#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 -4.31 -2.13 -2.24 -1.26 -4.68 114.28 99.66 1rxr n THR 131 Ca 0.00 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.52 1rxr n THR 131 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 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 2.12 0.81 -0.78 3.01 -1.26 -5.14 119.74 118.50 1rxr s LYS 132 Ca 0.00 -1.91 -0.12 0.00 -1.01 0.00 0.00 55.97 52.94 1rxr s LYS 132 Cb 0.00 -1.87 0.08 0.00 -1.01 0.00 0.00 37.83 35.03 1rxr s LYS 132 CO 0.00 -0.05 1.10 -1.01 0.51 0.00 0.00 175.35 175.90 1rxr s HIS 133 N -2.62 2.80 0.40 3.18 3.76 -1.26 -4.71 115.29 116.83 1rxr s HIS 133 Ca 0.38 1.10 -0.24 0.00 -0.15 0.00 0.00 55.06 56.15 1rxr s HIS 133 Cb 0.05 -3.16 -0.09 0.00 1.11 0.00 0.00 32.58 30.49 1rxr s HIS 133 CO 0.21 -1.84 1.05 0.96 -0.85 0.00 0.00 174.74 174.27 1rxr s ILE 134 N -3.19 3.70 -0.03 0.60 -4.36 -1.26 -0.55 121.20 116.12 1rxr s ILE 134 Ca 0.61 1.31 -0.30 0.00 -0.26 0.00 0.00 60.65 62.01 1rxr s ILE 134 Cb -0.14 -3.68 -0.07 0.00 1.25 0.00 0.00 42.46 39.82 1rxr s ILE 134 CO 0.54 0.02 1.77 0.00 0.24 0.00 0.00 174.94 177.50 1rxr h ALA 136 N 9.96 1.89 -2.67 0.00 0.00 -1.37 0.19 119.26 127.27 1rxr h ALA 136 Ca -0.43 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1rxr h ALA 136 Cb 1.20 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1rxr h ALA 136 CO 0.95 -0.68 0.00 -0.89 0.00 0.00 0.00 179.25 178.63 1rxr n ILE 137 N -5.17 0.00 0.58 0.00 5.41 -1.26 -4.66 119.36 114.27 1rxr n ILE 137 Ca 0.32 0.06 0.13 0.00 1.00 0.00 0.00 62.75 64.25 1rxr n ILE 137 Cb 1.03 -0.21 0.37 0.00 -0.71 0.00 0.00 39.64 40.12 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 1.29 0.85 3.88 0.00 0.00 0.68 -3.15 105.19 108.74 1rxr n GLY 139 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.73 5.31 0.12 1.61 1.11 -1.26 -4.34 116.67 116.48 1rxr s ASP 140 Ca 0.00 1.11 -0.32 0.00 0.18 0.00 0.00 52.55 53.52 1rxr s ASP 140 Cb 0.00 -1.88 -0.11 0.00 1.07 0.00 0.00 42.92 42.00 1rxr s ASP 140 CO 0.00 -1.43 1.80 -1.14 1.18 0.00 0.00 175.17 175.58 1rxr n ARG 141 N -3.06 2.66 -1.71 8.23 0.63 -1.26 0.13 116.66 122.28 1rxr n ARG 141 Ca 0.07 0.97 -0.34 0.00 -0.92 0.00 0.00 57.85 57.62 1rxr n ARG 141 Cb 0.57 -2.84 0.06 0.00 0.45 0.00 0.00 32.46 30.71 1rxr n ARG 141 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1rxr s SER 142 N 2.46 4.77 -0.04 6.15 0.01 0.29 -4.66 113.70 122.69 1rxr s SER 142 Ca 0.82 2.26 -0.11 0.00 1.31 0.00 0.00 55.95 60.23 1rxr s SER 142 Cb -0.53 -2.58 -0.31 0.00 0.21 0.00 0.00 66.02 62.81 1rxr s SER 142 CO 0.38 -1.87 0.72 0.28 0.41 0.00 0.00 173.24 173.16 1rxr h SER 143 N 0.18 0.63 0.00 2.44 0.02 -0.97 -3.44 113.55 112.40 1rxr h SER 143 Ca -0.48 -0.90 0.00 0.00 -0.84 0.00 0.00 61.79 59.57 1rxr h SER 143 Cb 1.28 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1rxr h SER 143 CO 0.53 1.75 0.00 0.61 -1.14 0.00 0.00 176.83 178.58 1rxr n GLY 144 N 1.83 -0.83 3.69 -3.77 0.00 -0.76 -5.02 105.19 100.33 1rxr n GLY 144 Ca -0.23 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.12 4.43 -0.10 1.61 2.47 -1.26 -1.14 119.74 125.63 1rxr s LYS 145 Ca 0.00 1.44 -0.01 0.00 -1.56 0.00 0.00 55.97 55.85 1rxr s LYS 145 Cb 0.00 -3.53 0.03 0.00 -1.46 0.00 0.00 37.83 32.87 1rxr s LYS 145 CO 0.00 -0.30 -0.05 -1.01 0.16 0.00 0.00 175.35 174.15 1rxr s HIS 146 N 1.89 1.22 -1.38 4.03 3.76 0.57 -4.80 115.29 120.59 1rxr s HIS 146 Ca 0.50 -0.56 -0.08 0.00 -0.15 0.00 0.00 55.06 54.78 1rxr s HIS 146 Cb -0.20 -1.09 0.05 0.00 1.11 0.00 0.00 32.58 32.45 1rxr s HIS 146 CO 0.20 -0.45 0.55 0.66 -0.85 0.00 0.00 174.74 174.85 1rxr n TYR 147 N 5.00 -1.88 -0.91 1.40 4.01 -1.26 -0.75 117.16 122.77 1rxr n TYR 147 Ca -0.11 0.51 0.00 0.00 -0.16 0.00 0.00 57.90 58.14 1rxr n TYR 147 Cb 0.50 -3.50 0.00 0.00 -0.31 0.00 0.00 39.34 36.03 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 -1.31 0.70 3.05 2.72 0.00 -1.26 -0.76 105.19 108.33 1rxr n GLY 148 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.70 0.91 0.03 1.61 1.01 0.07 -5.01 120.40 116.32 1rxr s VAL 149 Ca 0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 1rxr s VAL 149 Cb 0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 36.38 35.52 1rxr s VAL 149 CO 0.00 0.27 1.76 -0.31 0.00 0.00 0.00 175.10 176.81 1rxr s TYR 150 N -0.05 1.97 0.36 5.22 2.02 -1.26 -0.31 117.35 125.30 1rxr s TYR 150 Ca 0.01 0.04 -0.15 0.00 -0.37 0.00 0.00 57.07 56.60 1rxr s TYR 150 Cb -0.07 -4.05 0.04 0.00 -0.40 0.00 0.00 41.96 37.49 1rxr s TYR 150 CO 0.00 -4.42 0.73 -1.12 -1.57 0.00 0.00 175.55 169.17 1rxr s SER 151 N 3.22 0.06 0.14 2.29 0.01 -0.29 -0.92 113.70 118.21 1rxr s SER 151 Ca 0.78 -1.09 0.05 0.00 1.31 0.00 0.00 55.95 57.00 1rxr s SER 151 Cb -0.39 0.80 -0.04 0.00 0.21 0.00 0.00 66.02 66.60 1rxr s SER 151 CO 0.34 -1.58 0.09 0.00 0.41 0.00 0.00 173.24 172.51 1rxr h GLU 153 N 2.78 0.53 0.06 0.00 4.39 -1.95 0.27 114.58 120.66 1rxr h GLU 153 Ca -0.47 -0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.22 1rxr h GLU 153 Cb 1.19 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 1rxr h GLU 153 CO 0.63 0.35 -0.22 0.78 -1.16 0.00 0.00 179.01 179.39 1rxr h GLY 154 N 0.55 -0.36 1.00 -3.84 0.00 -1.99 0.78 103.07 99.21 1rxr h GLY 154 Ca 0.62 0.26 -0.02 0.00 0.00 0.00 0.00 47.33 48.19 1rxr h GLY 154 CO -0.48 -0.19 0.34 0.00 0.00 0.00 0.00 176.54 176.20 1rxr h LYS 156 N 0.92 -0.59 -0.33 0.00 3.64 -0.43 0.96 116.57 120.73 1rxr h LYS 156 Ca 0.23 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1rxr h LYS 156 Cb 0.09 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1rxr h LYS 156 CO -0.03 -0.39 0.16 0.78 -2.27 0.00 0.00 179.45 177.69 1rxr h GLY 157 N -0.61 0.51 0.39 5.01 0.00 -0.72 -0.28 103.07 107.36 1rxr h GLY 157 Ca 0.03 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.14 1rxr h GLY 157 CO -0.29 0.24 -0.27 -2.75 0.00 0.00 0.00 176.54 173.47 1rxr h PHE 158 N 0.40 -0.74 -0.17 5.60 3.57 -0.76 -0.98 116.94 123.86 1rxr h PHE 158 Ca 0.11 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.65 1rxr h PHE 158 Cb 0.12 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1rxr h PHE 158 CO -0.02 -0.37 0.06 0.35 -2.23 0.00 0.00 178.31 176.11 1rxr h PHE 159 N -0.42 0.11 -0.26 0.41 3.57 -0.67 0.11 116.94 119.78 1rxr h PHE 159 Ca 0.06 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.63 1rxr h PHE 159 Cb 0.50 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.14 1rxr h PHE 159 CO -0.30 0.05 -0.31 -0.22 -2.23 0.00 0.00 178.31 175.30 1rxr h LYS 160 N 0.14 -0.30 0.05 1.11 3.64 -0.61 0.18 116.57 120.78 1rxr h LYS 160 Ca 0.07 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1rxr h LYS 160 Cb 0.04 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1rxr h LYS 160 CO -0.08 -0.20 -0.02 0.00 -2.27 0.00 0.00 179.45 176.88 1rxr h ARG 161 N -0.31 -0.06 -0.47 1.90 3.08 -1.02 -2.82 114.38 114.68 1rxr h ARG 161 Ca 0.13 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.27 1rxr h ARG 161 Cb 0.53 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 30.52 1rxr h ARG 161 CO -0.44 0.15 0.06 1.15 -1.07 0.00 0.00 179.97 179.82 1rxr h THR 162 N -0.26 0.70 0.22 2.04 2.02 -0.34 0.19 112.91 117.47 1rxr h THR 162 Ca -0.01 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1rxr h THR 162 Cb 0.24 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 1rxr h THR 162 CO 0.01 0.03 -0.17 0.58 0.37 0.00 0.00 175.52 176.34 1rxr h VAL 163 N 0.18 0.63 -0.29 3.16 2.07 -0.64 0.61 116.25 121.97 1rxr h VAL 163 Ca 0.24 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.75 1rxr h VAL 163 Cb 0.33 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1rxr h VAL 163 CO -0.34 0.00 0.16 0.03 0.02 0.00 0.00 177.57 177.44 1rxr h ARG 164 N -0.40 0.39 0.00 1.57 3.08 -1.18 -3.19 114.38 114.64 1rxr h ARG 164 Ca -0.01 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.90 1rxr h ARG 164 Cb 0.36 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1rxr h ARG 164 CO -0.01 0.32 -0.76 0.87 -1.07 0.00 0.00 179.97 179.33 1rxr h LYS 165 N 0.35 0.00 -6.37 0.04 1.79 -0.93 -3.49 116.57 107.97 1rxr h LYS 165 Ca 0.10 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.10 1rxr h LYS 165 Cb 0.04 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 30.72 1rxr h LYS 165 CO -0.02 0.31 -0.93 -3.47 -1.08 0.00 0.00 179.45 174.26 1rxr n ASP 166 N -3.04 -3.43 -4.69 0.86 2.03 0.21 -4.89 116.55 103.61 1rxr n ASP 166 Ca -0.01 -1.03 -0.44 0.00 0.52 0.00 0.00 54.79 53.82 1rxr n ASP 166 Cb 0.71 -3.15 -0.04 0.00 -0.72 0.00 0.00 41.12 37.92 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 -4.33 3.61 -3.80 -2.67 7.99 -1.25 -4.85 117.00 111.70 1rxr n LEU 167 Ca -0.17 1.03 -0.42 0.00 -0.01 0.00 0.00 56.01 56.44 1rxr n LEU 167 Cb 0.62 -1.48 -0.04 0.00 -0.11 0.00 0.00 43.42 42.42 1rxr n LEU 167 CO 0.70 -0.02 2.23 0.41 -1.51 0.00 0.00 177.39 179.20 1rxr n THR 168 N 4.21 2.47 -1.51 -5.08 -1.04 -1.26 -4.94 114.28 107.13 1rxr n THR 168 Ca 0.18 -2.22 -0.30 0.00 -2.04 0.00 0.00 64.05 59.67 1rxr n THR 168 Cb 0.33 -2.40 0.11 0.00 -1.82 0.00 0.00 70.33 66.55 1rxr n THR 168 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1rxr s TYR 169 N 4.94 2.69 -0.11 -1.42 2.02 -1.26 -5.09 117.35 119.12 1rxr s TYR 169 Ca 0.55 1.08 -0.24 0.00 -0.37 0.00 0.00 57.07 58.08 1rxr s TYR 169 Cb 0.12 -3.20 0.06 0.00 -0.40 0.00 0.00 41.96 38.54 1rxr s TYR 169 CO 0.05 -2.00 0.59 0.99 -1.57 0.00 0.00 175.55 173.61 1rxr s THR 170 N -3.17 0.01 -0.09 -0.71 2.01 -1.26 -4.82 115.64 107.61 1rxr s THR 170 Ca 0.62 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.54 1rxr s THR 170 Cb -0.15 -0.87 -0.03 0.00 0.01 0.00 0.00 72.50 71.46 1rxr s THR 170 CO 0.54 -0.05 -0.09 0.00 -0.69 0.00 0.00 174.62 174.34 1rxr n ARG 172 N 2.68 1.91 0.00 0.00 3.00 -1.26 -4.46 116.66 118.53 1rxr n ARG 172 Ca -0.18 -1.07 0.00 0.00 -0.01 0.00 0.00 57.85 56.59 1rxr n ARG 172 Cb 0.53 -2.10 0.00 0.00 0.00 0.00 0.00 32.46 30.88 1rxr n ARG 172 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1rxr n ASP 173 N 3.03 0.00 -4.09 0.55 8.00 -1.26 -5.19 116.55 117.58 1rxr n ASP 173 Ca 0.41 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.80 1rxr n ASP 173 Cb 0.53 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.55 1rxr n ASP 173 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1rxr s ASN 174 N 1.48 0.11 0.55 -2.24 0.02 -1.26 -5.05 114.94 108.55 1rxr s ASN 174 Ca 0.00 -1.14 0.30 0.00 -1.02 0.00 0.00 52.86 51.00 1rxr s ASN 174 Cb 0.00 0.42 1.46 0.00 0.02 0.00 0.00 41.25 43.15 1rxr s ASN 174 CO 0.00 -0.89 1.91 0.50 0.02 0.00 0.00 177.10 178.64 1rxr h LYS 175 N 2.58 0.00 0.00 -0.60 3.64 -2.03 0.13 116.57 120.28 1rxr h LYS 175 Ca -0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1rxr h LYS 175 Cb 1.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1rxr h LYS 175 CO 0.50 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.28 1rxr n ASP 176 N -4.18 0.00 -4.02 4.20 5.75 -1.26 -4.61 116.55 112.44 1rxr n ASP 176 Ca 0.15 -1.36 -0.37 0.00 -0.01 0.00 0.00 54.79 53.20 1rxr n ASP 176 Cb 0.84 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.87 1rxr n ASP 176 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1rxr n LEU 178 N 10.32 3.48 -4.75 0.00 7.94 -1.26 -4.89 117.00 127.83 1rxr n LEU 178 Ca 0.48 1.15 -0.40 0.00 -1.11 0.00 0.00 56.01 56.13 1rxr n LEU 178 Cb 0.43 -1.48 -0.06 0.00 0.53 0.00 0.00 43.42 42.85 1rxr n LEU 178 CO 0.90 -0.33 0.60 -0.63 -1.11 0.00 0.00 177.39 176.81 1rxr s ILE 179 N -0.20 4.25 0.33 1.96 -1.09 -1.26 -4.84 121.20 120.35 1rxr s ILE 179 Ca 0.65 1.96 -0.18 0.00 -2.23 0.00 0.00 60.65 60.85 1rxr s ILE 179 Cb -0.60 -4.27 0.04 0.00 -1.58 0.00 0.00 42.46 36.06 1rxr s ILE 179 CO 0.51 0.47 0.79 -1.81 -1.23 0.00 0.00 174.94 173.67 1rxr s ASP 180 N -0.94 -0.09 0.39 3.58 1.01 -1.26 -4.92 116.67 114.44 1rxr s ASP 180 Ca 0.40 -0.92 0.20 0.00 0.71 0.00 0.00 52.55 52.94 1rxr s ASP 180 Cb -0.25 0.78 1.15 0.00 1.01 0.00 0.00 42.92 45.62 1rxr s ASP 180 CO 0.30 -1.52 1.72 0.11 0.21 0.00 0.00 175.17 175.99 1rxr h LYS 181 N 2.00 0.33 -1.01 8.23 1.79 -1.90 0.42 116.57 126.42 1rxr h LYS 181 Ca -0.27 -0.02 0.26 0.00 -2.18 0.00 0.00 60.65 58.44 1rxr h LYS 181 Cb 1.25 -0.07 -0.13 0.00 -1.58 0.00 0.00 32.23 31.70 1rxr h LYS 181 CO 0.34 0.22 0.60 0.00 -1.08 0.00 0.00 179.45 179.53 1rxr h ARG 182 N 0.34 0.51 -6.10 3.15 3.08 -1.95 -3.41 114.38 109.98 1rxr h ARG 182 Ca 0.67 -0.03 -0.58 0.00 0.07 0.00 0.00 59.98 60.11 1rxr h ARG 182 Cb 1.73 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 31.61 1rxr h ARG 182 CO -0.38 0.33 0.83 -0.65 -1.07 0.00 0.00 179.97 179.03 1rxr s GLN 183 N -5.72 4.25 0.47 0.04 -1.52 0.14 -5.01 119.66 112.31 1rxr s GLN 183 Ca -0.10 1.45 -0.24 0.00 -1.95 0.00 0.00 55.36 54.52 1rxr s GLN 183 Cb 0.27 -3.68 -0.08 0.00 -0.22 0.00 0.00 33.01 29.31 1rxr s GLN 183 CO 0.80 -0.65 1.27 0.54 -0.25 0.00 0.00 175.29 176.99 1rxr n ARG 184 N 6.40 1.78 -0.34 2.91 3.00 -1.26 -4.86 116.66 124.27 1rxr n ARG 184 Ca 0.13 0.64 0.09 0.00 -0.01 0.00 0.00 57.85 58.70 1rxr n ARG 184 Cb 0.46 -2.42 0.20 0.00 0.00 0.00 0.00 32.46 30.70 1rxr n ARG 184 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1rxr n ASN 185 N -0.20 -0.25 -3.59 0.55 5.15 -1.26 -2.89 115.26 112.76 1rxr n ASN 185 Ca 0.08 1.66 -0.41 0.00 -0.60 0.00 0.00 54.58 55.32 1rxr n ASN 185 Cb 0.42 -0.54 -0.04 0.00 -0.53 0.00 0.00 39.78 39.08 1rxr n ASN 185 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1rxr n ARG 186 N -5.53 1.93 -2.56 1.20 1.74 -1.26 -4.28 116.66 107.91 1rxr n ARG 186 Ca 0.19 -1.99 -0.12 0.00 -0.77 0.00 0.00 57.85 55.16 1rxr n ARG 186 Cb 0.59 -2.95 0.03 0.00 -1.02 0.00 0.00 32.46 29.12 1rxr n ARG 186 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rxr h GLN 188 N 2.61 -0.04 -0.12 0.00 7.50 -1.89 -0.39 115.11 122.77 1rxr h GLN 188 Ca 0.05 0.00 0.03 0.00 0.50 0.00 0.00 58.65 59.24 1rxr h GLN 188 Cb 1.26 0.01 -0.06 0.00 0.05 0.00 0.00 27.48 28.73 1rxr h GLN 188 CO 0.49 -0.03 -0.49 -0.92 -1.50 0.00 0.00 178.83 176.38 1rxr h TYR 189 N -0.04 -1.45 -0.64 2.96 3.20 -1.88 0.72 116.97 119.85 1rxr h TYR 189 Ca 0.10 0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.07 1rxr h TYR 189 Cb 0.30 0.65 -0.05 0.00 1.54 0.00 0.00 36.73 39.17 1rxr h TYR 189 CO -0.96 -0.53 0.36 0.00 -1.64 0.00 0.00 178.16 175.40 1rxr h ARG 191 N 0.68 0.54 -0.05 0.00 3.08 -0.41 0.14 114.38 118.35 1rxr h ARG 191 Ca 0.28 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1rxr h ARG 191 Cb 0.14 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 1rxr h ARG 191 CO -0.16 0.36 0.03 -0.92 -1.07 0.00 0.00 179.97 178.22 1rxr h TYR 192 N 0.55 0.07 -0.51 3.04 3.20 -0.29 -0.57 116.97 122.46 1rxr h TYR 192 Ca 0.15 0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.09 1rxr h TYR 192 Cb -0.06 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.13 1rxr h TYR 192 CO -0.05 0.07 0.20 1.96 -1.64 0.00 0.00 178.16 178.70 1rxr h GLN 193 N 0.05 0.37 0.31 1.82 1.08 -0.60 -0.13 115.11 118.01 1rxr h GLN 193 Ca 0.02 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1rxr h GLN 193 Cb 0.02 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 1rxr h GLN 193 CO -0.00 0.25 -0.31 0.87 -0.95 0.00 0.00 178.83 178.68 1rxr h LYS 194 N 0.38 -0.62 -0.55 1.46 1.79 -0.39 0.13 116.57 118.77 1rxr h LYS 194 Ca 0.25 0.04 0.11 0.00 -2.18 0.00 0.00 60.65 58.87 1rxr h LYS 194 Cb 0.25 0.14 -0.09 0.00 -1.58 0.00 0.00 32.23 30.95 1rxr h LYS 194 CO -0.24 -0.42 0.01 0.00 -1.08 0.00 0.00 179.45 177.72 1rxr h ALA 195 N -0.09 0.53 0.36 3.86 0.00 -0.57 0.88 119.26 124.22 1rxr h ALA 195 Ca -0.01 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1rxr h ALA 195 Cb 0.59 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1rxr h ALA 195 CO -0.06 -0.38 -0.17 -0.07 0.00 0.00 0.00 179.25 178.56 1rxr h LEU 196 N 0.12 -0.41 -0.74 0.00 3.38 -0.79 -0.95 115.31 115.92 1rxr h LEU 196 Ca 0.28 -0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.32 1rxr h LEU 196 Cb 0.43 0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.21 1rxr h LEU 196 CO -0.46 -0.22 0.35 0.00 0.09 0.00 0.00 178.44 178.20 1rxr h ALA 197 N 0.02 1.04 0.00 1.53 0.00 -0.15 0.90 119.26 122.61 1rxr h ALA 197 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1rxr h ALA 197 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1rxr h ALA 197 CO 0.08 -0.11 0.00 -1.33 0.00 0.00 0.00 179.25 177.90 1rxr n MET 198 N -4.91 0.19 -2.20 0.00 2.81 0.25 -4.90 117.12 108.36 1rxr n MET 198 Ca 0.13 0.12 0.00 0.00 -1.81 0.00 0.00 57.70 56.14 1rxr n MET 198 Cb 0.34 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.35 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 0.46 0.88 3.69 3.03 0.00 0.31 -5.00 105.19 108.56 1rxr n GLY 199 Ca 0.08 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.56 2.80 -1.89 1.61 2.00 -0.39 -4.80 117.12 115.89 1rxr n MET 200 Ca 0.00 1.02 -0.23 0.00 0.00 0.00 0.00 57.70 58.49 1rxr n MET 200 Cb 0.46 -2.91 -0.08 0.00 0.00 0.00 0.00 33.22 30.69 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 2.59 2.02 0.30 0.03 -0.14 0.06 -4.79 119.74 119.80 1rxr s LYS 201 Ca 0.81 -0.73 0.07 0.00 -1.36 0.00 0.00 55.97 54.77 1rxr s LYS 201 Cb -0.48 -5.11 0.86 0.00 -1.68 0.00 0.00 37.83 31.42 1rxr s LYS 201 CO 0.37 -4.44 1.41 -2.13 -0.76 0.00 0.00 175.35 169.79 1rxr n ARG 202 N 8.35 -0.07 -0.26 1.68 0.63 -1.26 -0.42 116.66 125.31 1rxr n ARG 202 Ca 0.43 1.31 0.07 0.00 -0.92 0.00 0.00 57.85 58.74 1rxr n ARG 202 Cb 0.46 -2.16 0.20 0.00 0.45 0.00 0.00 32.46 31.41 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 0.17 -0.80 -0.14 3.07 -1.99 -0.02 114.58 114.87 1rxr h GLU 203 Ca 0.62 -0.01 0.23 0.00 -0.50 0.00 0.00 59.36 59.69 1rxr h GLU 203 Cb 1.42 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 29.25 1rxr h GLU 203 CO -0.79 0.11 0.57 0.00 -1.40 0.00 0.00 179.01 177.50 1rxr h ALA 204 N 1.70 2.69 -0.54 3.43 0.00 -1.14 -0.05 119.26 125.36 1rxr h ALA 204 Ca 0.45 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.40 1rxr h ALA 204 Cb 0.82 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 1rxr h ALA 204 CO -0.62 -0.92 0.23 0.28 0.00 0.00 0.00 179.25 178.22 1rxr h VAL 205 N 0.04 0.87 0.00 0.00 2.07 -1.13 0.10 116.25 118.21 1rxr h VAL 205 Ca 0.38 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.75 1rxr h VAL 205 Cb 1.47 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1rxr h VAL 205 CO -0.02 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.65 1rxr n GLN 206 N -4.94 0.17 -0.03 1.57 6.02 -0.04 -0.37 117.38 119.76 1rxr n GLN 206 Ca 0.06 0.11 -0.21 0.00 -0.01 0.00 0.00 57.00 56.95 1rxr n GLN 206 Cb 0.19 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 29.82 1rxr n GLN 206 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1rxr n GLU 207 N -1.38 0.72 -0.07 -1.09 1.02 0.21 -4.27 120.64 115.78 1rxr n GLU 207 Ca 0.08 0.26 -0.08 0.00 -0.02 0.00 0.00 57.16 57.40 1rxr n GLU 207 Cb 0.20 -1.67 -0.06 0.00 -0.02 0.00 0.00 31.44 29.89 1rxr n GLU 207 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1rxr h GLU 208 N -0.04 0.00 -6.00 3.49 4.81 -1.02 -3.41 114.58 112.40 1rxr h GLU 208 Ca -0.46 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.17 1rxr h GLU 208 Cb 1.95 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 31.22 1rxr h GLU 208 CO 0.02 0.44 1.31 1.03 -0.73 0.00 0.00 179.01 181.08 1rxr s ARG 209 N -2.01 3.50 0.16 1.92 1.81 0.50 -4.96 118.95 119.88 1rxr s ARG 209 Ca -0.13 -1.03 -0.32 0.00 -1.72 0.00 0.00 55.73 52.53 1rxr s ARG 209 Cb 0.01 -5.06 -0.16 0.00 -0.45 0.00 0.00 34.95 29.28 1rxr s ARG 209 CO 0.33 -2.13 0.98 1.04 -0.68 0.00 0.00 175.30 174.84 1rxr n GLN 210 N 8.66 0.73 -0.70 3.54 1.13 -1.26 -4.35 117.38 125.12 1rxr n GLN 210 Ca 0.25 0.26 -0.41 0.00 -1.94 0.00 0.00 57.00 55.16 1rxr n GLN 210 Cb 0.50 -1.62 -0.09 0.00 0.11 0.00 0.00 30.24 29.14 1rxr n GLN 210 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1rxr n ARG 211 N 1.41 0.58 0.00 -1.09 1.85 -1.26 -5.07 116.66 113.09 1rxr n ARG 211 Ca 0.16 -1.27 0.00 0.00 -1.00 0.00 0.00 57.85 55.74 1rxr n ARG 211 Cb 0.23 -2.61 0.00 0.00 -1.05 0.00 0.00 32.46 29.03 1rxr n ARG 211 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03