#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 -2.20 -2.13 -2.24 -1.26 -3.36 114.28 103.09 1rxr n THR 131 Ca 0.00 1.47 -0.42 0.00 -2.27 0.00 0.00 64.05 62.83 1rxr n THR 131 Cb 0.00 -2.15 -0.03 0.00 -2.10 0.00 0.00 70.33 66.05 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 -2.88 3.25 -0.93 -0.78 3.01 -1.26 -4.88 119.74 115.28 1rxr s LYS 132 Ca 0.00 0.89 -0.24 0.00 -1.01 0.00 0.00 55.97 55.61 1rxr s LYS 132 Cb 0.00 -4.17 -0.16 0.00 -1.01 0.00 0.00 37.83 32.48 1rxr s LYS 132 CO 0.00 -1.97 1.92 0.72 0.51 0.00 0.00 175.35 176.53 1rxr n HIS 133 N 10.21 1.90 -2.49 3.18 8.25 -1.21 -4.93 115.22 130.13 1rxr n HIS 133 Ca 0.18 -1.24 -0.35 0.00 -0.26 0.00 0.00 57.72 56.05 1rxr n HIS 133 Cb 0.49 -2.17 -0.03 0.00 1.12 0.00 0.00 29.99 29.40 1rxr n HIS 133 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 1rxr s ILE 134 N 10.03 3.64 -0.08 1.59 -4.36 -1.26 -0.77 121.20 129.98 1rxr s ILE 134 Ca 0.68 1.14 -0.29 0.00 -0.26 0.00 0.00 60.65 61.91 1rxr s ILE 134 Cb 0.04 -3.53 -0.05 0.00 1.25 0.00 0.00 42.46 40.17 1rxr s ILE 134 CO 0.16 -0.11 1.71 0.00 0.24 0.00 0.00 174.94 176.95 1rxr h ALA 136 N 10.18 1.84 0.06 0.00 0.00 -1.69 0.29 119.26 129.94 1rxr h ALA 136 Ca -0.39 0.11 -0.25 0.00 0.00 0.00 0.00 54.91 54.38 1rxr h ALA 136 Cb 1.18 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.99 1rxr h ALA 136 CO 0.96 -0.30 -1.08 0.82 0.00 0.00 0.00 179.25 179.66 1rxr h ILE 137 N 0.58 1.42 0.00 0.00 2.04 -1.90 -3.42 117.51 116.23 1rxr h ILE 137 Ca 0.63 -2.65 0.00 0.00 1.00 0.00 0.00 64.86 63.84 1rxr h ILE 137 Cb 1.23 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.94 1rxr h ILE 137 CO -0.44 0.79 -0.06 0.00 0.00 0.00 0.00 178.15 178.44 1rxr n GLY 139 N 0.00 0.73 3.77 0.00 0.00 0.99 -3.69 105.19 106.98 1rxr n GLY 139 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.63 5.21 0.07 1.61 1.01 -1.26 -4.28 116.67 116.39 1rxr s ASP 140 Ca 0.00 2.08 -0.30 0.00 0.71 0.00 0.00 52.55 55.04 1rxr s ASP 140 Cb 0.00 -2.56 -0.09 0.00 1.01 0.00 0.00 42.92 41.28 1rxr s ASP 140 CO 0.00 -1.56 1.87 -0.60 0.21 0.00 0.00 175.17 175.09 1rxr s ARG 141 N -3.85 4.15 0.55 8.23 3.52 -1.26 0.28 118.95 130.56 1rxr s ARG 141 Ca 0.69 2.56 -0.21 0.00 -0.13 0.00 0.00 55.73 58.64 1rxr s ARG 141 Cb -0.22 -3.90 -0.05 0.00 -1.56 0.00 0.00 34.95 29.22 1rxr s ARG 141 CO 0.38 -0.89 1.35 -1.12 -0.81 0.00 0.00 175.30 174.20 1rxr s SER 142 N 3.58 5.25 0.12 -2.12 0.01 0.05 -4.75 113.70 115.85 1rxr s SER 142 Ca 0.84 2.74 -0.01 0.00 1.31 0.00 0.00 55.95 60.82 1rxr s SER 142 Cb -0.43 -2.63 -0.15 0.00 0.21 0.00 0.00 66.02 63.02 1rxr s SER 142 CO 0.38 -1.58 1.26 0.28 0.41 0.00 0.00 173.24 174.00 1rxr h SER 143 N 1.41 0.36 0.00 2.44 0.02 -0.84 -3.47 113.55 113.47 1rxr h SER 143 Ca -0.51 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 1rxr h SER 143 Cb 1.30 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1rxr h SER 143 CO 0.57 1.19 0.00 0.61 -1.14 0.00 0.00 176.83 178.06 1rxr n GLY 144 N 1.18 -1.27 3.69 -3.77 0.00 -0.93 -5.01 105.19 99.08 1rxr n GLY 144 Ca -0.06 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.37 4.41 -0.06 1.61 2.20 -1.26 -1.17 119.74 125.09 1rxr s LYS 145 Ca 0.00 1.31 0.01 0.00 -0.36 0.00 0.00 55.97 56.94 1rxr s LYS 145 Cb 0.00 -3.54 0.02 0.00 -1.51 0.00 0.00 37.83 32.80 1rxr s LYS 145 CO 0.00 -0.29 -0.08 -1.01 -0.36 0.00 0.00 175.35 173.60 1rxr s HIS 146 N 1.95 1.14 -1.56 4.03 3.76 0.39 -4.82 115.29 120.17 1rxr s HIS 146 Ca 0.46 -0.40 -0.17 0.00 -0.15 0.00 0.00 55.06 54.80 1rxr s HIS 146 Cb -0.18 -0.90 0.15 0.00 1.11 0.00 0.00 32.58 32.76 1rxr s HIS 146 CO 0.17 -0.26 0.65 0.66 -0.85 0.00 0.00 174.74 175.11 1rxr n TYR 147 N 4.03 -1.64 0.00 1.40 4.01 -1.26 -0.99 117.16 122.71 1rxr n TYR 147 Ca -0.22 0.67 0.00 0.00 -0.16 0.00 0.00 57.90 58.18 1rxr n TYR 147 Cb 0.51 -2.58 0.00 0.00 -0.31 0.00 0.00 39.34 36.96 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 -1.22 1.13 3.08 2.72 0.00 -1.26 -0.67 105.19 108.97 1rxr n GLY 148 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.28 0.59 0.10 1.61 1.01 -0.17 -5.05 120.40 116.22 1rxr s VAL 149 Ca 0.00 -1.18 -0.31 0.00 0.00 0.00 0.00 61.98 60.49 1rxr s VAL 149 Cb 0.00 -0.74 -0.09 0.00 0.00 0.00 0.00 36.38 35.54 1rxr s VAL 149 CO 0.00 -0.42 1.74 -0.31 0.00 0.00 0.00 175.10 176.11 1rxr s TYR 150 N -1.59 2.30 0.35 5.22 2.02 -1.26 -0.46 117.35 123.92 1rxr s TYR 150 Ca -0.07 0.15 -0.12 0.00 -0.37 0.00 0.00 57.07 56.66 1rxr s TYR 150 Cb -0.09 -4.08 0.03 0.00 -0.40 0.00 0.00 41.96 37.43 1rxr s TYR 150 CO 0.00 -4.38 0.65 0.45 -1.57 0.00 0.00 175.55 170.71 1rxr s SER 151 N 2.52 0.24 0.09 2.29 0.15 -0.32 -1.82 113.70 116.85 1rxr s SER 151 Ca 0.77 -1.17 0.04 0.00 0.70 0.00 0.00 55.95 56.30 1rxr s SER 151 Cb -0.43 0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 64.59 1rxr s SER 151 CO 0.34 -1.47 0.01 0.00 1.20 0.00 0.00 173.24 173.32 1rxr h GLU 153 N 3.45 0.36 -0.42 0.00 4.39 -1.95 0.64 114.58 121.05 1rxr h GLU 153 Ca -0.48 -0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.25 1rxr h GLU 153 Cb 1.16 -0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 29.69 1rxr h GLU 153 CO 0.61 0.23 0.15 0.78 -1.16 0.00 0.00 179.01 179.62 1rxr h GLY 154 N 0.37 0.54 1.06 -3.84 0.00 -1.99 0.11 103.07 99.33 1rxr h GLY 154 Ca 0.59 -0.09 -0.11 0.00 0.00 0.00 0.00 47.33 47.73 1rxr h GLY 154 CO -0.56 0.03 -0.11 0.00 0.00 0.00 0.00 176.54 175.89 1rxr h LYS 156 N 0.82 -0.96 -0.42 0.00 3.64 -0.31 0.13 116.57 119.46 1rxr h LYS 156 Ca 0.13 0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.63 1rxr h LYS 156 Cb 0.67 0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 32.66 1rxr h LYS 156 CO 0.05 -0.64 0.12 0.78 -2.27 0.00 0.00 179.45 177.49 1rxr h GLY 157 N -1.00 0.53 0.48 5.01 0.00 -0.77 0.81 103.07 108.13 1rxr h GLY 157 Ca -0.06 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.25 1rxr h GLY 157 CO -0.07 -0.01 -0.19 -2.75 0.00 0.00 0.00 176.54 173.52 1rxr h PHE 158 N 0.27 -0.49 -0.19 5.60 3.57 -0.75 0.43 116.94 125.37 1rxr h PHE 158 Ca 0.20 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.74 1rxr h PHE 158 Cb 0.22 0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1rxr h PHE 158 CO -0.18 -0.27 0.08 0.35 -2.23 0.00 0.00 178.31 176.06 1rxr h PHE 159 N -0.28 0.14 0.14 0.41 3.57 -0.28 0.60 116.94 121.24 1rxr h PHE 159 Ca 0.07 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.60 1rxr h PHE 159 Cb 0.38 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.04 1rxr h PHE 159 CO -0.26 0.07 -0.50 -0.22 -2.23 0.00 0.00 178.31 175.17 1rxr h LYS 160 N 0.17 -0.72 -0.08 1.11 3.64 -0.42 0.22 116.57 120.49 1rxr h LYS 160 Ca 0.08 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1rxr h LYS 160 Cb 0.04 0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 31.96 1rxr h LYS 160 CO -0.07 -0.48 -0.32 0.00 -2.27 0.00 0.00 179.45 176.31 1rxr h ARG 161 N -0.74 -0.41 -0.43 1.90 3.08 -0.78 -1.32 114.38 115.66 1rxr h ARG 161 Ca -0.00 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.15 1rxr h ARG 161 Cb 0.75 0.09 -0.06 0.00 0.08 0.00 0.00 29.97 30.83 1rxr h ARG 161 CO -0.27 -0.28 0.04 1.15 -1.07 0.00 0.00 179.97 179.55 1rxr h THR 162 N -0.43 0.72 0.15 2.04 2.02 -0.51 -1.10 112.91 115.80 1rxr h THR 162 Ca 0.08 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1rxr h THR 162 Cb 0.55 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1rxr h THR 162 CO -0.32 0.03 -0.07 0.58 0.37 0.00 0.00 175.52 176.11 1rxr h VAL 163 N 0.16 0.91 -0.52 3.16 2.07 -0.25 0.76 116.25 122.54 1rxr h VAL 163 Ca 0.21 -0.22 0.08 0.00 0.82 0.00 0.00 66.70 67.59 1rxr h VAL 163 Cb 0.29 1.04 -0.07 0.00 -1.52 0.00 0.00 31.29 31.04 1rxr h VAL 163 CO -0.32 0.05 0.14 0.03 0.02 0.00 0.00 177.57 177.49 1rxr h ARG 164 N -0.31 0.28 0.00 1.57 3.08 -0.95 -2.11 114.38 115.95 1rxr h ARG 164 Ca -0.02 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 1rxr h ARG 164 Cb 0.24 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1rxr h ARG 164 CO 0.03 0.19 -0.43 0.87 -1.07 0.00 0.00 179.97 179.56 1rxr h LYS 165 N 0.29 0.00 -6.31 0.04 1.79 -1.09 -3.48 116.57 107.81 1rxr h LYS 165 Ca 0.26 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 58.27 1rxr h LYS 165 Cb 0.32 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1rxr h LYS 165 CO -0.30 0.40 -0.87 -3.47 -1.08 0.00 0.00 179.45 174.13 1rxr n ASP 166 N -3.19 -1.01 -4.62 0.86 2.03 0.26 -4.88 116.55 106.00 1rxr n ASP 166 Ca 0.02 -0.93 -0.43 0.00 0.52 0.00 0.00 54.79 53.97 1rxr n ASP 166 Cb 0.70 -3.49 -0.02 0.00 -0.72 0.00 0.00 41.12 37.59 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 -6.81 3.76 -1.31 -2.67 1.43 -1.09 -4.92 118.68 107.08 1rxr s LEU 167 Ca 0.04 1.38 -0.18 0.00 -1.03 0.00 0.00 54.13 54.34 1rxr s LEU 167 Cb -0.01 -3.53 0.05 0.00 0.03 0.00 0.00 46.19 42.73 1rxr s LEU 167 CO 0.86 -1.35 1.82 0.35 0.23 0.00 0.00 176.35 178.26 1rxr n THR 168 N 6.70 3.71 -1.43 5.49 -2.24 -1.26 -4.96 114.28 120.29 1rxr n THR 168 Ca 0.19 -3.77 -0.23 0.00 -2.27 0.00 0.00 64.05 57.96 1rxr n THR 168 Cb 0.46 -2.37 0.18 0.00 -2.10 0.00 0.00 70.33 66.49 1rxr n THR 168 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1rxr n TYR 169 N 8.49 -3.89 -3.75 4.78 4.01 -1.26 -5.09 117.16 120.45 1rxr n TYR 169 Ca 0.49 -0.87 -0.10 0.00 -0.16 0.00 0.00 57.90 57.26 1rxr n TYR 169 Cb 0.45 -0.85 -0.06 0.00 -0.31 0.00 0.00 39.34 38.57 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 -3.02 0.11 0.08 -0.72 2.01 -1.26 -4.76 115.64 108.07 1rxr s THR 170 Ca 0.58 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 1rxr s THR 170 Cb -0.03 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 1rxr s THR 170 CO 0.42 -0.48 -0.01 0.00 -0.69 0.00 0.00 174.62 173.86 1rxr h ARG 172 N 3.05 0.45 -6.10 0.00 -0.00 -2.01 -3.42 114.38 106.34 1rxr h ARG 172 Ca -0.34 -0.03 -0.60 0.00 -0.50 0.00 0.00 59.98 58.50 1rxr h ARG 172 Cb 1.16 -0.10 -0.13 0.00 0.00 0.00 0.00 29.97 30.90 1rxr h ARG 172 CO 0.64 0.30 -0.71 -0.51 0.00 0.00 0.00 179.97 179.69 1rxr s ASP 173 N -6.03 3.80 1.00 7.04 1.01 -1.26 -5.16 116.67 117.07 1rxr s ASP 173 Ca -0.08 -1.04 -0.03 0.00 0.71 0.00 0.00 52.55 52.11 1rxr s ASP 173 Cb 0.21 -0.40 0.04 0.00 1.01 0.00 0.00 42.92 43.78 1rxr s ASP 173 CO 0.76 -0.07 0.24 0.59 0.21 0.00 0.00 175.17 176.90 1rxr n ASN 174 N -0.74 -0.07 0.30 0.27 3.02 -1.26 -4.79 115.26 112.00 1rxr n ASN 174 Ca -0.05 -1.05 0.10 0.00 -0.03 0.00 0.00 54.58 53.54 1rxr n ASN 174 Cb 0.61 -0.18 0.52 0.00 -0.61 0.00 0.00 39.78 40.12 1rxr n ASN 174 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1rxr h LYS 175 N 0.00 0.00 0.00 3.52 3.64 -1.96 0.09 116.57 121.86 1rxr h LYS 175 Ca -0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1rxr h LYS 175 Cb 0.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1rxr h LYS 175 CO 0.05 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 176.83 1rxr n ASP 176 N -2.63 0.64 -4.59 4.20 5.75 -1.26 -4.86 116.55 113.80 1rxr n ASP 176 Ca -0.01 0.60 -0.56 0.00 -0.01 0.00 0.00 54.79 54.81 1rxr n ASP 176 Cb 0.54 -0.76 -0.08 0.00 -1.03 0.00 0.00 41.12 39.79 1rxr n ASP 176 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1rxr s LEU 178 N 4.78 3.84 -0.97 0.00 2.96 -1.26 -4.92 118.68 123.11 1rxr s LEU 178 Ca 1.04 1.78 -0.24 0.00 -0.22 0.00 0.00 54.13 56.49 1rxr s LEU 178 Cb -1.08 -3.53 0.04 0.00 0.50 0.00 0.00 46.19 42.13 1rxr s LEU 178 CO 0.62 -1.42 1.44 -0.63 -1.32 0.00 0.00 176.35 175.05 1rxr s ILE 179 N 5.88 3.87 0.82 6.68 -1.09 -1.26 -5.00 121.20 131.10 1rxr s ILE 179 Ca 0.80 -0.56 -0.11 0.00 -2.23 0.00 0.00 60.65 58.56 1rxr s ILE 179 Cb -0.29 -4.99 0.08 0.00 -1.58 0.00 0.00 42.46 35.69 1rxr s ILE 179 CO 0.33 -1.89 1.11 -1.81 -1.23 0.00 0.00 174.94 171.46 1rxr s ASP 180 N 4.91 3.97 0.32 3.58 1.01 -1.26 -4.65 116.67 124.55 1rxr s ASP 180 Ca 0.45 1.97 0.07 0.00 0.71 0.00 0.00 52.55 55.75 1rxr s ASP 180 Cb -0.02 -2.54 0.90 0.00 1.01 0.00 0.00 42.92 42.27 1rxr s ASP 180 CO -0.06 -2.40 1.60 0.11 0.21 0.00 0.00 175.17 174.64 1rxr h LYS 181 N -1.32 0.07 -0.01 8.23 1.79 -1.95 0.35 116.57 123.73 1rxr h LYS 181 Ca -0.44 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 1rxr h LYS 181 Cb 1.25 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 1rxr h LYS 181 CO 0.48 0.05 -0.08 0.54 -1.08 0.00 0.00 179.45 179.36 1rxr n ARG 182 N -5.35 1.35 -2.37 3.15 5.12 -1.26 -4.79 116.66 112.51 1rxr n ARG 182 Ca 0.27 -0.75 -0.38 0.00 -1.93 0.00 0.00 57.85 55.06 1rxr n ARG 182 Cb 0.88 -1.48 -0.03 0.00 -1.16 0.00 0.00 32.46 30.66 1rxr n ARG 182 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1rxr s GLN 183 N -2.16 3.11 0.00 5.56 -0.21 0.11 -4.95 119.66 121.11 1rxr s GLN 183 Ca 0.34 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 55.29 1rxr s GLN 183 Cb 0.21 -4.83 0.00 0.00 1.00 0.00 0.00 33.01 29.39 1rxr s GLN 183 CO 0.39 -2.53 0.00 -2.13 -2.12 0.00 0.00 175.29 168.91 1rxr n ARG 184 N 9.06 1.39 -0.43 2.91 3.00 -1.26 -4.86 116.66 126.47 1rxr n ARG 184 Ca 0.24 0.00 -0.05 0.00 -0.00 0.00 0.00 57.85 58.04 1rxr n ARG 184 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.89 1rxr n ARG 184 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1rxr n ASN 185 N -0.32 2.28 -0.02 6.15 6.94 -1.26 -2.75 115.26 126.29 1rxr n ASN 185 Ca 0.00 -1.93 -0.03 0.00 -0.02 0.00 0.00 54.58 52.61 1rxr n ASN 185 Cb 0.00 -0.62 -0.01 0.00 -2.36 0.00 0.00 39.78 36.79 1rxr n ASN 185 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1rxr n ARG 186 N 2.84 0.08 -1.19 -3.83 5.12 -1.26 -4.62 116.66 113.80 1rxr n ARG 186 Ca 0.19 0.02 -0.19 0.00 -1.93 0.00 0.00 57.85 55.94 1rxr n ARG 186 Cb 0.38 -0.98 -0.12 0.00 -1.16 0.00 0.00 32.46 30.58 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 3.22 -0.86 -0.13 0.00 4.20 -1.82 -1.46 115.11 118.27 1rxr h GLN 188 Ca 0.32 0.06 0.03 0.00 0.06 0.00 0.00 58.65 59.11 1rxr h GLN 188 Cb 1.17 0.19 -0.06 0.00 0.30 0.00 0.00 27.48 29.08 1rxr h GLN 188 CO 0.57 -0.57 -0.53 -0.92 -0.67 0.00 0.00 178.83 176.71 1rxr h TYR 189 N -0.89 -1.58 -0.30 2.96 3.20 -1.84 0.68 116.97 119.20 1rxr h TYR 189 Ca -0.03 0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.94 1rxr h TYR 189 Cb 0.82 0.70 -0.04 0.00 1.54 0.00 0.00 36.73 39.75 1rxr h TYR 189 CO -0.36 -0.53 0.02 0.00 -1.64 0.00 0.00 178.16 175.65 1rxr h ARG 191 N 0.12 0.46 -0.15 0.00 3.08 -0.81 0.14 114.38 117.21 1rxr h ARG 191 Ca 0.14 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1rxr h ARG 191 Cb 0.17 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1rxr h ARG 191 CO -0.22 0.30 0.09 -0.92 -1.07 0.00 0.00 179.97 178.16 1rxr h TYR 192 N 0.47 0.20 -0.61 3.04 3.20 -0.26 -0.40 116.97 122.61 1rxr h TYR 192 Ca 0.22 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.16 1rxr h TYR 192 Cb 0.15 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.29 1rxr h TYR 192 CO -0.11 0.17 0.30 1.96 -1.64 0.00 0.00 178.16 178.84 1rxr h GLN 193 N 0.18 0.53 0.36 1.82 1.08 -0.28 0.56 115.11 119.36 1rxr h GLN 193 Ca 0.06 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1rxr h GLN 193 Cb 0.03 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 1rxr h GLN 193 CO -0.01 0.35 -0.25 0.87 -0.95 0.00 0.00 178.83 178.85 1rxr h LYS 194 N 0.55 -0.57 -0.47 1.46 6.56 -0.36 0.13 116.57 123.86 1rxr h LYS 194 Ca 0.29 0.04 0.09 0.00 -1.06 0.00 0.00 60.65 60.01 1rxr h LYS 194 Cb 0.24 0.13 -0.09 0.00 -0.57 0.00 0.00 32.23 31.95 1rxr h LYS 194 CO -0.22 -0.38 -0.08 0.00 -2.06 0.00 0.00 179.45 176.71 1rxr h ALA 195 N -0.00 0.35 0.00 3.86 0.00 -0.52 -0.18 119.26 122.77 1rxr h ALA 195 Ca -0.03 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1rxr h ALA 195 Cb 0.50 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1rxr h ALA 195 CO 0.02 -0.43 -0.00 -0.07 0.00 0.00 0.00 179.25 178.77 1rxr h LEU 196 N 0.03 -0.00 -0.53 0.00 3.38 -0.74 -0.47 115.31 116.99 1rxr h LEU 196 Ca 0.23 -0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.16 1rxr h LEU 196 Cb 0.35 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 1rxr h LEU 196 CO -0.46 0.13 0.14 0.00 0.09 0.00 0.00 178.44 178.34 1rxr h ALA 197 N 0.86 0.62 0.00 1.53 0.00 -0.06 0.99 119.26 123.21 1rxr h ALA 197 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1rxr h ALA 197 Cb 0.13 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1rxr h ALA 197 CO 0.00 -0.28 0.00 -1.33 0.00 0.00 0.00 179.25 177.64 1rxr n MET 198 N -5.08 0.75 -2.48 0.00 2.81 -0.14 -4.88 117.12 108.09 1rxr n MET 198 Ca 0.06 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.94 1rxr n MET 198 Cb 0.25 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.28 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 0.49 0.74 3.68 3.03 0.00 0.34 -4.97 105.19 108.50 1rxr n GLY 199 Ca 0.18 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.92 2.72 -1.94 1.61 2.00 -0.21 -4.81 117.12 115.58 1rxr n MET 200 Ca -0.00 0.99 -0.24 0.00 0.00 0.00 0.00 57.70 58.45 1rxr n MET 200 Cb 0.51 -2.90 -0.07 0.00 0.00 0.00 0.00 33.22 30.76 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 3.37 2.22 0.32 0.03 -0.14 0.15 -4.80 119.74 120.90 1rxr s LYS 201 Ca 0.85 -0.62 0.06 0.00 -1.36 0.00 0.00 55.97 54.91 1rxr s LYS 201 Cb -0.50 -5.10 0.88 0.00 -1.68 0.00 0.00 37.83 31.42 1rxr s LYS 201 CO 0.41 -4.08 1.54 -2.13 -0.76 0.00 0.00 175.35 170.32 1rxr n ARG 202 N 8.50 -0.07 -0.31 1.68 0.63 -1.26 -0.24 116.66 125.57 1rxr n ARG 202 Ca 0.43 1.45 0.10 0.00 -0.92 0.00 0.00 57.85 58.91 1rxr n ARG 202 Cb 0.46 -2.36 0.27 0.00 0.45 0.00 0.00 32.46 31.28 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 0.61 -0.03 -0.14 3.07 -1.99 -0.85 114.58 115.25 1rxr h GLU 203 Ca 0.65 -0.04 0.01 0.00 -0.50 0.00 0.00 59.36 59.48 1rxr h GLU 203 Cb 1.44 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 29.21 1rxr h GLU 203 CO -0.89 0.40 0.03 0.00 -1.40 0.00 0.00 179.01 177.16 1rxr h ALA 204 N 1.61 1.50 -0.60 3.43 0.00 -1.01 -1.22 119.26 122.96 1rxr h ALA 204 Ca 0.51 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.45 1rxr h ALA 204 Cb 0.79 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1rxr h ALA 204 CO -0.40 -0.05 0.40 0.28 0.00 0.00 0.00 179.25 179.48 1rxr h VAL 205 N 0.00 1.09 0.00 0.00 2.07 -1.26 0.95 116.25 119.10 1rxr h VAL 205 Ca 0.01 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1rxr h VAL 205 Cb 0.08 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1rxr h VAL 205 CO -0.00 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.72 1rxr n GLN 206 N -4.46 0.73 -0.07 1.57 1.13 -0.46 -2.04 117.38 113.79 1rxr n GLN 206 Ca 0.07 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 55.03 1rxr n GLN 206 Cb 0.12 -1.10 -0.08 0.00 0.11 0.00 0.00 30.24 29.29 1rxr n GLN 206 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1rxr h GLU 207 N 0.00 0.00 -0.12 -1.09 4.22 -0.93 -2.84 114.58 113.82 1rxr h GLU 207 Ca 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.34 1rxr h GLU 207 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1rxr h GLU 207 CO 0.00 0.60 -0.32 0.93 -2.18 0.00 0.00 179.01 178.03 1rxr h GLU 208 N -1.00 0.43 -2.25 1.92 3.07 -1.68 -3.35 114.58 111.73 1rxr h GLU 208 Ca -0.04 -0.30 -0.70 0.00 -0.50 0.00 0.00 59.36 57.81 1rxr h GLU 208 Cb 0.66 0.05 -0.34 0.00 -0.84 0.00 0.00 28.75 28.28 1rxr h GLU 208 CO -0.02 0.92 0.24 0.54 -1.40 0.00 0.00 179.01 179.29 1rxr n ARG 209 N -4.38 4.36 -0.16 2.33 5.12 -0.86 -4.76 116.66 118.30 1rxr n ARG 209 Ca -0.07 -4.73 -0.03 0.00 -1.93 0.00 0.00 57.85 51.09 1rxr n ARG 209 Cb 0.49 -2.36 0.06 0.00 -1.16 0.00 0.00 32.46 29.50 1rxr n ARG 209 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1rxr h GLN 210 N 3.59 0.28 -4.63 5.56 4.20 -1.65 -3.09 115.11 119.38 1rxr h GLN 210 Ca 0.35 -0.02 -0.61 0.00 0.06 0.00 0.00 58.65 58.43 1rxr h GLN 210 Cb 0.41 -0.06 0.05 0.00 0.30 0.00 0.00 27.48 28.18 1rxr h GLN 210 CO 1.02 0.18 2.06 0.54 -0.67 0.00 0.00 178.83 181.96 1rxr n ARG 211 N -5.06 1.32 -0.54 1.46 3.00 -1.26 -5.03 116.66 110.54 1rxr n ARG 211 Ca 0.05 -1.79 0.00 0.00 -0.01 0.00 0.00 57.85 56.10 1rxr n ARG 211 Cb 0.22 -2.94 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