#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 0.47 -0.10 4.37 1.35 -2.07 -3.12 112.91 113.81 1rxr h THR 131 Ca 0.00 0.00 -0.63 0.00 -0.55 0.00 0.00 66.41 65.23 1rxr h THR 131 Cb 0.00 0.47 0.01 0.00 -1.73 0.00 0.00 68.15 66.90 1rxr h THR 131 CO 0.00 0.00 2.36 0.29 -0.25 0.00 0.00 175.52 177.92 1rxr n LYS 132 N -5.38 1.92 -1.80 4.72 5.02 -1.26 -4.94 118.16 116.44 1rxr n LYS 132 Ca -0.09 -2.16 -0.40 0.00 -2.02 0.00 0.00 58.31 53.64 1rxr n LYS 132 Cb 0.28 -3.12 0.02 0.00 -0.02 0.00 0.00 35.03 32.19 1rxr n LYS 132 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1rxr s HIS 133 N 5.20 2.44 0.18 2.13 3.76 -1.18 -4.92 115.29 122.90 1rxr s HIS 133 Ca 0.56 1.28 0.04 0.00 -0.15 0.00 0.00 55.06 56.78 1rxr s HIS 133 Cb 0.12 -3.91 -0.03 0.00 1.11 0.00 0.00 32.58 29.87 1rxr s HIS 133 CO 0.07 -2.93 0.29 0.96 -0.85 0.00 0.00 174.74 172.27 1rxr s ILE 134 N -1.21 5.17 -0.06 0.60 -4.36 -1.26 -1.14 121.20 118.93 1rxr s ILE 134 Ca 0.62 -0.86 -0.30 0.00 -0.26 0.00 0.00 60.65 59.86 1rxr s ILE 134 Cb -0.43 -3.71 -0.04 0.00 1.25 0.00 0.00 42.46 39.53 1rxr s ILE 134 CO 0.55 -0.18 1.40 0.00 0.24 0.00 0.00 174.94 176.95 1rxr h ALA 136 N 8.25 1.66 0.01 0.00 0.00 -1.47 0.32 119.26 128.02 1rxr h ALA 136 Ca -0.35 0.08 -0.26 0.00 0.00 0.00 0.00 54.91 54.38 1rxr h ALA 136 Cb 1.16 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.88 1rxr h ALA 136 CO 0.93 -0.04 -1.04 0.82 0.00 0.00 0.00 179.25 179.91 1rxr h ILE 137 N 0.77 1.29 0.00 0.00 2.04 -1.91 -3.41 117.51 116.29 1rxr h ILE 137 Ca 0.58 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 64.15 1rxr h ILE 137 Cb 0.89 2.40 0.00 0.00 -0.74 0.00 0.00 36.82 39.37 1rxr h ILE 137 CO -0.38 0.70 0.00 0.00 0.00 0.00 0.00 178.15 178.47 1rxr n GLY 139 N -0.05 0.45 3.82 0.00 0.00 0.11 -3.93 105.19 105.58 1rxr n GLY 139 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.33 3.70 -0.04 1.61 1.11 -1.26 -4.37 116.67 115.09 1rxr s ASP 140 Ca 0.00 0.88 -0.33 0.00 0.18 0.00 0.00 52.55 53.28 1rxr s ASP 140 Cb 0.00 -1.40 -0.11 0.00 1.07 0.00 0.00 42.92 42.48 1rxr s ASP 140 CO 0.00 -2.42 1.90 -1.14 1.18 0.00 0.00 175.17 174.68 1rxr n ARG 141 N -3.67 2.39 -2.11 8.23 3.00 -1.26 0.13 116.66 123.37 1rxr n ARG 141 Ca 0.07 0.88 -0.41 0.00 -0.00 0.00 0.00 57.85 58.39 1rxr n ARG 141 Cb 0.60 -2.75 -0.02 0.00 0.00 0.00 0.00 32.46 30.29 1rxr n ARG 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1rxr s SER 142 N 4.01 6.76 0.02 6.15 0.15 -0.29 -4.55 113.70 125.95 1rxr s SER 142 Ca 0.91 2.69 -0.01 0.00 0.70 0.00 0.00 55.95 60.24 1rxr s SER 142 Cb -0.61 -2.65 -0.26 0.00 -1.71 0.00 0.00 66.02 60.78 1rxr s SER 142 CO 0.48 -0.55 0.92 0.28 1.20 0.00 0.00 173.24 175.57 1rxr h SER 143 N 3.54 0.31 0.00 5.45 0.02 -0.83 -3.47 113.55 118.57 1rxr h SER 143 Ca -0.49 -0.42 0.00 0.00 -0.84 0.00 0.00 61.79 60.05 1rxr h SER 143 Cb 1.23 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1rxr h SER 143 CO 0.67 1.34 0.00 0.61 -1.14 0.00 0.00 176.83 178.31 1rxr n GLY 144 N 1.60 -1.41 3.66 -3.77 0.00 -0.85 -5.01 105.19 99.42 1rxr n GLY 144 Ca -0.14 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.06 4.22 -0.06 1.61 2.47 -1.26 -1.02 119.74 124.65 1rxr s LYS 145 Ca 0.00 1.67 0.01 0.00 -1.56 0.00 0.00 55.97 56.10 1rxr s LYS 145 Cb 0.00 -3.78 0.02 0.00 -1.46 0.00 0.00 37.83 32.61 1rxr s LYS 145 CO 0.00 -0.72 -0.08 -1.01 0.16 0.00 0.00 175.35 173.70 1rxr s HIS 146 N 3.54 1.06 -1.10 4.03 3.76 0.40 -4.80 115.29 122.18 1rxr s HIS 146 Ca 0.55 -0.36 -0.08 0.00 -0.15 0.00 0.00 55.06 55.02 1rxr s HIS 146 Cb -0.22 -0.85 0.07 0.00 1.11 0.00 0.00 32.58 32.69 1rxr s HIS 146 CO 0.15 -0.24 0.36 0.66 -0.85 0.00 0.00 174.74 174.82 1rxr n TYR 147 N 4.03 -1.70 -0.40 1.40 4.01 -1.26 -0.80 117.16 122.43 1rxr n TYR 147 Ca -0.23 0.36 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 1rxr n TYR 147 Cb 0.51 -2.45 0.00 0.00 -0.31 0.00 0.00 39.34 37.09 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 -1.00 0.98 3.06 2.72 0.00 -1.26 -0.70 105.19 109.00 1rxr n GLY 148 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.94 0.61 0.05 1.61 1.01 0.02 -5.03 120.40 115.73 1rxr s VAL 149 Ca 0.00 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 1rxr s VAL 149 Cb 0.00 -0.64 -0.08 0.00 0.00 0.00 0.00 36.38 35.66 1rxr s VAL 149 CO 0.00 -0.28 1.65 -0.31 0.00 0.00 0.00 175.10 176.16 1rxr s TYR 150 N -1.18 2.34 0.32 5.22 2.02 -1.26 -0.45 117.35 124.35 1rxr s TYR 150 Ca -0.07 0.30 -0.09 0.00 -0.37 0.00 0.00 57.07 56.84 1rxr s TYR 150 Cb -0.09 -3.95 0.01 0.00 -0.40 0.00 0.00 41.96 37.53 1rxr s TYR 150 CO 0.01 -3.85 0.54 -1.12 -1.57 0.00 0.00 175.55 169.56 1rxr s SER 151 N 2.59 0.36 0.15 2.29 0.01 -0.19 -1.13 113.70 117.77 1rxr s SER 151 Ca 0.74 -1.21 0.06 0.00 1.31 0.00 0.00 55.95 56.86 1rxr s SER 151 Cb -0.38 0.68 -0.04 0.00 0.21 0.00 0.00 66.02 66.48 1rxr s SER 151 CO 0.32 -1.32 0.01 0.00 0.41 0.00 0.00 173.24 172.65 1rxr n GLU 153 N 0.07 -0.08 0.33 0.00 -0.00 -1.26 -0.36 120.64 119.35 1rxr n GLU 153 Ca -0.10 1.48 -0.17 0.00 -0.00 0.00 0.00 57.16 58.36 1rxr n GLU 153 Cb 0.54 -2.38 -0.09 0.00 -0.00 0.00 0.00 31.44 29.51 1rxr n GLU 153 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 1rxr h GLY 154 N 0.00 -0.91 0.77 -1.84 0.00 -1.96 -0.47 103.07 98.66 1rxr h GLY 154 Ca 0.64 0.36 0.06 0.00 0.00 0.00 0.00 47.33 48.38 1rxr h GLY 154 CO -0.91 -0.33 0.60 0.00 0.00 0.00 0.00 176.54 175.90 1rxr h LYS 156 N 1.11 -0.26 -0.45 0.00 3.64 -0.31 0.12 116.57 120.42 1rxr h LYS 156 Ca 0.40 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.85 1rxr h LYS 156 Cb 0.12 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.95 1rxr h LYS 156 CO -0.16 -0.17 0.17 0.78 -2.27 0.00 0.00 179.45 177.80 1rxr h GLY 157 N -0.27 0.60 0.12 5.01 0.00 -0.96 -0.40 103.07 107.17 1rxr h GLY 157 Ca -0.01 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.24 1rxr h GLY 157 CO -0.03 0.04 -0.44 -2.75 0.00 0.00 0.00 176.54 173.35 1rxr h PHE 158 N 0.36 -1.26 -0.23 5.60 3.57 -0.82 -0.37 116.94 123.79 1rxr h PHE 158 Ca 0.21 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 1rxr h PHE 158 Cb 0.19 0.55 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1rxr h PHE 158 CO -0.14 -0.51 0.14 0.35 -2.23 0.00 0.00 178.31 175.92 1rxr h PHE 159 N -0.59 0.30 -0.30 0.41 3.57 -0.43 0.19 116.94 120.09 1rxr h PHE 159 Ca 0.04 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.61 1rxr h PHE 159 Cb 0.67 -0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.24 1rxr h PHE 159 CO -0.44 0.22 -0.14 -0.22 -2.23 0.00 0.00 178.31 175.51 1rxr h LYS 160 N 0.29 -0.09 0.08 1.11 3.64 -0.72 0.17 116.57 121.07 1rxr h LYS 160 Ca 0.08 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1rxr h LYS 160 Cb 0.01 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1rxr h LYS 160 CO -0.02 -0.06 -0.04 0.00 -2.27 0.00 0.00 179.45 177.07 1rxr h ARG 161 N -0.09 -0.11 -0.88 1.90 3.08 -0.91 -3.20 114.38 114.17 1rxr h ARG 161 Ca 0.16 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.35 1rxr h ARG 161 Cb 0.32 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.31 1rxr h ARG 161 CO -0.36 0.28 0.49 1.15 -1.07 0.00 0.00 179.97 180.45 1rxr h THR 162 N -0.52 0.78 0.01 2.04 2.02 -0.31 0.66 112.91 117.60 1rxr h THR 162 Ca -0.01 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1rxr h THR 162 Cb 0.44 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1rxr h THR 162 CO 0.02 0.13 -0.02 0.58 0.37 0.00 0.00 175.52 176.60 1rxr h VAL 163 N 0.71 0.94 -0.20 3.16 2.07 -0.70 0.53 116.25 122.76 1rxr h VAL 163 Ca 0.47 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.95 1rxr h VAL 163 Cb 0.61 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1rxr h VAL 163 CO -0.33 0.00 -0.02 0.03 0.02 0.00 0.00 177.57 177.27 1rxr h ARG 164 N -0.05 0.37 0.05 1.57 3.08 -1.37 -3.30 114.38 114.73 1rxr h ARG 164 Ca 0.01 -0.13 -0.23 0.00 0.07 0.00 0.00 59.98 59.69 1rxr h ARG 164 Cb 0.05 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1rxr h ARG 164 CO -0.01 0.59 -1.04 0.87 -1.07 0.00 0.00 179.97 179.31 1rxr h LYS 165 N 0.11 0.23 -5.89 0.04 1.79 -0.86 -3.49 116.57 108.51 1rxr h LYS 165 Ca 0.05 -0.31 -0.36 0.00 -2.18 0.00 0.00 60.65 57.85 1rxr h LYS 165 Cb 0.44 0.10 0.12 0.00 -1.58 0.00 0.00 32.23 31.31 1rxr h LYS 165 CO 0.01 1.08 -0.87 -3.47 -1.08 0.00 0.00 179.45 175.13 1rxr n ASP 166 N -3.58 -4.26 -4.68 0.86 2.03 0.18 -4.92 116.55 102.17 1rxr n ASP 166 Ca -0.05 -0.83 -0.43 0.00 0.52 0.00 0.00 54.79 54.00 1rxr n ASP 166 Cb 0.91 -4.30 -0.03 0.00 -0.72 0.00 0.00 41.12 36.97 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 -3.90 4.00 -3.98 -2.67 7.99 -1.26 -4.87 117.00 112.31 1rxr n LEU 167 Ca -0.16 0.98 -0.41 0.00 -0.01 0.00 0.00 56.01 56.40 1rxr n LEU 167 Cb 0.63 -1.53 -0.02 0.00 -0.11 0.00 0.00 43.42 42.40 1rxr n LEU 167 CO 0.64 0.15 2.31 0.35 -1.51 0.00 0.00 177.39 179.34 1rxr n THR 168 N 4.81 3.12 -1.63 -5.08 -2.24 -1.26 -4.95 114.28 107.06 1rxr n THR 168 Ca 0.19 -2.91 -0.29 0.00 -2.27 0.00 0.00 64.05 58.77 1rxr n THR 168 Cb 0.37 -2.46 0.10 0.00 -2.10 0.00 0.00 70.33 66.24 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 4.45 2.80 0.12 4.78 2.02 -1.26 -5.10 117.35 125.16 1rxr s TYR 169 Ca 0.52 0.99 -0.18 0.00 -0.37 0.00 0.00 57.07 58.04 1rxr s TYR 169 Cb 0.11 -3.25 0.04 0.00 -0.40 0.00 0.00 41.96 38.46 1rxr s TYR 169 CO 0.01 -1.90 0.44 0.99 -1.57 0.00 0.00 175.55 173.52 1rxr s THR 170 N -3.27 0.06 -0.07 -0.71 2.01 -1.26 -4.87 115.64 107.52 1rxr s THR 170 Ca 0.62 -0.46 -0.10 0.00 0.31 0.00 0.00 61.69 62.05 1rxr s THR 170 Cb -0.14 -1.12 0.02 0.00 0.01 0.00 0.00 72.50 71.28 1rxr s THR 170 CO 0.53 -0.26 0.27 0.00 -0.69 0.00 0.00 174.62 174.47 1rxr n ARG 172 N 2.46 2.51 0.00 0.00 1.74 -1.26 -4.59 116.66 117.51 1rxr n ARG 172 Ca -0.16 -1.38 0.00 0.00 -0.77 0.00 0.00 57.85 55.54 1rxr n ARG 172 Cb 0.57 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 1rxr n ARG 172 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1rxr n ASP 173 N 2.93 1.64 -4.12 0.55 8.00 -1.26 -5.19 116.55 119.09 1rxr n ASP 173 Ca 0.54 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.93 1rxr n ASP 173 Cb 0.64 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.65 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 1.66 0.11 0.31 -2.24 0.02 -1.26 -5.06 114.94 108.48 1rxr s ASN 174 Ca 0.00 -1.21 0.08 0.00 -1.02 0.00 0.00 52.86 50.71 1rxr s ASN 174 Cb 0.00 0.41 0.85 0.00 0.02 0.00 0.00 41.25 42.53 1rxr s ASN 174 CO 0.00 -0.89 1.71 0.07 0.02 0.00 0.00 177.10 178.01 1rxr h LYS 175 N 2.58 0.47 -3.15 -0.60 2.10 -1.96 -2.80 116.57 113.21 1rxr h LYS 175 Ca -0.33 -0.03 -0.66 0.00 -2.00 0.00 0.00 60.65 57.62 1rxr h LYS 175 Cb 1.24 -0.11 0.02 0.00 -0.90 0.00 0.00 32.23 32.48 1rxr h LYS 175 CO 0.50 0.31 3.72 -3.47 -2.00 0.00 0.00 179.45 178.51 1rxr n ASP 176 N -4.96 7.98 -4.93 7.07 2.03 -1.26 -4.72 116.55 117.76 1rxr n ASP 176 Ca 0.26 -2.60 -0.25 0.00 0.52 0.00 0.00 54.79 52.72 1rxr n ASP 176 Cb 0.73 -1.55 0.05 0.00 -0.72 0.00 0.00 41.12 39.63 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 -2.72 5.22 -3.57 0.00 7.94 -1.26 -4.82 117.00 117.78 1rxr n LEU 178 Ca 0.07 -3.35 -0.40 0.00 -1.11 0.00 0.00 56.01 51.22 1rxr n LEU 178 Cb 0.60 -1.30 -0.02 0.00 0.53 0.00 0.00 43.42 43.22 1rxr n LEU 178 CO 0.51 0.27 2.71 -0.38 -1.11 0.00 0.00 177.39 179.39 1rxr n ILE 179 N 5.49 3.24 -1.29 1.96 2.08 -1.26 -4.90 119.36 124.68 1rxr n ILE 179 Ca 0.51 -2.51 -0.31 0.00 0.56 0.00 0.00 62.75 61.00 1rxr n ILE 179 Cb 0.37 -2.52 0.10 0.00 -0.75 0.00 0.00 39.64 36.85 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 3.34 4.35 0.27 4.38 1.01 -1.26 -4.73 116.67 124.02 1rxr s ASP 180 Ca 0.53 1.70 -0.05 0.00 0.71 0.00 0.00 52.55 55.45 1rxr s ASP 180 Cb 0.15 -2.42 0.52 0.00 1.01 0.00 0.00 42.92 42.18 1rxr s ASP 180 CO -0.04 -2.12 1.60 0.11 0.21 0.00 0.00 175.17 174.94 1rxr h LYS 181 N -1.19 0.05 -0.98 8.23 1.79 -1.93 0.17 116.57 122.72 1rxr h LYS 181 Ca -0.45 -0.00 0.26 0.00 -2.18 0.00 0.00 60.65 58.28 1rxr h LYS 181 Cb 1.24 -0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.82 1rxr h LYS 181 CO 0.53 0.03 0.68 0.00 -1.08 0.00 0.00 179.45 179.61 1rxr h ARG 182 N 0.05 0.17 -0.30 3.15 3.08 -1.91 0.62 114.38 119.24 1rxr h ARG 182 Ca 0.47 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.51 1rxr h ARG 182 Cb 0.86 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1rxr h ARG 182 CO -0.81 0.11 0.00 1.04 -1.07 0.00 0.00 179.97 179.25 1rxr n GLN 183 N -4.38 1.57 -0.29 0.04 6.02 0.60 -4.58 117.38 116.36 1rxr n GLN 183 Ca 0.21 -0.77 0.28 0.00 -0.01 0.00 0.00 57.00 56.71 1rxr n GLN 183 Cb 0.94 -1.24 0.52 0.00 1.02 0.00 0.00 30.24 31.48 1rxr n GLN 183 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1rxr n ARG 184 N 0.12 -0.05 -2.69 -1.09 1.85 0.21 -1.08 116.66 113.93 1rxr n ARG 184 Ca 0.07 1.16 -0.07 0.00 -1.00 0.00 0.00 57.85 58.01 1rxr n ARG 184 Cb 0.22 -2.12 0.04 0.00 -1.05 0.00 0.00 32.46 29.56 1rxr n ARG 184 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1rxr n ASN 185 N -4.85 1.25 0.01 2.89 5.15 -1.26 -4.61 115.26 113.84 1rxr n ASN 185 Ca 0.33 -2.57 -0.01 0.00 -0.60 0.00 0.00 54.58 51.73 1rxr n ASN 185 Cb 1.14 -0.42 -0.00 0.00 -0.53 0.00 0.00 39.78 39.96 1rxr n ASN 185 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1rxr n ARG 186 N -0.20 0.03 -1.36 1.20 0.63 -0.24 -4.89 116.66 111.82 1rxr n ARG 186 Ca 0.08 0.01 -0.38 0.00 -0.92 0.00 0.00 57.85 56.64 1rxr n ARG 186 Cb 0.82 -0.32 -0.02 0.00 0.45 0.00 0.00 32.46 33.38 1rxr n ARG 186 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1rxr n GLN 188 N 5.22 -0.20 -0.03 0.00 1.13 -1.26 -1.13 117.38 121.10 1rxr n GLN 188 Ca 0.59 1.14 -0.13 0.00 -1.94 0.00 0.00 57.00 56.65 1rxr n GLN 188 Cb 0.31 -1.69 -0.09 0.00 0.11 0.00 0.00 30.24 28.88 1rxr n GLN 188 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 1rxr h TYR 189 N 0.00 -1.46 -0.85 1.08 3.20 -1.88 0.25 116.97 117.31 1rxr h TYR 189 Ca 0.07 0.06 0.06 0.00 3.14 0.00 0.00 58.73 62.06 1rxr h TYR 189 Cb 0.19 0.66 -0.06 0.00 1.54 0.00 0.00 36.73 39.05 1rxr h TYR 189 CO -0.89 -0.48 0.53 0.00 -1.64 0.00 0.00 178.16 175.68 1rxr h ARG 191 N 0.97 0.43 0.08 0.00 3.08 -0.22 0.23 114.38 118.94 1rxr h ARG 191 Ca 0.37 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 1rxr h ARG 191 Cb 0.17 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1rxr h ARG 191 CO -0.17 0.29 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.06 1rxr h TYR 192 N 0.44 -0.10 -0.59 3.04 3.20 0.18 0.83 116.97 123.98 1rxr h TYR 192 Ca 0.19 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.11 1rxr h TYR 192 Cb 0.09 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.34 1rxr h TYR 192 CO -0.10 -0.04 0.30 1.96 -1.64 0.00 0.00 178.16 178.64 1rxr h GLN 193 N -0.12 0.55 -0.03 1.82 1.08 -0.64 -0.40 115.11 117.36 1rxr h GLN 193 Ca -0.01 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1rxr h GLN 193 Cb 0.10 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.40 1rxr h GLN 193 CO 0.02 0.36 0.01 0.87 -0.95 0.00 0.00 178.83 179.14 1rxr h LYS 194 N 0.56 0.04 -0.41 1.46 1.79 -0.28 0.21 116.57 119.94 1rxr h LYS 194 Ca 0.27 -0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.82 1rxr h LYS 194 Cb 0.20 -0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.76 1rxr h LYS 194 CO -0.19 0.10 -0.11 0.00 -1.08 0.00 0.00 179.45 178.17 1rxr h ALA 195 N 0.94 0.27 -0.31 3.86 0.00 -0.40 0.01 119.26 123.62 1rxr h ALA 195 Ca 0.01 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1rxr h ALA 195 Cb 0.07 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1rxr h ALA 195 CO -0.00 -0.45 0.14 -0.07 0.00 0.00 0.00 179.25 178.87 1rxr h LEU 196 N -0.01 0.42 -0.47 0.00 3.38 -0.82 -0.76 115.31 117.05 1rxr h LEU 196 Ca 0.20 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1rxr h LEU 196 Cb 0.31 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 1rxr h LEU 196 CO -0.43 0.44 0.09 0.00 0.09 0.00 0.00 178.44 178.63 1rxr h ALA 197 N 1.00 0.52 0.00 1.53 0.00 0.38 0.13 119.26 122.82 1rxr h ALA 197 Ca 0.11 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1rxr h ALA 197 Cb 0.14 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1rxr h ALA 197 CO -0.01 -0.31 0.00 -1.33 0.00 0.00 0.00 179.25 177.59 1rxr n MET 198 N -5.11 0.60 -2.45 0.00 2.81 -0.10 -4.88 117.12 108.00 1rxr n MET 198 Ca 0.05 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 1rxr n MET 198 Cb 0.23 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 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 0.36 0.90 3.67 3.03 0.00 0.45 -4.98 105.19 108.63 1rxr n GLY 199 Ca 0.15 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.55 2.71 -2.01 1.61 2.00 -0.31 -4.81 117.12 115.75 1rxr n MET 200 Ca 0.00 0.99 -0.26 0.00 0.00 0.00 0.00 57.70 58.43 1rxr n MET 200 Cb 0.50 -2.92 -0.06 0.00 0.00 0.00 0.00 33.22 30.75 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 4.11 2.43 0.32 0.03 -0.14 0.12 -4.80 119.74 121.81 1rxr s LYS 201 Ca 0.89 -0.56 0.09 0.00 -1.36 0.00 0.00 55.97 55.03 1rxr s LYS 201 Cb -0.50 -5.11 0.95 0.00 -1.68 0.00 0.00 37.83 31.49 1rxr s LYS 201 CO 0.43 -3.73 1.50 -2.13 -0.76 0.00 0.00 175.35 170.66 1rxr n ARG 202 N 8.63 -0.07 -0.25 1.68 0.63 -1.26 -0.14 116.66 125.88 1rxr n ARG 202 Ca 0.42 1.39 0.06 0.00 -0.92 0.00 0.00 57.85 58.80 1rxr n ARG 202 Cb 0.47 -2.31 0.18 0.00 0.45 0.00 0.00 32.46 31.25 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 0.21 -0.01 -0.14 3.07 -1.98 -0.50 114.58 115.23 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 1.57 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 29.43 1rxr h GLU 203 CO -0.83 0.14 0.02 0.00 -1.40 0.00 0.00 179.01 176.94 1rxr h ALA 204 N 1.65 1.15 -0.31 3.43 0.00 -0.92 -0.27 119.26 123.99 1rxr h ALA 204 Ca 0.42 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.35 1rxr h ALA 204 Cb 0.75 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1rxr h ALA 204 CO -0.56 -0.02 0.20 0.28 0.00 0.00 0.00 179.25 179.15 1rxr h VAL 205 N 0.00 1.05 0.00 0.00 2.07 -1.20 0.18 116.25 118.35 1rxr h VAL 205 Ca 0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1rxr h VAL 205 Cb 0.05 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1rxr h VAL 205 CO -0.00 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.66 1rxr n GLN 206 N -4.49 0.08 -0.14 1.57 1.13 -0.11 -3.14 117.38 112.28 1rxr n GLN 206 Ca 0.02 0.17 -0.29 0.00 -1.94 0.00 0.00 57.00 54.96 1rxr n GLN 206 Cb 0.11 -1.61 -0.10 0.00 0.11 0.00 0.00 30.24 28.75 1rxr n GLN 206 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1rxr n GLU 207 N -1.75 0.59 0.02 -1.09 -0.58 0.29 -4.22 120.64 113.90 1rxr n GLU 207 Ca 0.05 0.28 0.18 0.00 -0.42 0.00 0.00 57.16 57.25 1rxr n GLU 207 Cb 0.30 -1.51 0.66 0.00 -0.57 0.00 0.00 31.44 30.32 1rxr n GLU 207 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1rxr h GLU 208 N -0.97 0.04 -3.34 3.49 5.08 -0.86 -2.77 114.58 115.25 1rxr h GLU 208 Ca -0.68 -0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.03 1rxr h GLU 208 Cb 1.61 -0.01 -0.40 0.00 0.50 0.00 0.00 28.75 30.44 1rxr h GLU 208 CO -0.40 0.03 -0.58 1.03 -1.00 0.00 0.00 179.01 178.09 1rxr s ARG 209 N -5.06 2.17 0.57 2.33 0.52 -1.19 -5.10 118.95 113.19 1rxr s ARG 209 Ca -0.05 -2.78 -0.19 0.00 -0.52 0.00 0.00 55.73 52.18 1rxr s ARG 209 Cb 0.19 -3.40 -0.06 0.00 0.52 0.00 0.00 34.95 32.21 1rxr s ARG 209 CO 0.73 -1.16 0.97 1.04 0.02 0.00 0.00 175.30 176.90 1rxr n GLN 210 N 2.89 0.99 -0.99 3.54 1.13 -1.05 -4.71 117.38 119.17 1rxr n GLN 210 Ca 0.09 0.38 -0.30 0.00 -1.94 0.00 0.00 57.00 55.22 1rxr n GLN 210 Cb 0.33 -2.15 -0.02 0.00 0.11 0.00 0.00 30.24 28.51 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 -0.80 2.36 -0.58 -1.09 1.85 -1.26 -5.06 116.66 112.08 1rxr n ARG 211 Ca 0.13 -1.75 0.00 0.00 -1.00 0.00 0.00 57.85 55.22 1rxr n ARG 211 Cb 0.46 -2.66 0.00 0.00 -1.05 0.00 0.00 32.46 29.21 1rxr n ARG 211 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03