#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qsv h ASP 130 N 0.00 -0.31 -0.63 6.43 5.19 -2.04 -2.70 116.42 122.37 1qsv h ASP 130 Ca 0.00 0.02 -0.71 0.00 -0.62 0.00 0.00 57.03 55.72 1qsv h ASP 130 Cb 0.00 0.10 -0.06 0.00 0.18 0.00 0.00 39.33 39.55 1qsv h ASP 130 CO 0.00 -0.19 3.01 0.41 -3.12 0.00 0.00 179.24 179.35 1qsv n THR 131 N -5.24 4.65 0.00 0.35 -1.04 -1.26 -4.76 114.28 106.98 1qsv n THR 131 Ca -0.08 -3.54 0.00 0.00 -2.04 0.00 0.00 64.05 58.39 1qsv n THR 131 Cb 0.16 -2.36 0.00 0.00 -1.82 0.00 0.00 70.33 66.31 1qsv n THR 131 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1qsv n GLY 132 N 2.75 1.61 3.64 3.41 0.00 -1.02 -5.09 105.19 110.50 1qsv n GLY 132 Ca 0.66 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.64 1qsv n GLY 132 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qsv s ARG 133 N 0.04 0.34 0.04 1.61 3.52 -1.26 -5.05 118.95 118.19 1qsv s ARG 133 Ca 0.00 0.51 -0.21 0.00 -0.13 0.00 0.00 55.73 55.90 1qsv s ARG 133 Cb 0.00 0.11 -0.14 0.00 -1.56 0.00 0.00 34.95 33.36 1qsv s ARG 133 CO 0.00 -0.06 1.41 -1.00 -0.81 0.00 0.00 175.30 174.84 1qsv h PRO 134 N 5.14 0.28 -6.93 5.12 0.13 -1.95 -3.46 132.00 130.34 1qsv h PRO 134 Ca -0.28 -0.12 -0.51 0.00 -0.87 0.00 0.00 66.00 64.22 1qsv h PRO 134 Cb 1.18 -0.01 0.06 0.00 0.13 0.00 0.00 31.00 32.36 1qsv h PRO 134 CO 0.18 0.60 0.53 -0.06 -0.23 0.00 0.00 178.00 179.01 1qsv s PHE 135 N -4.62 3.04 -0.12 1.56 0.08 -1.26 -1.21 117.98 115.44 1qsv s PHE 135 Ca -0.14 1.53 -0.22 0.00 0.12 0.00 0.00 56.93 58.21 1qsv s PHE 135 Cb 0.05 -3.45 -0.19 0.00 -0.57 0.00 0.00 43.02 38.85 1qsv s PHE 135 CO 0.73 -1.46 0.62 0.28 -0.10 0.00 0.00 175.22 175.29 1qsv h VAL 136 N 2.41 1.33 -3.44 -0.44 2.07 -1.44 -3.44 116.25 113.30 1qsv h VAL 136 Ca -0.49 -1.94 -0.65 0.00 0.82 0.00 0.00 66.70 64.44 1qsv h VAL 136 Cb 1.24 2.50 -0.25 0.00 -1.52 0.00 0.00 31.29 33.25 1qsv h VAL 136 CO 0.63 0.44 -0.68 -0.70 0.02 0.00 0.00 177.57 177.28 1qsv s GLU 137 N -2.21 3.53 0.22 1.57 2.12 -1.26 -5.09 118.70 117.59 1qsv s GLU 137 Ca -0.14 -0.56 0.10 0.00 0.36 0.00 0.00 54.97 54.73 1qsv s GLU 137 Cb -0.02 -3.07 -0.05 0.00 0.26 0.00 0.00 34.13 31.26 1qsv s GLU 137 CO 0.52 -0.07 -0.20 0.00 -0.54 0.00 0.00 175.26 174.98 1qsv s MET 138 N 1.21 1.49 0.82 4.30 0.23 -1.26 -4.57 119.30 121.52 1qsv s MET 138 Ca 0.03 -1.60 -0.11 0.00 -1.03 0.00 0.00 55.69 52.98 1qsv s MET 138 Cb -0.15 -1.57 0.08 0.00 -1.53 0.00 0.00 34.83 31.66 1qsv s MET 138 CO 0.01 0.31 1.09 1.52 -2.03 0.00 0.00 175.02 175.91 1qsv s TYR 139 N -2.30 2.58 0.00 3.16 1.13 -1.26 -5.05 117.35 115.61 1qsv s TYR 139 Ca 0.23 1.35 0.00 0.00 -1.41 0.00 0.00 57.07 57.25 1qsv s TYR 139 Cb -0.05 -3.09 0.00 0.00 -1.10 0.00 0.00 41.96 37.72 1qsv s TYR 139 CO 0.10 -1.96 0.00 0.45 -2.51 0.00 0.00 175.55 171.63 1qsv n SER 140 N -3.60 0.00 -4.43 -0.18 2.88 -1.26 -4.96 113.62 102.06 1qsv n SER 140 Ca 0.08 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.18 1qsv n SER 140 Cb 0.54 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.93 1qsv n SER 140 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1qsv s GLU 141 N 2.95 3.05 0.00 -1.46 0.41 -1.26 -4.83 118.70 117.56 1qsv s GLU 141 Ca 0.00 -1.05 0.00 0.00 -0.41 0.00 0.00 54.97 53.51 1qsv s GLU 141 Cb 0.00 -4.08 0.00 0.00 -1.78 0.00 0.00 34.13 28.27 1qsv s GLU 141 CO 0.00 -1.05 0.00 -0.89 -0.49 0.00 0.00 175.26 172.83 1qsv n ILE 142 N 5.40 0.00 -1.50 -1.63 2.08 -1.26 -5.09 119.36 117.36 1qsv n ILE 142 Ca -0.09 0.00 -0.47 0.00 0.56 0.00 0.00 62.75 62.75 1qsv n ILE 142 Cb 0.45 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 39.32 1qsv n ILE 142 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 1qsv n PRO 143 N 0.04 0.65 -1.93 0.38 -0.02 -1.26 -4.84 135.00 128.02 1qsv n PRO 143 Ca 0.00 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.29 1qsv n PRO 143 Cb 0.00 -1.44 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 1qsv n PRO 143 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1qsv s GLU 144 N -1.16 4.10 -0.61 -0.52 2.12 -0.80 -4.54 118.70 117.28 1qsv s GLU 144 Ca 0.63 2.23 -0.28 0.00 0.36 0.00 0.00 54.97 57.92 1qsv s GLU 144 Cb -0.84 -4.04 0.01 0.00 0.26 0.00 0.00 34.13 29.52 1qsv s GLU 144 CO 0.57 -0.95 1.41 0.42 -0.54 0.00 0.00 175.26 176.17 1qsv s ILE 145 N 4.39 3.74 -0.20 -3.70 -1.09 -1.26 -0.62 121.20 122.45 1qsv s ILE 145 Ca 0.78 0.57 -0.05 0.00 -2.23 0.00 0.00 60.65 59.72 1qsv s ILE 145 Cb -0.35 -4.52 -0.02 0.00 -1.58 0.00 0.00 42.46 35.99 1qsv s ILE 145 CO 0.32 -1.32 -0.00 -0.63 -1.23 0.00 0.00 174.94 172.08 1qsv s ILE 146 N 6.23 3.89 -0.95 2.92 1.01 -0.55 -5.01 121.20 128.75 1qsv s ILE 146 Ca 0.49 -0.33 -0.23 0.00 0.00 0.00 0.00 60.65 60.58 1qsv s ILE 146 Cb -0.10 -2.76 0.06 0.00 0.01 0.00 0.00 42.46 39.67 1qsv s ILE 146 CO 0.22 0.42 1.37 -1.00 0.00 0.00 0.00 174.94 175.95 1qsv s HIS 147 N 1.08 2.57 0.60 3.97 3.76 -1.26 -1.53 115.29 124.48 1qsv s HIS 147 Ca 0.02 -0.77 -0.03 0.00 -0.15 0.00 0.00 55.06 54.13 1qsv s HIS 147 Cb -0.14 -4.62 0.03 0.00 1.11 0.00 0.00 32.58 28.96 1qsv s HIS 147 CO 0.01 -1.90 0.87 0.00 -0.85 0.00 0.00 174.74 172.87 1qsv s MET 148 N 4.79 2.56 0.01 1.40 0.23 -0.07 -4.65 119.30 123.55 1qsv s MET 148 Ca 0.42 -0.42 0.01 0.00 -1.03 0.00 0.00 55.69 54.67 1qsv s MET 148 Cb -0.02 -2.35 -0.01 0.00 -1.53 0.00 0.00 34.83 30.92 1qsv s MET 148 CO -0.05 -0.84 -0.05 0.99 -2.03 0.00 0.00 175.02 173.04 1qsv s THR 149 N -2.94 0.37 0.54 3.16 2.01 -1.26 -1.41 115.64 116.11 1qsv s THR 149 Ca 0.56 -0.41 -0.20 0.00 0.31 0.00 0.00 61.69 61.95 1qsv s THR 149 Cb -0.10 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 72.00 1qsv s THR 149 CO 0.42 -0.03 1.20 -1.61 -0.69 0.00 0.00 174.62 173.91 1qsv s GLU 150 N -0.48 3.27 0.00 4.92 0.41 -1.26 -3.93 118.70 121.63 1qsv s GLU 150 Ca -0.02 1.83 0.00 0.00 -0.41 0.00 0.00 54.97 56.37 1qsv s GLU 150 Cb -0.04 -2.11 0.00 0.00 -1.78 0.00 0.00 34.13 30.21 1qsv s GLU 150 CO -0.00 -0.97 0.00 0.41 -0.49 0.00 0.00 175.26 174.21 1qsv n GLY 151 N 0.45 1.41 3.61 -1.39 0.00 -0.10 -4.92 105.19 104.25 1qsv n GLY 151 Ca 0.11 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1qsv n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qsv n ARG 152 N 0.00 -0.41 -1.78 1.61 1.74 -1.25 -4.04 116.66 112.53 1qsv n ARG 152 Ca 0.00 -2.34 -0.32 0.00 -0.77 0.00 0.00 57.85 54.41 1qsv n ARG 152 Cb 0.00 -0.82 0.04 0.00 -1.02 0.00 0.00 32.46 30.66 1qsv n ARG 152 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1qsv s GLU 153 N -5.16 2.95 -0.23 5.56 4.04 -1.09 -1.41 118.70 123.36 1qsv s GLU 153 Ca 0.64 1.23 -0.03 0.00 0.04 0.00 0.00 54.97 56.85 1qsv s GLU 153 Cb -0.03 -1.98 0.12 0.00 0.02 0.00 0.00 34.13 32.26 1qsv s GLU 153 CO 0.43 -1.11 0.35 -1.17 -1.84 0.00 0.00 175.26 171.92 1qsv s LEU 154 N -4.96 -0.52 -0.02 1.83 2.96 -0.65 -4.82 118.68 112.51 1qsv s LEU 154 Ca 0.64 0.23 -0.20 0.00 -0.22 0.00 0.00 54.13 54.58 1qsv s LEU 154 Cb -0.17 0.98 -0.05 0.00 0.50 0.00 0.00 46.19 47.45 1qsv s LEU 154 CO 0.43 -0.30 0.56 -0.69 -1.32 0.00 0.00 176.35 175.04 1qsv s VAL 155 N 2.51 4.95 -0.60 1.68 1.01 -1.26 -0.75 120.40 127.93 1qsv s VAL 155 Ca 0.10 1.18 -0.06 0.00 0.00 0.00 0.00 61.98 63.20 1qsv s VAL 155 Cb -0.15 -3.90 0.16 0.00 0.00 0.00 0.00 36.38 32.49 1qsv s VAL 155 CO -0.14 0.42 0.44 -0.63 0.00 0.00 0.00 175.10 175.19 1qsv s ILE 156 N -0.18 4.04 -1.30 2.22 -1.09 -0.35 -4.95 121.20 119.59 1qsv s ILE 156 Ca 0.30 -2.57 -0.18 0.00 -2.23 0.00 0.00 60.65 55.97 1qsv s ILE 156 Cb -0.18 -3.62 0.04 0.00 -1.58 0.00 0.00 42.46 37.12 1qsv s ILE 156 CO 0.16 -0.86 1.86 -0.81 -1.23 0.00 0.00 174.94 174.06 1qsv n PRO 157 N 3.95 2.91 -2.42 2.79 -0.04 -1.26 -1.73 135.00 139.20 1qsv n PRO 157 Ca 0.05 -3.02 -0.21 0.00 -0.04 0.00 0.00 63.50 60.27 1qsv n PRO 157 Cb 0.40 -3.46 0.01 0.00 -0.04 0.00 0.00 33.50 30.41 1qsv n PRO 157 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qsv s ARG 159 N -3.51 1.58 0.19 0.00 1.70 -1.26 -4.84 118.95 112.81 1qsv s ARG 159 Ca 0.44 1.52 0.09 0.00 -0.47 0.00 0.00 55.73 57.31 1qsv s ARG 159 Cb 0.41 -1.79 -0.04 0.00 -0.57 0.00 0.00 34.95 32.95 1qsv s ARG 159 CO -0.09 -2.21 -0.08 0.14 -1.08 0.00 0.00 175.30 171.98 1qsv s VAL 160 N -2.53 3.21 0.06 4.99 -7.23 -0.25 -1.17 120.40 117.49 1qsv s VAL 160 Ca 0.67 -1.70 -0.32 0.00 -1.81 0.00 0.00 61.98 58.82 1qsv s VAL 160 Cb -0.23 -2.61 -0.17 0.00 0.56 0.00 0.00 36.38 33.93 1qsv s VAL 160 CO 0.54 -0.15 1.49 0.71 -0.31 0.00 0.00 175.10 177.38 1qsv h THR 161 N 2.63 0.00 -3.82 5.32 1.35 -1.45 -3.40 112.91 113.53 1qsv h THR 161 Ca -0.46 0.00 -0.63 0.00 -0.55 0.00 0.00 66.41 64.76 1qsv h THR 161 Cb 1.21 0.00 -0.16 0.00 -1.73 0.00 0.00 68.15 67.47 1qsv h THR 161 CO 0.55 0.00 -0.43 -0.55 -0.25 0.00 0.00 175.52 174.85 1qsv s SER 162 N -3.90 6.10 0.49 5.36 0.15 -1.26 -4.99 113.70 115.66 1qsv s SER 162 Ca -0.17 0.10 0.35 0.00 0.70 0.00 0.00 55.95 56.93 1qsv s SER 162 Cb 0.03 -2.15 1.49 0.00 -1.71 0.00 0.00 66.02 63.68 1qsv s SER 162 CO 0.52 -0.09 1.70 -0.65 1.20 0.00 0.00 173.24 175.92 1qsv h PRO 163 N 8.25 0.09 -0.16 5.44 0.11 -1.90 -1.59 132.00 142.24 1qsv h PRO 163 Ca -0.34 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.81 1qsv h PRO 163 Cb 1.18 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1qsv h PRO 163 CO 0.59 0.06 0.14 -0.91 -0.21 0.00 0.00 178.00 177.66 1qsv h ASN 164 N 0.09 0.00 -1.45 -2.05 2.35 -1.96 -3.39 115.58 109.16 1qsv h ASN 164 Ca 0.73 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 56.02 1qsv h ASN 164 Cb 2.58 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 40.89 1qsv h ASN 164 CO -0.17 0.00 1.13 -0.63 -1.65 0.00 0.00 177.43 176.11 1qsv s ILE 165 N -4.86 3.56 -0.16 2.81 1.01 -0.60 -4.95 121.20 118.01 1qsv s ILE 165 Ca -0.05 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.17 1qsv s ILE 165 Cb 0.17 -4.36 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 1qsv s ILE 165 CO 0.63 -1.29 1.48 -0.89 0.00 0.00 0.00 174.94 174.86 1qsv s THR 166 N 8.01 3.90 0.21 2.92 2.01 -1.26 -4.91 115.64 126.52 1qsv s THR 166 Ca 0.58 1.06 -0.13 0.00 0.31 0.00 0.00 61.69 63.52 1qsv s THR 166 Cb -0.07 -3.77 -0.07 0.00 0.01 0.00 0.00 72.50 68.59 1qsv s THR 166 CO 0.06 -0.19 0.59 -0.69 -0.69 0.00 0.00 174.62 173.70 1qsv s VAL 167 N 4.21 4.85 -0.38 3.82 1.01 -1.26 -4.96 120.40 127.69 1qsv s VAL 167 Ca 0.65 0.71 -0.13 0.00 0.00 0.00 0.00 61.98 63.21 1qsv s VAL 167 Cb -0.26 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1qsv s VAL 167 CO 0.24 0.04 0.25 -0.89 0.00 0.00 0.00 175.10 174.74 1qsv s THR 168 N -1.70 4.99 -0.59 3.92 2.01 -0.41 -4.97 115.64 118.89 1qsv s THR 168 Ca 0.45 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.58 1qsv s THR 168 Cb -0.13 -3.74 0.06 0.00 0.01 0.00 0.00 72.50 68.71 1qsv s THR 168 CO 0.20 -0.22 0.87 -0.22 -0.69 0.00 0.00 174.62 174.56 1qsv s LEU 169 N 1.64 4.51 0.58 4.42 2.96 -1.26 -0.89 118.68 130.64 1qsv s LEU 169 Ca 0.04 -0.84 -0.02 0.00 -0.22 0.00 0.00 54.13 53.09 1qsv s LEU 169 Cb -0.19 -2.53 0.03 0.00 0.50 0.00 0.00 46.19 44.01 1qsv s LEU 169 CO 0.09 -1.25 0.85 -0.54 -1.32 0.00 0.00 176.35 174.17 1qsv s LYS 170 N 3.64 2.58 -0.04 1.98 -0.14 0.29 -0.93 119.74 127.13 1qsv s LYS 170 Ca 0.22 -0.46 -0.09 0.00 -1.36 0.00 0.00 55.97 54.27 1qsv s LYS 170 Cb -0.17 -2.37 0.01 0.00 -1.68 0.00 0.00 37.83 33.62 1qsv s LYS 170 CO 0.13 -0.79 0.22 0.21 -0.76 0.00 0.00 175.35 174.35 1qsv s LYS 171 N -4.90 0.45 0.27 1.68 2.20 -0.25 -1.14 119.74 118.06 1qsv s LYS 171 Ca 0.56 -0.08 -0.30 0.00 -0.36 0.00 0.00 55.97 55.79 1qsv s LYS 171 Cb -0.10 0.20 -0.12 0.00 -1.51 0.00 0.00 37.83 36.29 1qsv s LYS 171 CO 0.41 -0.10 1.56 0.34 -0.36 0.00 0.00 175.35 177.20 1qsv n PHE 172 N 1.96 2.67 0.02 4.03 7.35 -0.40 -0.73 117.46 132.36 1qsv n PHE 172 Ca -0.19 0.29 -0.04 0.00 -0.76 0.00 0.00 57.45 56.75 1qsv n PHE 172 Cb 0.57 -2.57 -0.02 0.00 0.35 0.00 0.00 39.48 37.81 1qsv n PHE 172 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1qsv h PRO 173 N 4.78 -0.16 -0.36 -7.13 0.13 -2.01 -3.42 132.00 123.82 1qsv h PRO 173 Ca -0.46 0.01 -0.23 0.00 -0.87 0.00 0.00 66.00 64.45 1qsv h PRO 173 Cb 1.24 0.04 -0.39 0.00 0.13 0.00 0.00 31.00 32.02 1qsv h PRO 173 CO 0.79 -0.04 -1.07 1.28 -0.23 0.00 0.00 178.00 178.73 1qsv n LEU 174 N -4.88 1.35 -4.83 1.56 4.77 -1.13 -5.10 117.00 108.73 1qsv n LEU 174 Ca -0.03 -2.91 -0.32 0.00 -0.03 0.00 0.00 56.01 52.72 1qsv n LEU 174 Cb 0.10 0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 1qsv n LEU 174 CO 0.08 1.01 0.70 -1.81 -1.33 0.00 0.00 177.39 176.03 1qsv s ASP 175 N -3.47 6.32 -0.19 -1.43 1.01 0.09 -4.91 116.67 114.10 1qsv s ASP 175 Ca 0.27 1.63 -0.00 0.00 0.71 0.00 0.00 52.55 55.15 1qsv s ASP 175 Cb 0.33 -2.51 0.05 0.00 1.01 0.00 0.00 42.92 41.80 1qsv s ASP 175 CO -0.06 -0.80 -0.06 -0.89 0.21 0.00 0.00 175.17 173.58 1qsv s THR 176 N -2.63 1.28 -1.00 -1.27 2.01 -1.26 -1.09 115.64 111.68 1qsv s THR 176 Ca 0.60 -0.83 -0.17 0.00 0.31 0.00 0.00 61.69 61.59 1qsv s THR 176 Cb -0.12 -1.47 0.14 0.00 0.01 0.00 0.00 72.50 71.06 1qsv s THR 176 CO 0.35 0.07 1.20 -0.76 -0.69 0.00 0.00 174.62 174.79 1qsv s LEU 177 N 1.54 5.09 0.25 4.42 1.02 -0.11 -5.01 118.68 125.89 1qsv s LEU 177 Ca -0.01 -2.30 -0.30 0.00 0.02 0.00 0.00 54.13 51.54 1qsv s LEU 177 Cb -0.16 -2.40 -0.11 0.00 0.02 0.00 0.00 46.19 43.54 1qsv s LEU 177 CO -0.08 -0.97 1.54 -0.63 0.02 0.00 0.00 176.35 176.23 1qsv s ILE 178 N 2.35 2.37 -1.10 -0.59 1.01 -1.26 -4.45 121.20 119.54 1qsv s ILE 178 Ca 0.35 0.30 -0.23 0.00 0.00 0.00 0.00 60.65 61.07 1qsv s ILE 178 Cb -0.04 -3.19 -0.06 0.00 0.01 0.00 0.00 42.46 39.18 1qsv s ILE 178 CO -0.07 0.04 1.91 -2.16 0.00 0.00 0.00 174.94 174.66 1qsv s PRO 179 N -0.08 2.66 0.45 2.79 0.04 -1.26 -4.76 135.00 134.84 1qsv s PRO 179 Ca 0.64 -0.94 0.30 0.00 0.04 0.00 0.00 61.00 61.04 1qsv s PRO 179 Cb -0.45 -5.21 1.27 0.00 0.04 0.00 0.00 34.50 30.15 1qsv s PRO 179 CO 0.42 -3.60 1.90 0.38 0.04 0.00 0.00 177.00 176.14 1qsv h ASP 180 N 10.08 0.00 -2.06 6.66 2.03 -1.87 -3.47 116.42 127.78 1qsv h ASP 180 Ca 0.19 0.00 -0.24 0.00 -0.73 0.00 0.00 57.03 56.26 1qsv h ASP 180 Cb 0.96 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.46 1qsv h ASP 180 CO 1.24 0.00 -0.32 0.61 -1.03 0.00 0.00 179.24 179.74 1qsv n GLY 181 N -0.04 -0.08 1.37 7.15 0.00 -0.70 -4.88 105.19 108.01 1qsv n GLY 181 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1qsv n GLY 181 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qsv n LYS 182 N -2.31 0.00 -0.07 1.61 5.02 -1.26 -4.89 118.16 116.27 1qsv n LYS 182 Ca -0.11 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.10 1qsv n LYS 182 Cb 0.59 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.55 1qsv n LYS 182 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1qsv h ARG 183 N 0.00 0.00 -4.90 1.97 2.43 -1.90 -3.43 114.38 108.55 1qsv h ARG 183 Ca 0.00 0.00 -0.71 0.00 -0.81 0.00 0.00 59.98 58.46 1qsv h ARG 183 Cb 0.00 0.00 -0.17 0.00 -0.42 0.00 0.00 29.97 29.38 1qsv h ARG 183 CO 0.00 0.38 1.15 0.42 -1.51 0.00 0.00 179.97 180.41 1qsv s ILE 184 N -1.94 4.88 -0.36 1.20 -1.09 -1.26 -1.20 121.20 121.41 1qsv s ILE 184 Ca -0.11 -2.16 -0.18 0.00 -2.23 0.00 0.00 60.65 55.97 1qsv s ILE 184 Cb 0.00 -4.86 0.00 0.00 -1.58 0.00 0.00 42.46 36.02 1qsv s ILE 184 CO 0.29 -1.58 0.52 -0.63 -1.23 0.00 0.00 174.94 172.31 1qsv s ILE 185 N 2.13 5.00 -0.80 2.92 1.01 -0.89 -1.71 121.20 128.86 1qsv s ILE 185 Ca 0.39 0.27 -0.20 0.00 0.00 0.00 0.00 60.65 61.10 1qsv s ILE 185 Cb -0.03 -3.99 0.10 0.00 0.01 0.00 0.00 42.46 38.54 1qsv s ILE 185 CO -0.04 -0.27 1.04 0.86 0.00 0.00 0.00 174.94 176.53 1qsv s TRP 186 N 2.42 2.91 -0.76 3.97 -0.00 -1.26 -0.66 118.94 125.56 1qsv s TRP 186 Ca 0.19 -1.00 -0.20 0.00 -0.00 0.00 0.00 56.10 55.08 1qsv s TRP 186 Cb -0.15 -4.28 0.10 0.00 -0.00 0.00 0.00 33.47 29.14 1qsv s TRP 186 CO 0.14 -1.55 0.99 0.34 -0.00 0.00 0.00 176.95 176.86 1qsv s ASP 187 N 3.69 6.37 0.65 5.86 -1.08 -0.53 -4.92 116.67 126.71 1qsv s ASP 187 Ca 0.27 -1.51 0.38 0.00 -0.52 0.00 0.00 52.55 51.18 1qsv s ASP 187 Cb -0.11 -2.39 2.13 0.00 -1.46 0.00 0.00 42.92 41.09 1qsv s ASP 187 CO -0.00 -1.23 2.25 0.77 0.52 0.00 0.00 175.17 177.48 1qsv h SER 188 N 9.19 0.00 -0.45 -0.34 4.64 -1.93 0.21 113.55 124.88 1qsv h SER 188 Ca -0.10 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.07 1qsv h SER 188 Cb 1.05 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.06 1qsv h SER 188 CO 1.13 0.00 0.08 0.54 -0.87 0.00 0.00 176.83 177.71 1qsv n ARG 189 N -3.24 2.68 0.14 4.77 5.12 -1.26 -1.09 116.66 123.77 1qsv n ARG 189 Ca -0.02 -3.03 0.00 0.00 -1.93 0.00 0.00 57.85 52.87 1qsv n ARG 189 Cb 0.16 -1.94 0.00 0.00 -1.16 0.00 0.00 32.46 29.52 1qsv n ARG 189 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1qsv n LYS 190 N -0.69 0.00 -3.99 5.56 4.81 -0.35 -5.01 118.16 118.49 1qsv n LYS 190 Ca 0.32 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 1qsv n LYS 190 Cb 1.10 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.15 1qsv n LYS 190 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1qsv n GLY 191 N 0.45 -1.29 3.58 3.14 0.00 0.60 -4.15 105.19 107.51 1qsv n GLY 191 Ca 0.00 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 1qsv n GLY 191 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1qsv s PHE 192 N -3.00 3.13 -0.74 1.61 0.08 -0.71 -1.45 117.98 116.91 1qsv s PHE 192 Ca 0.00 0.45 -0.21 0.00 0.12 0.00 0.00 56.93 57.29 1qsv s PHE 192 Cb 0.00 -3.29 0.09 0.00 -0.57 0.00 0.00 43.02 39.25 1qsv s PHE 192 CO 0.00 -0.69 0.99 0.42 -0.10 0.00 0.00 175.22 175.84 1qsv s ILE 193 N 2.93 4.49 -1.24 0.64 1.01 0.16 -1.21 121.20 127.99 1qsv s ILE 193 Ca 0.28 -0.79 -0.20 0.00 0.00 0.00 0.00 60.65 59.94 1qsv s ILE 193 Cb -0.14 -4.70 0.01 0.00 0.01 0.00 0.00 42.46 37.64 1qsv s ILE 193 CO 0.16 -1.44 1.81 -0.63 0.00 0.00 0.00 174.94 174.84 1qsv s ILE 194 N 3.52 3.88 0.39 2.92 -1.09 0.07 -2.10 121.20 128.79 1qsv s ILE 194 Ca 0.24 -1.46 0.09 0.00 -2.23 0.00 0.00 60.65 57.29 1qsv s ILE 194 Cb -0.14 -4.93 0.31 0.00 -1.58 0.00 0.00 42.46 36.12 1qsv s ILE 194 CO 0.04 -1.61 1.96 0.77 -1.23 0.00 0.00 174.94 174.87 1qsv h SER 195 N 8.56 0.55 -4.13 3.58 4.64 -1.42 -1.71 113.55 123.61 1qsv h SER 195 Ca 0.34 0.01 -0.64 0.00 -0.47 0.00 0.00 61.79 61.03 1qsv h SER 195 Cb 0.90 -0.11 -0.40 0.00 -0.31 0.00 0.00 62.40 62.48 1qsv h SER 195 CO 1.36 0.34 -0.58 0.21 -0.87 0.00 0.00 176.83 177.30 1qsv s ASN 196 N -6.20 4.53 0.42 4.97 2.47 -1.26 -2.69 114.94 117.18 1qsv s ASN 196 Ca -0.09 -3.16 -0.25 0.00 0.42 0.00 0.00 52.86 49.79 1qsv s ASN 196 Cb 0.20 -1.67 -0.08 0.00 -1.45 0.00 0.00 41.25 38.24 1qsv s ASN 196 CO 0.76 -0.22 1.19 0.00 -3.72 0.00 0.00 177.10 175.11 1qsv s ALA 197 N -0.49 3.12 0.18 1.71 0.00 -0.50 -4.89 121.76 120.89 1qsv s ALA 197 Ca 0.19 0.99 -0.00 0.00 0.00 0.00 0.00 51.96 53.14 1qsv s ALA 197 Cb -0.21 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 1qsv s ALA 197 CO -0.03 -0.60 0.08 0.95 0.00 0.00 0.00 175.76 176.15 1qsv s THR 198 N -1.43 0.23 0.32 0.00 -4.23 -1.26 -0.93 115.64 108.34 1qsv s THR 198 Ca 0.59 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 1qsv s THR 198 Cb -0.31 -2.30 0.22 0.00 1.34 0.00 0.00 72.50 71.45 1qsv s THR 198 CO 0.39 -0.24 1.94 0.10 -0.54 0.00 0.00 174.62 176.27 1qsv h TYR 199 N 2.68 0.83 -0.89 3.99 -0.00 -1.97 -1.11 116.97 120.50 1qsv h TYR 199 Ca -0.36 -0.01 0.14 0.00 -0.00 0.00 0.00 58.73 58.50 1qsv h TYR 199 Cb 1.22 -0.27 -0.09 0.00 -0.00 0.00 0.00 36.73 37.59 1qsv h TYR 199 CO 0.42 0.59 0.49 0.87 -0.00 0.00 0.00 178.16 180.53 1qsv h LYS 200 N 0.85 0.68 0.00 0.10 1.79 -2.02 -2.10 116.57 115.89 1qsv h LYS 200 Ca 0.22 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 1qsv h LYS 200 Cb 0.04 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.54 1qsv h LYS 200 CO -0.03 0.45 0.00 0.39 -1.08 0.00 0.00 179.45 179.18 1qsv n GLU 201 N -4.81 0.98 -2.29 3.15 1.02 -0.43 -4.65 120.64 113.61 1qsv n GLU 201 Ca 0.18 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.89 1qsv n GLU 201 Cb 0.43 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.36 1qsv n GLU 201 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1qsv s ILE 202 N -2.00 3.83 -4.60 -3.67 1.01 -0.79 -4.82 121.20 110.16 1qsv s ILE 202 Ca 0.44 0.84 0.00 0.00 0.00 0.00 0.00 60.65 61.93 1qsv s ILE 202 Cb 0.20 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.55 1qsv s ILE 202 CO 0.34 -0.72 0.00 0.61 0.00 0.00 0.00 174.94 175.17 1qsv n GLY 203 N 5.15 -0.72 3.43 6.18 0.00 -0.68 -5.01 105.19 113.55 1qsv n GLY 203 Ca 0.17 -1.11 -0.44 0.00 0.00 0.00 0.00 46.02 44.65 1qsv n GLY 203 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qsv s LEU 204 N 0.00 4.93 0.35 0.99 2.96 -1.26 -0.92 118.68 125.72 1qsv s LEU 204 Ca 0.00 -1.03 -0.06 0.00 -0.22 0.00 0.00 54.13 52.82 1qsv s LEU 204 Cb 0.00 -2.44 -0.05 0.00 0.50 0.00 0.00 46.19 44.20 1qsv s LEU 204 CO 0.00 -1.08 0.64 -0.76 -1.32 0.00 0.00 176.35 173.84 1qsv s LEU 205 N 2.99 3.95 -0.21 -0.68 1.02 -0.25 -1.28 118.68 124.22 1qsv s LEU 205 Ca 0.17 0.85 -0.04 0.00 0.02 0.00 0.00 54.13 55.12 1qsv s LEU 205 Cb -0.20 -3.70 0.11 0.00 0.02 0.00 0.00 46.19 42.41 1qsv s LEU 205 CO 0.11 -0.30 0.34 -0.89 0.02 0.00 0.00 176.35 175.63 1qsv s THR 206 N -2.24 -0.54 0.19 5.49 2.01 -0.29 -1.11 115.64 119.16 1qsv s THR 206 Ca 0.46 0.04 -0.29 0.00 0.31 0.00 0.00 61.69 62.21 1qsv s THR 206 Cb -0.10 -0.69 -0.08 0.00 0.01 0.00 0.00 72.50 71.63 1qsv s THR 206 CO 0.32 -0.05 0.91 0.00 -0.69 0.00 0.00 174.62 175.11 1qsv s GLU 208 N -0.89 0.99 -0.01 0.00 2.02 -0.07 -1.55 118.70 119.19 1qsv s GLU 208 Ca 0.41 -0.36 -0.22 0.00 0.02 0.00 0.00 54.97 54.83 1qsv s GLU 208 Cb -0.25 -0.93 0.04 0.00 0.10 0.00 0.00 34.13 33.10 1qsv s GLU 208 CO 0.30 0.17 0.47 0.00 0.02 0.00 0.00 175.26 176.23 1qsv s ALA 209 N 0.01 -1.21 -0.01 5.21 0.00 -0.83 -1.29 121.76 123.64 1qsv s ALA 209 Ca -0.00 0.68 0.04 0.00 0.00 0.00 0.00 51.96 52.68 1qsv s ALA 209 Cb -0.07 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 1qsv s ALA 209 CO 0.00 -0.36 -0.13 0.99 0.00 0.00 0.00 175.76 176.26 1qsv s THR 210 N -1.62 1.03 -0.02 0.00 2.01 -1.26 -0.53 115.64 115.24 1qsv s THR 210 Ca -0.10 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.38 1qsv s THR 210 Cb -0.02 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.63 1qsv s THR 210 CO 0.04 0.29 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.48 1qsv s VAL 211 N -0.24 0.81 0.00 3.82 1.01 -0.86 -4.98 120.40 119.95 1qsv s VAL 211 Ca 0.04 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1qsv s VAL 211 Cb -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 36.38 35.62 1qsv s VAL 211 CO -0.00 0.25 0.00 0.59 0.00 0.00 0.00 175.10 175.93 1qsv n ASN 212 N 3.20 0.00 -2.69 3.32 3.02 -1.26 -1.32 115.26 119.52 1qsv n ASN 212 Ca -0.17 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.32 1qsv n ASN 212 Cb 0.55 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.83 1qsv n ASN 212 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qsv n GLY 213 N 0.00 1.56 2.78 7.41 0.00 -1.26 -5.11 105.19 110.58 1qsv n GLY 213 Ca 0.00 -0.24 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 1qsv n GLY 213 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qsv s HIS 214 N -0.18 -0.14 0.33 1.61 5.04 -0.44 -5.15 115.29 116.37 1qsv s HIS 214 Ca 0.19 0.40 -0.26 0.00 -1.54 0.00 0.00 55.06 53.85 1qsv s HIS 214 Cb 0.42 -0.34 -0.09 0.00 0.04 0.00 0.00 32.58 32.60 1qsv s HIS 214 CO -0.09 -0.36 1.00 -1.17 -2.34 0.00 0.00 174.74 171.78 1qsv s LEU 215 N 2.27 4.34 0.06 8.88 2.96 -1.26 -2.04 118.68 133.90 1qsv s LEU 215 Ca 0.04 1.97 0.04 0.00 -0.22 0.00 0.00 54.13 55.96 1qsv s LEU 215 Cb -0.13 -3.97 -0.03 0.00 0.50 0.00 0.00 46.19 42.56 1qsv s LEU 215 CO -0.07 -0.18 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.35 1qsv s TYR 216 N -1.52 1.03 0.05 5.38 1.51 0.30 -4.99 117.35 119.11 1qsv s TYR 216 Ca 0.51 -0.48 -0.03 0.00 -1.01 0.00 0.00 57.07 56.06 1qsv s TYR 216 Cb -0.22 -0.59 -0.03 0.00 -0.11 0.00 0.00 41.96 41.01 1qsv s TYR 216 CO 0.28 0.01 0.03 0.15 -1.11 0.00 0.00 175.55 174.91 1qsv s LYS 217 N -1.71 0.59 -0.22 -0.62 1.02 -1.26 -1.96 119.74 115.58 1qsv s LYS 217 Ca -0.04 -1.00 -0.13 0.00 0.02 0.00 0.00 55.97 54.82 1qsv s LYS 217 Cb -0.10 0.22 0.07 0.00 -0.52 0.00 0.00 37.83 37.50 1qsv s LYS 217 CO 0.02 -0.13 0.54 -0.08 -0.92 0.00 0.00 175.35 174.78 1qsv s THR 218 N -3.28 -0.01 -0.02 2.17 -1.32 -0.60 -4.68 115.64 107.90 1qsv s THR 218 Ca 0.01 0.04 0.02 0.00 -1.21 0.00 0.00 61.69 60.55 1qsv s THR 218 Cb 0.03 -0.79 -0.03 0.00 -1.51 0.00 0.00 72.50 70.19 1qsv s THR 218 CO -0.08 0.02 -0.04 0.20 -2.21 0.00 0.00 174.62 172.51 1qsv s ASN 219 N 1.40 4.85 -0.19 8.08 -0.87 -1.26 -0.88 114.94 126.07 1qsv s ASN 219 Ca -0.09 -0.05 -0.05 0.00 -1.57 0.00 0.00 52.86 51.10 1qsv s ASN 219 Cb -0.07 -1.22 0.07 0.00 -0.02 0.00 0.00 41.25 40.02 1qsv s ASN 219 CO -0.15 0.30 0.13 -0.31 -2.57 0.00 0.00 177.10 174.50 1qsv s TYR 220 N -0.99 0.09 -0.60 2.20 1.51 -0.26 -1.91 117.35 117.38 1qsv s TYR 220 Ca 0.17 -0.23 -0.21 0.00 -1.01 0.00 0.00 57.07 55.78 1qsv s TYR 220 Cb -0.11 -0.63 0.07 0.00 -0.11 0.00 0.00 41.96 41.18 1qsv s TYR 220 CO 0.07 -0.56 0.85 -1.17 -1.11 0.00 0.00 175.55 173.63 1qsv s LEU 221 N 2.18 4.64 -0.89 -1.29 0.20 0.21 -1.09 118.68 122.64 1qsv s LEU 221 Ca 0.04 -0.96 -0.19 0.00 0.69 0.00 0.00 54.13 53.70 1qsv s LEU 221 Cb -0.16 -2.47 0.13 0.00 -0.43 0.00 0.00 46.19 43.26 1qsv s LEU 221 CO -0.12 -1.25 1.09 0.42 -0.29 0.00 0.00 176.35 176.20 1qsv s THR 222 N 3.52 4.71 0.20 3.68 -4.23 -0.10 -1.48 115.64 121.95 1qsv s THR 222 Ca 0.20 -1.46 -0.07 0.00 -1.18 0.00 0.00 61.69 59.19 1qsv s THR 222 Cb -0.18 -4.75 -0.06 0.00 1.34 0.00 0.00 72.50 68.84 1qsv s THR 222 CO 0.11 -1.48 0.47 -1.38 -0.54 0.00 0.00 174.62 171.81 1qsv s HIS 223 N 2.77 3.45 0.57 3.99 -3.43 -0.58 -1.68 115.29 120.39 1qsv s HIS 223 Ca 0.31 0.70 -0.20 0.00 -0.80 0.00 0.00 55.06 55.06 1qsv s HIS 223 Cb -0.07 -2.12 -0.04 0.00 -1.43 0.00 0.00 32.58 28.92 1qsv s HIS 223 CO -0.07 0.33 1.32 -0.98 -2.00 0.00 0.00 174.74 173.33 1qsv s ARG 224 N -2.87 3.00 0.00 -0.38 1.70 -1.26 -0.90 118.95 118.24 1qsv s ARG 224 Ca 0.44 2.13 0.00 0.00 -0.47 0.00 0.00 55.73 57.83 1qsv s ARG 224 Cb -0.11 -2.12 0.00 0.00 -0.57 0.00 0.00 34.95 32.15 1qsv s ARG 224 CO 0.24 -1.27 0.00 0.00 -1.08 0.00 0.00 175.30 173.19 1qsv n GLN 225 N -1.29 -0.72 -2.01 3.89 10.64 -0.50 -4.68 117.38 122.71 1qsv n GLN 225 Ca 0.12 0.00 -0.28 0.00 -1.83 0.00 0.00 57.00 55.01 1qsv n GLN 225 Cb 0.46 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.78 1qsv n GLN 225 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1qsv n THR 226 N -2.13 1.85 -2.79 -0.39 -2.24 -1.26 -4.85 114.28 102.48 1qsv n THR 226 Ca 0.00 -1.91 -0.44 0.00 -2.27 0.00 0.00 64.05 59.43 1qsv n THR 226 Cb 0.00 -2.17 0.00 0.00 -2.10 0.00 0.00 70.33 66.06 1qsv n THR 226 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1qsv n ASN 227 N 14.33 5.18 -3.27 3.42 3.02 -1.26 -4.90 115.26 131.78 1qsv n ASN 227 Ca 0.45 -3.01 -0.38 0.00 -0.03 0.00 0.00 54.58 51.62 1qsv n ASN 227 Cb 0.46 -1.56 -0.03 0.00 -0.61 0.00 0.00 39.78 38.04 1qsv n ASN 227 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1qsv n THR 228 N 4.37 4.43 1.11 3.41 -2.24 -1.26 -5.24 114.28 118.86 1qsv n THR 228 Ca 0.38 -2.86 0.09 0.00 -2.27 0.00 0.00 64.05 59.39 1qsv n THR 228 Cb 0.41 -2.47 0.53 0.00 -2.10 0.00 0.00 70.33 66.69 1qsv n THR 228 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50