#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 -1.06 -0.93 6.43 3.58 -1.96 -0.38 116.42 122.10 1qsv h ASP 130 Ca 0.00 0.04 -0.74 0.00 0.42 0.00 0.00 57.03 56.76 1qsv h ASP 130 Cb 0.00 0.29 -0.11 0.00 1.72 0.00 0.00 39.33 41.23 1qsv h ASP 130 CO 0.00 -0.72 2.46 0.35 -2.88 0.00 0.00 179.24 178.46 1qsv n THR 131 N -5.25 4.24 0.00 2.25 -2.24 -1.26 -4.32 114.28 107.70 1qsv n THR 131 Ca -0.14 -3.94 0.00 0.00 -2.27 0.00 0.00 64.05 57.70 1qsv n THR 131 Cb 0.47 -2.40 0.00 0.00 -2.10 0.00 0.00 70.33 66.30 1qsv n THR 131 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qsv n GLY 132 N 3.02 -2.29 3.60 3.38 0.00 -1.18 -5.14 105.19 106.59 1qsv n GLY 132 Ca 0.48 0.76 -0.00 0.00 0.00 0.00 0.00 46.02 47.26 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 -0.57 0.25 0.04 1.61 3.52 -0.16 -5.02 118.95 118.61 1qsv s ARG 133 Ca 0.00 0.45 -0.20 0.00 -0.13 0.00 0.00 55.73 55.86 1qsv s ARG 133 Cb 0.00 0.09 -0.16 0.00 -1.56 0.00 0.00 34.95 33.32 1qsv s ARG 133 CO 0.00 -0.06 1.29 -1.00 -0.81 0.00 0.00 175.30 174.72 1qsv h PRO 134 N 5.96 0.41 -7.00 5.12 0.13 -1.86 -1.21 132.00 133.56 1qsv h PRO 134 Ca -0.26 -0.27 -0.53 0.00 -0.87 0.00 0.00 66.00 64.08 1qsv h PRO 134 Cb 1.17 0.03 0.10 0.00 0.13 0.00 0.00 31.00 32.43 1qsv h PRO 134 CO 0.19 0.87 0.60 -0.06 -0.23 0.00 0.00 178.00 179.37 1qsv s PHE 135 N -4.01 2.61 -0.07 1.56 0.08 -1.26 -1.80 117.98 115.09 1qsv s PHE 135 Ca -0.14 1.40 -0.25 0.00 0.12 0.00 0.00 56.93 58.07 1qsv s PHE 135 Cb 0.05 -3.68 -0.26 0.00 -0.57 0.00 0.00 43.02 38.55 1qsv s PHE 135 CO 0.78 -2.34 0.93 0.28 -0.10 0.00 0.00 175.22 174.76 1qsv h VAL 136 N 1.99 1.60 -4.20 -0.44 2.07 -1.62 -3.45 116.25 112.20 1qsv h VAL 136 Ca -0.50 -2.23 -0.54 0.00 0.82 0.00 0.00 66.70 64.24 1qsv h VAL 136 Cb 1.27 3.05 -0.27 0.00 -1.52 0.00 0.00 31.29 33.82 1qsv h VAL 136 CO 0.60 0.61 -0.83 -1.83 0.02 0.00 0.00 177.57 176.14 1qsv s GLU 137 N -2.69 1.32 0.10 1.57 1.03 -1.26 -5.11 118.70 113.65 1qsv s GLU 137 Ca -0.16 -0.81 -0.01 0.00 0.03 0.00 0.00 54.97 54.03 1qsv s GLU 137 Cb -0.00 -1.36 -0.04 0.00 -0.80 0.00 0.00 34.13 31.93 1qsv s GLU 137 CO 0.76 0.35 0.02 0.00 -1.33 0.00 0.00 175.26 175.06 1qsv s MET 138 N -0.92 0.79 0.74 -4.83 0.23 -1.26 -4.73 119.30 109.32 1qsv s MET 138 Ca 0.06 -1.34 -0.14 0.00 -1.03 0.00 0.00 55.69 53.24 1qsv s MET 138 Cb -0.08 0.22 0.05 0.00 -1.53 0.00 0.00 34.83 33.49 1qsv s MET 138 CO 0.01 -0.19 1.16 1.52 -2.03 0.00 0.00 175.02 175.49 1qsv s TYR 139 N -3.99 2.17 -0.01 3.16 1.13 -1.26 -5.02 117.35 113.53 1qsv s TYR 139 Ca 0.17 1.61 -0.00 0.00 -1.41 0.00 0.00 57.07 57.44 1qsv s TYR 139 Cb 0.08 -3.34 -0.00 0.00 -1.10 0.00 0.00 41.96 37.59 1qsv s TYR 139 CO -0.03 -2.35 -0.00 1.03 -2.51 0.00 0.00 175.55 171.69 1qsv h SER 140 N -0.52 0.00 0.00 -0.18 0.87 -1.96 -3.49 113.55 108.27 1qsv h SER 140 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1qsv h SER 140 Cb 1.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1qsv h SER 140 CO 0.50 0.05 0.00 -0.62 -0.53 0.00 0.00 176.83 176.23 1qsv n GLU 141 N -2.32 0.00 -2.49 2.24 1.02 -1.26 -5.07 120.64 112.76 1qsv n GLU 141 Ca -0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1qsv n GLU 141 Cb 0.01 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.40 1qsv n GLU 141 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1qsv s ILE 142 N -2.00 4.29 0.49 -3.67 1.01 -1.26 -5.01 121.20 115.05 1qsv s ILE 142 Ca 0.00 1.63 -0.21 0.00 0.00 0.00 0.00 60.65 62.07 1qsv s ILE 142 Cb 0.00 -4.04 -0.10 0.00 0.01 0.00 0.00 42.46 38.33 1qsv s ILE 142 CO 0.00 0.05 0.73 -2.65 0.00 0.00 0.00 174.94 173.07 1qsv n PRO 143 N 4.70 0.82 -2.01 2.79 -0.02 -1.26 -4.88 135.00 135.14 1qsv n PRO 143 Ca 0.10 0.30 -0.43 0.00 -2.02 0.00 0.00 63.50 61.45 1qsv n PRO 143 Cb 0.47 -1.80 -0.03 0.00 -0.02 0.00 0.00 33.50 32.12 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 -2.01 3.98 -0.80 -0.52 2.12 -0.88 -4.64 118.70 115.96 1qsv s GLU 144 Ca 0.67 2.01 -0.25 0.00 0.36 0.00 0.00 54.97 57.75 1qsv s GLU 144 Cb -0.52 -4.03 0.04 0.00 0.26 0.00 0.00 34.13 29.88 1qsv s GLU 144 CO 0.55 -1.09 1.28 0.42 -0.54 0.00 0.00 175.26 175.88 1qsv s ILE 145 N 4.73 3.86 -0.43 -3.70 -1.09 -1.26 -0.79 121.20 122.51 1qsv s ILE 145 Ca 0.75 0.02 -0.22 0.00 -2.23 0.00 0.00 60.65 58.96 1qsv s ILE 145 Cb -0.31 -4.92 0.02 0.00 -1.58 0.00 0.00 42.46 35.67 1qsv s ILE 145 CO 0.30 -1.83 0.72 -0.63 -1.23 0.00 0.00 174.94 172.28 1qsv s ILE 146 N 5.31 4.74 -1.27 2.92 1.01 -0.21 -4.95 121.20 128.75 1qsv s ILE 146 Ca 0.36 0.36 -0.19 0.00 0.00 0.00 0.00 60.65 61.19 1qsv s ILE 146 Cb -0.07 -4.25 0.07 0.00 0.01 0.00 0.00 42.46 38.21 1qsv s ILE 146 CO 0.08 -0.62 1.70 -1.00 0.00 0.00 0.00 174.94 175.10 1qsv s HIS 147 N 3.07 2.76 0.73 3.97 3.76 -1.26 -0.90 115.29 127.41 1qsv s HIS 147 Ca 0.27 -1.54 -0.03 0.00 -0.15 0.00 0.00 55.06 53.61 1qsv s HIS 147 Cb -0.13 -4.75 0.12 0.00 1.11 0.00 0.00 32.58 28.93 1qsv s HIS 147 CO 0.20 -1.82 1.01 0.00 -0.85 0.00 0.00 174.74 173.28 1qsv s MET 148 N 4.30 1.70 -0.07 1.40 0.23 -0.02 -4.63 119.30 122.21 1qsv s MET 148 Ca 0.53 -0.89 -0.08 0.00 -1.03 0.00 0.00 55.69 54.21 1qsv s MET 148 Cb 0.03 -2.27 0.02 0.00 -1.53 0.00 0.00 34.83 31.09 1qsv s MET 148 CO 0.06 -1.46 0.23 0.99 -2.03 0.00 0.00 175.02 172.80 1qsv s THR 149 N -3.21 0.02 0.53 3.16 2.01 -1.26 -0.89 115.64 116.00 1qsv s THR 149 Ca 0.66 -0.13 -0.22 0.00 0.31 0.00 0.00 61.69 62.31 1qsv s THR 149 Cb -0.06 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 72.03 1qsv s THR 149 CO 0.45 -0.07 1.30 -1.61 -0.69 0.00 0.00 174.62 174.00 1qsv s GLU 150 N -0.18 3.25 0.00 4.92 0.41 -1.18 -3.01 118.70 122.91 1qsv s GLU 150 Ca -0.03 2.10 0.00 0.00 -0.41 0.00 0.00 54.97 56.63 1qsv s GLU 150 Cb -0.03 -2.25 0.00 0.00 -1.78 0.00 0.00 34.13 30.07 1qsv s GLU 150 CO 0.01 -1.06 0.00 0.41 -0.49 0.00 0.00 175.26 174.13 1qsv n GLY 151 N 0.65 2.59 3.94 -1.39 0.00 -0.12 -4.87 105.19 106.00 1qsv n GLY 151 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1qsv n GLY 151 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qsv s ARG 152 N -0.17 2.85 -0.80 1.61 1.81 -1.16 -4.35 118.95 118.73 1qsv s ARG 152 Ca 0.00 -0.33 -0.25 0.00 -1.72 0.00 0.00 55.73 53.43 1qsv s ARG 152 Cb 0.00 -2.40 0.00 0.00 -0.45 0.00 0.00 34.95 32.10 1qsv s ARG 152 CO 0.00 -0.60 1.65 -2.00 -0.68 0.00 0.00 175.30 173.67 1qsv s GLU 153 N -4.82 2.96 -0.55 3.54 2.12 -1.11 -1.53 118.70 119.31 1qsv s GLU 153 Ca 0.53 -0.19 -0.22 0.00 0.36 0.00 0.00 54.97 55.45 1qsv s GLU 153 Cb -0.10 -4.70 0.05 0.00 0.26 0.00 0.00 34.13 29.64 1qsv s GLU 153 CO 0.41 -2.63 0.82 -1.17 -0.54 0.00 0.00 175.26 172.15 1qsv s LEU 154 N 7.61 4.52 -0.11 2.70 2.96 -0.17 -4.93 118.68 131.26 1qsv s LEU 154 Ca 0.55 -0.70 -0.20 0.00 -0.22 0.00 0.00 54.13 53.56 1qsv s LEU 154 Cb -0.07 -2.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1qsv s LEU 154 CO 0.08 -1.13 0.56 -0.69 -1.32 0.00 0.00 176.35 173.85 1qsv s VAL 155 N 3.42 5.13 -0.51 1.68 1.01 -1.26 -0.99 120.40 128.88 1qsv s VAL 155 Ca 0.23 1.14 -0.12 0.00 0.00 0.00 0.00 61.98 63.23 1qsv s VAL 155 Cb -0.16 -3.90 0.13 0.00 0.00 0.00 0.00 36.38 32.44 1qsv s VAL 155 CO 0.15 0.28 0.42 -0.63 0.00 0.00 0.00 175.10 175.32 1qsv s ILE 156 N 0.79 4.62 -1.15 2.22 -1.09 -0.52 -4.92 121.20 121.15 1qsv s ILE 156 Ca 0.30 -1.72 -0.21 0.00 -2.23 0.00 0.00 60.65 56.80 1qsv s ILE 156 Cb -0.16 -4.01 0.06 0.00 -1.58 0.00 0.00 42.46 36.77 1qsv s ILE 156 CO 0.13 -0.82 1.60 -2.16 -1.23 0.00 0.00 174.94 172.45 1qsv s PRO 157 N 1.40 3.76 -0.35 2.79 0.04 -1.26 -1.83 135.00 139.55 1qsv s PRO 157 Ca 0.05 -1.53 0.14 0.00 0.04 0.00 0.00 61.00 59.70 1qsv s PRO 157 Cb -0.27 -5.44 0.45 0.00 0.04 0.00 0.00 34.50 29.28 1qsv s PRO 157 CO 0.00 -2.26 1.03 0.00 0.04 0.00 0.00 177.00 175.82 1qsv s ARG 159 N -3.36 2.33 0.09 0.00 1.70 -1.26 -4.89 118.95 113.56 1qsv s ARG 159 Ca 0.35 1.37 0.09 0.00 -0.47 0.00 0.00 55.73 57.07 1qsv s ARG 159 Cb 0.42 -1.89 -0.03 0.00 -0.57 0.00 0.00 34.95 32.88 1qsv s ARG 159 CO -0.04 -1.61 -0.24 0.14 -1.08 0.00 0.00 175.30 172.47 1qsv s VAL 160 N -2.54 1.96 0.15 4.99 -7.23 -0.45 -1.60 120.40 115.69 1qsv s VAL 160 Ca 0.66 -1.51 -0.17 0.00 -1.81 0.00 0.00 61.98 59.15 1qsv s VAL 160 Cb -0.20 -1.73 0.03 0.00 0.56 0.00 0.00 36.38 35.03 1qsv s VAL 160 CO 0.49 0.13 1.73 0.71 -0.31 0.00 0.00 175.10 177.85 1qsv h THR 161 N 4.11 0.81 -3.74 5.32 1.35 -1.66 -3.38 112.91 115.73 1qsv h THR 161 Ca -0.47 -0.06 -0.69 0.00 -0.55 0.00 0.00 66.41 64.65 1qsv h THR 161 Cb 1.16 0.63 -0.32 0.00 -1.73 0.00 0.00 68.15 67.90 1qsv h THR 161 CO 0.41 0.03 -0.67 -0.44 -0.25 0.00 0.00 175.52 174.60 1qsv s SER 162 N -5.29 5.02 0.49 5.36 0.01 -1.26 -5.00 113.70 113.02 1qsv s SER 162 Ca -0.13 -1.27 0.32 0.00 1.31 0.00 0.00 55.95 56.18 1qsv s SER 162 Cb 0.12 -1.76 1.43 0.00 0.21 0.00 0.00 66.02 66.03 1qsv s SER 162 CO 0.71 -0.29 1.73 -0.65 0.41 0.00 0.00 173.24 175.15 1qsv h PRO 163 N 8.06 0.12 -0.99 12.44 0.11 -1.91 -1.54 132.00 148.29 1qsv h PRO 163 Ca -0.21 -0.01 0.22 0.00 0.11 0.00 0.00 66.00 66.11 1qsv h PRO 163 Cb 1.07 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.06 1qsv h PRO 163 CO 0.56 0.08 0.62 -0.91 -0.21 0.00 0.00 178.00 178.14 1qsv h ASN 164 N 0.12 0.58 -0.31 -2.05 4.21 -1.95 -2.52 115.58 113.67 1qsv h ASN 164 Ca 0.67 0.08 0.07 0.00 1.21 0.00 0.00 56.30 58.33 1qsv h ASN 164 Cb 2.30 -0.02 -0.07 0.00 -1.12 0.00 0.00 38.32 39.41 1qsv h ASN 164 CO -0.17 0.19 -0.18 0.40 -1.29 0.00 0.00 177.43 176.38 1qsv h ILE 165 N 0.56 0.48 -3.52 2.81 2.04 -1.70 -3.48 117.51 114.69 1qsv h ILE 165 Ca 0.56 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.42 1qsv h ILE 165 Cb 1.15 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1qsv h ILE 165 CO -0.30 0.00 -0.59 0.41 0.00 0.00 0.00 178.15 177.67 1qsv n THR 166 N -5.35 -8.92 -3.26 -0.27 -1.04 -0.95 -4.97 114.28 89.51 1qsv n THR 166 Ca 0.01 1.94 -0.31 0.00 -2.04 0.00 0.00 64.05 63.64 1qsv n THR 166 Cb 0.26 -4.75 -0.05 0.00 -1.82 0.00 0.00 70.33 63.97 1qsv n THR 166 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1qsv s VAL 167 N -0.35 4.88 -0.20 12.58 1.01 -1.26 -4.88 120.40 132.18 1qsv s VAL 167 Ca 0.00 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.45 1qsv s VAL 167 Cb 0.00 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1qsv s VAL 167 CO 0.00 -0.21 -0.07 -0.89 0.00 0.00 0.00 175.10 173.93 1qsv s THR 168 N -1.99 3.21 -0.70 3.92 2.01 -0.32 -4.98 115.64 116.80 1qsv s THR 168 Ca 0.48 -0.56 -0.21 0.00 0.31 0.00 0.00 61.69 61.72 1qsv s THR 168 Cb -0.11 -2.44 0.09 0.00 0.01 0.00 0.00 72.50 70.05 1qsv s THR 168 CO 0.24 0.45 0.95 -0.22 -0.69 0.00 0.00 174.62 175.35 1qsv s LEU 169 N 1.29 4.68 0.68 4.42 2.96 -1.26 -1.18 118.68 130.27 1qsv s LEU 169 Ca 0.03 -1.26 -0.02 0.00 -0.22 0.00 0.00 54.13 52.67 1qsv s LEU 169 Cb -0.14 -2.39 0.09 0.00 0.50 0.00 0.00 46.19 44.25 1qsv s LEU 169 CO -0.03 -1.32 0.95 -0.54 -1.32 0.00 0.00 176.35 174.09 1qsv s LYS 170 N 3.57 1.95 -0.03 1.98 -0.14 -0.03 -1.08 119.74 125.96 1qsv s LYS 170 Ca 0.22 -0.86 -0.06 0.00 -1.36 0.00 0.00 55.97 53.91 1qsv s LYS 170 Cb -0.16 -2.33 0.01 0.00 -1.68 0.00 0.00 37.83 33.67 1qsv s LYS 170 CO 0.06 -1.25 0.14 0.21 -0.76 0.00 0.00 175.35 173.74 1qsv s LYS 171 N -5.08 0.33 0.27 1.68 2.20 -0.26 -0.99 119.74 117.88 1qsv s LYS 171 Ca 0.63 -0.11 -0.30 0.00 -0.36 0.00 0.00 55.97 55.83 1qsv s LYS 171 Cb -0.07 0.14 -0.11 0.00 -1.51 0.00 0.00 37.83 36.27 1qsv s LYS 171 CO 0.43 -0.07 1.60 0.12 -0.36 0.00 0.00 175.35 177.08 1qsv s PHE 172 N -0.67 2.80 -0.09 4.03 5.36 -0.52 -0.70 117.98 128.20 1qsv s PHE 172 Ca -0.08 0.72 -0.07 0.00 -0.96 0.00 0.00 56.93 56.55 1qsv s PHE 172 Cb -0.05 -4.06 -0.05 0.00 -0.34 0.00 0.00 43.02 38.53 1qsv s PHE 172 CO 0.01 -3.64 0.24 -1.00 -1.46 0.00 0.00 175.22 169.36 1qsv h PRO 173 N 5.21 -0.12 -0.53 10.12 0.13 -2.01 -3.43 132.00 141.37 1qsv h PRO 173 Ca -0.46 0.01 -0.26 0.00 -0.87 0.00 0.00 66.00 64.41 1qsv h PRO 173 Cb 1.22 0.03 -0.40 0.00 0.13 0.00 0.00 31.00 31.98 1qsv h PRO 173 CO 0.82 0.01 -1.12 1.28 -0.23 0.00 0.00 178.00 178.76 1qsv n LEU 174 N -4.85 1.50 -4.85 1.56 4.77 -1.11 -5.09 117.00 108.93 1qsv n LEU 174 Ca -0.03 -3.16 -0.32 0.00 -0.03 0.00 0.00 56.01 52.48 1qsv n LEU 174 Cb 0.10 0.46 -0.01 0.00 -2.33 0.00 0.00 43.42 41.64 1qsv n LEU 174 CO 0.07 1.14 0.70 -1.81 -1.33 0.00 0.00 177.39 176.16 1qsv s ASP 175 N -3.64 6.39 -0.17 -1.43 1.01 0.12 -4.92 116.67 114.04 1qsv s ASP 175 Ca 0.27 1.52 -0.02 0.00 0.71 0.00 0.00 52.55 55.03 1qsv s ASP 175 Cb 0.35 -2.49 0.05 0.00 1.01 0.00 0.00 42.92 41.83 1qsv s ASP 175 CO -0.03 -0.75 0.00 -0.89 0.21 0.00 0.00 175.17 173.71 1qsv s THR 176 N -2.85 0.71 -1.03 -1.27 2.01 -1.26 -1.11 115.64 110.84 1qsv s THR 176 Ca 0.57 -0.50 -0.17 0.00 0.31 0.00 0.00 61.69 61.91 1qsv s THR 176 Cb -0.11 -1.06 0.15 0.00 0.01 0.00 0.00 72.50 71.50 1qsv s THR 176 CO 0.41 -0.03 1.23 -0.76 -0.69 0.00 0.00 174.62 174.78 1qsv s LEU 177 N 1.79 5.10 0.16 4.42 1.02 -0.24 -5.00 118.68 125.93 1qsv s LEU 177 Ca 0.00 -2.43 -0.31 0.00 0.02 0.00 0.00 54.13 51.41 1qsv s LEU 177 Cb -0.16 -2.39 -0.11 0.00 0.02 0.00 0.00 46.19 43.55 1qsv s LEU 177 CO -0.07 -0.93 1.78 -0.63 0.02 0.00 0.00 176.35 176.52 1qsv s ILE 178 N 2.18 2.35 -1.06 -0.59 -1.09 -1.26 -4.49 121.20 117.24 1qsv s ILE 178 Ca 0.36 0.05 -0.23 0.00 -2.23 0.00 0.00 60.65 58.60 1qsv s ILE 178 Cb -0.04 -3.03 -0.01 0.00 -1.58 0.00 0.00 42.46 37.79 1qsv s ILE 178 CO -0.06 0.00 1.78 -2.16 -1.23 0.00 0.00 174.94 173.27 1qsv s PRO 179 N 2.12 3.05 0.59 2.79 0.04 -1.26 -4.81 135.00 137.52 1qsv s PRO 179 Ca 0.78 -0.99 0.29 0.00 0.04 0.00 0.00 61.00 61.13 1qsv s PRO 179 Cb -0.47 -5.26 1.74 0.00 0.04 0.00 0.00 34.50 30.55 1qsv s PRO 179 CO 0.35 -3.03 2.17 0.38 0.04 0.00 0.00 177.00 176.91 1qsv h ASP 180 N 9.93 0.00 -1.72 6.66 3.04 -1.88 -3.47 116.42 128.98 1qsv h ASP 180 Ca 0.21 0.00 -0.15 0.00 -3.24 0.00 0.00 57.03 53.85 1qsv h ASP 180 Cb 0.97 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 39.27 1qsv h ASP 180 CO 1.31 0.00 -0.22 0.61 -2.04 0.00 0.00 179.24 178.91 1qsv n GLY 181 N -1.36 0.19 1.91 7.15 0.00 -0.36 -4.88 105.19 107.84 1qsv n GLY 181 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.89 0.00 -0.12 1.61 5.02 -1.26 -4.90 118.16 116.61 1qsv n LYS 182 Ca -0.06 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.00 1qsv n LYS 182 Cb 0.55 -0.04 -0.08 0.00 -0.02 0.00 0.00 35.03 35.44 1qsv n LYS 182 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1qsv n ARG 183 N -3.37 0.57 -2.93 1.97 0.63 -1.26 -4.77 116.66 107.51 1qsv n ARG 183 Ca 0.00 0.25 -0.44 0.00 -0.92 0.00 0.00 57.85 56.75 1qsv n ARG 183 Cb 0.00 -1.48 -0.02 0.00 0.45 0.00 0.00 32.46 31.41 1qsv n ARG 183 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1qsv s ILE 184 N -2.62 4.75 -0.28 5.15 1.01 -1.26 -1.53 121.20 126.42 1qsv s ILE 184 Ca -0.36 -1.67 -0.15 0.00 0.00 0.00 0.00 60.65 58.47 1qsv s ILE 184 Cb 0.11 -4.79 -0.03 0.00 0.01 0.00 0.00 42.46 37.76 1qsv s ILE 184 CO 0.47 -1.52 0.35 -0.63 0.00 0.00 0.00 174.94 173.61 1qsv s ILE 185 N 2.59 5.19 -0.80 2.92 1.01 -0.49 -1.22 121.20 130.40 1qsv s ILE 185 Ca 0.34 0.44 -0.20 0.00 0.00 0.00 0.00 60.65 61.23 1qsv s ILE 185 Cb -0.05 -3.70 0.10 0.00 0.01 0.00 0.00 42.46 38.83 1qsv s ILE 185 CO -0.09 0.12 1.04 0.86 0.00 0.00 0.00 174.94 176.88 1qsv s TRP 186 N 2.03 2.91 -0.68 3.97 -0.00 -1.26 -0.70 118.94 125.22 1qsv s TRP 186 Ca 0.14 -1.00 -0.21 0.00 -0.00 0.00 0.00 56.10 55.02 1qsv s TRP 186 Cb -0.16 -4.28 0.09 0.00 -0.00 0.00 0.00 33.47 29.12 1qsv s TRP 186 CO 0.10 -1.56 0.92 0.34 -0.00 0.00 0.00 176.95 176.76 1qsv s ASP 187 N 3.69 6.24 0.57 5.86 -1.08 -0.36 -4.92 116.67 126.67 1qsv s ASP 187 Ca 0.27 -1.24 0.29 0.00 -0.52 0.00 0.00 52.55 51.36 1qsv s ASP 187 Cb -0.11 -2.39 1.46 0.00 -1.46 0.00 0.00 42.92 40.43 1qsv s ASP 187 CO -0.00 -1.32 1.89 0.77 0.52 0.00 0.00 175.17 177.03 1qsv h SER 188 N 9.38 0.00 -0.46 -0.34 4.64 -1.94 0.19 113.55 125.03 1qsv h SER 188 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1qsv h SER 188 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1qsv h SER 188 CO 1.15 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 177.65 1qsv n ARG 189 N -3.87 3.71 0.11 4.77 5.12 -1.26 -1.34 116.66 123.91 1qsv n ARG 189 Ca 0.11 -2.87 0.00 0.00 -1.93 0.00 0.00 57.85 53.16 1qsv n ARG 189 Cb 0.75 -1.93 0.00 0.00 -1.16 0.00 0.00 32.46 30.12 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 0.32 0.00 -3.85 5.56 4.81 -0.49 -5.01 118.16 119.49 1qsv n LYS 190 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 1qsv n LYS 190 Cb 0.94 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.99 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 0.78 -1.33 3.54 3.14 0.00 0.56 -4.21 105.19 107.67 1qsv n GLY 191 Ca 0.00 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.43 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 3.02 -0.77 1.61 0.40 -0.76 -1.23 117.98 117.26 1qsv s PHE 192 Ca 0.00 0.16 -0.19 0.00 -0.60 0.00 0.00 56.93 56.30 1qsv s PHE 192 Cb 0.00 -3.56 0.12 0.00 0.51 0.00 0.00 43.02 40.10 1qsv s PHE 192 CO 0.00 -0.93 0.93 0.42 0.70 0.00 0.00 175.22 176.34 1qsv s ILE 193 N 3.15 4.80 -0.82 0.64 1.01 0.13 -1.44 121.20 128.68 1qsv s ILE 193 Ca 0.28 -1.31 -0.23 0.00 0.00 0.00 0.00 60.65 59.39 1qsv s ILE 193 Cb -0.13 -4.64 0.07 0.00 0.01 0.00 0.00 42.46 37.77 1qsv s ILE 193 CO 0.21 -1.32 1.20 -0.63 0.00 0.00 0.00 174.94 174.39 1qsv s ILE 194 N 2.59 4.14 0.36 2.92 1.09 -0.16 -1.39 121.20 130.75 1qsv s ILE 194 Ca 0.23 -0.49 0.10 0.00 -1.10 0.00 0.00 60.65 59.39 1qsv s ILE 194 Cb -0.13 -4.86 0.33 0.00 -1.06 0.00 0.00 42.46 36.74 1qsv s ILE 194 CO -0.01 -1.69 1.86 0.77 -0.10 0.00 0.00 174.94 175.76 1qsv h SER 195 N 9.60 0.63 -3.28 3.58 4.64 -1.53 -0.43 113.55 126.76 1qsv h SER 195 Ca -0.08 0.05 -0.60 0.00 -0.47 0.00 0.00 61.79 60.69 1qsv h SER 195 Cb 1.04 -0.08 -0.40 0.00 -0.31 0.00 0.00 62.40 62.66 1qsv h SER 195 CO 1.25 0.30 -0.75 0.20 -0.87 0.00 0.00 176.83 176.96 1qsv s ASN 196 N -5.71 3.91 0.39 4.97 -0.87 -1.24 -2.75 114.94 113.64 1qsv s ASN 196 Ca -0.10 -2.02 -0.27 0.00 -1.57 0.00 0.00 52.86 48.90 1qsv s ASN 196 Cb 0.22 -0.95 -0.10 0.00 -0.02 0.00 0.00 41.25 40.40 1qsv s ASN 196 CO 0.79 -0.36 1.45 0.00 -2.57 0.00 0.00 177.10 176.41 1qsv s ALA 197 N 1.14 3.47 0.41 0.60 0.00 -0.58 -4.68 121.76 122.11 1qsv s ALA 197 Ca 0.13 1.51 0.05 0.00 0.00 0.00 0.00 51.96 53.65 1qsv s ALA 197 Cb -0.20 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.31 1qsv s ALA 197 CO -0.15 -1.05 0.19 0.95 0.00 0.00 0.00 175.76 175.70 1qsv s THR 198 N -1.15 0.35 0.51 0.00 -4.23 -1.26 -0.94 115.64 108.92 1qsv s THR 198 Ca 0.55 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.30 1qsv s THR 198 Cb -0.45 -2.33 0.39 0.00 1.34 0.00 0.00 72.50 71.46 1qsv s THR 198 CO 0.60 0.00 1.98 0.10 -0.54 0.00 0.00 174.62 176.76 1qsv h TYR 199 N 1.81 0.07 -0.01 3.99 -0.00 -1.96 -0.03 116.97 120.85 1qsv h TYR 199 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.42 1qsv h TYR 199 Cb 1.26 -0.02 -0.00 0.00 -0.00 0.00 0.00 36.73 37.97 1qsv h TYR 199 CO 1.77 0.03 0.06 0.87 -0.00 0.00 0.00 178.16 180.89 1qsv h LYS 200 N 0.06 0.00 -0.67 0.10 1.79 -2.00 -1.23 116.57 114.63 1qsv h LYS 200 Ca 0.28 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.28 1qsv h LYS 200 Cb 1.02 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 31.35 1qsv h LYS 200 CO -0.02 0.00 -0.39 0.39 -1.08 0.00 0.00 179.45 178.35 1qsv n GLU 201 N -3.14 3.02 -4.00 3.15 4.71 -0.03 -4.89 120.64 119.47 1qsv n GLU 201 Ca -0.03 -3.80 -0.31 0.00 -0.01 0.00 0.00 57.16 53.01 1qsv n GLU 201 Cb 0.13 -2.16 -0.15 0.00 -1.01 0.00 0.00 31.44 28.26 1qsv n GLU 201 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1qsv s ILE 202 N -4.32 2.19 -4.82 -3.67 1.01 -0.46 -4.78 121.20 106.34 1qsv s ILE 202 Ca 0.51 -2.26 0.00 0.00 0.00 0.00 0.00 60.65 58.90 1qsv s ILE 202 Cb 0.42 -2.61 0.00 0.00 0.01 0.00 0.00 42.46 40.28 1qsv s ILE 202 CO 0.02 -0.58 0.00 0.61 0.00 0.00 0.00 174.94 174.98 1qsv n GLY 203 N 4.29 -0.94 3.45 6.18 0.00 -1.19 -5.00 105.19 111.99 1qsv n GLY 203 Ca 0.03 -1.16 -0.44 0.00 0.00 0.00 0.00 46.02 44.45 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 4.94 0.54 0.99 2.96 -1.26 -1.15 118.68 125.69 1qsv s LEU 204 Ca 0.00 -1.87 -0.18 0.00 -0.22 0.00 0.00 54.13 51.87 1qsv s LEU 204 Cb 0.00 -2.40 -0.06 0.00 0.50 0.00 0.00 46.19 44.23 1qsv s LEU 204 CO 0.00 -1.13 1.04 -0.76 -1.32 0.00 0.00 176.35 174.18 1qsv s LEU 205 N 2.92 3.65 -0.23 -0.68 1.02 -0.23 -1.44 118.68 123.69 1qsv s LEU 205 Ca 0.31 1.81 -0.04 0.00 0.02 0.00 0.00 54.13 56.23 1qsv s LEU 205 Cb -0.07 -4.54 0.10 0.00 0.02 0.00 0.00 46.19 41.70 1qsv s LEU 205 CO -0.06 -0.92 0.19 -0.89 0.02 0.00 0.00 176.35 174.69 1qsv s THR 206 N -2.31 -0.23 0.12 5.49 2.01 -0.16 -1.14 115.64 119.42 1qsv s THR 206 Ca 0.64 -0.34 -0.30 0.00 0.31 0.00 0.00 61.69 62.00 1qsv s THR 206 Cb -0.15 -0.78 -0.07 0.00 0.01 0.00 0.00 72.50 71.52 1qsv s THR 206 CO 0.29 -0.39 1.17 0.00 -0.69 0.00 0.00 174.62 175.01 1qsv s GLU 208 N 0.38 0.94 -0.23 0.00 2.02 -0.32 -1.42 118.70 120.06 1qsv s GLU 208 Ca 0.55 -0.54 -0.05 0.00 0.02 0.00 0.00 54.97 54.95 1qsv s GLU 208 Cb -0.30 -0.91 0.12 0.00 0.10 0.00 0.00 34.13 33.14 1qsv s GLU 208 CO 0.33 0.24 0.43 0.00 0.02 0.00 0.00 175.26 176.28 1qsv s ALA 209 N -0.49 -1.28 -0.19 5.21 0.00 -0.53 -1.17 121.76 123.31 1qsv s ALA 209 Ca 0.03 1.35 -0.20 0.00 0.00 0.00 0.00 51.96 53.14 1qsv s ALA 209 Cb -0.06 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.47 1qsv s ALA 209 CO 0.00 -1.02 0.60 0.99 0.00 0.00 0.00 175.76 176.33 1qsv s THR 210 N 2.63 5.05 0.00 0.00 2.01 -1.26 -1.15 115.64 122.91 1qsv s THR 210 Ca 0.06 1.13 0.00 0.00 0.31 0.00 0.00 61.69 63.19 1qsv s THR 210 Cb -0.14 -3.92 0.00 0.00 0.01 0.00 0.00 72.50 68.46 1qsv s THR 210 CO -0.15 0.14 0.00 0.52 -0.69 0.00 0.00 174.62 174.44 1qsv n VAL 211 N 4.59 0.00 -1.82 3.82 0.31 -0.63 -4.92 118.33 119.68 1qsv n VAL 211 Ca -0.02 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.92 1qsv n VAL 211 Cb 0.50 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.41 1qsv n VAL 211 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1qsv n ASN 212 N 0.00 8.02 -3.58 4.52 6.94 -1.26 -4.47 115.26 125.43 1qsv n ASN 212 Ca 0.00 -3.03 -0.25 0.00 -0.02 0.00 0.00 54.58 51.27 1qsv n ASN 212 Cb 0.00 -1.39 0.05 0.00 -2.36 0.00 0.00 39.78 36.09 1qsv n ASN 212 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1qsv n GLY 213 N 1.99 -0.53 3.19 4.83 0.00 -1.26 -4.99 105.19 108.42 1qsv n GLY 213 Ca 0.64 0.21 -0.10 0.00 0.00 0.00 0.00 46.02 46.77 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 -3.27 -0.61 -0.33 1.61 5.04 -1.26 -5.13 115.29 111.33 1qsv s HIS 214 Ca 0.56 1.27 -0.26 0.00 -1.54 0.00 0.00 55.06 55.08 1qsv s HIS 214 Cb -0.26 0.20 0.01 0.00 0.04 0.00 0.00 32.58 32.57 1qsv s HIS 214 CO 0.69 -0.39 0.93 -1.17 -2.34 0.00 0.00 174.74 172.46 1qsv s LEU 215 N 2.07 4.01 0.10 8.88 2.96 -1.26 -1.60 118.68 133.83 1qsv s LEU 215 Ca -0.04 0.79 0.01 0.00 -0.22 0.00 0.00 54.13 54.67 1qsv s LEU 215 Cb -0.11 -3.30 -0.04 0.00 0.50 0.00 0.00 46.19 43.24 1qsv s LEU 215 CO -0.11 -0.78 0.22 -0.31 -1.32 0.00 0.00 176.35 174.05 1qsv s TYR 216 N 3.35 3.47 0.16 5.38 1.51 -0.30 -4.98 117.35 125.94 1qsv s TYR 216 Ca 0.39 0.18 -0.12 0.00 -1.01 0.00 0.00 57.07 56.51 1qsv s TYR 216 Cb -0.13 -1.71 0.00 0.00 -0.11 0.00 0.00 41.96 40.02 1qsv s TYR 216 CO 0.15 0.56 0.35 -1.59 -1.11 0.00 0.00 175.55 173.90 1qsv s LYS 217 N -2.78 1.18 -0.19 -0.62 0.00 -1.26 -1.45 119.74 114.62 1qsv s LYS 217 Ca 0.34 -1.04 -0.18 0.00 0.00 0.00 0.00 55.97 55.09 1qsv s LYS 217 Cb -0.12 0.42 0.05 0.00 0.00 0.00 0.00 37.83 38.18 1qsv s LYS 217 CO 0.28 -0.45 0.52 -0.08 0.00 0.00 0.00 175.35 175.61 1qsv s THR 218 N -3.92 -0.00 0.03 3.79 -1.32 -0.50 -4.86 115.64 108.85 1qsv s THR 218 Ca 0.13 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.63 1qsv s THR 218 Cb 0.02 -0.72 -0.04 0.00 -1.51 0.00 0.00 72.50 70.25 1qsv s THR 218 CO -0.03 0.00 0.04 0.20 -2.21 0.00 0.00 174.62 172.62 1qsv s ASN 219 N 0.33 5.33 -0.24 8.08 -0.87 -1.26 -1.04 114.94 125.27 1qsv s ASN 219 Ca -0.00 -0.00 -0.03 0.00 -1.57 0.00 0.00 52.86 51.25 1qsv s ASN 219 Cb -0.04 -1.41 0.10 0.00 -0.02 0.00 0.00 41.25 39.87 1qsv s ASN 219 CO -0.00 0.23 0.18 -0.31 -2.57 0.00 0.00 177.10 174.63 1qsv s TYR 220 N -1.22 -0.02 -0.47 2.20 1.51 -0.29 -2.06 117.35 117.00 1qsv s TYR 220 Ca 0.24 -0.33 -0.25 0.00 -1.01 0.00 0.00 57.07 55.71 1qsv s TYR 220 Cb -0.12 -0.63 0.03 0.00 -0.11 0.00 0.00 41.96 41.13 1qsv s TYR 220 CO 0.15 -0.72 0.93 -1.17 -1.11 0.00 0.00 175.55 173.63 1qsv s LEU 221 N 2.22 4.01 -0.80 -1.29 0.20 0.03 -1.07 118.68 121.98 1qsv s LEU 221 Ca 0.07 0.08 -0.20 0.00 0.69 0.00 0.00 54.13 54.77 1qsv s LEU 221 Cb -0.15 -3.17 0.11 0.00 -0.43 0.00 0.00 46.19 42.54 1qsv s LEU 221 CO -0.24 -1.07 1.03 0.42 -0.29 0.00 0.00 176.35 176.20 1qsv s THR 222 N 3.79 4.60 -0.12 3.68 -4.23 -0.30 -1.04 115.64 122.01 1qsv s THR 222 Ca 0.37 -1.10 -0.20 0.00 -1.18 0.00 0.00 61.69 59.57 1qsv s THR 222 Cb -0.10 -4.72 -0.04 0.00 1.34 0.00 0.00 72.50 68.98 1qsv s THR 222 CO 0.26 -1.45 0.57 -2.28 -0.54 0.00 0.00 174.62 171.18 1qsv s HIS 223 N 3.15 3.49 -0.30 3.99 2.46 -0.08 -3.14 115.29 124.87 1qsv s HIS 223 Ca 0.27 0.99 -0.28 0.00 0.47 0.00 0.00 55.06 56.50 1qsv s HIS 223 Cb -0.11 -2.68 -0.02 0.00 -0.13 0.00 0.00 32.58 29.64 1qsv s HIS 223 CO -0.01 0.06 1.88 0.50 -2.47 0.00 0.00 174.74 174.71 1qsv s ARG 224 N 0.99 3.30 0.48 2.88 3.52 -1.26 -0.84 118.95 128.01 1qsv s ARG 224 Ca 0.30 1.56 -0.24 0.00 -0.13 0.00 0.00 55.73 57.21 1qsv s ARG 224 Cb -0.16 -4.23 -0.07 0.00 -1.56 0.00 0.00 34.95 28.92 1qsv s ARG 224 CO 0.12 -1.90 1.36 0.94 -0.81 0.00 0.00 175.30 175.01 1qsv n GLN 225 N 8.49 1.95 -1.67 5.12 7.27 -0.07 -4.89 117.38 133.59 1qsv n GLN 225 Ca 0.24 0.70 -0.41 0.00 0.07 0.00 0.00 57.00 57.61 1qsv n GLN 225 Cb 0.46 -2.55 -0.01 0.00 2.41 0.00 0.00 30.24 30.56 1qsv n GLN 225 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1qsv n THR 226 N -0.54 3.90 0.04 1.69 -2.24 -1.26 -4.05 114.28 111.82 1qsv n THR 226 Ca 0.07 -3.07 0.00 0.00 -2.27 0.00 0.00 64.05 58.78 1qsv n THR 226 Cb 0.42 -2.56 0.00 0.00 -2.10 0.00 0.00 70.33 66.09 1qsv n THR 226 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1qsv n ASN 227 N 4.87 0.24 -0.35 3.42 6.94 -1.26 -5.16 115.26 123.97 1qsv n ASN 227 Ca 0.60 0.11 0.00 0.00 -0.02 0.00 0.00 54.58 55.27 1qsv n ASN 227 Cb 0.33 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 1qsv n ASN 227 CO 0.00 0.00 0.00 1.07 -1.03 0.00 0.00 177.26 177.30 1qsv n THR 228 N -3.08 0.00 1.18 5.53 5.66 -1.26 -5.25 114.28 117.06 1qsv n THR 228 Ca 0.00 0.00 0.09 0.00 -3.05 0.00 0.00 64.05 61.09 1qsv n THR 228 Cb 0.19 0.00 0.56 0.00 -1.55 0.00 0.00 70.33 69.52 1qsv n THR 228 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02