.04 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1bhy s ALA 247 Cb -0.08 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1bhy s ALA 247 CO 0.01 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1bhy n GLY 248 N 1.76 0.70 0.00 0.00 0.00 -1.26 0.37 105.19 106.76 1bhy n GLY 248 Ca -0.22 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1bhy n GLY 248 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bhy n ASP 249 N 0.00 0.13 -4.61 1.61 9.92 -1.26 -4.59 116.55 117.76 1bhy n ASP 249 Ca 0.00 -0.05 -0.37 0.00 -0.53 0.00 0.00 54.79 53.85 1bhy n ASP 249 Cb 0.00 0.12 -0.10 0.00 -0.64 0.00 0.00 41.12 40.49 1bhy n ASP 249 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bhy s ALA 250 N -0.14 3.51 0.17 2.24 0.00 -1.26 -4.68 121.76 121.59 1bhy s ALA 250 Ca 0.00 -0.96 -0.33 0.00 0.00 0.00 0.00 51.96 50.66 1bhy s ALA 250 Cb 0.00 -2.29 -0.15 0.00 0.00 0.00 0.00 23.12 20.67 1bhy s ALA 250 CO 0.00 -0.30 1.27 0.98 0.00 0.00 0.00 175.76 177.72 1bhy n TYR 251 N 4.52 1.57 -0.10 0.00 4.19 -1.26 0.33 117.16 126.40 1bhy n TYR 251 Ca -0.15 0.60 0.00 0.00 3.31 0.00 0.00 57.90 61.66 1bhy n TYR 251 Cb 0.52 -2.34 0.00 0.00 0.49 0.00 0.00 39.34 38.01 1bhy n TYR 251 CO 0.00 0.00 0.00 0.39 0.91 0.00 0.00 176.86 178.16 1bhy n GLU 252 N 2.09 0.00 -3.77 2.98 1.02 -1.26 -4.92 120.64 116.77 1bhy n GLU 252 Ca 0.15 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 57.01 1bhy n GLU 252 Cb 0.25 -1.52 -0.12 0.00 -0.02 0.00 0.00 31.44 30.03 1bhy n GLU 252 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1bhy s GLN 253 N -0.05 1.95 0.06 3.49 -0.44 0.15 -5.07 119.66 119.75 1bhy s GLN 253 Ca 0.00 -2.87 0.08 0.00 -2.50 0.00 0.00 55.36 50.07 1bhy s GLN 253 Cb 0.00 -2.85 -0.03 0.00 -1.64 0.00 0.00 33.01 28.50 1bhy s GLN 253 CO 0.00 -1.28 -0.21 0.00 0.50 0.00 0.00 175.29 174.30 1bhy s ALA 254 N -0.83 1.78 0.01 1.58 0.00 -1.26 -4.05 121.76 118.99 1bhy s ALA 254 Ca 0.25 -1.10 0.04 0.00 0.00 0.00 0.00 51.96 51.15 1bhy s ALA 254 Cb -0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 1bhy s ALA 254 CO -0.14 0.39 -0.13 0.00 0.00 0.00 0.00 175.76 175.88 1bhy s ALA 255 N -0.88 1.06 -0.04 0.00 0.00 1.19 -4.84 121.76 118.25 1bhy s ALA 255 Ca 0.07 -0.63 -0.30 0.00 0.00 0.00 0.00 51.96 51.10 1bhy s ALA 255 Cb -0.09 -0.23 -0.06 0.00 0.00 0.00 0.00 23.12 22.74 1bhy s ALA 255 CO 0.02 0.24 1.70 -1.25 0.00 0.00 0.00 175.76 176.47 1bhy s PRO 256 N -0.59 4.18 0.18 0.00 0.04 -1.26 0.65 135.00 138.19 1bhy s PRO 256 Ca 0.03 2.26 0.18 0.00 0.04 0.00 0.00 61.00 63.51 1bhy s PRO 256 Cb -0.06 -4.01 0.82 0.00 0.04 0.00 0.00 34.50 31.29 1bhy s PRO 256 CO 0.00 -0.86 1.56 2.41 0.04 0.00 0.00 177.00 180.15 1bhy n THR 257 N 5.48 1.06 0.00 1.26 -1.04 0.25 -4.82 114.28 116.48 1bhy n THR 257 Ca 0.18 0.38 0.00 0.00 -2.04 0.00 0.00 64.05 62.56 1bhy n THR 257 Cb 0.42 -1.29 0.00 0.00 -1.82 0.00 0.00 70.33 67.65 1bhy n THR 257 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bhy n GLY 258 N -0.46 2.27 3.75 3.41 0.00 -1.26 -5.01 105.19 107.90 1bhy n GLY 258 Ca 0.01 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1bhy n GLY 258 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bhy s GLU 259 N 0.00 2.64 -0.02 1.61 -6.30 -1.26 -4.90 118.70 110.47 1bhy s GLU 259 Ca 0.00 1.59 -0.01 0.00 -2.50 0.00 0.00 54.97 54.06 1bhy s GLU 259 Cb 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 34.13 32.23 1bhy s GLU 259 CO 0.00 -1.41 0.03 0.15 0.02 0.00 0.00 175.26 174.05 1bhy s LYS 260 N -3.86 0.02 -0.03 4.30 1.02 -1.26 -1.74 119.74 118.19 1bhy s LYS 260 Ca 0.71 0.08 0.03 0.00 0.02 0.00 0.00 55.97 56.82 1bhy s LYS 260 Cb -0.25 -0.04 -0.03 0.00 -0.52 0.00 0.00 37.83 36.99 1bhy s LYS 260 CO 0.40 -0.04 -0.10 0.21 -0.92 0.00 0.00 175.35 174.90 1bhy s LYS 261 N 0.27 2.55 -0.27 1.68 2.20 -0.64 -4.65 119.74 120.87 1bhy s LYS 261 Ca -0.02 -0.69 -0.08 0.00 -0.36 0.00 0.00 55.97 54.83 1bhy s LYS 261 Cb -0.03 -2.46 -0.01 0.00 -1.51 0.00 0.00 37.83 33.81 1bhy s LYS 261 CO -0.01 0.62 0.09 0.42 -0.36 0.00 0.00 175.35 176.11 1bhy s ILE 262 N -0.85 4.25 -0.10 5.43 -1.09 0.36 0.10 121.20 129.29 1bhy s ILE 262 Ca 0.14 -0.37 -0.00 0.00 -2.23 0.00 0.00 60.65 58.19 1bhy s ILE 262 Cb -0.11 -3.08 -0.03 0.00 -1.58 0.00 0.00 42.46 37.67 1bhy s ILE 262 CO 0.03 0.22 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.20 1bhy s VAL 263 N 1.58 3.60 0.03 2.92 1.01 0.00 0.26 120.40 129.81 1bhy s VAL 263 Ca 0.05 -0.49 0.07 0.00 0.00 0.00 0.00 61.98 61.61 1bhy s VAL 263 Cb -0.16 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 1bhy s VAL 263 CO 0.04 0.56 -0.21 0.00 0.00 0.00 0.00 175.10 175.49 1bhy s ALA 264 N -0.29 2.48 0.01 5.51 0.00 0.60 -0.25 121.76 129.82 1bhy s ALA 264 Ca 0.04 -1.19 0.01 0.00 0.00 0.00 0.00 51.96 50.82 1bhy s ALA 264 Cb -0.13 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 1bhy s ALA 264 CO 0.02 0.56 -0.04 -0.59 0.00 0.00 0.00 175.76 175.72 1bhy s PHE 265 N -0.85 0.31 0.03 0.00 -0.12 -0.76 0.15 117.98 116.74 1bhy s PHE 265 Ca 0.13 -0.28 -0.26 0.00 -0.05 0.00 0.00 56.93 56.47 1bhy s PHE 265 Cb -0.10 -0.20 -0.14 0.00 -0.63 0.00 0.00 43.02 41.94 1bhy s PHE 265 CO 0.03 -0.08 1.21 0.87 -0.05 0.00 0.00 175.22 177.21 1bhy h LYS 266 N 5.33 -0.91 -6.42 1.99 6.56 0.12 -3.45 116.57 119.78 1bhy h LYS 266 Ca -0.30 0.06 -0.63 0.00 -1.06 0.00 0.00 60.65 58.73 1bhy h LYS 266 Cb 1.20 0.21 -0.13 0.00 -0.57 0.00 0.00 32.23 32.94 1bhy h LYS 266 CO 0.46 -0.61 -0.69 -0.80 -2.06 0.00 0.00 179.45 175.75 1bhy s ASN 267 N -3.94 4.59 -0.03 0.86 0.01 0.38 -4.90 114.94 111.89 1bhy s ASN 267 Ca -0.14 -0.41 0.01 0.00 -0.71 0.00 0.00 52.86 51.61 1bhy s ASN 267 Cb 0.01 -0.92 0.02 0.00 0.41 0.00 0.00 41.25 40.77 1bhy s ASN 267 CO 0.41 0.12 -0.04 0.00 -1.51 0.00 0.00 177.10 176.09 1bhy s ILE 269 N 0.77 4.08 -0.01 0.00 1.01 -0.13 -0.97 121.20 125.96 1bhy s ILE 269 Ca -0.10 -1.66 -0.30 0.00 0.00 0.00 0.00 60.65 58.60 1bhy s ILE 269 Cb -0.13 -3.62 -0.06 0.00 0.01 0.00 0.00 42.46 38.67 1bhy s ILE 269 CO -0.00 -0.64 1.47 -0.63 0.00 0.00 0.00 174.94 175.14 1bhy s ILE 270 N 1.36 3.62 -0.05 2.92 1.01 0.53 -1.86 121.20 128.73 1bhy s ILE 270 Ca 0.05 0.96 0.24 0.00 0.00 0.00 0.00 60.65 61.90 1bhy s ILE 270 Cb -0.24 -3.62 0.44 0.00 0.01 0.00 0.00 42.46 39.04 1bhy s ILE 270 CO -0.00 -0.02 1.17 0.00 0.00 0.00 0.00 174.94 176.09 1bhy n ALA 271 N 5.78 2.57 0.64 9.38 0.00 -0.64 -1.08 120.51 137.17 1bhy n ALA 271 Ca 0.14 -2.52 0.01 0.00 0.00 0.00 0.00 53.44 51.07 1bhy n ALA 271 Cb 0.43 -0.70 0.05 0.00 0.00 0.00 0.00 19.45 19.23 1bhy n ALA 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bhy n ALA 272 N 0.18 1.83 -0.69 0.00 0.00 -1.00 -4.59 120.51 116.25 1bhy n ALA 272 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1bhy n ALA 272 Cb 1.06 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1bhy n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bhy n GLY 273 N -0.21 1.15 1.39 0.00 0.00 -1.26 -4.50 105.19 101.76 1bhy n GLY 273 Ca 0.01 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 1bhy n GLY 273 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bhy n SER 274 N -2.91 0.40 -3.72 1.61 3.41 -1.26 -0.17 113.62 110.99 1bhy n SER 274 Ca 0.00 -1.92 -0.10 0.00 -0.26 0.00 0.00 58.87 56.59 1bhy n SER 274 Cb 0.00 0.57 -0.05 0.00 -0.26 0.00 0.00 64.21 64.47 1bhy n SER 274 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bhy s ARG 275 N -2.62 1.09 0.15 4.33 1.70 0.71 -4.80 118.95 119.51 1bhy s ARG 275 Ca 0.13 -0.83 -0.31 0.00 -0.47 0.00 0.00 55.73 54.25 1bhy s ARG 275 Cb 0.01 0.45 -0.10 0.00 -0.57 0.00 0.00 34.95 34.73 1bhy s ARG 275 CO 0.09 -0.42 1.65 0.14 -1.08 0.00 0.00 175.30 175.67 1bhy s VAL 276 N -3.84 2.57 0.03 4.99 -7.23 -1.26 -0.08 120.40 115.58 1bhy s VAL 276 Ca 0.06 0.32 -0.30 0.00 -1.81 0.00 0.00 61.98 60.25 1bhy s VAL 276 Cb 0.02 -3.21 -0.08 0.00 0.56 0.00 0.00 36.38 33.67 1bhy s VAL 276 CO -0.09 0.02 1.81 -0.89 -0.31 0.00 0.00 175.10 175.63 1bhy s THR 277 N 1.63 3.09 -0.14 5.32 2.01 -1.06 -4.76 115.64 121.72 1bhy s THR 277 Ca 0.73 0.29 -0.08 0.00 0.31 0.00 0.00 61.69 62.94 1bhy s THR 277 Cb -0.44 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 1bhy s THR 277 CO 0.32 -0.02 0.14 -0.54 -0.69 0.00 0.00 174.62 173.83 1bhy s LYS 278 N 3.74 3.65 0.09 4.92 1.02 -1.26 -4.72 119.74 127.18 1bhy s LYS 278 Ca 0.81 -0.15 -0.25 0.00 0.02 0.00 0.00 55.97 56.39 1bhy s LYS 278 Cb -0.40 -3.25 -0.06 0.00 -0.52 0.00 0.00 37.83 33.59 1bhy s LYS 278 CO 0.36 0.65 0.78 -0.51 -0.92 0.00 0.00 175.35 175.71 1bhy s LEU 279 N -0.64 4.50 0.15 3.17 1.43 -1.26 -4.95 118.68 121.07 1bhy s LEU 279 Ca 0.13 1.54 -0.17 0.00 -1.03 0.00 0.00 54.13 54.60 1bhy s LEU 279 Cb -0.12 -3.28 0.04 0.00 0.03 0.00 0.00 46.19 42.86 1bhy s LEU 279 CO 0.02 0.08 1.74 1.55 0.23 0.00 0.00 176.35 179.97 1bhy h PRO 280 N 5.19 0.18 0.00 1.29 0.13 -2.04 -3.03 132.00 133.73 1bhy h PRO 280 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1bhy h PRO 280 Cb 1.21 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1bhy h PRO 280 CO 0.69 0.12 0.00 1.97 -0.23 0.00 0.00 178.00 180.55 1bhy n PHE 281 N -5.07 0.72 -2.26 1.56 1.16 -1.26 -4.76 117.46 107.55 1bhy n PHE 281 Ca 0.00 0.24 -0.42 0.00 -1.87 0.00 0.00 57.45 55.40 1bhy n PHE 281 Cb 0.13 -0.89 -0.03 0.00 -1.61 0.00 0.00 39.48 37.09 1bhy n PHE 281 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1bhy s ILE 282 N -3.17 3.91 0.86 1.97 1.01 -1.15 -4.80 121.20 119.84 1bhy s ILE 282 Ca 0.08 1.19 -0.12 0.00 0.00 0.00 0.00 60.65 61.81 1bhy s ILE 282 Cb 0.12 -3.77 0.11 0.00 0.01 0.00 0.00 42.46 38.93 1bhy s ILE 282 CO 0.48 -0.06 1.10 -2.16 0.00 0.00 0.00 174.94 174.31 1bhy s PRO 283 N 3.11 1.52 0.40 2.79 0.04 -1.26 -4.93 135.00 136.68 1bhy s PRO 283 Ca 0.62 0.65 -0.11 0.00 0.04 0.00 0.00 61.00 62.21 1bhy s PRO 283 Cb -0.28 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 1bhy s PRO 283 CO 0.23 -2.01 0.77 -2.00 0.04 0.00 0.00 177.00 174.03 1bhy s GLU 284 N -5.07 3.79 0.00 4.56 -6.30 -1.26 -4.93 118.70 109.48 1bhy s GLU 284 Ca 0.62 0.48 0.00 0.00 -2.50 0.00 0.00 54.97 53.58 1bhy s GLU 284 Cb -0.16 -2.39 0.00 0.00 0.00 0.00 0.00 34.13 31.58 1bhy s GLU 284 CO 0.55 -0.04 0.00 -3.47 0.02 0.00 0.00 175.26 172.33 1bhy n ASP 285 N -1.28 0.00 0.28 -1.70 -0.08 -1.26 -4.99 116.55 107.52 1bhy n ASP 285 Ca 0.02 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.42 1bhy n ASP 285 Cb 0.54 0.00 0.59 0.00 2.34 0.00 0.00 41.12 44.59 1bhy n ASP 285 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1bhy h PRO 286 N 0.00 0.00 -0.01 -0.67 0.13 -2.03 0.46 132.00 129.88 1bhy h PRO 286 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1bhy h PRO 286 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1bhy h PRO 286 CO 0.00 0.00 -0.23 0.54 -0.23 0.00 0.00 178.00 178.08 1bhy n ARG 287 N -2.57 1.08 -3.71 0.86 1.74 -1.26 -4.69 116.66 108.11 1bhy n ARG 287 Ca -0.01 -0.69 -0.38 0.00 -0.77 0.00 0.00 57.85 56.00 1bhy n ARG 287 Cb 0.42 -1.49 -0.12 0.00 -1.02 0.00 0.00 32.46 30.25 1bhy n ARG 287 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bhy s ILE 288 N -2.39 4.09 0.26 0.55 1.01 0.15 -0.79 121.20 124.09 1bhy s ILE 288 Ca 0.26 -0.85 0.11 0.00 0.00 0.00 0.00 60.65 60.17 1bhy s ILE 288 Cb 0.19 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 39.40 1bhy s ILE 288 CO 0.48 -0.08 -0.11 0.27 0.00 0.00 0.00 174.94 175.51 1bhy s ILE 289 N 1.49 2.96 0.04 2.92 -4.36 0.34 -4.76 121.20 119.83 1bhy s ILE 289 Ca 0.01 -2.13 0.00 0.00 -0.26 0.00 0.00 60.65 58.28 1bhy s ILE 289 Cb -0.18 -2.56 0.00 0.00 1.25 0.00 0.00 42.46 40.97 1bhy s ILE 289 CO 0.04 -0.36 0.04 -0.90 0.24 0.00 0.00 174.94 173.99 1bhy n ASP 290 N -0.67 0.88 0.13 4.36 5.68 -1.26 0.80 116.55 126.47 1bhy n ASP 290 Ca -0.06 -1.13 0.12 0.00 -0.50 0.00 0.00 54.79 53.22 1bhy n ASP 290 Cb 0.59 -0.01 0.48 0.00 -1.14 0.00 0.00 41.12 41.04 1bhy n ASP 290 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1bhy n SER 291 N -2.23 0.72 0.07 -1.12 3.41 -1.26 -1.41 113.62 111.80 1bhy n SER 291 Ca 0.00 0.65 -0.14 0.00 -0.26 0.00 0.00 58.87 59.12 1bhy n SER 291 Cb 0.04 -0.81 -0.06 0.00 -0.26 0.00 0.00 64.21 63.12 1bhy n SER 291 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1bhy h SER 292 N 0.00 0.53 0.61 4.04 0.02 -1.95 -0.91 113.55 115.89 1bhy h SER 292 Ca 0.00 -0.44 -0.03 0.00 -0.84 0.00 0.00 61.79 60.48 1bhy h SER 292 Cb 0.44 -0.16 0.01 0.00 0.14 0.00 0.00 62.40 62.82 1bhy h SER 292 CO 0.00 1.25 -0.29 1.23 -1.14 0.00 0.00 176.83 177.88 1bhy h GLY 293 N 1.25 -0.85 -0.64 -3.77 0.00 -1.88 -2.03 103.07 95.14 1bhy h GLY 293 Ca -0.09 0.32 0.25 0.00 0.00 0.00 0.00 47.33 47.81 1bhy h GLY 293 CO 0.17 -0.31 0.16 0.00 0.00 0.00 0.00 176.54 176.56 1bhy h ALA 294 N -1.48 1.24 0.00 3.60 0.00 -1.31 3.20 119.26 124.51 1bhy h ALA 294 Ca -0.08 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1bhy h ALA 294 Cb 0.63 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1bhy h ALA 294 CO 0.14 -0.53 0.00 1.28 0.00 0.00 0.00 179.25 180.14 1bhy n LEU 295 N -5.33 0.00 0.03 0.00 4.77 -0.35 -2.20 117.00 113.92 1bhy n LEU 295 Ca 0.22 0.41 -0.05 0.00 -0.03 0.00 0.00 56.01 56.56 1bhy n LEU 295 Cb 0.72 -0.41 0.16 0.00 -2.33 0.00 0.00 43.42 41.56 1bhy n LEU 295 CO 0.01 -0.26 0.65 0.00 -1.33 0.00 0.00 177.39 176.46 1bhy h ALA 296 N 2.43 0.99 -5.41 -1.18 0.00 0.66 -3.48 119.26 113.27 1bhy h ALA 296 Ca 0.00 -0.41 -0.31 0.00 0.00 0.00 0.00 54.91 54.19 1bhy h ALA 296 Cb 0.15 -0.11 0.16 0.00 0.00 0.00 0.00 17.79 17.99 1bhy h ALA 296 CO 0.00 0.61 -0.71 1.28 0.00 0.00 0.00 179.25 180.42 1bhy n LEU 297 N -4.05 -3.87 0.17 0.00 4.77 -0.93 -4.89 117.00 108.19 1bhy n LEU 297 Ca -0.01 -0.57 0.03 0.00 -0.03 0.00 0.00 56.01 55.42 1bhy n LEU 297 Cb 0.48 -2.95 0.25 0.00 -2.33 0.00 0.00 43.42 38.87 1bhy n LEU 297 CO 0.43 0.37 0.60 0.50 -1.33 0.00 0.00 177.39 177.96 1bhy h LYS 298 N -1.81 0.00 0.00 3.23 3.64 -1.85 -3.48 116.57 116.31 1bhy h LYS 298 Ca -0.55 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 1bhy h LYS 298 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1bhy h LYS 298 CO 0.47 0.47 0.00 -0.85 -2.27 0.00 0.00 179.45 177.27 1bhy n GLU 299 N -3.58 0.00 -2.64 1.90 0.28 -1.26 -5.10 120.64 110.24 1bhy n GLU 299 Ca -0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.57 1bhy n GLU 299 Cb 0.57 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.42 1bhy n GLU 299 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1bhy s VAL 300 N -2.00 4.40 0.67 3.84 1.01 -1.26 -5.00 120.40 122.06 1bhy s VAL 300 Ca 0.00 1.50 -0.17 0.00 0.00 0.00 0.00 61.98 63.31 1bhy s VAL 300 Cb 0.00 -4.48 0.00 0.00 0.00 0.00 0.00 36.38 31.90 1bhy s VAL 300 CO 0.00 -0.69 1.28 -2.16 0.00 0.00 0.00 175.10 173.53 1bhy s PRO 301 N 3.95 2.41 0.13 2.72 0.04 -1.26 -4.88 135.00 138.11 1bhy s PRO 301 Ca 0.46 2.02 -0.06 0.00 0.04 0.00 0.00 61.00 63.45 1bhy s PRO 301 Cb -0.10 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.51 1bhy s PRO 301 CO 0.22 -1.70 1.31 0.78 0.04 0.00 0.00 177.00 177.65 1bhy h GLY 302 N 0.32 0.56 -6.33 0.56 0.00 -1.91 -3.31 103.07 92.96 1bhy h GLY 302 Ca -0.50 -0.92 -0.36 0.00 0.00 0.00 0.00 47.33 45.55 1bhy h GLY 302 CO 0.52 0.82 -0.75 0.54 0.00 0.00 0.00 176.54 177.66 1bhy s LYS 303 N -3.41 0.44 -0.13 4.80 1.02 -1.26 -1.77 119.74 119.44 1bhy s LYS 303 Ca -0.07 0.02 -0.01 0.00 0.02 0.00 0.00 55.97 55.93 1bhy s LYS 303 Cb 0.09 -0.57 0.03 0.00 -0.52 0.00 0.00 37.83 36.86 1bhy s LYS 303 CO 0.88 -0.11 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.97 1bhy s LEU 304 N 0.95 1.21 0.45 3.17 2.96 -0.70 -0.70 118.68 126.03 1bhy s LEU 304 Ca -0.10 -0.39 -0.15 0.00 -0.22 0.00 0.00 54.13 53.27 1bhy s LEU 304 Cb -0.14 -0.79 -0.08 0.00 0.50 0.00 0.00 46.19 45.68 1bhy s LEU 304 CO -0.01 -0.16 0.89 -0.22 -1.32 0.00 0.00 176.35 175.53 1bhy s LEU 305 N 1.73 3.76 -0.23 -0.68 0.20 -0.10 -1.87 118.68 121.49 1bhy s LEU 305 Ca 0.04 1.40 -0.02 0.00 0.69 0.00 0.00 54.13 56.24 1bhy s LEU 305 Cb -0.13 -4.30 0.07 0.00 -0.43 0.00 0.00 46.19 41.39 1bhy s LEU 305 CO -0.08 -0.47 0.05 -0.63 -0.29 0.00 0.00 176.35 174.94 1bhy s ILE 306 N -2.44 0.60 -0.33 6.68 1.01 -0.86 -0.13 121.20 125.73 1bhy s ILE 306 Ca 0.56 -0.78 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 1bhy s ILE 306 Cb -0.10 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.18 1bhy s ILE 306 CO 0.28 -0.34 0.69 -0.63 0.00 0.00 0.00 174.94 174.95 1bhy s ILE 307 N 1.80 4.85 0.00 2.92 1.01 0.20 -0.19 121.20 131.79 1bhy s ILE 307 Ca 0.02 0.83 0.00 0.00 0.00 0.00 0.00 60.65 61.49 1bhy s ILE 307 Cb -0.17 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.21 1bhy s ILE 307 CO -0.13 -0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.14 1bhy n GLY 308 N 4.49 2.63 1.56 6.18 0.00 0.34 -0.74 105.19 119.65 1bhy n GLY 308 Ca 0.01 -1.25 0.01 0.00 0.00 0.00 0.00 46.02 44.79 1bhy n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bhy n GLY 309 N 1.48 2.79 3.82 -0.02 0.00 -1.19 -4.68 105.19 107.39 1bhy n GLY 309 Ca 0.00 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 1bhy n GLY 309 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bhy s GLY 310 N -0.56 1.59 0.15 -0.02 0.00 -1.26 -0.95 107.32 106.27 1bhy s GLY 310 Ca 0.39 -0.60 -0.26 0.00 0.00 0.00 0.00 44.72 44.24 1bhy s GLY 310 CO 0.11 -0.05 1.59 -2.22 0.00 0.00 0.00 173.10 172.52 1bhy h ILE 311 N -1.39 0.17 -0.58 0.90 2.04 -1.94 -2.02 117.51 114.70 1bhy h ILE 311 Ca -0.49 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.48 1bhy h ILE 311 Cb 1.33 0.17 -0.11 0.00 -0.74 0.00 0.00 36.82 37.46 1bhy h ILE 311 CO 0.62 0.00 -0.33 0.40 0.00 0.00 0.00 178.15 178.83 1bhy h ILE 312 N -0.36 0.18 -0.09 -0.67 1.08 -1.94 0.52 117.51 116.23 1bhy h ILE 312 Ca 0.12 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.57 1bhy h ILE 312 Cb 0.58 0.18 -0.00 0.00 -3.07 0.00 0.00 36.82 34.51 1bhy h ILE 312 CO -0.49 0.00 -0.04 1.23 -0.69 0.00 0.00 178.15 178.16 1bhy h GLY 313 N -0.17 0.20 1.48 5.37 0.00 -1.85 0.56 103.07 108.66 1bhy h GLY 313 Ca 0.23 -0.18 0.07 0.00 0.00 0.00 0.00 47.33 47.45 1bhy h GLY 313 CO -0.67 0.16 0.19 1.41 0.00 0.00 0.00 176.54 177.64 1bhy h LEU 314 N -0.17 0.02 -0.22 3.11 3.38 -0.76 3.04 115.31 123.71 1bhy h LEU 314 Ca 0.02 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1bhy h LEU 314 Cb 0.48 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1bhy h LEU 314 CO 0.01 0.02 -0.45 -0.33 0.09 0.00 0.00 178.44 177.78 1bhy h GLU 315 N 0.03 0.69 -0.05 1.13 5.08 0.60 0.32 114.58 122.39 1bhy h GLU 315 Ca 0.13 -0.45 -0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1bhy h GLU 315 Cb 0.47 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1bhy h GLU 315 CO -0.01 1.07 0.03 0.52 -1.00 0.00 0.00 179.01 179.62 1bhy h MET 316 N 0.40 0.07 -0.21 2.33 2.86 0.17 -2.78 114.93 117.77 1bhy h MET 316 Ca 0.01 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1bhy h MET 316 Cb 1.06 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.63 1bhy h MET 316 CO 0.10 0.15 -0.36 0.78 1.06 0.00 0.00 176.91 178.63 1bhy h GLY 317 N -0.02 -0.50 0.17 8.32 0.00 0.54 -1.14 103.07 110.43 1bhy h GLY 317 Ca 0.02 0.45 0.16 0.00 0.00 0.00 0.00 47.33 47.96 1bhy h GLY 317 CO -0.00 -0.22 0.45 -0.84 0.00 0.00 0.00 176.54 175.93 1bhy h THR 318 N -0.39 0.70 -0.26 4.70 2.02 -0.74 0.21 112.91 119.14 1bhy h THR 318 Ca 0.11 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 1bhy h THR 318 Cb 0.57 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1bhy h THR 318 CO -0.42 0.11 -0.05 -0.37 0.37 0.00 0.00 175.52 175.16 1bhy h VAL 319 N 0.61 1.28 -0.14 3.16 -1.51 -0.98 -2.04 116.25 116.63 1bhy h VAL 319 Ca 0.49 -1.04 0.00 0.00 -1.23 0.00 0.00 66.70 64.91 1bhy h VAL 319 Cb 0.72 1.43 -0.01 0.00 -2.13 0.00 0.00 31.29 31.30 1bhy h VAL 319 CO -0.38 0.33 0.09 1.88 -1.23 0.00 0.00 177.57 178.25 1bhy h TYR 320 N 0.25 0.18 -0.03 5.19 0.05 -0.14 0.14 116.97 122.62 1bhy h TYR 320 Ca 0.07 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.88 1bhy h TYR 320 Cb 0.51 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.14 1bhy h TYR 320 CO 0.05 0.14 -0.27 1.03 -1.05 0.00 0.00 178.16 178.05 1bhy h SER 321 N 0.17 -0.82 -0.02 3.88 0.87 -0.65 0.21 113.55 117.19 1bhy h SER 321 Ca 0.05 0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.73 1bhy h SER 321 Cb 0.01 0.34 -0.00 0.00 -0.44 0.00 0.00 62.40 62.31 1bhy h SER 321 CO -0.01 -0.34 0.03 0.74 -0.53 0.00 0.00 176.83 176.72 1bhy h THR 322 N -0.40 0.54 -0.00 2.23 2.02 -1.14 0.21 112.91 116.36 1bhy h THR 322 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1bhy h THR 322 Cb 0.50 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1bhy h THR 322 CO -0.26 0.00 -0.21 0.18 0.37 0.00 0.00 175.52 175.60 1bhy n LEU 323 N -3.87 0.32 0.00 2.58 4.77 0.46 -4.93 117.00 116.34 1bhy n LEU 323 Ca -0.02 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1bhy n LEU 323 Cb 0.11 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1bhy n LEU 323 CO 0.28 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1bhy n GLY 324 N 1.44 1.38 3.77 -0.72 0.00 0.74 -4.99 105.19 106.81 1bhy n GLY 324 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1bhy n GLY 324 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bhy s SER 325 N -0.64 4.74 -0.13 1.61 0.01 0.19 -4.89 113.70 114.60 1bhy s SER 325 Ca 0.00 1.89 -0.05 0.00 1.31 0.00 0.00 55.95 59.11 1bhy s SER 325 Cb 0.00 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 1bhy s SER 325 CO 0.00 -1.88 0.04 0.00 0.41 0.00 0.00 173.24 171.82 1bhy s ARG 326 N -4.58 3.44 0.26 12.44 3.03 -0.73 -4.00 118.95 128.81 1bhy s ARG 326 Ca 0.63 -0.34 0.10 0.00 2.03 0.00 0.00 55.73 58.15 1bhy s ARG 326 Cb -0.18 -3.01 -0.04 0.00 -1.03 0.00 0.00 34.95 30.68 1bhy s ARG 326 CO 0.50 0.55 -0.02 -0.51 -1.13 0.00 0.00 175.30 174.69 1bhy s LEU 327 N -0.42 3.17 0.10 -1.89 1.43 -1.20 -1.72 118.68 118.15 1bhy s LEU 327 Ca 0.09 -0.65 0.06 0.00 -1.03 0.00 0.00 54.13 52.60 1bhy s LEU 327 Cb -0.12 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1bhy s LEU 327 CO 0.02 0.01 -0.14 -1.81 0.23 0.00 0.00 176.35 174.66 1bhy s ASP 328 N -3.59 1.89 0.00 2.29 1.11 -0.78 -1.04 116.67 116.54 1bhy s ASP 328 Ca 0.31 -0.73 0.01 0.00 0.18 0.00 0.00 52.55 52.32 1bhy s ASP 328 Cb -0.07 -0.06 -0.00 0.00 1.07 0.00 0.00 42.92 43.86 1bhy s ASP 328 CO 0.19 -0.11 -0.02 0.54 1.18 0.00 0.00 175.17 176.95 1bhy s VAL 329 N -1.75 0.15 -0.08 -1.27 0.11 -0.42 -2.02 120.40 115.12 1bhy s VAL 329 Ca 0.04 -0.18 0.05 0.00 -2.93 0.00 0.00 61.98 58.96 1bhy s VAL 329 Cb -0.07 -0.15 -0.01 0.00 -1.53 0.00 0.00 36.38 34.62 1bhy s VAL 329 CO 0.03 -0.02 -0.24 -0.69 -3.33 0.00 0.00 175.10 170.85 1bhy s VAL 330 N -0.21 2.14 -0.03 2.04 1.01 0.73 -0.66 120.40 125.42 1bhy s VAL 330 Ca -0.01 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.94 1bhy s VAL 330 Cb -0.02 -1.80 0.03 0.00 0.00 0.00 0.00 36.38 34.59 1bhy s VAL 330 CO -0.00 0.56 0.04 -0.70 0.00 0.00 0.00 175.10 175.01 1bhy s GLU 331 N 0.02 -0.01 0.28 2.72 2.56 0.59 0.12 118.70 124.99 1bhy s GLU 331 Ca -0.09 0.27 0.07 0.00 0.00 0.00 0.00 54.97 55.23 1bhy s GLU 331 Cb -0.15 -0.42 0.42 0.00 2.00 0.00 0.00 34.13 35.97 1bhy s GLU 331 CO 0.06 -0.25 1.67 0.52 -0.56 0.00 0.00 175.26 176.69 1bhy h MET 332 N 7.90 0.19 -7.57 4.30 2.86 -1.86 0.59 114.93 121.34 1bhy h MET 332 Ca -0.28 -0.10 -0.45 0.00 -2.06 0.00 0.00 59.70 56.81 1bhy h MET 332 Cb 1.12 0.00 0.14 0.00 0.06 0.00 0.00 31.60 32.93 1bhy h MET 332 CO 0.31 0.63 0.32 -1.64 1.06 0.00 0.00 176.91 177.58 1bhy s MET 333 N -3.99 0.77 0.08 1.72 -1.94 -1.26 -3.63 119.30 111.06 1bhy s MET 333 Ca -0.04 0.06 0.09 0.00 -1.71 0.00 0.00 55.69 54.08 1bhy s MET 333 Cb 0.13 -1.82 0.42 0.00 2.01 0.00 0.00 34.83 35.57 1bhy s MET 333 CO 0.77 -2.40 1.27 -0.25 -0.01 0.00 0.00 175.02 174.40 1bhy n ASP 334 N -3.86 0.16 -0.38 3.03 9.92 -1.26 0.21 116.55 124.38 1bhy n ASP 334 Ca 0.10 0.57 0.00 0.00 -0.53 0.00 0.00 54.79 54.92 1bhy n ASP 334 Cb 0.60 -0.59 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1bhy n ASP 334 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bhy n GLY 335 N -1.10 2.24 4.03 0.44 0.00 -1.26 -4.75 105.19 104.78 1bhy n GLY 335 Ca 0.00 -0.82 -0.19 0.00 0.00 0.00 0.00 46.02 45.01 1bhy n GLY 335 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bhy s LEU 336 N 0.00 3.21 -0.29 0.99 1.02 -1.26 -4.60 118.68 117.75 1bhy s LEU 336 Ca 0.00 -0.71 -0.06 0.00 0.02 0.00 0.00 54.13 53.38 1bhy s LEU 336 Cb 0.00 -1.89 0.01 0.00 0.02 0.00 0.00 46.19 44.33 1bhy s LEU 336 CO 0.00 -1.25 0.11 0.23 0.02 0.00 0.00 176.35 175.46 1bhy n MET 337 N -2.20 -0.90 -1.63 1.70 2.81 -0.12 -4.69 117.12 112.07 1bhy n MET 337 Ca 0.14 -0.29 -0.46 0.00 -1.81 0.00 0.00 57.70 55.28 1bhy n MET 337 Cb 0.61 -0.07 -0.03 0.00 -0.71 0.00 0.00 33.22 33.02 1bhy n MET 337 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1bhy n GLN 338 N -1.85 1.69 0.00 0.03 3.00 -1.26 -1.57 117.38 117.42 1bhy n GLN 338 Ca -0.04 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.55 1bhy n GLN 338 Cb 0.13 -2.19 0.00 0.00 0.00 0.00 0.00 30.24 28.19 1bhy n GLN 338 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1bhy n GLY 339 N 2.04 2.50 3.94 1.08 0.00 -1.26 -4.97 105.19 108.52 1bhy n GLY 339 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 1bhy n GLY 339 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bhy s ALA 340 N -2.52 3.36 0.08 4.61 0.00 -0.61 -5.02 121.76 121.67 1bhy s ALA 340 Ca 0.00 -1.09 -0.31 0.00 0.00 0.00 0.00 51.96 50.57 1bhy s ALA 340 Cb 0.00 -2.43 -0.06 0.00 0.00 0.00 0.00 23.12 20.62 1bhy s ALA 340 CO 0.00 -1.20 1.22 -0.51 0.00 0.00 0.00 175.76 175.28 1bhy s ASP 341 N -4.52 7.05 0.56 0.00 1.01 -1.26 -4.91 116.67 114.59 1bhy s ASP 341 Ca 0.60 2.09 0.25 0.00 0.71 0.00 0.00 52.55 56.19 1bhy s ASP 341 Cb -0.10 -2.58 1.52 0.00 1.01 0.00 0.00 42.92 42.76 1bhy s ASP 341 CO 0.43 -0.48 2.11 0.03 0.21 0.00 0.00 175.17 177.47 1bhy h ARG 342 N 6.60 0.00 -0.61 8.23 -0.00 -1.95 0.87 114.38 127.52 1bhy h ARG 342 Ca -0.42 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.05 1bhy h ARG 342 Cb 1.21 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 31.15 1bhy h ARG 342 CO 0.81 0.00 0.33 0.38 0.00 0.00 0.00 179.97 181.49 1bhy h ASP 343 N 0.00 0.74 -0.10 7.04 2.03 -1.99 0.57 116.42 124.70 1bhy h ASP 343 Ca 0.09 -0.05 -0.10 0.00 -0.73 0.00 0.00 57.03 56.23 1bhy h ASP 343 Cb 0.40 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 1bhy h ASP 343 CO -0.00 0.60 -0.34 -0.07 -1.03 0.00 0.00 179.24 178.39 1bhy h LEU 344 N 0.84 0.47 -0.74 0.15 4.07 -1.26 -2.93 115.31 115.92 1bhy h LEU 344 Ca 0.22 -0.61 -0.02 0.00 0.08 0.00 0.00 57.88 57.54 1bhy h LEU 344 Cb 0.02 -0.14 -0.03 0.00 1.08 0.00 0.00 40.66 41.59 1bhy h LEU 344 CO -0.04 1.01 0.37 0.58 -1.08 0.00 0.00 178.44 179.28 1bhy h VAL 345 N -0.03 1.23 -0.61 1.22 2.07 -0.57 -1.64 116.25 117.92 1bhy h VAL 345 Ca -0.01 -0.63 0.11 0.00 0.82 0.00 0.00 66.70 66.99 1bhy h VAL 345 Cb 0.97 0.30 -0.12 0.00 -1.52 0.00 0.00 31.29 30.92 1bhy h VAL 345 CO 0.07 0.27 -0.28 0.50 0.02 0.00 0.00 177.57 178.15 1bhy h LYS 346 N 1.03 -0.11 0.10 1.57 1.63 0.10 2.88 116.57 123.76 1bhy h LYS 346 Ca 0.26 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.07 1bhy h LYS 346 Cb 0.09 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 1bhy h LYS 346 CO -0.04 -0.07 -0.16 0.28 -3.45 0.00 0.00 179.45 176.01 1bhy h VAL 347 N -0.12 0.62 -0.13 2.00 2.07 -1.26 0.23 116.25 119.67 1bhy h VAL 347 Ca 0.26 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.80 1bhy h VAL 347 Cb 0.53 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1bhy h VAL 347 CO -0.68 0.00 -0.00 -0.25 0.02 0.00 0.00 177.57 176.66 1bhy h TRP 348 N -0.32 -0.01 -0.85 1.57 7.01 0.95 -2.52 115.95 121.78 1bhy h TRP 348 Ca 0.02 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1bhy h TRP 348 Cb 0.34 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.38 1bhy h TRP 348 CO -0.17 -0.02 0.54 0.37 -2.79 0.00 0.00 178.44 176.37 1bhy h GLN 349 N 0.04 1.14 -0.34 2.65 4.15 0.50 -2.35 115.11 120.91 1bhy h GLN 349 Ca 0.06 -0.09 0.05 0.00 0.77 0.00 0.00 58.65 59.44 1bhy h GLN 349 Cb 0.07 -0.25 -0.04 0.00 0.21 0.00 0.00 27.48 27.47 1bhy h GLN 349 CO -0.10 0.78 0.08 0.87 -1.93 0.00 0.00 178.83 178.53 1bhy h LYS 350 N 1.17 0.20 0.00 1.69 6.56 -0.12 0.15 116.57 126.22 1bhy h LYS 350 Ca 0.31 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.89 1bhy h LYS 350 Cb -0.09 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.53 1bhy h LYS 350 CO -0.06 0.14 0.00 0.94 -2.06 0.00 0.00 179.45 178.40 1bhy n GLN 351 N -5.07 0.05 0.00 3.15 7.27 -1.00 -3.54 117.38 118.24 1bhy n GLN 351 Ca 0.01 0.20 0.00 0.00 0.07 0.00 0.00 57.00 57.27 1bhy n GLN 351 Cb 0.14 -1.57 0.00 0.00 2.41 0.00 0.00 30.24 31.22 1bhy n GLN 351 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1bhy n ASN 352 N -1.66 0.55 -0.31 1.69 3.02 -0.92 -4.70 115.26 112.94 1bhy n ASN 352 Ca 0.05 -0.84 0.17 0.00 -0.03 0.00 0.00 54.58 53.92 1bhy n ASN 352 Cb 0.25 0.19 0.35 0.00 -0.61 0.00 0.00 39.78 39.96 1bhy n ASN 352 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1bhy h GLU 353 N 0.00 0.18 0.00 3.52 4.81 -0.76 1.13 114.58 123.46 1bhy h GLU 353 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1bhy h GLU 353 Cb 0.10 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1bhy h GLU 353 CO 0.00 0.12 0.00 2.48 -0.73 0.00 0.00 179.01 180.88 1bhy n TYR 354 N -5.24 0.00 0.42 0.92 4.11 -1.26 -1.78 117.16 114.33 1bhy n TYR 354 Ca 0.25 0.00 0.12 0.00 -0.00 0.00 0.00 57.90 58.27 1bhy n TYR 354 Cb 0.81 -0.35 0.19 0.00 -0.00 0.00 0.00 39.34 39.98 1bhy n TYR 354 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1bhy h ARG 355 N 0.00 0.00 -6.24 -3.48 3.08 0.99 -3.47 114.38 105.27 1bhy h ARG 355 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1bhy h ARG 355 Cb 0.03 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.00 1bhy h ARG 355 CO 0.00 0.00 -0.60 -0.06 -1.07 0.00 0.00 179.97 178.24 1bhy s PHE 356 N -3.20 2.97 -0.21 3.04 0.40 -0.74 -3.21 117.98 117.03 1bhy s PHE 356 Ca 0.06 -0.11 -0.20 0.00 -0.60 0.00 0.00 56.93 56.08 1bhy s PHE 356 Cb 0.11 -1.39 -0.17 0.00 0.51 0.00 0.00 43.02 42.08 1bhy s PHE 356 CO 0.70 0.54 0.12 -0.25 0.70 0.00 0.00 175.22 177.02 1bhy n ASP 357 N -0.61 1.87 -3.86 1.36 8.00 -0.21 -4.88 116.55 118.21 1bhy n ASP 357 Ca -0.08 0.43 -0.23 0.00 0.71 0.00 0.00 54.79 55.62 1bhy n ASP 357 Cb 0.56 -0.94 -0.17 0.00 -0.02 0.00 0.00 41.12 40.55 1bhy n ASP 357 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1bhy s ASN 358 N -6.85 1.48 -0.88 -2.24 -0.87 -1.26 -5.05 114.94 99.28 1bhy s ASN 358 Ca -0.29 -0.16 -0.10 0.00 -1.57 0.00 0.00 52.86 50.74 1bhy s ASN 358 Cb 0.07 -0.55 0.23 0.00 -0.02 0.00 0.00 41.25 40.97 1bhy s ASN 358 CO 0.55 -0.11 0.81 -0.63 -2.57 0.00 0.00 177.10 175.15 1bhy s ILE 359 N 1.43 5.36 -0.59 0.60 1.01 -1.26 -1.30 121.20 126.45 1bhy s ILE 359 Ca -0.03 -2.89 -0.24 0.00 0.00 0.00 0.00 60.65 57.50 1bhy s ILE 359 Cb -0.13 -4.31 0.05 0.00 0.01 0.00 0.00 42.46 38.08 1bhy s ILE 359 CO -0.03 -1.05 0.96 -0.04 0.00 0.00 0.00 174.94 174.78 1bhy s MET 360 N -0.34 3.26 0.35 2.79 -1.94 0.17 -4.97 119.30 118.61 1bhy s MET 360 Ca 0.22 -0.43 0.08 0.00 -1.71 0.00 0.00 55.69 53.84 1bhy s MET 360 Cb -0.11 -4.11 -0.03 0.00 2.01 0.00 0.00 34.83 32.59 1bhy s MET 360 CO -0.08 -1.61 0.28 0.54 -0.01 0.00 0.00 175.02 174.14 1bhy s VAL 361 N 4.05 3.35 -1.67 -6.03 0.11 -1.26 -0.30 120.40 118.65 1bhy s VAL 361 Ca 0.28 -1.41 -0.19 0.00 -2.93 0.00 0.00 61.98 57.73 1bhy s VAL 361 Cb -0.14 -3.13 0.18 0.00 -1.53 0.00 0.00 36.38 31.76 1bhy s VAL 361 CO 0.16 -0.15 0.67 0.59 -3.33 0.00 0.00 175.10 173.04 1bhy n ASN 362 N -1.36 -2.73 -4.17 3.54 5.03 0.20 -4.68 115.26 111.08 1bhy n ASN 362 Ca -0.01 -0.99 -0.22 0.00 0.87 0.00 0.00 54.58 54.24 1bhy n ASN 362 Cb 0.60 -2.28 -0.13 0.00 -1.02 0.00 0.00 39.78 36.95 1bhy n ASN 362 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1bhy s THR 363 N -3.18 1.27 -0.18 3.41 -4.23 -0.71 -4.24 115.64 107.78 1bhy s THR 363 Ca 0.73 -1.06 -0.13 0.00 -1.18 0.00 0.00 61.69 60.05 1bhy s THR 363 Cb -0.41 -1.14 -0.05 0.00 1.34 0.00 0.00 72.50 72.25 1bhy s THR 363 CO 0.89 0.06 0.25 -0.54 -0.54 0.00 0.00 174.62 174.75 1bhy s LYS 364 N -1.15 4.22 -0.36 3.99 -0.14 0.75 -3.64 119.74 123.41 1bhy s LYS 364 Ca 0.03 0.01 -0.28 0.00 -1.36 0.00 0.00 55.97 54.37 1bhy s LYS 364 Cb -0.08 -3.44 0.02 0.00 -1.68 0.00 0.00 37.83 32.64 1bhy s LYS 364 CO 0.01 0.21 1.05 0.99 -0.76 0.00 0.00 175.35 176.85 1bhy s THR 365 N 0.56 4.48 -0.21 2.17 2.01 -1.26 0.27 115.64 123.66 1bhy s THR 365 Ca 0.14 1.52 -0.14 0.00 0.31 0.00 0.00 61.69 63.52 1bhy s THR 365 Cb -0.13 -4.42 -0.08 0.00 0.01 0.00 0.00 72.50 67.88 1bhy s THR 365 CO 0.03 -0.57 -0.32 0.55 -0.69 0.00 0.00 174.62 173.61 1bhy n VAL 366 N 6.05 1.43 -3.90 3.82 3.14 0.15 -4.90 118.33 124.12 1bhy n VAL 366 Ca 0.11 -0.11 -0.34 0.00 -2.96 0.00 0.00 64.34 61.03 1bhy n VAL 366 Cb 0.48 -2.05 -0.05 0.00 -1.06 0.00 0.00 33.84 31.16 1bhy n VAL 366 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1bhy s ALA 367 N -2.63 3.94 -0.31 1.55 0.00 -0.81 -4.97 121.76 118.53 1bhy s ALA 367 Ca -0.31 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 50.91 1bhy s ALA 367 Cb 0.09 -1.91 0.13 0.00 0.00 0.00 0.00 23.12 21.44 1bhy s ALA 367 CO 0.42 0.72 0.26 0.08 0.00 0.00 0.00 175.76 177.24 1bhy s VAL 368 N -1.25 -0.26 -0.22 0.00 1.01 -1.26 -1.21 120.40 117.21 1bhy s VAL 368 Ca 0.24 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1bhy s VAL 368 Cb -0.12 -0.95 0.06 0.00 0.00 0.00 0.00 36.38 35.36 1bhy s VAL 368 CO 0.15 -0.60 -0.04 -1.61 0.00 0.00 0.00 175.10 173.00 1bhy s GLU 369 N 2.02 1.49 0.38 2.72 2.02 0.67 -4.42 118.70 123.58 1bhy s GLU 369 Ca 0.11 -0.83 -0.27 0.00 0.02 0.00 0.00 54.97 54.00 1bhy s GLU 369 Cb -0.15 -2.42 -0.10 0.00 0.10 0.00 0.00 34.13 31.56 1bhy s GLU 369 CO -0.26 -0.56 1.38 -2.14 0.02 0.00 0.00 175.26 173.69 1bhy s PRO 370 N 1.50 4.11 0.24 0.39 0.02 -1.26 -0.51 135.00 139.49 1bhy s PRO 370 Ca -0.04 2.34 0.02 0.00 0.02 0.00 0.00 61.00 63.34 1bhy s PRO 370 Cb -0.18 -2.92 -0.05 0.00 0.02 0.00 0.00 34.50 31.37 1bhy s PRO 370 CO -0.07 -0.44 0.06 0.15 -0.33 0.00 0.00 177.00 176.38 1bhy s LYS 371 N -2.06 1.35 0.43 5.54 1.02 -0.27 -4.82 119.74 120.92 1bhy s LYS 371 Ca 0.53 -1.71 0.12 0.00 0.02 0.00 0.00 55.97 54.93 1bhy s LYS 371 Cb -0.42 -0.33 1.00 0.00 -0.52 0.00 0.00 37.83 37.56 1bhy s LYS 371 CO 0.56 -0.23 2.02 1.49 -0.92 0.00 0.00 175.35 178.26 1bhy h GLU 372 N 2.45 0.41 -1.49 1.68 4.81 -2.03 -2.40 114.58 118.01 1bhy h GLU 372 Ca -0.38 -0.02 -0.72 0.00 -0.13 0.00 0.00 59.36 58.11 1bhy h GLU 372 Cb 1.24 -0.09 -0.29 0.00 0.63 0.00 0.00 28.75 30.24 1bhy h GLU 372 CO 0.62 0.27 0.88 -0.40 -0.73 0.00 0.00 179.01 179.65 1bhy n ASP 373 N -4.47 7.48 0.00 1.04 5.75 -1.26 -5.02 116.55 120.06 1bhy n ASP 373 Ca 0.07 -3.81 0.00 0.00 -0.01 0.00 0.00 54.79 51.04 1bhy n ASP 373 Cb 0.26 -0.99 0.00 0.00 -1.03 0.00 0.00 41.12 39.36 1bhy n ASP 373 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bhy n GLY 374 N -0.72 0.05 3.66 6.12 0.00 -0.90 -4.83 105.19 108.57 1bhy n GLY 374 Ca 0.58 -1.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.43 1bhy n GLY 374 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bhy s VAL 375 N -2.61 3.92 -0.28 1.61 1.01 -0.55 -1.12 120.40 122.38 1bhy s VAL 375 Ca 0.00 1.10 -0.10 0.00 0.00 0.00 0.00 61.98 62.98 1bhy s VAL 375 Cb 0.00 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1bhy s VAL 375 CO 0.00 -0.13 0.16 -0.31 0.00 0.00 0.00 175.10 174.82 1bhy s TYR 376 N 3.92 3.18 -0.05 5.22 1.51 0.34 -0.80 117.35 130.67 1bhy s TYR 376 Ca 0.64 -0.05 0.02 0.00 -1.01 0.00 0.00 57.07 56.68 1bhy s TYR 376 Cb -0.27 -2.35 0.01 0.00 -0.11 0.00 0.00 41.96 39.25 1bhy s TYR 376 CO 0.23 -0.23 -0.11 0.54 -1.11 0.00 0.00 175.55 174.87 1bhy s VAL 377 N 1.72 1.01 -0.11 0.71 0.11 0.24 -0.24 120.40 123.84 1bhy s VAL 377 Ca 0.07 -0.42 -0.15 0.00 -2.93 0.00 0.00 61.98 58.54 1bhy s VAL 377 Cb -0.16 -0.92 -0.05 0.00 -1.53 0.00 0.00 36.38 33.72 1bhy s VAL 377 CO 0.09 0.32 0.37 -0.89 -3.33 0.00 0.00 175.10 171.66 1bhy s THR 378 N 0.57 5.22 0.22 5.04 2.01 -0.35 -1.22 115.64 127.12 1bhy s THR 378 Ca -0.11 0.73 0.11 0.00 0.31 0.00 0.00 61.69 62.72 1bhy s THR 378 Cb -0.14 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 1bhy s THR 378 CO 0.03 0.41 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.85 1bhy s PHE 379 N 0.17 2.45 -0.05 4.92 0.08 -1.26 0.30 117.98 124.59 1bhy s PHE 379 Ca 0.21 -0.29 0.05 0.00 0.12 0.00 0.00 56.93 57.02 1bhy s PHE 379 Cb -0.14 -1.16 -0.01 0.00 -0.57 0.00 0.00 43.02 41.14 1bhy s PHE 379 CO 0.08 0.57 -0.22 -2.00 -0.10 0.00 0.00 175.22 173.55 1bhy s GLU 380 N -3.03 2.24 0.00 0.44 2.56 0.77 -4.76 118.70 116.92 1bhy s GLU 380 Ca 0.25 -0.78 0.00 0.00 0.00 0.00 0.00 54.97 54.44 1bhy s GLU 380 Cb -0.07 -1.91 0.00 0.00 2.00 0.00 0.00 34.13 34.15 1bhy s GLU 380 CO 0.14 0.32 0.00 0.41 -0.56 0.00 0.00 175.26 175.57 1bhy n GLY 381 N 3.03 -0.32 3.14 -1.50 0.00 -1.26 0.27 105.19 108.55 1bhy n GLY 381 Ca -0.18 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.34 1bhy n GLY 381 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bhy s ALA 382 N -1.00 0.85 -0.94 4.61 0.00 -1.26 -4.73 121.76 119.28 1bhy s ALA 382 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.79 1bhy s ALA 382 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1bhy s ALA 382 CO 0.00 -0.17 0.00 -1.71 0.00 0.00 0.00 175.76 173.88 1bhy n ASN 383 N 0.43 -3.25 -4.30 0.00 4.05 -1.26 -4.81 115.26 106.12 1bhy n ASN 383 Ca -0.15 0.25 -0.35 0.00 0.45 0.00 0.00 54.58 54.77 1bhy n ASN 383 Cb 0.59 -2.87 -0.14 0.00 1.23 0.00 0.00 39.78 38.59 1bhy n ASN 383 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1bhy s ALA 384 N -2.34 2.80 -0.30 5.20 0.00 -1.26 -4.80 121.76 121.05 1bhy s ALA 384 Ca 0.00 -1.21 -0.41 0.00 0.00 0.00 0.00 51.96 50.34 1bhy s ALA 384 Cb 0.00 -1.71 -0.16 0.00 0.00 0.00 0.00 23.12 21.25 1bhy s ALA 384 CO 0.00 -0.48 1.71 -2.30 0.00 0.00 0.00 175.76 174.68 1bhy n PRO 385 N 4.79 0.96 0.18 0.00 -0.02 -1.26 -4.79 135.00 134.86 1bhy n PRO 385 Ca -0.18 0.35 0.14 0.00 -2.02 0.00 0.00 63.50 61.79 1bhy n PRO 385 Cb 0.50 -2.01 0.51 0.00 -0.02 0.00 0.00 33.50 32.49 1bhy n PRO 385 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1bhy h LYS 386 N 6.76 0.00 -5.92 -0.52 6.56 -1.97 -3.41 116.57 118.07 1bhy h LYS 386 Ca -0.46 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 58.55 1bhy h LYS 386 Cb 1.33 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 32.92 1bhy h LYS 386 CO 0.96 0.00 0.22 -1.21 -2.06 0.00 0.00 179.45 177.35 1bhy s GLU 387 N -3.39 4.33 0.30 3.15 2.02 -1.26 -4.97 118.70 118.88 1bhy s GLU 387 Ca 0.04 0.88 -0.29 0.00 0.02 0.00 0.00 54.97 55.62 1bhy s GLU 387 Cb 0.09 -3.53 -0.13 0.00 0.10 0.00 0.00 34.13 30.67 1bhy s GLU 387 CO 0.49 -0.16 1.29 -2.30 0.02 0.00 0.00 175.26 174.60 1bhy n PRO 388 N 4.64 1.97 -3.51 0.39 -0.02 -1.26 -4.91 135.00 132.29 1bhy n PRO 388 Ca 0.01 0.69 -0.28 0.00 -2.02 0.00 0.00 63.50 61.91 1bhy n PRO 388 Cb 0.50 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 1bhy n PRO 388 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1bhy s GLN 389 N -1.31 3.58 -0.03 -0.52 -1.52 -0.36 -4.86 119.66 114.64 1bhy s GLN 389 Ca 0.60 -0.17 0.07 0.00 -1.95 0.00 0.00 55.36 53.92 1bhy s GLN 389 Cb -0.62 -2.74 -0.02 0.00 -0.22 0.00 0.00 33.01 29.41 1bhy s GLN 389 CO 0.57 0.31 -0.25 0.50 -0.25 0.00 0.00 175.29 176.17 1bhy s ARG 390 N -3.44 2.25 0.04 2.91 3.52 -1.26 0.82 118.95 123.79 1bhy s ARG 390 Ca 0.41 -0.90 0.02 0.00 -0.13 0.00 0.00 55.73 55.12 1bhy s ARG 390 Cb -0.11 -2.10 -0.02 0.00 -1.56 0.00 0.00 34.95 31.16 1bhy s ARG 390 CO 0.29 0.52 -0.06 0.71 -0.81 0.00 0.00 175.30 175.95 1bhy s TYR 391 N -0.51 0.59 -2.11 5.12 2.02 0.02 -4.98 117.35 117.50 1bhy s TYR 391 Ca 0.07 -0.55 0.28 0.00 -0.37 0.00 0.00 57.07 56.50 1bhy s TYR 391 Cb -0.11 -0.36 1.54 0.00 -0.40 0.00 0.00 41.96 42.63 1bhy s TYR 391 CO 0.00 -0.12 2.01 -0.25 -1.57 0.00 0.00 175.55 175.62 1bhy n ASP 392 N 1.35 0.38 -3.64 2.29 8.00 0.12 -1.48 116.55 123.56 1bhy n ASP 392 Ca -0.22 -1.21 -0.02 0.00 0.71 0.00 0.00 54.79 54.05 1bhy n ASP 392 Cb 0.55 -0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.61 1bhy n ASP 392 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bhy s ALA 393 N -1.99 -2.12 -0.04 2.24 0.00 -1.01 -4.87 121.76 113.97 1bhy s ALA 393 Ca 0.42 1.90 0.01 0.00 0.00 0.00 0.00 51.96 54.28 1bhy s ALA 393 Cb 0.20 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.85 1bhy s ALA 393 CO 0.33 -0.25 -0.04 0.14 0.00 0.00 0.00 175.76 175.94 1bhy s VAL 394 N -1.05 0.49 -0.38 0.00 -7.23 0.03 -0.92 120.40 111.34 1bhy s VAL 394 Ca 0.09 -0.11 -0.15 0.00 -1.81 0.00 0.00 61.98 60.00 1bhy s VAL 394 Cb -0.01 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 36.41 1bhy s VAL 394 CO -0.08 0.21 0.32 -0.22 -0.31 0.00 0.00 175.10 175.03 1bhy s LEU 395 N 0.87 4.77 -0.44 1.32 2.96 0.82 -0.50 118.68 128.48 1bhy s LEU 395 Ca -0.11 -0.59 -0.21 0.00 -0.22 0.00 0.00 54.13 53.00 1bhy s LEU 395 Cb -0.14 -2.24 0.03 0.00 0.50 0.00 0.00 46.19 44.34 1bhy s LEU 395 CO 0.00 -0.40 0.65 -0.69 -1.32 0.00 0.00 176.35 174.59 1bhy s VAL 396 N 1.85 4.82 -0.40 1.68 1.01 0.24 0.60 120.40 130.20 1bhy s VAL 396 Ca 0.08 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.22 1bhy s VAL 396 Cb -0.18 -4.22 0.43 0.00 0.00 0.00 0.00 36.38 32.42 1bhy s VAL 396 CO 0.11 -0.62 1.09 0.00 0.00 0.00 0.00 175.10 175.68 1bhy n ALA 397 N 6.28 4.71 1.13 5.51 0.00 0.08 -4.30 120.51 133.93 1bhy n ALA 397 Ca -0.02 -4.02 0.11 0.00 0.00 0.00 0.00 53.44 49.51 1bhy n ALA 397 Cb 0.48 -0.60 0.57 0.00 0.00 0.00 0.00 19.45 19.90 1bhy n ALA 397 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bhy n ALA 398 N -0.43 2.18 0.00 0.00 0.00 -1.12 -4.43 120.51 116.70 1bhy n ALA 398 Ca 0.33 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1bhy n ALA 398 Cb 0.72 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1bhy n ALA 398 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bhy n GLY 399 N 0.44 0.82 2.87 0.00 0.00 -1.26 -4.95 105.19 103.10 1bhy n GLY 399 Ca 0.12 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 1bhy n GLY 399 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bhy s ARG 400 N -1.29 0.03 -0.10 1.61 0.52 -1.26 -2.58 118.95 115.87 1bhy s ARG 400 Ca 0.00 0.01 -0.04 0.00 -0.52 0.00 0.00 55.73 55.18 1bhy s ARG 400 Cb 0.00 -0.05 -0.04 0.00 0.52 0.00 0.00 34.95 35.38 1bhy s ARG 400 CO 0.00 -0.01 0.05 0.00 0.02 0.00 0.00 175.30 175.36 1bhy s ALA 401 N 0.10 3.47 0.56 2.13 0.00 0.89 -4.82 121.76 124.08 1bhy s ALA 401 Ca -0.01 -0.75 -0.17 0.00 0.00 0.00 0.00 51.96 51.03 1bhy s ALA 401 Cb -0.01 -1.66 -0.05 0.00 0.00 0.00 0.00 23.12 21.39 1bhy s ALA 401 CO -0.00 0.56 1.05 -1.25 0.00 0.00 0.00 175.76 176.12 1bhy s PRO 402 N -0.82 3.48 -0.50 0.00 0.04 -1.26 0.25 135.00 136.19 1bhy s PRO 402 Ca 0.13 1.23 0.02 0.00 0.04 0.00 0.00 61.00 62.42 1bhy s PRO 402 Cb -0.12 -2.05 0.58 0.00 0.04 0.00 0.00 34.50 32.95 1bhy s PRO 402 CO 0.03 -0.68 1.94 0.09 0.04 0.00 0.00 177.00 178.42 1bhy n ASN 403 N -1.73 4.97 -0.28 6.66 5.03 0.77 -4.65 115.26 126.03 1bhy n ASN 403 Ca 0.09 -3.62 -0.03 0.00 0.87 0.00 0.00 54.58 51.88 1bhy n ASN 403 Cb 0.53 -0.88 0.08 0.00 -1.02 0.00 0.00 39.78 38.49 1bhy n ASN 403 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1bhy h GLY 404 N 1.39 1.10 1.11 7.41 0.00 -1.45 -2.08 103.07 110.55 1bhy h GLY 404 Ca 0.61 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1bhy h GLY 404 CO 1.23 0.36 0.00 0.28 0.00 0.00 0.00 176.54 178.41 1bhy n LYS 405 N -4.58 0.43 -0.95 4.80 5.02 -1.26 -3.14 118.16 118.49 1bhy n LYS 405 Ca 0.08 0.03 -0.08 0.00 -2.02 0.00 0.00 58.31 56.33 1bhy n LYS 405 Cb 0.05 -1.50 0.18 0.00 -0.02 0.00 0.00 35.03 33.74 1bhy n LYS 405 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1bhy n LEU 406 N -1.06 4.34 0.00 -0.35 4.77 -0.78 -4.58 117.00 119.35 1bhy n LEU 406 Ca 0.11 -3.91 0.00 0.00 -0.03 0.00 0.00 56.01 52.17 1bhy n LEU 406 Cb 0.07 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1bhy n LEU 406 CO 0.09 1.37 0.34 2.30 -1.33 0.00 0.00 177.39 180.17 1bhy n ILE 407 N -1.08 0.42 -3.63 -0.08 -5.35 -1.19 -5.00 119.36 103.46 1bhy n ILE 407 Ca 0.35 -0.44 -0.22 0.00 -0.27 0.00 0.00 62.75 62.17 1bhy n ILE 407 Cb 1.01 0.84 0.06 0.00 -1.74 0.00 0.00 39.64 39.80 1bhy n ILE 407 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1bhy n SER 408 N -0.21 -2.94 0.22 7.28 7.64 -1.26 -1.00 113.62 123.35 1bhy n SER 408 Ca 0.00 -0.70 0.05 0.00 1.01 0.00 0.00 58.87 59.23 1bhy n SER 408 Cb 0.36 -4.54 0.51 0.00 -1.01 0.00 0.00 64.21 59.53 1bhy n SER 408 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bhy h ALA 409 N 0.92 1.71 0.00 -0.43 0.00 -1.88 -0.64 119.26 118.94 1bhy h ALA 409 Ca -0.59 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.16 1bhy h ALA 409 Cb 1.36 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1bhy h ALA 409 CO 0.56 0.22 -0.03 1.05 0.00 0.00 0.00 179.25 181.04 1bhy h GLU 410 N 0.01 0.00 0.00 0.00 9.09 -1.90 0.32 114.58 122.10 1bhy h GLU 410 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1bhy h GLU 410 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.40 1bhy h GLU 410 CO 0.02 0.03 0.00 1.63 0.05 0.00 0.00 179.01 180.74 1bhy n LYS 411 N -4.01 0.02 0.00 1.06 5.02 -0.25 -2.12 118.16 117.88 1bhy n LYS 411 Ca -0.03 0.06 0.09 0.00 -2.02 0.00 0.00 58.31 56.41 1bhy n LYS 411 Cb 0.12 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.61 1bhy n LYS 411 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bhy n ALA 412 N -1.49 3.44 -0.20 7.82 0.00 0.11 -2.42 120.51 127.77 1bhy n ALA 412 Ca 0.06 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1bhy n ALA 412 Cb 0.29 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1bhy n ALA 412 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bhy n GLY 413 N 1.27 0.97 3.72 0.00 0.00 -0.82 -4.17 105.19 106.16 1bhy n GLY 413 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1bhy n GLY 413 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bhy s VAL 414 N -2.60 2.36 -0.08 1.61 1.01 -0.87 -4.69 120.40 117.13 1bhy s VAL 414 Ca 0.00 0.26 -0.17 0.00 0.00 0.00 0.00 61.98 62.07 1bhy s VAL 414 Cb 0.00 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 1bhy s VAL 414 CO 0.00 0.02 0.44 0.00 0.00 0.00 0.00 175.10 175.56 1bhy s ALA 415 N 1.02 3.56 -0.02 5.51 0.00 -1.26 -4.12 121.76 126.45 1bhy s ALA 415 Ca 0.71 -0.22 0.08 0.00 0.00 0.00 0.00 51.96 52.53 1bhy s ALA 415 Cb -0.46 -2.54 -0.02 0.00 0.00 0.00 0.00 23.12 20.10 1bhy s ALA 415 CO 0.33 0.18 -0.25 0.08 0.00 0.00 0.00 175.76 176.10 1bhy s VAL 416 N 0.01 2.19 0.75 0.00 1.01 -1.26 -4.51 120.40 118.58 1bhy s VAL 416 Ca 0.24 -1.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 1bhy s VAL 416 Cb -0.16 -1.78 0.05 0.00 0.00 0.00 0.00 36.38 34.50 1bhy s VAL 416 CO 0.11 0.56 1.12 0.42 0.00 0.00 0.00 175.10 177.30 1bhy s THR 417 N -0.65 3.05 0.52 3.92 -4.23 0.14 -4.90 115.64 113.49 1bhy s THR 417 Ca 0.10 0.40 0.21 0.00 -1.18 0.00 0.00 61.69 61.23 1bhy s THR 417 Cb -0.10 -2.85 0.29 0.00 1.34 0.00 0.00 72.50 71.18 1bhy s THR 417 CO -0.00 -0.38 2.15 0.44 -0.54 0.00 0.00 174.62 176.28 1bhy h ASP 418 N -0.77 0.00 1.12 3.99 5.19 -2.00 0.28 116.42 124.23 1bhy h ASP 418 Ca -0.45 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.92 1bhy h ASP 418 Cb 1.25 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.75 1bhy h ASP 418 CO 0.51 0.04 -0.18 -0.09 -3.12 0.00 0.00 179.24 176.40 1bhy h ARG 419 N 0.00 0.00 0.00 3.56 9.65 -2.00 -3.47 114.38 122.12 1bhy h ARG 419 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1bhy h ARG 419 Cb 0.08 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1bhy h ARG 419 CO 0.01 0.18 0.00 0.41 2.80 0.00 0.00 179.97 183.36 1bhy n GLY 420 N 0.34 0.84 3.93 2.80 0.00 0.09 -4.57 105.19 108.60 1bhy n GLY 420 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 1bhy n GLY 420 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bhy s PHE 421 N -2.00 3.27 -0.57 1.61 0.40 -1.26 -1.26 117.98 118.17 1bhy s PHE 421 Ca 0.00 0.55 -0.05 0.00 -0.60 0.00 0.00 56.93 56.83 1bhy s PHE 421 Cb 0.00 -2.58 0.15 0.00 0.51 0.00 0.00 43.02 41.10 1bhy s PHE 421 CO 0.00 -0.65 0.40 0.42 0.70 0.00 0.00 175.22 176.09 1bhy s ILE 422 N -2.85 3.86 0.54 0.64 1.01 -0.47 0.25 121.20 124.17 1bhy s ILE 422 Ca 0.52 -2.55 -0.22 0.00 0.00 0.00 0.00 60.65 58.40 1bhy s ILE 422 Cb -0.10 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.79 1bhy s ILE 422 CO 0.43 -0.83 1.38 -1.61 0.00 0.00 0.00 174.94 174.30 1bhy s GLU 423 N 0.43 3.17 0.28 2.79 0.41 -1.26 -4.34 118.70 120.19 1bhy s GLU 423 Ca 0.13 2.28 0.04 0.00 -0.41 0.00 0.00 54.97 57.01 1bhy s GLU 423 Cb -0.21 -2.30 -0.04 0.00 -1.78 0.00 0.00 34.13 29.81 1bhy s GLU 423 CO -0.04 -1.18 0.20 0.54 -0.49 0.00 0.00 175.26 174.30 1bhy s VAL 424 N -1.28 0.06 0.43 2.63 0.11 -1.26 -4.57 120.40 116.51 1bhy s VAL 424 Ca 0.71 -2.00 0.07 0.00 -2.93 0.00 0.00 61.98 57.83 1bhy s VAL 424 Cb -0.41 -2.50 -0.02 0.00 -1.53 0.00 0.00 36.38 31.91 1bhy s VAL 424 CO 0.49 0.00 0.34 1.51 -3.33 0.00 0.00 175.10 174.12 1bhy s ASP 425 N -3.30 4.88 0.16 3.54 1.47 0.12 -4.89 116.67 118.65 1bhy s ASP 425 Ca 0.39 -0.86 0.03 0.00 1.18 0.00 0.00 52.55 53.29 1bhy s ASP 425 Cb 0.05 -0.47 0.15 0.00 -0.34 0.00 0.00 42.92 42.30 1bhy s ASP 425 CO 0.20 -0.67 0.80 0.29 0.68 0.00 0.00 175.17 176.47 1bhy n LYS 426 N -1.50 0.02 -0.07 2.11 4.01 -1.26 0.29 118.16 121.76 1bhy n LYS 426 Ca 0.02 0.31 0.12 0.00 -0.51 0.00 0.00 58.31 58.26 1bhy n LYS 426 Cb 0.63 -2.03 0.22 0.00 -0.51 0.00 0.00 35.03 33.34 1bhy n LYS 426 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1bhy n GLN 427 N -1.49 2.25 -0.20 1.97 6.02 -1.26 0.19 117.38 124.87 1bhy n GLN 427 Ca -0.00 -1.85 0.00 0.00 -0.01 0.00 0.00 57.00 55.13 1bhy n GLN 427 Cb 0.46 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.25 1bhy n GLN 427 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1bhy n MET 428 N 1.16 0.00 -1.86 -1.09 2.81 0.85 -4.29 117.12 114.70 1bhy n MET 428 Ca 0.17 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.65 1bhy n MET 428 Cb 0.55 -1.85 -0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1bhy n MET 428 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1bhy s ARG 429 N -0.01 4.08 0.19 0.03 0.52 -1.25 -2.03 118.95 120.48 1bhy s ARG 429 Ca 0.00 2.48 0.01 0.00 -0.52 0.00 0.00 55.73 57.69 1bhy s ARG 429 Cb 0.00 -2.93 0.04 0.00 0.52 0.00 0.00 34.95 32.58 1bhy s ARG 429 CO 0.00 -0.52 0.26 0.25 0.02 0.00 0.00 175.30 175.31 1bhy n THR 430 N 0.40 0.00 0.21 0.02 -2.24 0.13 -0.70 114.28 112.10 1bhy n THR 430 Ca 0.02 -0.46 0.09 0.00 -2.27 0.00 0.00 64.05 61.43 1bhy n THR 430 Cb 0.40 -1.14 0.63 0.00 -2.10 0.00 0.00 70.33 68.13 1bhy n THR 430 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1bhy h ASN 431 N -0.11 0.03 -3.56 3.42 -0.00 -1.83 -3.34 115.58 110.19 1bhy h ASN 431 Ca -0.09 -0.00 -0.59 0.00 -0.00 0.00 0.00 56.30 55.63 1bhy h ASN 431 Cb 0.33 -0.01 -0.10 0.00 -0.00 0.00 0.00 38.32 38.55 1bhy h ASN 431 CO 0.10 0.02 0.70 -0.69 -0.00 0.00 0.00 177.43 177.56 1bhy s VAL 432 N -5.09 4.35 0.60 6.14 1.01 -1.26 -4.91 120.40 121.23 1bhy s VAL 432 Ca -0.05 0.79 0.29 0.00 0.00 0.00 0.00 61.98 63.01 1bhy s VAL 432 Cb 0.17 -4.52 0.41 0.00 0.00 0.00 0.00 36.38 32.45 1bhy s VAL 432 CO 0.68 -0.97 1.61 -0.65 0.00 0.00 0.00 175.10 175.77 1bhy h PRO 433 N 9.20 0.00 -0.35 2.72 0.11 -1.98 0.23 132.00 141.93 1bhy h PRO 433 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1bhy h PRO 433 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1bhy h PRO 433 CO 1.08 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 176.48 1bhy n HIS 434 N -3.52 0.47 -4.07 0.65 1.44 -1.26 -4.87 115.22 104.06 1bhy n HIS 434 Ca 0.18 -0.41 -0.32 0.00 -2.01 0.00 0.00 57.72 55.15 1bhy n HIS 434 Cb 1.15 -0.02 -0.16 0.00 0.12 0.00 0.00 29.99 31.08 1bhy n HIS 434 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1bhy s ILE 435 N -1.02 1.99 0.11 0.61 1.01 0.81 -1.50 121.20 123.20 1bhy s ILE 435 Ca 0.26 -1.22 0.04 0.00 0.00 0.00 0.00 60.65 59.72 1bhy s ILE 435 Cb 0.14 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 1bhy s ILE 435 CO 0.19 0.22 0.09 -0.31 0.00 0.00 0.00 174.94 175.13 1bhy s TYR 436 N 1.25 3.15 -0.03 3.97 2.02 -0.14 0.18 117.35 127.75 1bhy s TYR 436 Ca -0.02 0.04 0.03 0.00 -0.37 0.00 0.00 57.07 56.75 1bhy s TYR 436 Cb -0.17 -1.58 0.00 0.00 -0.40 0.00 0.00 41.96 39.82 1bhy s TYR 436 CO -0.09 0.52 -0.11 0.00 -1.57 0.00 0.00 175.55 174.30 1bhy s ALA 437 N -1.50 0.99 0.17 3.71 0.00 -0.86 0.20 121.76 124.47 1bhy s ALA 437 Ca 0.29 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1bhy s ALA 437 Cb -0.11 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 1bhy s ALA 437 CO 0.22 0.18 0.05 0.96 0.00 0.00 0.00 175.76 177.17 1bhy s ILE 438 N 0.09 0.32 0.00 0.00 -4.36 -0.24 -4.80 121.20 112.21 1bhy s ILE 438 Ca -0.02 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 58.42 1bhy s ILE 438 Cb -0.08 -2.20 0.00 0.00 1.25 0.00 0.00 42.46 41.43 1bhy s ILE 438 CO 0.01 -0.35 0.00 0.61 0.24 0.00 0.00 174.94 175.44 1bhy n GLY 439 N -0.21 -0.31 0.29 6.27 0.00 -1.26 -3.98 105.19 106.00 1bhy n GLY 439 Ca -0.04 -1.05 0.13 0.00 0.00 0.00 0.00 46.02 45.05 1bhy n GLY 439 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bhy h ASP 440 N 6.20 0.00 0.32 1.61 5.19 -1.87 -2.27 116.42 125.60 1bhy h ASP 440 Ca 0.00 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 1bhy h ASP 440 Cb 0.00 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1bhy h ASP 440 CO 0.00 0.00 -0.25 -0.29 -3.12 0.00 0.00 179.24 175.58 1bhy h ILE 441 N 0.00 1.05 0.04 0.35 2.10 -1.69 -3.16 117.51 116.20 1bhy h ILE 441 Ca 0.01 -0.89 -0.08 0.00 1.08 0.00 0.00 64.86 64.99 1bhy h ILE 441 Cb 0.07 1.50 0.01 0.00 -1.09 0.00 0.00 36.82 37.30 1bhy h ILE 441 CO -0.00 0.24 -0.32 0.58 -1.08 0.00 0.00 178.15 177.57 1bhy h VAL 442 N 0.00 1.62 0.00 2.19 2.07 -1.60 -1.24 116.25 119.30 1bhy h VAL 442 Ca -0.00 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.27 1bhy h VAL 442 Cb 0.48 3.10 0.00 0.00 -1.52 0.00 0.00 31.29 33.35 1bhy h VAL 442 CO 0.03 0.61 0.00 0.61 0.02 0.00 0.00 177.57 178.84 1bhy n GLY 443 N 1.41 -0.17 3.80 2.17 0.00 -1.17 -4.26 105.19 106.97 1bhy n GLY 443 Ca -0.11 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.46 1bhy n GLY 443 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bhy s GLN 444 N -2.00 2.91 0.04 1.61 -1.52 -1.26 -4.07 119.66 115.37 1bhy s GLN 444 Ca 0.00 1.07 -0.30 0.00 -1.95 0.00 0.00 55.36 54.18 1bhy s GLN 444 Cb 0.00 -1.98 -0.04 0.00 -0.22 0.00 0.00 33.01 30.76 1bhy s GLN 444 CO 0.00 -1.13 1.04 -1.25 -0.25 0.00 0.00 175.29 173.71 1bhy s PRO 445 N -4.73 4.54 -0.65 2.91 0.04 -1.26 -5.08 135.00 130.78 1bhy s PRO 445 Ca 0.60 1.53 -0.27 0.00 0.04 0.00 0.00 61.00 62.91 1bhy s PRO 445 Cb -0.15 -3.41 -0.00 0.00 0.04 0.00 0.00 34.50 30.97 1bhy s PRO 445 CO 0.50 -0.07 1.62 -1.64 0.04 0.00 0.00 177.00 177.45 1bhy s MET 446 N 0.85 2.89 -0.04 4.56 -1.94 -1.26 -4.89 119.30 119.47 1bhy s MET 446 Ca 0.53 0.32 -0.02 0.00 -1.71 0.00 0.00 55.69 54.81 1bhy s MET 446 Cb -0.24 -4.29 0.03 0.00 2.01 0.00 0.00 34.83 32.34 1bhy s MET 446 CO 0.29 -2.45 0.09 -0.51 -0.01 0.00 0.00 175.02 172.43 1bhy s LEU 447 N 7.63 1.12 0.44 -0.03 1.43 -1.26 -5.04 118.68 122.97 1bhy s LEU 447 Ca 0.55 0.17 0.19 0.00 -1.03 0.00 0.00 54.13 54.01 1bhy s LEU 447 Cb -0.11 0.18 1.14 0.00 0.03 0.00 0.00 46.19 47.43 1bhy s LEU 447 CO 0.19 -0.11 1.87 0.00 0.23 0.00 0.00 176.35 178.53 1bhy h ALA 448 N 6.93 2.29 -0.03 4.21 0.00 -1.99 -1.63 119.26 129.04 1bhy h ALA 448 Ca -0.39 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 1bhy h ALA 448 Cb 1.15 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1bhy h ALA 448 CO 0.45 -0.57 -0.73 1.12 0.00 0.00 0.00 179.25 179.53 1bhy h HIS 449 N 0.34 0.23 0.66 0.00 2.07 -1.97 0.08 115.15 116.56 1bhy h HIS 449 Ca 0.46 -0.11 -0.03 0.00 -2.85 0.00 0.00 60.37 57.84 1bhy h HIS 449 Cb 1.22 -0.03 -0.00 0.00 2.57 0.00 0.00 27.41 31.17 1bhy h HIS 449 CO -0.00 0.84 -0.39 -0.22 -3.07 0.00 0.00 177.93 175.09 1bhy h LYS 450 N 0.11 -0.94 -0.96 5.12 3.64 -1.66 -2.72 116.57 119.15 1bhy h LYS 450 Ca -0.02 0.06 0.12 0.00 -1.27 0.00 0.00 60.65 59.55 1bhy h LYS 450 Cb 1.29 0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 33.24 1bhy h LYS 450 CO 0.11 -0.63 0.59 0.00 -2.27 0.00 0.00 179.45 177.25 1bhy h ALA 451 N -0.71 1.45 -0.55 5.00 0.00 -1.21 0.16 119.26 123.41 1bhy h ALA 451 Ca -0.08 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1bhy h ALA 451 Cb 0.79 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1bhy h ALA 451 CO 0.10 0.16 0.18 0.28 0.00 0.00 0.00 179.25 179.96 1bhy h VAL 452 N 0.91 1.21 0.33 0.00 2.07 -0.76 0.10 116.25 120.12 1bhy h VAL 452 Ca 0.48 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1bhy h VAL 452 Cb 0.51 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1bhy h VAL 452 CO -0.28 0.28 -0.16 0.45 0.02 0.00 0.00 177.57 177.87 1bhy h HIS 453 N 0.79 -0.42 -1.00 1.57 -0.00 -0.71 -0.22 115.15 115.16 1bhy h HIS 453 Ca 0.18 -0.01 0.17 0.00 -0.00 0.00 0.00 60.37 60.71 1bhy h HIS 453 Cb 0.22 0.14 -0.10 0.00 -0.00 0.00 0.00 27.41 27.67 1bhy h HIS 453 CO 0.01 -0.08 0.62 0.93 -0.00 0.00 0.00 177.93 179.41 1bhy h GLU 454 N -0.82 0.82 -0.64 2.45 5.08 -1.21 0.34 114.58 120.60 1bhy h GLU 454 Ca -0.05 -0.05 0.13 0.00 -1.00 0.00 0.00 59.36 58.40 1bhy h GLU 454 Cb 0.52 -0.18 -0.11 0.00 0.50 0.00 0.00 28.75 29.48 1bhy h GLU 454 CO 0.08 0.54 0.02 0.78 -1.00 0.00 0.00 179.01 179.42 1bhy h GLY 455 N 0.84 0.70 1.69 -3.84 0.00 -0.32 -0.98 103.07 101.16 1bhy h GLY 455 Ca 0.55 0.07 -0.17 0.00 0.00 0.00 0.00 47.33 47.78 1bhy h GLY 455 CO -0.34 -0.20 -0.72 0.45 0.00 0.00 0.00 176.54 175.72 1bhy h HIS 456 N 0.13 0.41 0.10 5.60 3.86 0.15 -2.49 115.15 122.91 1bhy h HIS 456 Ca 0.34 -0.18 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 1bhy h HIS 456 Cb 0.55 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1bhy h HIS 456 CO -0.36 0.92 -0.05 -0.39 0.86 0.00 0.00 177.93 178.91 1bhy h VAL 457 N 0.21 1.06 -0.83 2.45 -1.51 -0.38 -1.43 116.25 115.82 1bhy h VAL 457 Ca -0.03 -0.65 0.02 0.00 -1.23 0.00 0.00 66.70 64.82 1bhy h VAL 457 Cb 1.29 1.47 -0.05 0.00 -2.13 0.00 0.00 31.29 31.87 1bhy h VAL 457 CO 0.12 0.16 0.55 0.00 -1.23 0.00 0.00 177.57 177.16 1bhy h ALA 458 N 0.41 1.46 -0.84 5.19 0.00 -1.30 -1.11 119.26 123.07 1bhy h ALA 458 Ca -0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1bhy h ALA 458 Cb 0.37 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1bhy h ALA 458 CO 0.02 0.48 0.49 0.00 0.00 0.00 0.00 179.25 180.24 1bhy h ALA 459 N 1.50 1.07 -0.35 0.00 0.00 -1.26 -1.22 119.26 119.01 1bhy h ALA 459 Ca 0.32 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1bhy h ALA 459 Cb -0.03 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1bhy h ALA 459 CO -0.09 0.55 0.06 0.93 0.00 0.00 0.00 179.25 180.70 1bhy h GLU 460 N 1.15 0.57 -0.14 0.00 5.08 -0.12 -2.00 114.58 119.13 1bhy h GLU 460 Ca 0.30 -0.15 0.04 0.00 -1.00 0.00 0.00 59.36 58.55 1bhy h GLU 460 Cb -0.02 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 1bhy h GLU 460 CO -0.05 0.64 -0.15 -0.91 -1.00 0.00 0.00 179.01 177.54 1bhy h ASN 461 N 0.41 -0.48 -1.28 1.42 2.35 -1.15 -0.23 115.58 116.61 1bhy h ASN 461 Ca 0.11 0.09 0.37 0.00 -0.55 0.00 0.00 56.30 56.32 1bhy h ASN 461 Cb 0.35 0.23 -0.07 0.00 0.05 0.00 0.00 38.32 38.88 1bhy h ASN 461 CO 0.01 -0.20 0.89 0.00 -1.65 0.00 0.00 177.43 176.48 1bhy n ALA 463 N -2.71 2.94 -1.19 0.00 0.00 -0.23 -4.92 120.51 114.41 1bhy n ALA 463 Ca 0.29 -1.07 -0.06 0.00 0.00 0.00 0.00 53.44 52.60 1bhy n ALA 463 Cb 1.30 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.70 1bhy n ALA 463 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bhy n GLY 464 N 0.83 0.80 3.85 0.00 0.00 0.63 -5.02 105.19 106.29 1bhy n GLY 464 Ca 0.17 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 1bhy n GLY 464 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1bhy s HIS 465 N -1.98 3.41 -0.30 1.61 3.76 -0.46 -4.98 115.29 116.34 1bhy s HIS 465 Ca 0.00 1.26 -0.14 0.00 -0.15 0.00 0.00 55.06 56.03 1bhy s HIS 465 Cb 0.00 -2.59 -0.03 0.00 1.11 0.00 0.00 32.58 31.07 1bhy s HIS 465 CO 0.00 -0.07 0.33 0.15 -0.85 0.00 0.00 174.74 174.30 1bhy s LYS 466 N -3.45 3.82 -0.02 1.40 -0.14 -1.26 -3.61 119.74 116.46 1bhy s LYS 466 Ca 0.55 -0.22 0.06 0.00 -1.36 0.00 0.00 55.97 54.99 1bhy s LYS 466 Cb -0.10 -3.72 -0.01 0.00 -1.68 0.00 0.00 37.83 32.32 1bhy s LYS 466 CO 0.23 -0.36 -0.19 0.00 -0.76 0.00 0.00 175.35 174.27 1bhy s ALA 467 N 1.98 1.63 0.01 5.17 0.00 -1.26 -4.99 121.76 124.30 1bhy s ALA 467 Ca 0.12 -0.82 0.06 0.00 0.00 0.00 0.00 51.96 51.32 1bhy s ALA 467 Cb -0.16 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 1bhy s ALA 467 CO 0.11 0.37 -0.15 0.71 0.00 0.00 0.00 175.76 176.80 1bhy s TYR 468 N -0.33 2.65 -0.54 0.00 1.51 -1.26 -4.33 117.35 115.05 1bhy s TYR 468 Ca 0.04 -0.20 -0.27 0.00 -1.01 0.00 0.00 57.07 55.63 1bhy s TYR 468 Cb -0.09 -1.53 -0.01 0.00 -0.11 0.00 0.00 41.96 40.22 1bhy s TYR 468 CO 0.00 0.24 1.73 0.12 -1.11 0.00 0.00 175.55 176.53 1bhy s PHE 469 N -0.88 1.86 -1.07 2.71 5.36 0.51 -4.71 117.98 121.76 1bhy s PHE 469 Ca 0.14 0.66 0.17 0.00 -0.96 0.00 0.00 56.93 56.94 1bhy s PHE 469 Cb -0.11 -4.18 -0.13 0.00 -0.34 0.00 0.00 43.02 38.26 1bhy s PHE 469 CO 0.04 -2.36 0.79 -0.40 -1.46 0.00 0.00 175.22 171.84 1bhy n ASP 470 N 11.38 1.10 -4.69 6.13 5.68 -1.26 -4.93 116.55 129.97 1bhy n ASP 470 Ca 0.19 -1.05 -0.44 0.00 -0.50 0.00 0.00 54.79 52.98 1bhy n ASP 470 Cb 0.50 0.84 -0.03 0.00 -1.14 0.00 0.00 41.12 41.29 1bhy n ASP 470 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1bhy n ALA 471 N -1.00 1.52 1.20 2.12 0.00 -1.26 -4.85 120.51 118.23 1bhy n ALA 471 Ca 0.05 0.41 0.13 0.00 0.00 0.00 0.00 53.44 54.02 1bhy n ALA 471 Cb 0.30 -2.33 0.36 0.00 0.00 0.00 0.00 19.45 17.78 1bhy n ALA 471 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1bhy n ARG 472 N 2.33 0.68 -3.78 0.00 1.85 -1.26 -4.93 116.66 111.55 1bhy n ARG 472 Ca 0.12 -0.40 -0.13 0.00 -1.00 0.00 0.00 57.85 56.45 1bhy n ARG 472 Cb 0.32 -1.49 -0.12 0.00 -1.05 0.00 0.00 32.46 30.12 1bhy n ARG 472 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1bhy s VAL 473 N -2.59 -0.00 -0.14 8.89 0.11 -1.26 -4.92 120.40 120.49 1bhy s VAL 473 Ca 0.22 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 1bhy s VAL 473 Cb 0.19 -0.36 0.02 0.00 -1.53 0.00 0.00 36.38 34.70 1bhy s VAL 473 CO 0.55 0.00 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.57 1bhy s ILE 474 N 0.20 1.41 0.27 7.04 1.01 -1.26 -5.00 121.20 124.87 1bhy s ILE 474 Ca -0.01 -0.54 -0.29 0.00 0.00 0.00 0.00 60.65 59.81 1bhy s ILE 474 Cb -0.02 -1.35 -0.10 0.00 0.01 0.00 0.00 42.46 41.00 1bhy s ILE 474 CO -0.00 0.43 1.31 -2.16 0.00 0.00 0.00 174.94 174.52 1bhy s PRO 475 N 1.51 4.38 0.07 2.79 0.04 -1.26 -4.62 135.00 137.91 1bhy s PRO 475 Ca 0.04 2.14 0.06 0.00 0.04 0.00 0.00 61.00 63.28 1bhy s PRO 475 Cb -0.13 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 1bhy s PRO 475 CO -0.09 -0.22 -0.08 0.20 0.04 0.00 0.00 177.00 176.85 1bhy s GLY 476 N -0.09 1.79 -0.15 0.56 0.00 -0.45 -5.00 107.32 103.98 1bhy s GLY 476 Ca 0.53 -1.15 -0.06 0.00 0.00 0.00 0.00 44.72 44.04 1bhy s GLY 476 CO 0.45 -1.09 0.33 0.14 0.00 0.00 0.00 173.10 172.93 1bhy s VAL 477 N -1.15 -0.40 -0.21 1.40 1.01 -1.26 -2.15 120.40 117.64 1bhy s VAL 477 Ca 0.21 0.21 -0.19 0.00 0.00 0.00 0.00 61.98 62.20 1bhy s VAL 477 Cb -0.11 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 1bhy s VAL 477 CO 0.12 0.09 0.56 0.00 0.00 0.00 0.00 175.10 175.87 1bhy s ALA 478 N 2.22 3.55 -0.37 5.51 0.00 -0.64 -4.95 121.76 127.08 1bhy s ALA 478 Ca -0.02 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.57 1bhy s ALA 478 Cb -0.11 -2.88 0.40 0.00 0.00 0.00 0.00 23.12 20.53 1bhy s ALA 478 CO -0.10 -0.52 1.79 0.66 0.00 0.00 0.00 175.76 177.59 1bhy n TYR 479 N 4.97 2.17 -0.33 0.00 4.02 -1.26 -2.10 117.16 124.63 1bhy n TYR 479 Ca -0.03 -1.82 0.00 0.00 -0.01 0.00 0.00 57.90 56.03 1bhy n TYR 479 Cb 0.50 -0.91 0.00 0.00 -0.02 0.00 0.00 39.34 38.91 1bhy n TYR 479 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1bhy n THR 480 N -0.45 0.00 -3.85 -0.72 -2.24 -1.26 -4.87 114.28 100.89 1bhy n THR 480 Ca 0.42 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.91 1bhy n THR 480 Cb 1.03 -1.27 -0.16 0.00 -2.10 0.00 0.00 70.33 67.83 1bhy n THR 480 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1bhy s SER 481 N -1.37 3.52 0.93 3.42 0.01 -1.26 -2.62 113.70 116.34 1bhy s SER 481 Ca 0.00 -1.08 -0.12 0.00 1.31 0.00 0.00 55.95 56.06 1bhy s SER 481 Cb 0.00 -0.95 0.15 0.00 0.21 0.00 0.00 66.02 65.43 1bhy s SER 481 CO 0.00 -0.28 1.09 -2.16 0.41 0.00 0.00 173.24 172.30 1bhy s PRO 482 N 1.58 0.97 0.19 12.44 0.04 -1.26 -4.78 135.00 144.17 1bhy s PRO 482 Ca -0.03 0.80 -0.30 0.00 0.04 0.00 0.00 61.00 61.51 1bhy s PRO 482 Cb -0.18 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 1bhy s PRO 482 CO -0.08 -2.43 1.00 -1.21 0.04 0.00 0.00 177.00 174.32 1bhy s GLU 483 N -4.90 4.73 -0.43 4.56 2.02 -1.08 -4.71 118.70 118.88 1bhy s GLU 483 Ca 0.64 1.57 -0.16 0.00 0.02 0.00 0.00 54.97 57.04 1bhy s GLU 483 Cb -0.19 -3.30 0.04 0.00 0.10 0.00 0.00 34.13 30.78 1bhy s GLU 483 CO 0.58 0.29 0.36 0.08 0.02 0.00 0.00 175.26 176.59 1bhy s VAL 484 N -0.62 5.22 -0.08 2.63 1.01 -0.89 -0.18 120.40 127.49 1bhy s VAL 484 Ca 0.45 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1bhy s VAL 484 Cb -0.27 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.07 1bhy s VAL 484 CO 0.33 -0.43 -0.15 0.00 0.00 0.00 0.00 175.10 174.85 1bhy s ALA 485 N 1.76 2.59 0.17 5.51 0.00 0.22 -1.62 121.76 130.38 1bhy s ALA 485 Ca 0.06 -0.95 -0.09 0.00 0.00 0.00 0.00 51.96 50.97 1bhy s ALA 485 Cb -0.20 -1.02 -0.01 0.00 0.00 0.00 0.00 23.12 21.88 1bhy s ALA 485 CO 0.09 0.43 0.30 1.67 0.00 0.00 0.00 175.76 178.25 1bhy s TRP 486 N -0.26 0.39 0.15 0.00 -0.00 -0.91 0.70 118.94 118.99 1bhy s TRP 486 Ca 0.01 -0.75 -0.18 0.00 -0.00 0.00 0.00 56.10 55.19 1bhy s TRP 486 Cb -0.13 -0.04 0.04 0.00 -0.00 0.00 0.00 33.47 33.35 1bhy s TRP 486 CO 0.03 -0.74 0.47 0.08 -0.00 0.00 0.00 176.95 176.79 1bhy s VAL 487 N -3.97 0.04 0.00 -0.66 1.01 0.11 -1.34 120.40 115.59 1bhy s VAL 487 Ca 0.17 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.69 1bhy s VAL 487 Cb 0.03 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.21 1bhy s VAL 487 CO 0.00 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.51 1bhy n GLY 488 N -0.28 1.49 3.77 4.51 0.00 -1.26 -1.37 105.19 112.05 1bhy n GLY 488 Ca -0.15 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 1bhy n GLY 488 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1bhy n GLU 489 N 7.36 2.65 -4.53 1.61 4.07 0.86 -4.82 120.64 127.83 1bhy n GLU 489 Ca 0.00 0.93 -0.26 0.00 -0.06 0.00 0.00 57.16 57.78 1bhy n GLU 489 Cb 0.00 -2.66 -0.10 0.00 -0.06 0.00 0.00 31.44 28.61 1bhy n GLU 489 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 1bhy s THR 490 N -0.91 2.23 0.23 6.31 -4.23 -1.26 -3.96 115.64 114.06 1bhy s THR 490 Ca 0.55 -2.22 -0.07 0.00 -1.18 0.00 0.00 61.69 58.78 1bhy s THR 490 Cb -0.48 -2.61 0.21 0.00 1.34 0.00 0.00 72.50 70.95 1bhy s THR 490 CO 0.61 -0.22 1.89 -0.33 -0.54 0.00 0.00 174.62 176.03 1bhy h GLU 491 N 2.05 1.09 -0.11 3.99 5.08 -1.98 0.33 114.58 125.03 1bhy h GLU 491 Ca -0.42 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 57.83 1bhy h GLU 491 Cb 1.25 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 30.25 1bhy h GLU 491 CO 0.70 0.72 -0.09 -0.07 -1.00 0.00 0.00 179.01 179.27 1bhy h LEU 492 N 1.13 0.28 -0.25 1.33 4.07 -1.96 0.95 115.31 120.87 1bhy h LEU 492 Ca 0.34 -0.46 0.06 0.00 0.08 0.00 0.00 57.88 57.90 1bhy h LEU 492 Cb -0.03 -0.08 -0.07 0.00 1.08 0.00 0.00 40.66 41.56 1bhy h LEU 492 CO -0.11 0.68 -0.28 0.77 -1.08 0.00 0.00 178.44 178.43 1bhy h SER 493 N -0.12 -0.90 -0.29 -0.43 4.64 -1.85 0.83 113.55 115.43 1bhy h SER 493 Ca 0.02 0.15 0.07 0.00 -0.47 0.00 0.00 61.79 61.56 1bhy h SER 493 Cb 0.60 0.41 -0.07 0.00 -0.31 0.00 0.00 62.40 63.03 1bhy h SER 493 CO 0.02 -0.31 -0.21 0.00 -0.87 0.00 0.00 176.83 175.47 1bhy h ALA 494 N 0.69 -0.03 -0.25 5.18 0.00 -0.13 0.27 119.26 124.99 1bhy h ALA 494 Ca 0.13 0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.21 1bhy h ALA 494 Cb 0.50 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1bhy h ALA 494 CO -0.41 -0.61 0.18 -0.22 0.00 0.00 0.00 179.25 178.19 1bhy h LYS 495 N -0.19 0.00 0.35 0.00 3.64 0.26 3.74 116.57 124.37 1bhy h LYS 495 Ca 0.15 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1bhy h LYS 495 Cb 0.42 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1bhy h LYS 495 CO -0.40 0.00 -0.17 0.00 -2.27 0.00 0.00 179.45 176.62 1bhy h ALA 496 N 1.87 -0.47 0.00 5.00 0.00 0.33 -3.05 119.26 122.94 1bhy h ALA 496 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bhy h ALA 496 Cb 0.48 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1bhy h ALA 496 CO -0.00 -0.45 0.00 -1.13 0.00 0.00 0.00 179.25 177.67 1bhy n SER 497 N -5.09 0.42 -2.74 0.00 3.41 0.68 -4.80 113.62 105.51 1bhy n SER 497 Ca -0.06 0.63 -0.20 0.00 -0.26 0.00 0.00 58.87 58.97 1bhy n SER 497 Cb 0.20 -0.71 0.01 0.00 -0.26 0.00 0.00 64.21 63.45 1bhy n SER 497 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bhy n ALA 498 N -1.68 -0.82 -1.64 7.33 0.00 1.21 -4.93 120.51 119.98 1bhy n ALA 498 Ca 0.01 0.19 -0.35 0.00 0.00 0.00 0.00 53.44 53.30 1bhy n ALA 498 Cb 0.15 -2.77 0.04 0.00 0.00 0.00 0.00 19.45 16.86 1bhy n ALA 498 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1bhy s ARG 499 N -5.39 2.88 -0.26 0.00 6.06 0.25 -4.97 118.95 117.52 1bhy s ARG 499 Ca 0.15 1.69 -0.07 0.00 -2.50 0.00 0.00 55.73 55.00 1bhy s ARG 499 Cb -0.07 -1.93 -0.02 0.00 0.06 0.00 0.00 34.95 32.98 1bhy s ARG 499 CO 0.19 -1.25 0.07 0.21 -2.50 0.00 0.00 175.30 172.02 1bhy s LYS 500 N -3.57 3.57 0.42 5.12 2.20 -1.26 -4.62 119.74 121.60 1bhy s LYS 500 Ca 0.74 -0.53 0.06 0.00 -0.36 0.00 0.00 55.97 55.88 1bhy s LYS 500 Cb -0.27 -3.33 -0.07 0.00 -1.51 0.00 0.00 37.83 32.65 1bhy s LYS 500 CO 0.35 -0.23 0.01 0.42 -0.36 0.00 0.00 175.35 175.55 1bhy s ILE 501 N 1.60 1.78 -0.31 5.43 1.01 -1.26 -0.89 121.20 128.57 1bhy s ILE 501 Ca 0.06 -2.00 -0.01 0.00 0.00 0.00 0.00 60.65 58.70 1bhy s ILE 501 Cb -0.15 -2.85 0.10 0.00 0.01 0.00 0.00 42.46 39.57 1bhy s ILE 501 CO 0.03 0.00 0.10 -0.89 0.00 0.00 0.00 174.94 174.19 1bhy s THR 502 N -2.79 0.69 -0.00 2.92 2.01 0.29 -4.60 115.64 114.16 1bhy s THR 502 Ca 0.31 -1.28 -0.14 0.00 0.31 0.00 0.00 61.69 60.89 1bhy s THR 502 Cb 0.09 -1.53 -0.06 0.00 0.01 0.00 0.00 72.50 71.00 1bhy s THR 502 CO 0.15 -0.69 0.39 -1.59 -0.69 0.00 0.00 174.62 172.19 1bhy s LYS 503 N 1.70 3.87 -0.29 4.92 -2.85 -1.26 0.23 119.74 126.07 1bhy s LYS 503 Ca 0.10 0.35 0.01 0.00 -1.00 0.00 0.00 55.97 55.43 1bhy s LYS 503 Cb -0.17 -3.20 0.06 0.00 -2.06 0.00 0.00 37.83 32.46 1bhy s LYS 503 CO -0.27 0.69 -0.05 0.00 0.10 0.00 0.00 175.35 175.81 1bhy s ALA 504 N -1.10 2.70 -0.16 0.59 0.00 0.31 -4.96 121.76 119.14 1bhy s ALA 504 Ca 0.24 -1.86 -0.07 0.00 0.00 0.00 0.00 51.96 50.27 1bhy s ALA 504 Cb -0.16 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 1bhy s ALA 504 CO 0.13 -1.29 0.08 1.21 0.00 0.00 0.00 175.76 175.89 1bhy s ASN 505 N 1.16 5.83 -0.24 0.00 3.84 -1.26 -1.60 114.94 122.66 1bhy s ASN 505 Ca -0.05 0.19 -0.02 0.00 0.21 0.00 0.00 52.86 53.19 1bhy s ASN 505 Cb -0.20 -1.94 0.02 0.00 -0.55 0.00 0.00 41.25 38.58 1bhy s ASN 505 CO -0.04 0.25 -0.07 0.12 -2.79 0.00 0.00 177.10 174.57 1bhy s PHE 506 N -0.09 3.02 0.20 0.43 2.19 0.16 -4.94 117.98 118.95 1bhy s PHE 506 Ca 0.08 -1.43 -0.30 0.00 0.33 0.00 0.00 56.93 55.60 1bhy s PHE 506 Cb -0.12 -2.06 -0.08 0.00 -1.31 0.00 0.00 43.02 39.45 1bhy s PHE 506 CO 0.01 -0.70 1.18 -2.14 1.83 0.00 0.00 175.22 175.40 1bhy s PRO 507 N 1.35 4.51 0.12 10.12 0.02 -1.26 -1.03 135.00 148.83 1bhy s PRO 507 Ca 0.02 1.86 0.26 0.00 0.02 0.00 0.00 61.00 63.15 1bhy s PRO 507 Cb -0.16 -3.23 0.97 0.00 0.02 0.00 0.00 34.50 32.10 1bhy s PRO 507 CO -0.05 -0.04 1.79 0.91 -0.33 0.00 0.00 177.00 179.28 1bhy n TRP 508 N 2.31 0.47 0.21 6.54 7.02 0.12 -2.72 117.44 131.40 1bhy n TRP 508 Ca 0.03 0.15 0.13 0.00 -1.02 0.00 0.00 57.50 56.79 1bhy n TRP 508 Cb 0.45 -0.74 0.74 0.00 -2.42 0.00 0.00 31.31 29.33 1bhy n TRP 508 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1bhy h ALA 509 N 2.67 1.96 -0.00 6.99 0.00 -1.32 0.46 119.26 130.01 1bhy h ALA 509 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bhy h ALA 509 Cb 0.55 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1bhy h ALA 509 CO 0.00 -0.17 -0.39 0.00 0.00 0.00 0.00 179.25 178.70 1bhy n ALA 510 N -2.48 3.29 -2.62 0.00 0.00 -1.10 -4.90 120.51 112.70 1bhy n ALA 510 Ca 0.00 -0.32 -0.41 0.00 0.00 0.00 0.00 53.44 52.71 1bhy n ALA 510 Cb 0.22 -1.18 -0.05 0.00 0.00 0.00 0.00 19.45 18.44 1bhy n ALA 510 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bhy s SER 511 N -2.92 6.67 0.20 0.00 0.15 0.16 -4.94 113.70 113.01 1bhy s SER 511 Ca 0.14 0.76 -0.12 0.00 0.70 0.00 0.00 55.95 57.42 1bhy s SER 511 Cb 0.18 -2.39 0.23 0.00 -1.71 0.00 0.00 66.02 62.33 1bhy s SER 511 CO 0.65 -0.51 1.68 1.23 1.20 0.00 0.00 173.24 177.49 1bhy h GLY 512 N 9.21 0.58 1.01 9.45 0.00 -1.90 -1.36 103.07 120.05 1bhy h GLY 512 Ca -0.25 0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1bhy h GLY 512 CO 0.84 -0.16 0.37 -0.09 0.00 0.00 0.00 176.54 177.51 1bhy h ARG 513 N 0.13 1.01 -0.40 4.80 9.65 -1.88 0.52 114.38 128.22 1bhy h ARG 513 Ca 0.28 -0.13 -0.09 0.00 -1.10 0.00 0.00 59.98 58.93 1bhy h ARG 513 Cb 0.43 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.81 1bhy h ARG 513 CO -0.45 0.78 -0.13 0.00 2.80 0.00 0.00 179.97 182.96 1bhy h ALA 514 N 1.18 1.02 0.39 2.80 0.00 -1.69 0.12 119.26 123.08 1bhy h ALA 514 Ca 0.25 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1bhy h ALA 514 Cb 0.08 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1bhy h ALA 514 CO -0.04 0.59 -0.19 0.82 0.00 0.00 0.00 179.25 180.44 1bhy h ILE 515 N 0.65 0.60 -0.73 0.00 2.04 -0.81 1.04 117.51 120.30 1bhy h ILE 515 Ca 0.11 -0.36 0.17 0.00 1.00 0.00 0.00 64.86 65.78 1bhy h ILE 515 Cb 0.60 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.42 1bhy h ILE 515 CO 0.04 0.07 0.50 0.00 0.00 0.00 0.00 178.15 178.76 1bhy h ALA 516 N -0.22 2.33 -0.03 1.87 0.00 0.28 0.17 119.26 123.66 1bhy h ALA 516 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1bhy h ALA 516 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1bhy h ALA 516 CO 0.09 -0.54 0.00 0.09 0.00 0.00 0.00 179.25 178.89 1bhy n ASN 517 N -4.43 2.43 -3.18 0.00 5.03 0.41 -4.95 115.26 110.57 1bhy n ASN 517 Ca 0.14 -1.81 -0.18 0.00 0.87 0.00 0.00 54.58 53.60 1bhy n ASN 517 Cb 0.63 -0.00 0.07 0.00 -1.02 0.00 0.00 39.78 39.47 1bhy n ASN 517 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bhy n GLY 518 N 1.28 -0.32 2.46 7.41 0.00 0.25 -4.94 105.19 111.33 1bhy n GLY 518 Ca 0.16 0.09 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 1bhy n GLY 518 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bhy n ASP 520 N 0.05 2.12 0.07 0.00 5.75 -1.22 -3.92 116.55 119.39 1bhy n ASP 520 Ca 0.20 -1.89 0.12 0.00 -0.01 0.00 0.00 54.79 53.21 1bhy n ASP 520 Cb 0.71 -0.21 0.25 0.00 -1.03 0.00 0.00 41.12 40.84 1bhy n ASP 520 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1bhy n LYS 521 N 0.64 0.26 -2.70 0.11 -0.00 -1.26 -1.22 118.16 113.98 1bhy n LYS 521 Ca 0.15 0.11 -0.22 0.00 -0.00 0.00 0.00 58.31 58.36 1bhy n LYS 521 Cb 0.36 -1.70 0.07 0.00 -0.00 0.00 0.00 35.03 33.76 1bhy n LYS 521 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1bhy s PRO 522 N -3.13 2.14 0.18 -1.58 0.05 -1.25 -4.89 135.00 126.52 1bhy s PRO 522 Ca 0.08 -1.09 -0.23 0.00 0.05 0.00 0.00 61.00 59.81 1bhy s PRO 522 Cb 0.14 -2.46 0.06 0.00 0.05 0.00 0.00 34.50 32.28 1bhy s PRO 522 CO 0.68 -1.03 0.68 -0.59 0.05 0.00 0.00 177.00 176.79 1bhy s PHE 523 N -2.89 -0.39 -0.19 0.56 -0.12 -1.16 0.12 117.98 113.91 1bhy s PHE 523 Ca 0.62 0.10 -0.04 0.00 -0.05 0.00 0.00 56.93 57.56 1bhy s PHE 523 Cb -0.07 0.61 -0.02 0.00 -0.63 0.00 0.00 43.02 42.90 1bhy s PHE 523 CO 0.41 -0.95 -0.02 0.99 -0.05 0.00 0.00 175.22 175.60 1bhy s THR 524 N -3.72 3.86 -0.11 -4.49 2.01 -0.20 -2.22 115.64 110.76 1bhy s THR 524 Ca 0.05 -0.35 0.02 0.00 0.31 0.00 0.00 61.69 61.72 1bhy s THR 524 Cb -0.03 -2.73 0.02 0.00 0.01 0.00 0.00 72.50 69.77 1bhy s THR 524 CO -0.06 0.45 -0.15 -0.75 -0.69 0.00 0.00 174.62 173.43 1bhy s LYS 525 N 0.82 2.17 -0.17 4.92 2.20 0.44 0.38 119.74 130.51 1bhy s LYS 525 Ca -0.00 -0.54 -0.03 0.00 -0.36 0.00 0.00 55.97 55.04 1bhy s LYS 525 Cb -0.14 -1.86 -0.02 0.00 -1.51 0.00 0.00 37.83 34.29 1bhy s LYS 525 CO 0.02 -0.07 -0.07 -0.51 -0.36 0.00 0.00 175.35 174.36 1bhy s LEU 526 N 1.02 2.99 -0.05 5.43 1.02 -0.63 -0.98 118.68 127.49 1bhy s LEU 526 Ca -0.06 -0.26 0.06 0.00 0.02 0.00 0.00 54.13 53.88 1bhy s LEU 526 Cb -0.15 -1.72 -0.02 0.00 0.02 0.00 0.00 46.19 44.32 1bhy s LEU 526 CO -0.02 0.11 -0.21 0.27 0.02 0.00 0.00 176.35 176.52 1bhy s ILE 527 N 0.70 2.45 0.15 -0.59 -4.36 -0.96 0.11 121.20 118.69 1bhy s ILE 527 Ca -0.03 -0.94 0.11 0.00 -0.26 0.00 0.00 60.65 59.52 1bhy s ILE 527 Cb -0.15 -1.91 -0.04 0.00 1.25 0.00 0.00 42.46 41.61 1bhy s ILE 527 CO 0.02 0.58 -0.26 -0.36 0.24 0.00 0.00 174.94 175.16 1bhy s PHE 528 N -0.48 2.27 -0.29 1.37 0.40 0.64 -1.13 117.98 120.76 1bhy s PHE 528 Ca 0.06 -0.38 -0.29 0.00 -0.60 0.00 0.00 56.93 55.72 1bhy s PHE 528 Cb -0.11 -1.19 -0.02 0.00 0.51 0.00 0.00 43.02 42.20 1bhy s PHE 528 CO 0.01 0.38 1.72 0.34 0.70 0.00 0.00 175.22 178.37 1bhy s ASP 529 N -2.25 6.08 0.58 1.36 2.15 0.25 0.10 116.67 124.95 1bhy s ASP 529 Ca 0.16 1.41 0.28 0.00 0.43 0.00 0.00 52.55 54.82 1bhy s ASP 529 Cb -0.09 -2.53 1.64 0.00 -0.30 0.00 0.00 42.92 41.63 1bhy s ASP 529 CO 0.07 -1.54 2.11 0.00 -0.17 0.00 0.00 175.17 175.64 1bhy h ALA 530 N 12.02 1.83 -0.27 3.66 0.00 -1.26 3.78 119.26 139.03 1bhy h ALA 530 Ca -0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1bhy h ALA 530 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1bhy h ALA 530 CO 1.02 -0.28 0.00 0.39 0.00 0.00 0.00 179.25 180.38 1bhy n GLU 531 N -3.88 0.00 0.27 0.00 1.02 -1.26 -4.37 120.64 112.42 1bhy n GLU 531 Ca 0.01 0.35 0.13 0.00 -0.02 0.00 0.00 57.16 57.63 1bhy n GLU 531 Cb 0.31 -0.83 0.79 0.00 -0.02 0.00 0.00 31.44 31.68 1bhy n GLU 531 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1bhy h THR 532 N 0.00 0.57 -0.08 2.62 1.35 -1.95 -3.46 112.91 111.97 1bhy h THR 532 Ca 0.00 -0.34 -0.03 0.00 -0.55 0.00 0.00 66.41 65.49 1bhy h THR 532 Cb 0.00 1.22 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 1bhy h THR 532 CO 0.00 0.08 -0.03 0.61 -0.25 0.00 0.00 175.52 175.93 1bhy n GLY 533 N -0.94 0.51 3.80 5.82 0.00 1.25 -4.98 105.19 110.65 1bhy n GLY 533 Ca -0.02 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1bhy n GLY 533 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bhy s ARG 534 N -1.11 4.38 0.33 1.61 0.52 -1.22 -4.11 118.95 119.36 1bhy s ARG 534 Ca 0.00 1.14 -0.28 0.00 -0.52 0.00 0.00 55.73 56.07 1bhy s ARG 534 Cb 0.00 -2.60 -0.09 0.00 0.52 0.00 0.00 34.95 32.78 1bhy s ARG 534 CO 0.00 0.19 1.16 0.42 0.02 0.00 0.00 175.30 177.09 1bhy s ILE 535 N -1.80 3.26 0.00 1.52 1.09 -0.47 0.85 121.20 125.64 1bhy s ILE 535 Ca 0.53 1.19 0.00 0.00 -1.10 0.00 0.00 60.65 61.27 1bhy s ILE 535 Cb -0.15 -3.72 0.00 0.00 -1.06 0.00 0.00 42.46 37.53 1bhy s ILE 535 CO 0.20 0.22 0.04 2.30 -0.10 0.00 0.00 174.94 177.60 1bhy n ILE 536 N 0.73 0.00 -3.78 2.92 -5.35 -0.28 -4.62 119.36 108.98 1bhy n ILE 536 Ca 0.01 -0.04 -0.09 0.00 -0.27 0.00 0.00 62.75 62.36 1bhy n ILE 536 Cb 0.45 1.84 -0.04 0.00 -1.74 0.00 0.00 39.64 40.15 1bhy n ILE 536 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1bhy s GLY 537 N -0.01 -0.02 -0.17 3.28 0.00 -1.08 0.30 107.32 109.62 1bhy s GLY 537 Ca 0.00 -0.31 -0.28 0.00 0.00 0.00 0.00 44.72 44.13 1bhy s GLY 537 CO 0.00 -0.28 0.86 -0.32 0.00 0.00 0.00 173.10 173.36 1bhy s GLY 538 N -2.90 -0.38 -0.12 0.20 0.00 -0.47 -2.27 107.32 101.38 1bhy s GLY 538 Ca 0.11 1.95 -0.11 0.00 0.00 0.00 0.00 44.72 46.67 1bhy s GLY 538 CO -0.00 1.29 0.32 -0.32 0.00 0.00 0.00 173.10 174.39 1bhy s GLY 539 N -0.61 -0.24 -0.10 0.20 0.00 -0.15 -0.72 107.32 105.70 1bhy s GLY 539 Ca -0.03 0.94 -0.03 0.00 0.00 0.00 0.00 44.72 45.59 1bhy s GLY 539 CO 0.02 0.83 0.11 -0.42 0.00 0.00 0.00 173.10 173.65 1bhy s ILE 540 N 0.25 -0.17 -0.28 0.90 1.01 0.22 -0.42 121.20 122.71 1bhy s ILE 540 Ca -0.01 0.21 -0.10 0.00 0.00 0.00 0.00 60.65 60.75 1bhy s ILE 540 Cb -0.03 -0.35 -0.04 0.00 0.01 0.00 0.00 42.46 42.06 1bhy s ILE 540 CO -0.00 0.02 0.17 -0.69 0.00 0.00 0.00 174.94 174.44 1bhy s VAL 541 N 2.22 5.04 0.00 2.92 1.01 -0.94 0.71 120.40 131.36 1bhy s VAL 541 Ca 0.04 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1bhy s VAL 541 Cb -0.13 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1bhy s VAL 541 CO -0.06 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1bhy n GLY 542 N 5.03 3.35 3.64 4.51 0.00 0.75 -3.01 105.19 119.46 1bhy n GLY 542 Ca -0.14 -1.21 -0.45 0.00 0.00 0.00 0.00 46.02 44.22 1bhy n GLY 542 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1bhy n PRO 543 N -1.42 1.71 -1.00 1.61 -0.02 -1.26 -0.88 135.00 133.74 1bhy n PRO 543 Ca 0.00 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1bhy n PRO 543 Cb 0.00 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1bhy n PRO 543 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1bhy n ASN 544 N 1.65 -4.61 -0.31 2.55 4.13 -1.26 -4.91 115.26 112.50 1bhy n ASN 544 Ca 0.10 0.00 0.02 0.00 1.68 0.00 0.00 54.58 56.39 1bhy n ASN 544 Cb 0.31 -2.12 0.09 0.00 -1.54 0.00 0.00 39.78 36.52 1bhy n ASN 544 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 1bhy h GLY 545 N 0.00 0.49 2.00 7.41 0.00 -1.26 3.12 103.07 114.83 1bhy h GLY 545 Ca 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.65 1bhy h GLY 545 CO 0.00 -0.30 -0.06 -1.33 0.00 0.00 0.00 176.54 174.85 1bhy h GLY 546 N -0.02 0.00 1.92 4.60 0.00 -1.89 0.14 103.07 107.83 1bhy h GLY 546 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1bhy h GLY 546 CO -0.89 0.00 -0.06 -0.55 0.00 0.00 0.00 176.54 175.04 1bhy h ASP 547 N 0.00 0.00 0.00 0.19 3.32 0.52 -3.36 116.42 117.09 1bhy h ASP 547 Ca -0.00 -0.02 -0.28 0.00 0.02 0.00 0.00 57.03 56.76 1bhy h ASP 547 Cb 0.31 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.81 1bhy h ASP 547 CO 0.01 0.01 -2.16 0.23 -1.72 0.00 0.00 179.24 175.60 1bhy n MET 548 N -2.33 1.03 0.27 3.56 2.81 -0.00 -4.43 117.12 118.02 1bhy n MET 548 Ca 0.05 -0.03 0.18 0.00 -1.81 0.00 0.00 57.70 56.09 1bhy n MET 548 Cb 0.44 -1.45 0.93 0.00 -0.71 0.00 0.00 33.22 32.43 1bhy n MET 548 CO 0.00 0.00 0.00 -0.84 1.51 0.00 0.00 175.97 176.64 1bhy h ILE 549 N 0.00 0.00 -0.41 2.02 -0.00 -0.98 -1.66 117.51 116.49 1bhy h ILE 549 Ca -0.41 -0.06 0.12 0.00 -0.00 0.00 0.00 64.86 64.51 1bhy h ILE 549 Cb 1.91 0.87 -0.02 0.00 -0.00 0.00 0.00 36.82 39.59 1bhy h ILE 549 CO 0.02 0.00 0.37 1.23 -0.00 0.00 0.00 178.15 179.78 1bhy h GLY 550 N 0.30 0.00 1.22 0.16 0.00 -1.78 0.17 103.07 103.14 1bhy h GLY 550 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 1bhy h GLY 550 CO 0.00 0.00 -1.54 1.05 0.00 0.00 0.00 176.54 176.05 1bhy h GLU 551 N 0.00 0.32 0.00 4.80 4.11 -1.61 -1.74 114.58 120.46 1bhy h GLU 551 Ca 0.19 -0.54 0.00 0.00 0.07 0.00 0.00 59.36 59.08 1bhy h GLU 551 Cb 0.94 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1bhy h GLU 551 CO -0.00 1.21 0.00 1.55 0.07 0.00 0.00 179.01 181.83 1bhy n VAL 552 N -3.52 1.50 0.14 -1.06 3.14 -0.36 -1.25 118.33 116.93 1bhy n VAL 552 Ca -0.17 0.40 -0.10 0.00 -2.96 0.00 0.00 64.34 61.51 1bhy n VAL 552 Cb 1.06 -1.30 -0.06 0.00 -1.06 0.00 0.00 33.84 32.48 1bhy n VAL 552 CO 0.00 0.00 0.00 1.88 -6.46 0.00 0.00 176.83 172.25 1bhy h TYR 553 N 0.00 -0.40 -0.22 1.45 0.05 -0.32 -2.20 116.97 115.33 1bhy h TYR 553 Ca 0.00 -0.01 -0.09 0.00 0.05 0.00 0.00 58.73 58.68 1bhy h TYR 553 Cb 0.11 0.13 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 1bhy h TYR 553 CO 0.00 -0.10 -0.24 1.25 -1.05 0.00 0.00 178.16 178.02 1bhy h LEU 554 N -1.01 0.40 0.24 3.88 5.85 -0.84 -0.74 115.31 123.09 1bhy h LEU 554 Ca -0.04 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1bhy h LEU 554 Cb 0.47 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1bhy h LEU 554 CO 0.07 0.65 -0.24 0.00 -0.34 0.00 0.00 178.44 178.58 1bhy h ALA 555 N 1.39 -0.95 -0.32 1.25 0.00 -1.27 1.75 119.26 121.11 1bhy h ALA 555 Ca 0.06 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1bhy h ALA 555 Cb 0.62 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 1bhy h ALA 555 CO 0.04 -0.96 -0.19 0.82 0.00 0.00 0.00 179.25 178.96 1bhy h ILE 556 N -0.48 0.46 0.51 0.00 2.04 -1.32 -0.82 117.51 117.90 1bhy h ILE 556 Ca -0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 1bhy h ILE 556 Cb 0.42 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1bhy h ILE 556 CO -0.03 0.00 -0.44 -0.33 0.00 0.00 0.00 178.15 177.35 1bhy h GLU 557 N -0.15 -0.91 0.00 2.37 4.39 -0.71 -0.21 114.58 119.36 1bhy h GLU 557 Ca 0.17 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1bhy h GLU 557 Cb 0.40 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1bhy h GLU 557 CO -0.41 -0.61 0.00 -1.33 -1.16 0.00 0.00 179.01 175.50 1bhy n MET 558 N -5.54 0.11 -3.69 2.33 2.81 0.59 -4.83 117.12 108.90 1bhy n MET 558 Ca -0.12 0.00 -0.23 0.00 -1.81 0.00 0.00 57.70 55.54 1bhy n MET 558 Cb 0.43 -1.26 0.05 0.00 -0.71 0.00 0.00 33.22 31.72 1bhy n MET 558 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bhy n GLY 559 N -0.60 -0.38 3.80 3.03 0.00 -0.09 -4.96 105.19 105.99 1bhy n GLY 559 Ca 0.01 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1bhy n GLY 559 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bhy s ASP 561 N -3.93 3.38 0.34 0.00 1.47 -1.26 -1.37 116.67 115.29 1bhy s ASP 561 Ca 0.62 -1.36 0.08 0.00 1.18 0.00 0.00 52.55 53.07 1bhy s ASP 561 Cb -0.15 -0.29 0.79 0.00 -0.34 0.00 0.00 42.92 42.93 1bhy s ASP 561 CO 0.54 -0.48 1.85 0.00 0.68 0.00 0.00 175.17 177.76 1bhy h ALA 562 N 1.91 1.80 0.00 2.11 0.00 -1.92 0.71 119.26 123.87 1bhy h ALA 562 Ca -0.43 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1bhy h ALA 562 Cb 1.24 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1bhy h ALA 562 CO 0.77 -0.06 -0.31 0.00 0.00 0.00 0.00 179.25 179.65 1bhy h ALA 563 N 1.60 1.27 -0.04 0.00 0.00 -1.93 -0.19 119.26 119.97 1bhy h ALA 563 Ca 0.48 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1bhy h ALA 563 Cb 0.75 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1bhy h ALA 563 CO -0.24 0.38 0.00 -0.44 0.00 0.00 0.00 179.25 178.96 1bhy h ASP 564 N 0.00 0.07 0.10 0.00 3.32 0.04 -2.15 116.42 117.80 1bhy h ASP 564 Ca -0.00 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.76 1bhy h ASP 564 Cb 0.63 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1bhy h ASP 564 CO 0.04 0.33 -0.05 0.40 -1.72 0.00 0.00 179.24 178.24 1bhy h ILE 565 N -0.20 1.10 -0.65 0.35 2.04 -1.36 -3.28 117.51 115.51 1bhy h ILE 565 Ca 0.01 -1.22 0.11 0.00 1.00 0.00 0.00 64.86 64.75 1bhy h ILE 565 Cb 0.30 1.82 -0.08 0.00 -0.74 0.00 0.00 36.82 38.12 1bhy h ILE 565 CO 0.00 0.28 0.24 1.23 0.00 0.00 0.00 178.15 179.90 1bhy h GLY 566 N -0.75 0.92 0.34 5.37 0.00 -1.14 0.30 103.07 108.09 1bhy h GLY 566 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1bhy h GLY 566 CO 0.02 -0.04 0.00 0.28 0.00 0.00 0.00 176.54 176.81 1bhy n LYS 567 N -5.00 0.95 -2.89 4.80 5.02 -0.81 -4.63 118.16 115.61 1bhy n LYS 567 Ca 0.10 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.98 1bhy n LYS 567 Cb 0.31 -1.17 -0.04 0.00 -0.02 0.00 0.00 35.03 34.11 1bhy n LYS 567 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1bhy s THR 568 N -2.00 4.90 -0.91 -0.18 2.01 0.10 -4.95 115.64 114.62 1bhy s THR 568 Ca 0.15 1.66 -0.24 0.00 0.31 0.00 0.00 61.69 63.57 1bhy s THR 568 Cb 0.07 -4.15 0.02 0.00 0.01 0.00 0.00 72.50 68.46 1bhy s THR 568 CO 0.12 0.07 1.52 -0.63 -0.69 0.00 0.00 174.62 175.01 1bhy s ILE 569 N 1.85 3.76 0.38 1.82 1.01 -1.26 -4.91 121.20 123.85 1bhy s ILE 569 Ca 0.40 -0.37 -0.24 0.00 0.00 0.00 0.00 60.65 60.45 1bhy s ILE 569 Cb -0.17 -4.77 -0.10 0.00 0.01 0.00 0.00 42.46 37.42 1bhy s ILE 569 CO 0.15 -1.68 0.96 -1.00 0.00 0.00 0.00 174.94 173.37 1bhy s HIS 570 N 6.30 3.46 0.49 3.97 3.76 -1.26 -5.03 115.29 126.97 1bhy s HIS 570 Ca 0.49 1.69 -0.20 0.00 -0.15 0.00 0.00 55.06 56.89 1bhy s HIS 570 Cb -0.04 -2.93 -0.08 0.00 1.11 0.00 0.00 32.58 30.64 1bhy s HIS 570 CO -0.01 -0.06 1.03 -1.25 -0.85 0.00 0.00 174.74 173.60 1bhy s PRO 571 N -2.60 3.82 0.17 8.40 0.04 -1.26 -4.93 135.00 138.64 1bhy s PRO 571 Ca 0.57 1.32 0.11 0.00 0.04 0.00 0.00 61.00 63.03 1bhy s PRO 571 Cb -0.15 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1bhy s PRO 571 CO 0.20 -0.41 -0.23 -1.58 0.04 0.00 0.00 177.00 175.02 1bhy s HIS 572 N -2.03 2.17 -0.09 0.56 2.46 -1.26 -3.86 115.29 113.23 1bhy s HIS 572 Ca 0.66 -0.39 -0.21 0.00 0.47 0.00 0.00 55.06 55.60 1bhy s HIS 572 Cb -0.15 -1.09 -0.04 0.00 -0.13 0.00 0.00 32.58 31.16 1bhy s HIS 572 CO 0.20 0.42 0.60 -1.25 -2.47 0.00 0.00 174.74 172.24 1bhy s PRO 573 N -2.56 4.39 0.28 2.88 0.04 -1.26 -5.17 135.00 133.60 1bhy s PRO 573 Ca 0.18 0.68 -0.10 0.00 0.04 0.00 0.00 61.00 61.80 1bhy s PRO 573 Cb -0.08 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.02 1bhy s PRO 573 CO 0.08 0.11 0.48 0.95 0.04 0.00 0.00 177.00 178.67 1bhy s THR 574 N 0.70 0.00 -0.03 1.26 -4.23 -1.25 -4.84 115.64 107.25 1bhy s THR 574 Ca 0.32 -1.46 -0.08 0.00 -1.18 0.00 0.00 61.69 59.29 1bhy s THR 574 Cb -0.17 -2.39 -0.30 0.00 1.34 0.00 0.00 72.50 70.98 1bhy s THR 574 CO 0.14 0.00 0.72 -0.07 -0.54 0.00 0.00 174.62 174.87 1bhy h LEU 575 N 2.21 0.54 -0.80 4.79 4.07 -1.95 -3.35 115.31 120.82 1bhy h LEU 575 Ca -0.28 -0.80 0.19 0.00 0.08 0.00 0.00 57.88 57.08 1bhy h LEU 575 Cb 1.25 -0.18 -0.14 0.00 1.08 0.00 0.00 40.66 42.67 1bhy h LEU 575 CO 0.38 1.67 0.04 1.23 -1.08 0.00 0.00 178.44 180.68 1bhy h GLY 576 N 1.03 0.96 2.00 0.83 0.00 -1.96 0.17 103.07 106.10 1bhy h GLY 576 Ca -0.32 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1bhy h GLY 576 CO 0.17 -0.32 0.00 -1.84 0.00 0.00 0.00 176.54 174.55 1bhy n GLU 577 N -5.35 0.03 0.15 4.80 0.28 -1.26 -1.26 120.64 118.04 1bhy n GLU 577 Ca 0.16 0.51 0.12 0.00 -0.16 0.00 0.00 57.16 57.79 1bhy n GLU 577 Cb 0.53 -1.60 0.53 0.00 1.43 0.00 0.00 31.44 32.34 1bhy n GLU 577 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1bhy h SER 578 N 0.00 0.00 0.13 -1.84 4.64 -0.89 0.41 113.55 116.01 1bhy h SER 578 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1bhy h SER 578 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1bhy h SER 578 CO 0.00 0.00 -0.06 0.40 -0.87 0.00 0.00 176.83 176.30 1bhy h ILE 579 N 0.00 0.97 0.14 0.95 2.04 -1.38 0.57 117.51 120.81 1bhy h ILE 579 Ca 0.00 -0.45 0.02 0.00 1.00 0.00 0.00 64.86 65.43 1bhy h ILE 579 Cb 0.31 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 1bhy h ILE 579 CO 0.00 0.11 -0.38 1.23 0.00 0.00 0.00 178.15 179.11 1bhy h GLY 580 N -0.39 -0.76 1.70 5.37 0.00 -1.61 -1.14 103.07 106.23 1bhy h GLY 580 Ca -0.02 0.45 0.03 0.00 0.00 0.00 0.00 47.33 47.79 1bhy h GLY 580 CO 0.03 -0.27 0.15 -0.33 0.00 0.00 0.00 176.54 176.12 1bhy h MET 581 N -0.62 0.17 -0.23 4.80 2.86 -0.86 0.78 114.93 121.83 1bhy h MET 581 Ca 0.02 -0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.56 1bhy h MET 581 Cb 0.65 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1bhy h MET 581 CO -0.21 0.11 -0.25 0.00 1.06 0.00 0.00 176.91 177.62 1bhy h ALA 582 N 1.88 1.15 0.48 6.32 0.00 0.11 -1.92 119.26 127.28 1bhy h ALA 582 Ca 0.09 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1bhy h ALA 582 Cb 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1bhy h ALA 582 CO -0.02 0.54 -0.23 0.00 0.00 0.00 0.00 179.25 179.54 1bhy h ALA 583 N 1.36 -0.65 -0.94 0.00 0.00 0.16 0.02 119.26 119.21 1bhy h ALA 583 Ca 0.06 -0.18 0.16 0.00 0.00 0.00 0.00 54.91 54.95 1bhy h ALA 583 Cb 0.65 0.25 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 1bhy h ALA 583 CO 0.05 -0.77 0.54 0.93 0.00 0.00 0.00 179.25 180.00 1bhy h GLU 584 N -0.84 0.72 -0.98 0.00 5.08 -0.87 1.27 114.58 118.96 1bhy h GLU 584 Ca -0.07 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1bhy h GLU 584 Cb 0.58 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 1bhy h GLU 584 CO 0.11 0.48 0.64 0.28 -1.00 0.00 0.00 179.01 179.52 1bhy h VAL 585 N 0.74 1.15 -0.06 3.13 2.07 -1.05 1.05 116.25 123.28 1bhy h VAL 585 Ca 0.52 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.63 1bhy h VAL 585 Cb 0.73 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1bhy h VAL 585 CO -0.36 0.22 -0.02 0.00 0.02 0.00 0.00 177.57 177.44 1bhy h ALA 586 N 1.44 0.04 0.00 1.67 0.00 0.35 0.21 119.26 122.97 1bhy h ALA 586 Ca 0.40 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1bhy h ALA 586 Cb 0.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1bhy h ALA 586 CO -0.13 -0.49 0.00 1.28 0.00 0.00 0.00 179.25 179.90 1bhy n LEU 587 N -5.12 0.00 -1.01 0.00 4.77 0.13 -4.85 117.00 110.92 1bhy n LEU 587 Ca -0.06 0.28 -0.13 0.00 -0.03 0.00 0.00 56.01 56.07 1bhy n LEU 587 Cb 0.06 -0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 40.81 1bhy n LEU 587 CO 0.30 -0.19 -0.13 0.61 -1.33 0.00 0.00 177.39 176.66 1bhy n GLY 588 N -0.43 1.37 0.89 -0.72 0.00 0.34 -4.89 105.19 101.74 1bhy n GLY 588 Ca 0.05 -0.28 0.07 0.00 0.00 0.00 0.00 46.02 45.86 1bhy n GLY 588 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bhy n THR 589 N -2.54 1.27 -2.67 2.61 -1.04 0.26 -4.49 114.28 107.68 1bhy n THR 589 Ca -0.13 -1.14 -0.43 0.00 -2.04 0.00 0.00 64.05 60.31 1bhy n THR 589 Cb 0.47 0.36 -0.02 0.00 -1.82 0.00 0.00 70.33 69.32 1bhy n THR 589 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bhy n THR 591 N 5.60 2.36 0.28 0.00 -2.24 -1.26 -3.71 114.28 115.31 1bhy n THR 591 Ca 0.11 -1.21 0.03 0.00 -2.27 0.00 0.00 64.05 60.71 1bhy n THR 591 Cb 0.47 -0.28 0.02 0.00 -2.10 0.00 0.00 70.33 68.44 1bhy n THR 591 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1bhy n ASP 592 N 0.58 1.37 -4.16 3.42 8.00 -1.26 -4.96 116.55 119.54 1bhy n ASP 592 Ca 0.24 -1.18 -0.10 0.00 0.71 0.00 0.00 54.79 54.46 1bhy n ASP 592 Cb 1.06 0.15 -0.10 0.00 -0.02 0.00 0.00 41.12 42.22 1bhy n ASP 592 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1bhy s LEU 593 N -0.83 2.50 0.56 0.64 1.43 -1.24 -4.94 118.68 116.80 1bhy s LEU 593 Ca 0.07 -1.01 -0.18 0.00 -1.03 0.00 0.00 54.13 51.98 1bhy s LEU 593 Cb 0.05 -0.03 -0.09 0.00 0.03 0.00 0.00 46.19 46.15 1bhy s LEU 593 CO 0.11 -0.49 0.44 -2.65 0.23 0.00 0.00 176.35 173.99 1bhy n PRO 594 N -0.02 0.44 -1.60 1.29 -0.02 -1.26 -4.88 135.00 128.96 1bhy n PRO 594 Ca -0.12 0.17 -0.37 0.00 -2.02 0.00 0.00 63.50 61.16 1bhy n PRO 594 Cb 0.61 -1.61 0.06 0.00 -0.02 0.00 0.00 33.50 32.54 1bhy n PRO 594 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1bhy n PRO 595 N 0.14 0.84 -4.21 0.52 -0.04 -1.26 -4.94 135.00 126.05 1bhy n PRO 595 Ca 0.11 0.33 -0.34 0.00 -0.04 0.00 0.00 63.50 63.56 1bhy n PRO 595 Cb 0.47 -2.21 -0.10 0.00 -0.04 0.00 0.00 33.50 31.62 1bhy n PRO 595 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1bhy s GLN 596 N -2.93 3.69 -0.42 0.54 1.11 -1.26 -4.71 119.66 115.68 1bhy s GLN 596 Ca 0.77 -0.41 -0.27 0.00 0.01 0.00 0.00 55.36 55.46 1bhy s GLN 596 Cb -0.40 -3.04 0.04 0.00 -1.01 0.00 0.00 33.01 28.60 1bhy s GLN 596 CO 0.46 0.35 0.60 1.17 0.01 0.00 0.00 175.29 177.88 1bhy n LYS 597 N 3.25 -2.12 0.00 2.91 4.81 -1.26 -4.98 118.16 120.78 1bhy n LYS 597 Ca -0.17 1.75 0.00 0.00 -0.87 0.00 0.00 58.31 59.01 1bhy n LYS 597 Cb 0.53 -3.66 0.00 0.00 0.02 0.00 0.00 35.03 31.91 1bhy n LYS 597 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74