#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rxr h THR 131 N 0.00 0.00 -0.15 -2.13 1.35 -2.08 -3.24 112.91 106.66 1rxr h THR 131 Ca 0.00 -0.07 -0.47 0.00 -0.55 0.00 0.00 66.41 65.32 1rxr h THR 131 Cb 0.00 0.00 -0.03 0.00 -1.73 0.00 0.00 68.15 66.39 1rxr h THR 131 CO 0.00 0.00 1.85 0.29 -0.25 0.00 0.00 175.52 177.41 1rxr n LYS 132 N -2.64 3.01 -1.63 4.72 5.02 -1.26 -4.95 118.16 120.44 1rxr n LYS 132 Ca -0.02 -1.82 -0.58 0.00 -2.02 0.00 0.00 58.31 53.87 1rxr n LYS 132 Cb 0.07 -2.43 -0.08 0.00 -0.02 0.00 0.00 35.03 32.57 1rxr n LYS 132 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1rxr n HIS 133 N 2.85 1.50 -0.72 2.13 -0.00 -1.23 -4.69 115.22 115.05 1rxr n HIS 133 Ca 0.62 0.80 -0.32 0.00 -0.00 0.00 0.00 57.72 58.82 1rxr n HIS 133 Cb 0.53 -2.29 0.15 0.00 -0.00 0.00 0.00 29.99 28.38 1rxr n HIS 133 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 1rxr n ILE 134 N 3.11 0.00 -1.68 3.57 -5.35 -1.26 -4.52 119.36 113.22 1rxr n ILE 134 Ca 0.23 -0.22 -0.48 0.00 -0.27 0.00 0.00 62.75 62.01 1rxr n ILE 134 Cb 0.10 -0.69 -0.05 0.00 -1.74 0.00 0.00 39.64 37.26 1rxr n ILE 134 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rxr h ALA 136 N 9.04 1.28 0.08 0.00 0.00 -1.16 0.28 119.26 128.79 1rxr h ALA 136 Ca -0.48 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1rxr h ALA 136 Cb 1.27 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1rxr h ALA 136 CO 0.95 -0.28 -0.04 0.82 0.00 0.00 0.00 179.25 180.70 1rxr h ILE 137 N 0.43 1.17 0.00 0.00 2.04 -1.89 -3.41 117.51 115.86 1rxr h ILE 137 Ca 0.50 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 65.23 1rxr h ILE 137 Cb 0.87 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1rxr h ILE 137 CO -0.48 0.27 0.00 0.00 0.00 0.00 0.00 178.15 177.94 1rxr n GLY 139 N 0.23 0.61 3.92 0.00 0.00 0.98 -4.26 105.19 106.66 1rxr n GLY 139 Ca 0.00 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 1rxr n GLY 139 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rxr s ASP 140 N -2.37 4.22 -0.17 1.61 1.01 -1.26 -4.56 116.67 115.14 1rxr s ASP 140 Ca 0.00 0.57 -0.33 0.00 0.71 0.00 0.00 52.55 53.50 1rxr s ASP 140 Cb 0.00 -0.98 -0.10 0.00 1.01 0.00 0.00 42.92 42.86 1rxr s ASP 140 CO 0.00 -2.05 2.05 -1.14 0.21 0.00 0.00 175.17 174.23 1rxr n ARG 141 N -3.35 1.94 -2.07 8.23 3.00 -1.26 -0.64 116.66 122.51 1rxr n ARG 141 Ca 0.10 0.64 -0.39 0.00 -0.00 0.00 0.00 57.85 58.20 1rxr n ARG 141 Cb 0.61 -2.78 -0.01 0.00 0.00 0.00 0.00 32.46 30.28 1rxr n ARG 141 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1rxr s SER 142 N 5.91 6.32 -0.18 6.15 1.04 -1.26 -4.57 113.70 127.11 1rxr s SER 142 Ca 0.98 2.64 0.01 0.00 0.48 0.00 0.00 55.95 60.06 1rxr s SER 142 Cb -0.62 -2.64 -0.22 0.00 0.10 0.00 0.00 66.02 62.65 1rxr s SER 142 CO 0.46 -0.84 0.10 -1.20 0.98 0.00 0.00 173.24 172.74 1rxr n SER 143 N 0.13 1.80 -3.65 7.02 7.64 0.73 -4.90 113.62 122.39 1rxr n SER 143 Ca 0.04 0.05 0.02 0.00 1.01 0.00 0.00 58.87 59.99 1rxr n SER 143 Cb 0.44 -0.45 -0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1rxr n SER 143 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1rxr s GLY 144 N -5.96 -0.37 -1.49 0.23 0.00 -0.62 -5.01 107.32 94.11 1rxr s GLY 144 Ca -0.26 0.60 -0.10 0.00 0.00 0.00 0.00 44.72 44.96 1rxr s GLY 144 CO 0.70 1.22 2.53 1.17 0.00 0.00 0.00 173.10 178.72 1rxr n LYS 145 N -0.57 3.61 -2.47 2.90 4.81 -1.26 -0.70 118.16 124.47 1rxr n LYS 145 Ca -0.06 -2.70 -0.39 0.00 -0.87 0.00 0.00 58.31 54.29 1rxr n LYS 145 Cb 0.62 -2.92 -0.04 0.00 0.02 0.00 0.00 35.03 32.71 1rxr n LYS 145 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1rxr s HIS 146 N 1.66 3.39 -1.22 5.64 3.76 -0.81 -2.66 115.29 125.04 1rxr s HIS 146 Ca 0.57 1.66 0.00 0.00 -0.15 0.00 0.00 55.06 57.14 1rxr s HIS 146 Cb 0.16 -3.24 0.00 0.00 1.11 0.00 0.00 32.58 30.61 1rxr s HIS 146 CO -0.07 -0.69 0.00 0.66 -0.85 0.00 0.00 174.74 173.79 1rxr n TYR 147 N 0.54 -1.23 -1.00 1.40 4.01 -1.26 -0.89 117.16 118.73 1rxr n TYR 147 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 1rxr n TYR 147 Cb 0.47 -2.94 0.00 0.00 -0.31 0.00 0.00 39.34 36.56 1rxr n TYR 147 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1rxr n GLY 148 N -0.78 0.41 2.93 2.72 0.00 -1.09 -0.61 105.19 108.77 1rxr n GLY 148 Ca -0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.70 1rxr n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rxr s VAL 149 N -1.83 0.35 -0.19 1.61 1.01 -0.06 -4.98 120.40 116.31 1rxr s VAL 149 Ca 0.00 -0.16 -0.36 0.00 0.00 0.00 0.00 61.98 61.46 1rxr s VAL 149 Cb 0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 36.38 35.93 1rxr s VAL 149 CO 0.00 0.12 1.91 -1.22 0.00 0.00 0.00 175.10 175.91 1rxr n TYR 150 N 3.19 2.12 -3.91 5.22 4.01 -1.26 -1.93 117.16 124.59 1rxr n TYR 150 Ca -0.15 0.19 -0.09 0.00 -0.16 0.00 0.00 57.90 57.68 1rxr n TYR 150 Cb 0.57 -2.59 -0.06 0.00 -0.31 0.00 0.00 39.34 36.95 1rxr n TYR 150 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1rxr s SER 151 N 4.65 -0.01 0.11 7.72 1.04 0.12 -0.57 113.70 126.75 1rxr s SER 151 Ca 0.98 -0.79 0.05 0.00 0.48 0.00 0.00 55.95 56.67 1rxr s SER 151 Cb -0.82 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 65.72 1rxr s SER 151 CO 0.55 -0.92 -0.01 0.00 0.98 0.00 0.00 173.24 173.85 1rxr h GLU 153 N 3.32 0.05 0.18 0.00 4.39 -1.95 0.15 114.58 120.71 1rxr h GLU 153 Ca -0.48 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.23 1rxr h GLU 153 Cb 1.17 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.79 1rxr h GLU 153 CO 0.59 0.03 -0.24 0.78 -1.16 0.00 0.00 179.01 179.01 1rxr h GLY 154 N 0.05 -0.48 0.99 -3.84 0.00 -1.98 0.71 103.07 98.52 1rxr h GLY 154 Ca 0.63 0.27 -0.02 0.00 0.00 0.00 0.00 47.33 48.22 1rxr h GLY 154 CO -0.84 -0.21 0.31 0.00 0.00 0.00 0.00 176.54 175.80 1rxr h LYS 156 N 0.84 -0.51 -0.08 0.00 3.64 -0.38 0.11 116.57 120.20 1rxr h LYS 156 Ca 0.21 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 1rxr h LYS 156 Cb 0.09 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 1rxr h LYS 156 CO -0.03 -0.34 -0.11 0.78 -2.27 0.00 0.00 179.45 177.48 1rxr h GLY 157 N -0.52 -0.06 0.31 5.01 0.00 -0.78 0.16 103.07 107.19 1rxr h GLY 157 Ca -0.00 0.14 0.06 0.00 0.00 0.00 0.00 47.33 47.53 1rxr h GLY 157 CO -0.21 -0.12 -0.11 -2.75 0.00 0.00 0.00 176.54 173.35 1rxr h PHE 158 N -0.15 -0.26 -0.08 5.60 3.57 -0.90 0.13 116.94 124.84 1rxr h PHE 158 Ca 0.07 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1rxr h PHE 158 Cb 0.25 0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.15 1rxr h PHE 158 CO -0.21 -0.18 0.04 0.35 -2.23 0.00 0.00 178.31 176.08 1rxr h PHE 159 N -0.05 0.12 -0.10 0.41 3.57 -0.54 -0.90 116.94 119.45 1rxr h PHE 159 Ca 0.15 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.69 1rxr h PHE 159 Cb 0.28 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1rxr h PHE 159 CO -0.32 0.19 -0.23 -0.22 -2.23 0.00 0.00 178.31 175.50 1rxr h LYS 160 N 0.02 -0.30 -0.01 1.11 3.64 -0.46 0.36 116.57 120.94 1rxr h LYS 160 Ca 0.03 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1rxr h LYS 160 Cb 0.11 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.94 1rxr h LYS 160 CO -0.00 -0.20 -0.48 0.00 -2.27 0.00 0.00 179.45 176.50 1rxr h ARG 161 N -0.31 -0.60 -0.32 1.90 3.08 -0.63 0.17 114.38 117.68 1rxr h ARG 161 Ca 0.09 0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.25 1rxr h ARG 161 Cb 0.44 0.14 -0.08 0.00 0.08 0.00 0.00 29.97 30.55 1rxr h ARG 161 CO -0.28 -0.40 -0.25 1.15 -1.07 0.00 0.00 179.97 179.12 1rxr h THR 162 N -0.62 0.36 -0.17 2.04 2.02 -0.65 -0.16 112.91 115.72 1rxr h THR 162 Ca 0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 1rxr h THR 162 Cb 0.69 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1rxr h THR 162 CO -0.34 0.00 -0.03 0.58 0.37 0.00 0.00 175.52 176.09 1rxr h VAL 163 N -0.22 1.28 -0.56 3.16 2.07 -0.71 0.41 116.25 121.67 1rxr h VAL 163 Ca 0.16 -0.98 0.10 0.00 0.82 0.00 0.00 66.70 66.80 1rxr h VAL 163 Cb 0.47 1.58 -0.08 0.00 -1.52 0.00 0.00 31.29 31.75 1rxr h VAL 163 CO -0.44 0.29 0.14 0.03 0.02 0.00 0.00 177.57 177.61 1rxr h ARG 164 N 0.05 0.28 0.00 1.57 3.08 -0.34 0.15 114.38 119.16 1rxr h ARG 164 Ca 0.04 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 1rxr h ARG 164 Cb 0.46 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1rxr h ARG 164 CO 0.02 0.18 -0.49 0.87 -1.07 0.00 0.00 179.97 179.48 1rxr h LYS 165 N 0.29 0.00 -4.10 0.04 1.79 -0.97 -3.48 116.57 110.14 1rxr h LYS 165 Ca 0.29 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.55 1rxr h LYS 165 Cb 0.40 0.00 0.10 0.00 -1.58 0.00 0.00 32.23 31.15 1rxr h LYS 165 CO -0.35 0.49 -0.44 -3.47 -1.08 0.00 0.00 179.45 174.59 1rxr n ASP 166 N -3.47 -2.64 -4.60 0.86 2.03 0.12 -5.05 116.55 103.80 1rxr n ASP 166 Ca 0.00 -0.36 -0.24 0.00 0.52 0.00 0.00 54.79 54.71 1rxr n ASP 166 Cb 0.61 -3.23 0.12 0.00 -0.72 0.00 0.00 41.12 37.90 1rxr n ASP 166 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1rxr s LEU 167 N -4.62 2.93 0.04 -2.67 1.43 0.05 -5.00 118.68 110.83 1rxr s LEU 167 Ca 0.08 -0.35 -0.27 0.00 -1.03 0.00 0.00 54.13 52.56 1rxr s LEU 167 Cb -0.04 -1.92 0.07 0.00 0.03 0.00 0.00 46.19 44.33 1rxr s LEU 167 CO 0.43 -2.00 0.63 -0.89 0.23 0.00 0.00 176.35 174.75 1rxr s THR 168 N -3.24 0.00 0.00 5.49 2.01 -1.26 -4.85 115.64 113.80 1rxr s THR 168 Ca 0.68 -0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.65 1rxr s THR 168 Cb -0.05 -0.99 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1rxr s THR 168 CO 0.46 -0.02 0.00 -1.22 -0.69 0.00 0.00 174.62 173.15 1rxr n TYR 169 N 0.40 -0.13 -3.81 4.92 4.01 -1.26 -5.04 117.16 116.25 1rxr n TYR 169 Ca -0.18 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.46 1rxr n TYR 169 Cb 0.60 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.56 1rxr n TYR 169 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1rxr s THR 170 N -2.11 0.12 0.10 -0.72 2.01 -1.26 -4.79 115.64 108.99 1rxr s THR 170 Ca 0.00 -1.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.00 1rxr s THR 170 Cb 0.00 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 1rxr s THR 170 CO 0.00 -0.55 0.01 0.00 -0.69 0.00 0.00 174.62 173.39 1rxr h ARG 172 N 2.98 0.67 -7.40 0.00 3.08 -2.02 -3.42 114.38 108.25 1rxr h ARG 172 Ca -0.35 -0.09 -0.50 0.00 0.07 0.00 0.00 59.98 59.11 1rxr h ARG 172 Cb 1.17 -0.13 0.07 0.00 0.08 0.00 0.00 29.97 31.17 1rxr h ARG 172 CO 0.62 0.55 0.42 -0.51 -1.07 0.00 0.00 179.97 179.97 1rxr s ASP 173 N -5.81 5.88 1.02 7.04 1.11 -1.26 -5.08 116.67 119.56 1rxr s ASP 173 Ca -0.13 1.31 -0.17 0.00 0.18 0.00 0.00 52.55 53.74 1rxr s ASP 173 Cb 0.11 -2.26 0.23 0.00 1.07 0.00 0.00 42.92 42.08 1rxr s ASP 173 CO 0.75 -1.09 1.33 0.20 1.18 0.00 0.00 175.17 177.55 1rxr s ASN 174 N -4.23 2.58 0.35 0.27 0.02 -1.26 -4.91 114.94 107.76 1rxr s ASN 174 Ca 0.56 0.19 0.16 0.00 -1.02 0.00 0.00 52.86 52.75 1rxr s ASN 174 Cb -0.11 -0.15 1.15 0.00 0.02 0.00 0.00 41.25 42.15 1rxr s ASN 174 CO 0.53 -3.06 1.63 0.07 0.02 0.00 0.00 177.10 176.29 1rxr h LYS 175 N -1.87 0.20 -3.04 -0.60 2.10 -1.94 -2.66 116.57 108.75 1rxr h LYS 175 Ca -0.44 -0.01 -0.65 0.00 -2.00 0.00 0.00 60.65 57.55 1rxr h LYS 175 Cb 1.22 -0.04 0.03 0.00 -0.90 0.00 0.00 32.23 32.53 1rxr h LYS 175 CO 0.31 0.13 3.77 -3.47 -2.00 0.00 0.00 179.45 178.19 1rxr n ASP 176 N -5.14 8.45 -4.94 7.07 2.03 -1.26 -4.76 116.55 118.00 1rxr n ASP 176 Ca 0.33 -2.55 -0.25 0.00 0.52 0.00 0.00 54.79 52.84 1rxr n ASP 176 Cb 1.07 -1.53 0.04 0.00 -0.72 0.00 0.00 41.12 39.98 1rxr n ASP 176 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rxr n LEU 178 N -2.56 4.73 -3.53 0.00 4.77 -1.26 -4.81 117.00 114.35 1rxr n LEU 178 Ca 0.06 -3.12 -0.40 0.00 -0.03 0.00 0.00 56.01 52.53 1rxr n LEU 178 Cb 0.59 -1.20 -0.02 0.00 -2.33 0.00 0.00 43.42 40.46 1rxr n LEU 178 CO 0.50 0.05 2.90 -0.38 -1.33 0.00 0.00 177.39 179.13 1rxr n ILE 179 N 5.56 3.60 -2.07 -0.08 2.08 -1.26 -4.91 119.36 122.28 1rxr n ILE 179 Ca 0.50 -2.65 -0.28 0.00 0.56 0.00 0.00 62.75 60.88 1rxr n ILE 179 Cb 0.36 -2.56 0.12 0.00 -0.75 0.00 0.00 39.64 36.81 1rxr n ILE 179 CO 0.00 0.00 0.00 -1.81 0.56 0.00 0.00 176.55 175.30 1rxr s ASP 180 N 2.96 4.07 0.18 4.38 1.11 -1.26 -4.60 116.67 123.50 1rxr s ASP 180 Ca 0.56 0.38 -0.13 0.00 0.18 0.00 0.00 52.55 53.55 1rxr s ASP 180 Cb 0.15 -0.74 0.15 0.00 1.07 0.00 0.00 42.92 43.56 1rxr s ASP 180 CO -0.06 -2.12 1.78 0.11 1.18 0.00 0.00 175.17 176.06 1rxr h LYS 181 N -1.09 0.46 -3.06 8.23 1.79 -1.91 -3.18 116.57 117.81 1rxr h LYS 181 Ca -0.44 -0.03 -0.56 0.00 -2.18 0.00 0.00 60.65 57.44 1rxr h LYS 181 Cb 1.28 -0.10 0.02 0.00 -1.58 0.00 0.00 32.23 31.85 1rxr h LYS 181 CO 0.52 0.31 3.28 0.54 -1.08 0.00 0.00 179.45 183.01 1rxr n ARG 182 N -4.91 3.16 -3.58 3.15 1.74 -1.26 -4.87 116.66 110.10 1rxr n ARG 182 Ca 0.05 -1.92 -0.21 0.00 -0.77 0.00 0.00 57.85 54.99 1rxr n ARG 182 Cb 0.15 -2.65 -0.03 0.00 -1.02 0.00 0.00 32.46 28.91 1rxr n ARG 182 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1rxr s GLN 183 N 2.43 2.50 0.09 5.56 -1.52 -1.21 -5.13 119.66 122.39 1rxr s GLN 183 Ca 0.61 -1.58 0.02 0.00 -1.95 0.00 0.00 55.36 52.47 1rxr s GLN 183 Cb 0.17 -2.36 -0.04 0.00 -0.22 0.00 0.00 33.01 30.56 1rxr s GLN 183 CO -0.05 -0.24 -0.08 1.03 -0.25 0.00 0.00 175.29 175.71 1rxr s ARG 184 N -4.15 0.78 0.32 2.91 0.52 -1.26 -5.05 118.95 113.02 1rxr s ARG 184 Ca 0.47 -1.17 0.10 0.00 -0.52 0.00 0.00 55.73 54.61 1rxr s ARG 184 Cb -0.03 -0.32 0.95 0.00 0.52 0.00 0.00 34.95 36.07 1rxr s ARG 184 CO 0.28 0.02 1.65 -0.97 0.02 0.00 0.00 175.30 176.30 1rxr h ASN 185 N 3.43 0.26 -1.08 0.23 -1.24 -2.01 -1.88 115.58 113.29 1rxr h ASN 185 Ca -0.36 0.20 0.42 0.00 0.71 0.00 0.00 56.30 57.27 1rxr h ASN 185 Cb 1.18 0.21 -0.15 0.00 0.73 0.00 0.00 38.32 40.29 1rxr h ASN 185 CO 0.57 -0.18 0.63 -2.11 -1.29 0.00 0.00 177.43 175.05 1rxr n ARG 186 N -5.16 -0.05 -0.96 6.67 1.85 -1.26 -2.17 116.66 115.59 1rxr n ARG 186 Ca 0.28 1.25 -0.11 0.00 -1.00 0.00 0.00 57.85 58.26 1rxr n ARG 186 Cb 0.89 -2.32 -0.16 0.00 -1.05 0.00 0.00 32.46 29.81 1rxr n ARG 186 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1rxr h GLN 188 N 3.13 -0.79 -0.41 0.00 4.20 -1.71 -2.68 115.11 116.85 1rxr h GLN 188 Ca 0.18 0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.99 1rxr h GLN 188 Cb 1.45 0.18 -0.07 0.00 0.30 0.00 0.00 27.48 29.34 1rxr h GLN 188 CO 0.24 -0.52 -0.48 -0.92 -0.67 0.00 0.00 178.83 176.48 1rxr h TYR 189 N -0.82 -1.48 -0.13 2.96 3.20 -1.81 0.73 116.97 119.62 1rxr h TYR 189 Ca -0.05 0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1rxr h TYR 189 Cb 0.69 0.70 -0.01 0.00 1.54 0.00 0.00 36.73 39.66 1rxr h TYR 189 CO -0.15 -0.41 0.08 0.00 -1.64 0.00 0.00 178.16 176.04 1rxr h ARG 191 N 0.16 1.05 0.08 0.00 3.08 -1.13 0.14 114.38 117.76 1rxr h ARG 191 Ca 0.05 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1rxr h ARG 191 Cb -0.01 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.80 1rxr h ARG 191 CO -0.02 0.69 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.62 1rxr h TYR 192 N 1.08 -0.10 -0.38 3.04 3.20 -0.36 0.11 116.97 123.56 1rxr h TYR 192 Ca 0.33 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.25 1rxr h TYR 192 Cb -0.03 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 1rxr h TYR 192 CO -0.02 0.01 0.10 1.96 -1.64 0.00 0.00 178.16 178.57 1rxr h GLN 193 N -0.19 0.23 -0.10 1.82 1.08 -0.46 -0.15 115.11 117.33 1rxr h GLN 193 Ca -0.01 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.20 1rxr h GLN 193 Cb 0.15 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 1rxr h GLN 193 CO 0.02 0.15 -0.03 0.87 -0.95 0.00 0.00 178.83 178.89 1rxr h LYS 194 N 0.23 -0.01 -0.31 1.46 1.79 -0.52 0.15 116.57 119.36 1rxr h LYS 194 Ca 0.18 0.00 0.07 0.00 -2.18 0.00 0.00 60.65 58.72 1rxr h LYS 194 Cb 0.20 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.79 1rxr h LYS 194 CO -0.22 -0.00 -0.11 0.00 -1.08 0.00 0.00 179.45 178.04 1rxr h ALA 195 N 1.09 0.16 -0.10 3.86 0.00 -0.24 0.10 119.26 124.14 1rxr h ALA 195 Ca 0.05 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1rxr h ALA 195 Cb 0.08 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1rxr h ALA 195 CO -0.11 -0.49 0.06 -0.07 0.00 0.00 0.00 179.25 178.64 1rxr h LEU 196 N -0.04 0.13 -0.46 0.00 3.38 -0.72 -0.16 115.31 117.44 1rxr h LEU 196 Ca 0.15 -0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.13 1rxr h LEU 196 Cb 0.28 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.92 1rxr h LEU 196 CO -0.34 0.18 -0.02 0.00 0.09 0.00 0.00 178.44 178.35 1rxr h ALA 197 N 0.96 0.41 0.00 1.53 0.00 -0.10 0.56 119.26 122.61 1rxr h ALA 197 Ca 0.04 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1rxr h ALA 197 Cb 0.08 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1rxr h ALA 197 CO -0.01 -0.40 0.00 -1.33 0.00 0.00 0.00 179.25 177.52 1rxr n MET 198 N -5.24 0.57 -1.04 0.00 2.81 -0.03 -4.90 117.12 109.29 1rxr n MET 198 Ca 0.04 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 1rxr n MET 198 Cb 0.25 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 1rxr n MET 198 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rxr n GLY 199 N 0.64 1.14 3.64 3.03 0.00 0.19 -4.98 105.19 108.84 1rxr n GLY 199 Ca 0.15 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.36 1rxr n GLY 199 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1rxr n MET 200 N -0.73 2.52 -1.90 1.61 2.00 -0.12 -4.79 117.12 115.71 1rxr n MET 200 Ca 0.00 0.86 -0.23 0.00 0.00 0.00 0.00 57.70 58.33 1rxr n MET 200 Cb 0.24 -3.09 -0.06 0.00 0.00 0.00 0.00 33.22 30.30 1rxr n MET 200 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1rxr s LYS 201 N 5.18 2.18 0.32 0.03 -0.14 0.22 -4.79 119.74 122.74 1rxr s LYS 201 Ca 0.94 -0.32 0.08 0.00 -1.36 0.00 0.00 55.97 55.31 1rxr s LYS 201 Cb -0.40 -5.03 0.94 0.00 -1.68 0.00 0.00 37.83 31.66 1rxr s LYS 201 CO 0.40 -3.97 1.52 -2.13 -0.76 0.00 0.00 175.35 170.40 1rxr n ARG 202 N 8.66 -0.07 -0.25 1.68 0.63 -1.26 -0.27 116.66 125.77 1rxr n ARG 202 Ca 0.43 1.41 0.06 0.00 -0.92 0.00 0.00 57.85 58.83 1rxr n ARG 202 Cb 0.46 -2.34 0.18 0.00 0.45 0.00 0.00 32.46 31.22 1rxr n ARG 202 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1rxr h GLU 203 N 0.00 0.20 0.00 -0.14 3.07 -1.98 -0.62 114.58 115.11 1rxr h GLU 203 Ca 0.67 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.52 1rxr h GLU 203 Cb 1.56 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.42 1rxr h GLU 203 CO -0.85 0.13 0.00 0.00 -1.40 0.00 0.00 179.01 176.89 1rxr h ALA 204 N 1.65 1.00 -0.69 3.43 0.00 -1.02 -2.38 119.26 121.26 1rxr h ALA 204 Ca 0.43 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.41 1rxr h ALA 204 Cb 0.75 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 1rxr h ALA 204 CO -0.57 0.00 0.37 0.28 0.00 0.00 0.00 179.25 179.33 1rxr h VAL 205 N 0.00 0.92 0.00 0.00 2.07 -1.21 0.11 116.25 118.15 1rxr h VAL 205 Ca 0.00 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1rxr h VAL 205 Cb 0.15 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1rxr h VAL 205 CO 0.00 0.12 0.04 1.56 0.02 0.00 0.00 177.57 179.31 1rxr h GLN 206 N 0.65 0.00 0.01 1.57 1.08 -1.59 0.12 115.11 116.95 1rxr h GLN 206 Ca 0.32 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 57.18 1rxr h GLN 206 Cb 0.26 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.64 1rxr h GLN 206 CO -0.22 0.00 -1.88 0.39 -0.95 0.00 0.00 178.83 176.17 1rxr n GLU 207 N -2.69 0.59 0.19 1.46 1.02 0.18 -4.29 120.64 117.10 1rxr n GLU 207 Ca -0.02 0.41 0.14 0.00 -0.02 0.00 0.00 57.16 57.67 1rxr n GLU 207 Cb 0.10 -1.63 0.62 0.00 -0.02 0.00 0.00 31.44 30.51 1rxr n GLU 207 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1rxr h GLU 208 N -0.88 0.00 -5.69 3.49 5.08 -0.35 -3.46 114.58 112.77 1rxr h GLU 208 Ca -0.51 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.12 1rxr h GLU 208 Cb 1.51 0.00 0.06 0.00 0.50 0.00 0.00 28.75 30.81 1rxr h GLU 208 CO -0.27 0.00 -0.02 0.54 -1.00 0.00 0.00 179.01 178.26 1rxr n ARG 209 N -2.50 0.00 -3.79 2.33 1.74 0.37 -5.00 116.66 109.81 1rxr n ARG 209 Ca 0.01 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 1rxr n ARG 209 Cb 0.19 -1.36 -0.10 0.00 -1.02 0.00 0.00 32.46 30.17 1rxr n ARG 209 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1rxr s GLN 210 N -0.13 0.43 -1.18 5.56 -1.52 -1.26 -5.06 119.66 116.50 1rxr s GLN 210 Ca 0.83 0.13 -0.08 0.00 -1.95 0.00 0.00 55.36 54.28 1rxr s GLN 210 Cb -1.16 0.20 -0.11 0.00 -0.22 0.00 0.00 33.01 31.72 1rxr s GLN 210 CO 0.54 -0.08 3.08 2.89 -0.25 0.00 0.00 175.29 181.46 1rxr n ARG 211 N 2.32 3.33 -0.46 2.91 -4.01 -1.26 -5.15 116.66 114.34 1rxr n ARG 211 Ca -0.16 -2.02 0.00 0.00 -1.04 0.00 0.00 57.85 54.63 1rxr n ARG 211 Cb 0.57 -2.58 0.00 0.00 -3.04 0.00 0.00 32.46 27.42 1rxr n ARG 211 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00