#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rxr n THR 131 N 0.00 0.00 -1.66 4.37 -2.24 -1.26 -4.83 114.28 108.67 1rxr n THR 131 Ca 0.00 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.47 1rxr n THR 131 Cb 0.00 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.27 1rxr n THR 131 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1rxr s LYS 132 N 0.00 2.95 -0.19 -0.78 1.02 -1.26 -4.96 119.74 116.53 1rxr s LYS 132 Ca 0.00 1.05 -0.29 0.00 0.02 0.00 0.00 55.97 56.75 1rxr s LYS 132 Cb 0.00 -1.99 -0.05 0.00 -0.52 0.00 0.00 37.83 35.28 1rxr s LYS 132 CO 0.00 -1.09 1.94 -1.58 -0.92 0.00 0.00 175.35 173.70 1rxr s HIS 133 N -2.87 1.54 0.39 3.18 5.65 -1.26 -4.77 115.29 117.16 1rxr s HIS 133 Ca 0.60 0.35 -0.22 0.00 0.25 0.00 0.00 55.06 56.05 1rxr s HIS 133 Cb -0.15 -4.04 -0.15 0.00 -1.18 0.00 0.00 32.58 27.06 1rxr s HIS 133 CO 0.50 -3.90 0.19 0.44 -0.65 0.00 0.00 174.74 171.33 1rxr n ILE 134 N 6.90 0.93 -1.62 0.89 -5.35 -1.26 -4.36 119.36 115.49 1rxr n ILE 134 Ca 0.24 -0.50 -0.49 0.00 -0.27 0.00 0.00 62.75 61.73 1rxr n ILE 134 Cb 0.45 -0.09 -0.05 0.00 -1.74 0.00 0.00 39.64 38.20 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 10.62 1.79 -2.12 0.00 0.00 -1.26 0.14 119.26 128.44 1rxr h ALA 136 Ca -0.43 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1rxr h ALA 136 Cb 1.28 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1rxr h ALA 136 CO 0.97 -0.67 0.00 -0.89 0.00 0.00 0.00 179.25 178.66 1rxr n ILE 137 N -5.20 0.00 1.33 0.00 5.41 -1.26 -4.58 119.36 115.05 1rxr n ILE 137 Ca 0.31 0.15 0.15 0.00 1.00 0.00 0.00 62.75 64.35 1rxr n ILE 137 Cb 0.99 -0.47 0.73 0.00 -0.71 0.00 0.00 39.64 40.17 1rxr n ILE 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1rxr n GLY 139 N 1.30 0.71 3.98 0.00 0.00 0.49 -3.88 105.19 107.80 1rxr n GLY 139 Ca 0.13 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.41 4.03 0.18 1.61 1.01 -1.26 -4.63 116.67 115.21 1rxr s ASP 140 Ca 0.00 -0.25 -0.31 0.00 0.71 0.00 0.00 52.55 52.70 1rxr s ASP 140 Cb 0.00 -0.03 -0.10 0.00 1.01 0.00 0.00 42.92 43.80 1rxr s ASP 140 CO 0.00 -2.08 1.56 -0.60 0.21 0.00 0.00 175.17 174.25 1rxr s ARG 141 N -5.32 4.22 0.84 8.23 3.52 -1.26 -0.39 118.95 128.79 1rxr s ARG 141 Ca 0.68 2.37 -0.13 0.00 -0.13 0.00 0.00 55.73 58.53 1rxr s ARG 141 Cb -0.05 -3.14 0.10 0.00 -1.56 0.00 0.00 34.95 30.31 1rxr s ARG 141 CO 0.46 -0.59 1.20 -1.54 -0.81 0.00 0.00 175.30 174.03 1rxr s SER 142 N 1.01 4.18 -0.23 -2.12 1.04 -1.26 -4.68 113.70 111.64 1rxr s SER 142 Ca 0.68 0.71 -0.05 0.00 0.48 0.00 0.00 55.95 57.78 1rxr s SER 142 Cb -0.44 -1.14 -0.12 0.00 0.10 0.00 0.00 66.02 64.42 1rxr s SER 142 CO 0.34 -2.11 -0.25 -1.20 0.98 0.00 0.00 173.24 171.00 1rxr n SER 143 N -3.44 1.97 0.00 7.02 7.64 0.49 -4.84 113.62 122.46 1rxr n SER 143 Ca 0.09 0.09 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1rxr n SER 143 Cb 0.61 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1rxr n SER 143 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rxr n GLY 144 N 1.99 -1.05 3.69 0.23 0.00 -0.60 -5.02 105.19 104.43 1rxr n GLY 144 Ca -0.42 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.41 1rxr n GLY 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rxr s LYS 145 N -0.08 4.41 -0.05 1.61 2.20 -1.26 -0.78 119.74 125.78 1rxr s LYS 145 Ca 0.00 1.36 0.01 0.00 -0.36 0.00 0.00 55.97 56.98 1rxr s LYS 145 Cb 0.00 -3.54 0.02 0.00 -1.51 0.00 0.00 37.83 32.79 1rxr s LYS 145 CO 0.00 -0.32 -0.06 -1.01 -0.36 0.00 0.00 175.35 173.60 1rxr s HIS 146 N 2.03 0.90 -1.37 4.03 3.76 0.40 -4.80 115.29 120.23 1rxr s HIS 146 Ca 0.47 -0.28 -0.10 0.00 -0.15 0.00 0.00 55.06 55.00 1rxr s HIS 146 Cb -0.18 -0.75 0.08 0.00 1.11 0.00 0.00 32.58 32.84 1rxr s HIS 146 CO 0.17 -0.21 0.58 0.66 -0.85 0.00 0.00 174.74 175.10 1rxr n TYR 147 N 3.97 -1.86 -0.82 1.40 4.01 -1.26 -0.83 117.16 121.77 1rxr n TYR 147 Ca -0.25 0.55 0.00 0.00 -0.16 0.00 0.00 57.90 58.04 1rxr n TYR 147 Cb 0.51 -3.20 0.00 0.00 -0.31 0.00 0.00 39.34 36.34 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 -1.28 0.90 3.07 2.72 0.00 -1.26 -0.75 105.19 108.59 1rxr n GLY 148 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.59 0.85 -0.01 1.61 1.01 -0.01 -4.99 120.40 115.28 1rxr s VAL 149 Ca 0.00 -0.68 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 1rxr s VAL 149 Cb 0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 36.38 35.55 1rxr s VAL 149 CO 0.00 0.08 1.83 -0.31 0.00 0.00 0.00 175.10 176.70 1rxr s TYR 150 N -0.55 1.59 0.33 5.22 2.02 -1.26 -0.45 117.35 124.23 1rxr s TYR 150 Ca 0.02 -0.15 -0.09 0.00 -0.37 0.00 0.00 57.07 56.48 1rxr s TYR 150 Cb -0.06 -4.10 0.01 0.00 -0.40 0.00 0.00 41.96 37.42 1rxr s TYR 150 CO 0.00 -4.78 0.55 0.45 -1.57 0.00 0.00 175.55 170.21 1rxr s SER 151 N 4.02 0.42 0.10 2.29 0.15 0.04 -0.80 113.70 119.91 1rxr s SER 151 Ca 0.82 -1.24 0.03 0.00 0.70 0.00 0.00 55.95 56.26 1rxr s SER 151 Cb -0.38 0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 64.58 1rxr s SER 151 CO 0.36 -1.35 0.10 0.00 1.20 0.00 0.00 173.24 173.55 1rxr h GLU 153 N 3.07 0.73 -0.36 0.00 4.39 -1.93 0.33 114.58 120.81 1rxr h GLU 153 Ca -0.47 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.24 1rxr h GLU 153 Cb 1.17 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.61 1rxr h GLU 153 CO 0.65 0.48 0.10 0.78 -1.16 0.00 0.00 179.01 179.87 1rxr h GLY 154 N 0.75 0.44 1.24 -3.84 0.00 -1.99 0.13 103.07 99.81 1rxr h GLY 154 Ca 0.52 -0.05 -0.11 0.00 0.00 0.00 0.00 47.33 47.70 1rxr h GLY 154 CO -0.30 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.10 1rxr h LYS 156 N 0.79 -0.39 0.03 0.00 3.64 -0.26 0.12 116.57 120.49 1rxr h LYS 156 Ca 0.12 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1rxr h LYS 156 Cb 0.67 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.55 1rxr h LYS 156 CO 0.05 -0.26 -0.17 0.78 -2.27 0.00 0.00 179.45 177.58 1rxr h GLY 157 N -0.41 -0.24 0.02 5.01 0.00 -0.59 0.12 103.07 106.98 1rxr h GLY 157 Ca 0.03 0.20 0.06 0.00 0.00 0.00 0.00 47.33 47.61 1rxr h GLY 157 CO -0.13 -0.16 -0.35 -2.75 0.00 0.00 0.00 176.54 173.16 1rxr h PHE 158 N -0.29 -0.97 -0.00 5.60 3.57 -0.73 0.64 116.94 124.77 1rxr h PHE 158 Ca 0.05 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1rxr h PHE 158 Cb 0.34 0.46 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 1rxr h PHE 158 CO -0.21 -0.41 -0.09 0.35 -2.23 0.00 0.00 178.31 175.73 1rxr h PHE 159 N -0.37 -0.21 -0.00 0.41 3.57 -0.45 0.79 116.94 120.67 1rxr h PHE 159 Ca 0.11 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.65 1rxr h PHE 159 Cb 0.56 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.34 1rxr h PHE 159 CO -0.47 -0.13 -0.45 -0.22 -2.23 0.00 0.00 178.31 174.81 1rxr h LYS 160 N -0.15 -0.58 -0.03 1.11 3.64 -0.25 0.19 116.57 120.51 1rxr h LYS 160 Ca 0.03 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1rxr h LYS 160 Cb 0.19 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1rxr h LYS 160 CO -0.09 -0.39 -0.14 0.00 -2.27 0.00 0.00 179.45 176.56 1rxr h ARG 161 N -0.60 -0.22 -0.25 1.90 3.08 -0.73 0.40 114.38 117.95 1rxr h ARG 161 Ca 0.04 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.16 1rxr h ARG 161 Cb 0.68 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.71 1rxr h ARG 161 CO -0.33 -0.15 -0.16 1.15 -1.07 0.00 0.00 179.97 179.41 1rxr h THR 162 N -0.23 0.53 0.11 2.04 2.02 -0.46 -2.67 112.91 114.25 1rxr h THR 162 Ca 0.06 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 1rxr h THR 162 Cb 0.31 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1rxr h THR 162 CO -0.16 0.00 -0.05 0.58 0.37 0.00 0.00 175.52 176.26 1rxr h VAL 163 N -0.15 0.98 -0.79 3.16 2.07 -0.35 0.69 116.25 121.87 1rxr h VAL 163 Ca 0.14 -0.32 0.19 0.00 0.82 0.00 0.00 66.70 67.53 1rxr h VAL 163 Cb 0.36 1.18 -0.13 0.00 -1.52 0.00 0.00 31.29 31.18 1rxr h VAL 163 CO -0.34 0.08 0.08 0.03 0.02 0.00 0.00 177.57 177.43 1rxr h ARG 164 N -0.29 0.14 0.00 1.57 3.08 -0.72 -0.85 114.38 117.32 1rxr h ARG 164 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1rxr h ARG 164 Cb 0.24 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1rxr h ARG 164 CO 0.02 0.09 -1.13 1.63 -1.07 0.00 0.00 179.97 179.52 1rxr n LYS 165 N -5.30 0.47 -3.54 0.04 4.76 -1.03 -4.99 118.16 108.57 1rxr n LYS 165 Ca 0.16 0.02 -0.21 0.00 -2.87 0.00 0.00 58.31 55.41 1rxr n LYS 165 Cb 0.52 -1.68 0.05 0.00 -1.84 0.00 0.00 35.03 32.08 1rxr n LYS 165 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1rxr n ASP 166 N -2.31 -3.28 -4.64 4.39 2.03 0.23 -4.83 116.55 108.14 1rxr n ASP 166 Ca 0.00 -0.79 -0.46 0.00 0.52 0.00 0.00 54.79 54.07 1rxr n ASP 166 Cb 0.50 -4.41 -0.04 0.00 -0.72 0.00 0.00 41.12 36.45 1rxr n ASP 166 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1rxr n LEU 167 N -3.99 3.56 -3.88 -2.67 4.77 -0.17 -4.85 117.00 109.77 1rxr n LEU 167 Ca -0.21 0.78 -0.42 0.00 -0.03 0.00 0.00 56.01 56.13 1rxr n LEU 167 Cb 0.65 -1.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.27 1rxr n LEU 167 CO 0.65 -0.12 2.34 0.35 -1.33 0.00 0.00 177.39 179.27 1rxr n THR 168 N 5.88 2.93 -1.76 -5.08 -2.24 -1.26 -4.95 114.28 107.80 1rxr n THR 168 Ca 0.24 -2.68 -0.31 0.00 -2.27 0.00 0.00 64.05 59.03 1rxr n THR 168 Cb 0.35 -2.46 0.03 0.00 -2.10 0.00 0.00 70.33 66.15 1rxr n THR 168 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1rxr s TYR 169 N 4.44 3.28 -0.26 4.78 2.02 -1.26 -5.07 117.35 125.27 1rxr s TYR 169 Ca 0.53 1.39 -0.01 0.00 -0.37 0.00 0.00 57.07 58.61 1rxr s TYR 169 Cb 0.12 -2.84 0.15 0.00 -0.40 0.00 0.00 41.96 38.99 1rxr s TYR 169 CO 0.01 -1.00 0.43 0.99 -1.57 0.00 0.00 175.55 174.41 1rxr s THR 170 N -3.00 -0.69 0.69 -0.71 2.01 -1.26 -4.83 115.64 107.85 1rxr s THR 170 Ca 0.58 -0.09 -0.11 0.00 0.31 0.00 0.00 61.69 62.37 1rxr s THR 170 Cb -0.13 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.50 1rxr s THR 170 CO 0.51 -0.12 1.07 0.00 -0.69 0.00 0.00 174.62 175.39 1rxr h ARG 172 N -0.61 0.00 -5.24 0.00 2.47 -2.03 -3.42 114.38 105.55 1rxr h ARG 172 Ca -0.45 0.00 -0.39 0.00 -1.26 0.00 0.00 59.98 57.88 1rxr h ARG 172 Cb 1.23 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 29.41 1rxr h ARG 172 CO 0.62 0.00 -0.70 -0.51 0.56 0.00 0.00 179.97 179.94 1rxr s ASP 173 N -5.27 2.10 1.04 7.04 1.11 -1.26 -5.17 116.67 116.26 1rxr s ASP 173 Ca -0.03 -1.09 -0.13 0.00 0.18 0.00 0.00 52.55 51.48 1rxr s ASP 173 Cb 0.11 -0.05 0.18 0.00 1.07 0.00 0.00 42.92 44.23 1rxr s ASP 173 CO 0.45 -0.34 0.98 0.59 1.18 0.00 0.00 175.17 178.02 1rxr n ASN 174 N -0.34 -0.28 0.00 0.27 4.13 -1.26 -4.82 115.26 112.95 1rxr n ASN 174 Ca -0.08 -1.30 0.00 0.00 1.68 0.00 0.00 54.58 54.88 1rxr n ASN 174 Cb 0.62 -0.77 0.00 0.00 -1.54 0.00 0.00 39.78 38.08 1rxr n ASN 174 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1rxr n LYS 175 N -3.31 0.00 0.18 3.52 2.85 -1.26 -1.42 118.16 118.73 1rxr n LYS 175 Ca 0.12 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.45 1rxr n LYS 175 Cb 0.44 -1.18 0.25 0.00 -0.65 0.00 0.00 35.03 33.88 1rxr n LYS 175 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 1rxr h ASP 176 N 0.00 0.00 0.00 -5.58 3.58 -2.00 -3.30 116.42 109.12 1rxr h ASP 176 Ca 0.00 0.00 -0.41 0.00 0.42 0.00 0.00 57.03 57.04 1rxr h ASP 176 Cb 0.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 1rxr h ASP 176 CO 0.00 0.34 2.12 0.00 -2.88 0.00 0.00 179.24 178.83 1rxr n LEU 178 N 3.42 3.57 -4.76 0.00 4.77 -1.24 -4.84 117.00 117.91 1rxr n LEU 178 Ca 0.54 1.15 -0.38 0.00 -0.03 0.00 0.00 56.01 57.30 1rxr n LEU 178 Cb 0.38 -1.49 0.01 0.00 -2.33 0.00 0.00 43.42 40.00 1rxr n LEU 178 CO 0.57 -0.29 0.90 -0.63 -1.33 0.00 0.00 177.39 176.61 1rxr s ILE 179 N -0.21 2.63 0.18 -0.08 -1.09 -1.26 -4.97 121.20 116.41 1rxr s ILE 179 Ca 0.65 0.47 -0.09 0.00 -2.23 0.00 0.00 60.65 59.45 1rxr s ILE 179 Cb -0.59 -3.24 -0.01 0.00 -1.58 0.00 0.00 42.46 37.05 1rxr s ILE 179 CO 0.51 -0.01 0.31 -1.81 -1.23 0.00 0.00 174.94 172.71 1rxr s ASP 180 N -1.20 0.02 0.29 3.58 1.11 -1.26 -4.95 116.67 114.26 1rxr s ASP 180 Ca 0.68 -0.93 0.03 0.00 0.18 0.00 0.00 52.55 52.51 1rxr s ASP 180 Cb -0.34 0.46 0.69 0.00 1.07 0.00 0.00 42.92 44.80 1rxr s ASP 180 CO 0.40 -0.94 1.71 0.50 1.18 0.00 0.00 175.17 178.03 1rxr h LYS 181 N 2.49 0.45 -0.92 8.23 1.63 -1.87 0.13 116.57 126.71 1rxr h LYS 181 Ca -0.31 -0.03 0.17 0.00 -0.85 0.00 0.00 60.65 59.63 1rxr h LYS 181 Cb 1.24 -0.10 -0.08 0.00 -0.60 0.00 0.00 32.23 32.69 1rxr h LYS 181 CO 0.46 0.30 0.59 0.00 -3.45 0.00 0.00 179.45 177.35 1rxr h ARG 182 N 0.47 0.63 -3.73 1.90 -0.00 -1.96 -3.26 114.38 108.43 1rxr h ARG 182 Ca 0.54 -0.04 -0.66 0.00 -0.50 0.00 0.00 59.98 59.32 1rxr h ARG 182 Cb 0.97 -0.14 -0.00 0.00 0.00 0.00 0.00 29.97 30.79 1rxr h ARG 182 CO -0.48 0.42 3.20 1.04 0.00 0.00 0.00 179.97 184.14 1rxr n GLN 183 N -4.59 2.86 0.21 0.04 6.02 0.46 -4.59 117.38 117.78 1rxr n GLN 183 Ca 0.19 -2.29 0.07 0.00 -0.01 0.00 0.00 57.00 54.96 1rxr n GLN 183 Cb 0.54 -3.03 0.44 0.00 1.02 0.00 0.00 30.24 29.21 1rxr n GLN 183 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1rxr h ARG 184 N 5.98 0.00 -7.23 -1.09 9.65 -1.78 -3.45 114.38 116.47 1rxr h ARG 184 Ca 0.63 0.00 -0.53 0.00 -1.10 0.00 0.00 59.98 58.98 1rxr h ARG 184 Cb 0.50 0.00 0.18 0.00 -1.39 0.00 0.00 29.97 29.26 1rxr h ARG 184 CO 1.83 0.31 0.31 1.21 2.80 0.00 0.00 179.97 186.43 1rxr s ASN 185 N -6.49 3.41 -0.99 -3.80 2.47 -1.26 -4.86 114.94 103.42 1rxr s ASN 185 Ca -0.01 2.31 -0.11 0.00 0.42 0.00 0.00 52.86 55.46 1rxr s ASN 185 Cb 0.12 -2.58 -0.08 0.00 -1.45 0.00 0.00 41.25 37.26 1rxr s ASN 185 CO 0.67 -2.79 2.15 0.54 -3.72 0.00 0.00 177.10 173.95 1rxr n ARG 186 N -3.57 2.14 -1.30 0.43 5.12 -1.26 -4.75 116.66 113.47 1rxr n ARG 186 Ca 0.13 -1.72 -0.30 0.00 -1.93 0.00 0.00 57.85 54.03 1rxr n ARG 186 Cb 0.51 -2.68 -0.07 0.00 -1.16 0.00 0.00 32.46 29.06 1rxr n ARG 186 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1rxr h GLN 188 N 4.22 -0.04 0.08 0.00 1.08 -1.99 -0.23 115.11 118.24 1rxr h GLN 188 Ca 0.62 0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.84 1rxr h GLN 188 Cb 0.69 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.10 1rxr h GLN 188 CO 1.22 -0.03 -0.24 -0.92 -0.95 0.00 0.00 178.83 177.91 1rxr h TYR 189 N -0.04 -0.65 -0.71 2.96 3.20 -1.88 0.39 116.97 120.24 1rxr h TYR 189 Ca 0.29 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.15 1rxr h TYR 189 Cb 0.48 0.28 -0.03 0.00 1.54 0.00 0.00 36.73 39.00 1rxr h TYR 189 CO -0.53 -0.34 0.35 0.00 -1.64 0.00 0.00 178.16 175.99 1rxr h ARG 191 N 1.00 -0.38 0.16 0.00 3.08 -0.52 0.13 114.38 117.86 1rxr h ARG 191 Ca 0.25 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.33 1rxr h ARG 191 Cb 0.09 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1rxr h ARG 191 CO -0.03 -0.25 -0.20 -0.92 -1.07 0.00 0.00 179.97 177.50 1rxr h TYR 192 N -0.39 -0.52 -0.43 3.04 3.20 -0.44 0.29 116.97 121.72 1rxr h TYR 192 Ca -0.00 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.94 1rxr h TYR 192 Cb 0.36 0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.78 1rxr h TYR 192 CO -0.14 -0.29 0.10 1.96 -1.64 0.00 0.00 178.16 178.15 1rxr h GLN 193 N -0.41 0.23 -0.47 1.82 1.08 -0.69 -0.42 115.11 116.26 1rxr h GLN 193 Ca 0.01 -0.01 -0.07 0.00 -1.45 0.00 0.00 58.65 57.12 1rxr h GLN 193 Cb 0.40 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 1rxr h GLN 193 CO -0.07 0.15 0.01 -0.22 -0.95 0.00 0.00 178.83 177.75 1rxr h LYS 194 N 0.24 0.82 -0.43 1.46 3.64 -0.47 0.99 116.57 122.82 1rxr h LYS 194 Ca 0.21 -0.26 0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1rxr h LYS 194 Cb 0.25 -0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 31.92 1rxr h LYS 194 CO -0.26 0.87 -0.03 0.00 -2.27 0.00 0.00 179.45 177.76 1rxr h ALA 195 N 0.92 0.37 0.09 5.00 0.00 -0.42 0.16 119.26 125.37 1rxr h ALA 195 Ca 0.13 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1rxr h ALA 195 Cb 0.49 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1rxr h ALA 195 CO 0.02 -0.41 -0.04 -0.07 0.00 0.00 0.00 179.25 178.75 1rxr h LEU 196 N 0.08 -0.10 -0.77 0.00 3.38 -0.81 -0.78 115.31 116.31 1rxr h LEU 196 Ca 0.21 -0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.21 1rxr h LEU 196 Cb 0.31 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 1rxr h LEU 196 CO -0.38 0.02 0.38 0.00 0.09 0.00 0.00 178.44 178.55 1rxr h ALA 197 N 0.69 1.10 0.00 1.53 0.00 -0.11 0.11 119.26 122.58 1rxr h ALA 197 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rxr h ALA 197 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1rxr h ALA 197 CO 0.02 -0.07 0.00 -1.33 0.00 0.00 0.00 179.25 177.86 1rxr n MET 198 N -4.88 0.33 -1.36 0.00 2.81 0.49 -4.88 117.12 109.62 1rxr n MET 198 Ca 0.14 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.12 1rxr n MET 198 Cb 0.35 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 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 0.32 0.92 3.69 3.03 0.00 0.38 -4.97 105.19 108.56 1rxr n GLY 199 Ca 0.10 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 1rxr n GLY 199 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rxr s MET 200 N -3.02 4.16 -1.10 1.61 1.00 -0.32 -4.82 119.30 116.81 1rxr s MET 200 Ca 0.00 2.52 -0.24 0.00 0.00 0.00 0.00 55.69 57.97 1rxr s MET 200 Cb 0.00 -3.57 -0.11 0.00 0.00 0.00 0.00 34.83 31.14 1rxr s MET 200 CO 0.00 -0.80 2.00 0.15 0.00 0.00 0.00 175.02 176.36 1rxr s LYS 201 N 2.64 2.17 0.33 2.03 -0.14 0.07 -4.78 119.74 122.07 1rxr s LYS 201 Ca 0.79 -0.80 0.11 0.00 -1.36 0.00 0.00 55.97 54.70 1rxr s LYS 201 Cb -0.44 -5.14 1.02 0.00 -1.68 0.00 0.00 37.83 31.59 1rxr s LYS 201 CO 0.35 -4.25 1.59 -0.09 -0.76 0.00 0.00 175.35 172.19 1rxr h ARG 202 N 10.51 0.04 -0.28 1.68 2.43 -1.88 0.19 114.38 127.08 1rxr h ARG 202 Ca 0.14 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1rxr h ARG 202 Cb 0.96 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 1rxr h ARG 202 CO 1.17 0.03 0.19 0.93 -1.51 0.00 0.00 179.97 180.77 1rxr h GLU 203 N 0.05 0.32 -0.12 0.20 4.39 -2.00 -1.82 114.58 115.59 1rxr h GLU 203 Ca 0.71 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 60.42 1rxr h GLU 203 Cb 1.67 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 30.24 1rxr h GLU 203 CO -0.81 0.21 0.13 0.00 -1.16 0.00 0.00 179.01 177.37 1rxr h ALA 204 N 1.83 1.78 0.00 3.43 0.00 -1.00 0.23 119.26 125.53 1rxr h ALA 204 Ca 0.11 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1rxr h ALA 204 Cb 0.03 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1rxr h ALA 204 CO -0.02 -0.19 -0.00 0.28 0.00 0.00 0.00 179.25 179.31 1rxr h VAL 205 N 0.00 0.73 0.00 0.00 2.07 -1.46 0.11 116.25 117.69 1rxr h VAL 205 Ca 0.06 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.57 1rxr h VAL 205 Cb 0.31 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1rxr h VAL 205 CO -0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 1rxr n GLN 206 N -4.14 0.08 -0.32 1.57 6.02 0.07 -1.71 117.38 118.96 1rxr n GLN 206 Ca -0.03 0.25 0.11 0.00 -0.01 0.00 0.00 57.00 57.31 1rxr n GLN 206 Cb 0.09 -1.50 0.32 0.00 1.02 0.00 0.00 30.24 30.17 1rxr n GLN 206 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 1rxr h GLU 207 N 0.00 0.78 0.00 -1.09 4.11 -1.14 -2.50 114.58 114.74 1rxr h GLU 207 Ca 0.00 -0.05 -0.12 0.00 0.07 0.00 0.00 59.36 59.26 1rxr h GLU 207 Cb 0.07 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 1rxr h GLU 207 CO 0.00 0.52 -0.96 -1.91 0.07 0.00 0.00 179.01 176.72 1rxr n GLU 208 N -4.61 0.51 -1.56 1.06 2.13 -0.69 -4.52 120.64 112.96 1rxr n GLU 208 Ca 0.19 0.52 -0.41 0.00 0.66 0.00 0.00 57.16 58.11 1rxr n GLU 208 Cb 0.45 -1.69 -0.01 0.00 0.27 0.00 0.00 31.44 30.46 1rxr n GLU 208 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1rxr n ARG 209 N -4.51 2.69 -0.31 5.31 1.74 -1.12 -4.69 116.66 115.77 1rxr n ARG 209 Ca -0.21 -2.40 0.03 0.00 -0.77 0.00 0.00 57.85 54.50 1rxr n ARG 209 Cb 0.49 -3.15 0.17 0.00 -1.02 0.00 0.00 32.46 28.94 1rxr n ARG 209 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1rxr h GLN 210 N 6.22 0.87 -4.03 5.56 7.50 -1.68 -2.89 115.11 126.65 1rxr h GLN 210 Ca 0.58 -0.05 -0.63 0.00 0.50 0.00 0.00 58.65 59.04 1rxr h GLN 210 Cb 0.59 -0.20 0.01 0.00 0.05 0.00 0.00 27.48 27.94 1rxr h GLN 210 CO 1.88 0.57 2.76 2.89 -1.50 0.00 0.00 178.83 185.44 1rxr n ARG 211 N -4.68 2.23 -0.62 1.46 0.00 -1.26 -5.06 116.66 108.73 1rxr n ARG 211 Ca 0.14 -2.07 0.00 0.00 -0.00 0.00 0.00 57.85 55.92 1rxr n ARG 211 Cb 0.24 -2.96 0.00 0.00 -0.00 0.00 0.00 32.46 29.74 1rxr n ARG 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04