#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 -3.06 -2.13 1.35 -2.07 -3.27 112.91 103.73 1rxr h THR 131 Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 66.41 65.29 1rxr h THR 131 Cb 0.00 0.00 -0.04 0.00 -1.73 0.00 0.00 68.15 66.38 1rxr h THR 131 CO 0.00 0.00 1.08 -0.54 -0.25 0.00 0.00 175.52 175.81 1rxr s LYS 132 N -3.83 3.69 -0.71 4.72 1.02 -1.26 -4.89 119.74 118.48 1rxr s LYS 132 Ca -0.05 1.23 -0.23 0.00 0.02 0.00 0.00 55.97 56.94 1rxr s LYS 132 Cb 0.02 -4.01 -0.18 0.00 -0.52 0.00 0.00 37.83 33.14 1rxr s LYS 132 CO 0.19 -1.42 1.89 0.72 -0.92 0.00 0.00 175.35 175.80 1rxr n HIS 133 N 8.59 1.69 -2.28 3.18 8.25 -1.23 -4.92 115.22 128.49 1rxr n HIS 133 Ca 0.17 -1.60 -0.33 0.00 -0.26 0.00 0.00 57.72 55.71 1rxr n HIS 133 Cb 0.47 -1.66 -0.02 0.00 1.12 0.00 0.00 29.99 29.90 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 5.84 4.18 -0.13 1.59 -5.25 -1.26 -1.51 121.20 124.65 1rxr s ILE 134 Ca 0.60 1.08 -0.29 0.00 -0.99 0.00 0.00 60.65 61.04 1rxr s ILE 134 Cb 0.13 -3.56 -0.04 0.00 2.95 0.00 0.00 42.46 41.94 1rxr s ILE 134 CO 0.15 -0.57 1.70 0.00 -1.79 0.00 0.00 174.94 174.44 1rxr h ALA 136 N 10.53 2.73 -1.07 0.00 0.00 -1.32 0.17 119.26 130.30 1rxr h ALA 136 Ca -0.38 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1rxr h ALA 136 Cb 1.18 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1rxr h ALA 136 CO 0.97 -1.25 0.00 -0.89 0.00 0.00 0.00 179.25 178.08 1rxr n ILE 137 N -4.55 0.00 0.91 0.00 5.41 -1.26 -4.71 119.36 115.17 1rxr n ILE 137 Ca 0.33 0.32 0.12 0.00 1.00 0.00 0.00 62.75 64.52 1rxr n ILE 137 Cb 1.29 -0.98 0.11 0.00 -0.71 0.00 0.00 39.64 39.36 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 1.37 0.46 3.62 0.00 0.00 0.58 -2.55 105.19 108.66 1rxr n GLY 139 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.14 1.93 0.02 1.61 1.11 -1.26 -4.34 116.67 113.61 1rxr s ASP 140 Ca 0.00 1.14 -0.30 0.00 0.18 0.00 0.00 52.55 53.57 1rxr s ASP 140 Cb 0.00 -1.78 -0.06 0.00 1.07 0.00 0.00 42.92 42.15 1rxr s ASP 140 CO 0.00 -3.56 1.42 -0.60 1.18 0.00 0.00 175.17 173.62 1rxr s ARG 141 N -4.93 4.28 0.50 8.23 3.52 -1.26 0.21 118.95 129.51 1rxr s ARG 141 Ca 0.67 2.02 -0.20 0.00 -0.13 0.00 0.00 55.73 58.09 1rxr s ARG 141 Cb -0.19 -3.53 -0.08 0.00 -1.56 0.00 0.00 34.95 29.60 1rxr s ARG 141 CO 0.59 -0.57 1.04 -1.12 -0.81 0.00 0.00 175.30 174.43 1rxr s SER 142 N 1.82 6.25 -0.18 -2.12 0.01 -0.57 -4.42 113.70 114.49 1rxr s SER 142 Ca 0.65 1.92 0.15 0.00 1.31 0.00 0.00 55.95 59.98 1rxr s SER 142 Cb -0.33 -2.56 -0.24 0.00 0.21 0.00 0.00 66.02 63.11 1rxr s SER 142 CO 0.28 -0.85 0.15 -1.54 0.41 0.00 0.00 173.24 171.69 1rxr n SER 143 N -1.12 0.43 -3.60 2.44 3.41 0.43 -4.90 113.62 110.72 1rxr n SER 143 Ca 0.09 0.06 -0.01 0.00 -0.26 0.00 0.00 58.87 58.76 1rxr n SER 143 Cb 0.52 0.61 0.00 0.00 -0.26 0.00 0.00 64.21 65.08 1rxr n SER 143 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1rxr s GLY 144 N -5.54 -0.15 -1.34 5.00 0.00 -1.08 -5.03 107.32 99.18 1rxr s GLY 144 Ca -0.12 0.10 -0.16 0.00 0.00 0.00 0.00 44.72 44.54 1rxr s GLY 144 CO 0.80 1.85 1.87 0.58 0.00 0.00 0.00 173.10 178.20 1rxr n LYS 145 N -0.63 3.13 -2.22 2.90 2.85 -1.26 -0.73 118.16 122.19 1rxr n LYS 145 Ca -0.04 -3.13 -0.42 0.00 -1.05 0.00 0.00 58.31 53.67 1rxr n LYS 145 Cb 0.60 -3.38 -0.03 0.00 -0.65 0.00 0.00 35.03 31.58 1rxr n LYS 145 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1rxr s HIS 146 N 3.55 3.16 -1.41 5.58 3.76 -0.04 -1.87 115.29 128.02 1rxr s HIS 146 Ca 0.50 0.97 -0.06 0.00 -0.15 0.00 0.00 55.06 56.32 1rxr s HIS 146 Cb 0.07 -3.64 0.03 0.00 1.11 0.00 0.00 32.58 30.15 1rxr s HIS 146 CO 0.02 -2.23 0.50 0.66 -0.85 0.00 0.00 174.74 172.84 1rxr n TYR 147 N 4.35 -1.83 -0.97 1.40 4.01 -1.26 -1.20 117.16 121.67 1rxr n TYR 147 Ca 0.12 0.45 0.00 0.00 -0.16 0.00 0.00 57.90 58.30 1rxr n TYR 147 Cb 0.43 -3.71 0.00 0.00 -0.31 0.00 0.00 39.34 35.76 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 0.75 3.01 2.72 0.00 -0.78 -0.79 105.19 108.79 1rxr n GLY 148 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.98 0.91 -0.30 1.61 1.01 -0.34 -4.97 120.40 115.34 1rxr s VAL 149 Ca 0.00 -0.41 -0.39 0.00 0.00 0.00 0.00 61.98 61.19 1rxr s VAL 149 Cb 0.00 -0.82 -0.14 0.00 0.00 0.00 0.00 36.38 35.41 1rxr s VAL 149 CO 0.00 0.29 1.90 -1.22 0.00 0.00 0.00 175.10 176.07 1rxr n TYR 150 N 3.46 1.90 -3.85 5.22 4.01 -1.26 -0.86 117.16 125.78 1rxr n TYR 150 Ca -0.20 0.44 -0.09 0.00 -0.16 0.00 0.00 57.90 57.89 1rxr n TYR 150 Cb 0.53 -2.48 -0.07 0.00 -0.31 0.00 0.00 39.34 37.01 1rxr n TYR 150 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1rxr s SER 151 N 4.76 0.10 0.34 7.72 0.15 0.09 -0.83 113.70 126.04 1rxr s SER 151 Ca 1.02 -0.64 0.07 0.00 0.70 0.00 0.00 55.95 57.11 1rxr s SER 151 Cb -1.02 0.35 -0.02 0.00 -1.71 0.00 0.00 66.02 63.62 1rxr s SER 151 CO 0.60 -0.74 0.33 0.00 1.20 0.00 0.00 173.24 174.64 1rxr h GLU 153 N 1.16 0.04 0.00 0.00 3.07 -1.96 0.14 114.58 117.04 1rxr h GLU 153 Ca -0.45 -0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.44 1rxr h GLU 153 Cb 1.26 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 29.12 1rxr h GLU 153 CO 0.57 0.03 -0.19 0.78 -1.40 0.00 0.00 179.01 178.80 1rxr h GLY 154 N 0.04 -0.26 1.00 -3.84 0.00 -1.98 -2.50 103.07 95.54 1rxr h GLY 154 Ca 0.29 0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.84 1rxr h GLY 154 CO -0.57 -0.17 0.38 0.00 0.00 0.00 0.00 176.54 176.18 1rxr h LYS 156 N 0.84 -0.17 0.05 0.00 1.63 -0.38 0.56 116.57 119.10 1rxr h LYS 156 Ca 0.22 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.03 1rxr h LYS 156 Cb -0.04 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1rxr h LYS 156 CO -0.04 -0.12 -0.03 0.78 -3.45 0.00 0.00 179.45 176.60 1rxr h GLY 157 N -0.18 -0.08 0.22 5.01 0.00 -1.38 -2.45 103.07 104.22 1rxr h GLY 157 Ca 0.04 0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.45 1rxr h GLY 157 CO -0.30 -0.03 -0.24 -2.75 0.00 0.00 0.00 176.54 173.22 1rxr h PHE 158 N -0.31 -0.63 -0.24 5.60 3.57 -0.73 0.11 116.94 124.31 1rxr h PHE 158 Ca -0.01 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1rxr h PHE 158 Cb 0.28 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1rxr h PHE 158 CO 0.00 -0.32 0.15 0.35 -2.23 0.00 0.00 178.31 176.27 1rxr h PHE 159 N -0.27 0.31 -0.04 0.41 3.57 -0.93 -0.36 116.94 119.63 1rxr h PHE 159 Ca 0.12 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1rxr h PHE 159 Cb 0.45 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 39.04 1rxr h PHE 159 CO -0.37 0.23 -0.29 -0.22 -2.23 0.00 0.00 178.31 175.43 1rxr h LYS 160 N 0.31 -0.40 0.16 1.11 3.64 -0.89 0.39 116.57 120.89 1rxr h LYS 160 Ca 0.09 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1rxr h LYS 160 Cb 0.00 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1rxr h LYS 160 CO -0.02 -0.26 -0.53 0.00 -2.27 0.00 0.00 179.45 176.37 1rxr h ARG 161 N -0.41 -0.75 -0.38 1.90 3.08 -0.60 0.85 114.38 118.07 1rxr h ARG 161 Ca 0.07 0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.26 1rxr h ARG 161 Cb 0.52 0.17 -0.09 0.00 0.08 0.00 0.00 29.97 30.65 1rxr h ARG 161 CO -0.27 -0.50 -0.22 1.15 -1.07 0.00 0.00 179.97 179.06 1rxr h THR 162 N -0.78 0.39 -0.03 2.04 2.02 -0.73 -0.10 112.91 115.73 1rxr h THR 162 Ca -0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 1rxr h THR 162 Cb 0.77 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1rxr h THR 162 CO -0.27 0.00 -0.00 0.58 0.37 0.00 0.00 175.52 176.20 1rxr h VAL 163 N -0.15 1.27 -0.69 3.16 2.07 -0.75 0.49 116.25 121.64 1rxr h VAL 163 Ca 0.19 -0.81 0.08 0.00 0.82 0.00 0.00 66.70 66.97 1rxr h VAL 163 Cb 0.44 1.77 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 1rxr h VAL 163 CO -0.47 0.22 0.36 0.03 0.02 0.00 0.00 177.57 177.72 1rxr h ARG 164 N -0.28 0.61 0.00 1.57 3.08 -0.51 -0.62 114.38 118.24 1rxr h ARG 164 Ca 0.01 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.89 1rxr h ARG 164 Cb 0.35 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1rxr h ARG 164 CO 0.00 0.41 -0.61 0.87 -1.07 0.00 0.00 179.97 179.56 1rxr h LYS 165 N 0.63 0.00 -4.23 0.04 1.79 -1.00 -3.48 116.57 110.33 1rxr h LYS 165 Ca 0.33 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.60 1rxr h LYS 165 Cb 0.30 0.00 0.10 0.00 -1.58 0.00 0.00 32.23 31.05 1rxr h LYS 165 CO -0.24 0.61 -0.47 -3.47 -1.08 0.00 0.00 179.45 174.81 1rxr n ASP 166 N -3.52 -2.03 -4.95 0.86 2.03 0.15 -5.04 116.55 104.05 1rxr n ASP 166 Ca -0.00 -0.38 -0.23 0.00 0.52 0.00 0.00 54.79 54.70 1rxr n ASP 166 Cb 0.68 -3.33 0.05 0.00 -0.72 0.00 0.00 41.12 37.80 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 -4.66 3.10 0.03 -2.67 1.43 0.08 -5.01 118.68 110.98 1rxr s LEU 167 Ca 0.00 0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 1rxr s LEU 167 Cb -0.00 -3.00 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 1rxr s LEU 167 CO 0.45 -1.31 -0.02 0.42 0.23 0.00 0.00 176.35 176.11 1rxr s THR 168 N -2.96 0.16 0.00 5.49 -4.23 -1.26 -4.86 115.64 107.97 1rxr s THR 168 Ca 0.58 -1.28 0.00 0.00 -1.18 0.00 0.00 61.69 59.81 1rxr s THR 168 Cb -0.10 -0.80 0.00 0.00 1.34 0.00 0.00 72.50 72.93 1rxr s THR 168 CO 0.41 -0.71 0.00 -1.22 -0.54 0.00 0.00 174.62 172.56 1rxr n TYR 169 N 0.95 -0.03 -3.76 3.99 4.01 -1.26 -5.07 117.16 115.99 1rxr n TYR 169 Ca -0.20 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.45 1rxr n TYR 169 Cb 0.58 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.55 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 -2.01 0.09 0.09 -0.72 2.01 -1.26 -4.88 115.64 108.95 1rxr s THR 170 Ca 0.00 -0.91 0.02 0.00 0.31 0.00 0.00 61.69 61.11 1rxr s THR 170 Cb 0.00 -1.36 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 1rxr s THR 170 CO 0.00 -0.41 -0.08 0.00 -0.69 0.00 0.00 174.62 173.45 1rxr n ARG 172 N 0.44 3.52 -3.83 0.00 5.12 -1.26 -4.75 116.66 115.90 1rxr n ARG 172 Ca -0.15 -2.47 -0.08 0.00 -1.93 0.00 0.00 57.85 53.22 1rxr n ARG 172 Cb 0.59 -2.50 0.01 0.00 -1.16 0.00 0.00 32.46 29.39 1rxr n ARG 172 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1rxr s ASP 173 N 1.21 -0.10 0.93 0.55 1.01 -1.26 -5.17 116.67 113.84 1rxr s ASP 173 Ca 0.62 -0.92 -0.15 0.00 0.71 0.00 0.00 52.55 52.81 1rxr s ASP 173 Cb 0.24 0.79 0.17 0.00 1.01 0.00 0.00 42.92 45.13 1rxr s ASP 173 CO -0.09 -1.53 1.27 0.20 0.21 0.00 0.00 175.17 175.22 1rxr s ASN 174 N -3.02 3.40 0.36 0.27 0.01 -1.26 -4.94 114.94 109.77 1rxr s ASN 174 Ca 0.14 0.45 0.07 0.00 -0.71 0.00 0.00 52.86 52.81 1rxr s ASN 174 Cb -0.05 -0.65 0.76 0.00 0.41 0.00 0.00 41.25 41.72 1rxr s ASN 174 CO 0.09 -2.57 1.93 0.11 -1.51 0.00 0.00 177.10 175.15 1rxr h LYS 175 N -1.52 0.72 -2.62 -0.60 1.57 -2.02 -2.68 116.57 109.40 1rxr h LYS 175 Ca -0.45 -0.04 -0.51 0.00 -1.87 0.00 0.00 60.65 57.77 1rxr h LYS 175 Cb 1.27 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 1rxr h LYS 175 CO 0.46 0.48 2.30 -0.40 -0.57 0.00 0.00 179.45 181.72 1rxr n ASP 176 N -4.50 7.53 -4.77 0.86 5.75 -1.26 -4.94 116.55 115.22 1rxr n ASP 176 Ca 0.13 -2.60 -0.40 0.00 -0.01 0.00 0.00 54.79 51.91 1rxr n ASP 176 Cb 0.30 -1.49 -0.02 0.00 -1.03 0.00 0.00 41.12 38.88 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 -1.96 3.20 -0.11 0.00 1.43 -1.26 -4.93 118.68 115.05 1rxr s LEU 178 Ca 0.51 -1.64 -0.30 0.00 -1.03 0.00 0.00 54.13 51.68 1rxr s LEU 178 Cb -0.35 -2.58 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 1rxr s LEU 178 CO 0.45 -2.69 1.22 -0.63 0.23 0.00 0.00 176.35 174.94 1rxr s ILE 179 N 9.64 4.30 0.35 -0.59 -1.09 -1.26 -4.77 121.20 127.78 1rxr s ILE 179 Ca 0.66 1.60 -0.17 0.00 -2.23 0.00 0.00 60.65 60.50 1rxr s ILE 179 Cb -0.01 -4.03 0.05 0.00 -1.58 0.00 0.00 42.46 36.89 1rxr s ILE 179 CO 0.10 -0.07 0.80 -1.81 -1.23 0.00 0.00 174.94 172.72 1rxr s ASP 180 N 1.68 -0.04 0.34 3.58 1.01 -1.26 -4.98 116.67 117.00 1rxr s ASP 180 Ca 0.55 -1.01 0.12 0.00 0.71 0.00 0.00 52.55 52.92 1rxr s ASP 180 Cb -0.23 0.80 1.07 0.00 1.01 0.00 0.00 42.92 45.58 1rxr s ASP 180 CO 0.18 -1.57 1.58 0.11 0.21 0.00 0.00 175.17 175.68 1rxr h LYS 181 N 2.00 0.03 -0.97 8.23 1.79 -1.85 0.13 116.57 125.93 1rxr h LYS 181 Ca -0.29 -0.00 0.19 0.00 -2.18 0.00 0.00 60.65 58.37 1rxr h LYS 181 Cb 1.25 -0.01 -0.11 0.00 -1.58 0.00 0.00 32.23 31.78 1rxr h LYS 181 CO 0.37 0.02 0.56 0.00 -1.08 0.00 0.00 179.45 179.32 1rxr h ARG 182 N 0.03 0.67 -6.03 3.15 3.08 -1.94 -3.35 114.38 109.99 1rxr h ARG 182 Ca 0.73 -0.04 -0.57 0.00 0.07 0.00 0.00 59.98 60.18 1rxr h ARG 182 Cb 1.76 -0.15 -0.09 0.00 0.08 0.00 0.00 29.97 31.57 1rxr h ARG 182 CO -0.82 0.44 1.46 -0.65 -1.07 0.00 0.00 179.97 179.34 1rxr s GLN 183 N -5.87 3.48 1.21 0.04 -1.52 0.46 -4.99 119.66 112.47 1rxr s GLN 183 Ca -0.11 -1.10 -0.18 0.00 -1.95 0.00 0.00 55.36 52.02 1rxr s GLN 183 Cb 0.25 -5.34 0.29 0.00 -0.22 0.00 0.00 33.01 27.98 1rxr s GLN 183 CO 0.80 -2.38 1.07 1.03 -0.25 0.00 0.00 175.29 175.56 1rxr s ARG 184 N 5.18 -1.24 0.00 2.91 1.81 -1.26 -4.78 118.95 121.57 1rxr s ARG 184 Ca 0.50 0.12 0.00 0.00 -1.72 0.00 0.00 55.73 54.63 1rxr s ARG 184 Cb -0.00 -1.58 0.00 0.00 -0.45 0.00 0.00 34.95 32.92 1rxr s ARG 184 CO -0.07 -3.76 0.90 -1.71 -0.68 0.00 0.00 175.30 169.98 1rxr n ASN 185 N -4.83 0.00 -0.26 0.23 5.15 -1.26 -0.96 115.26 113.33 1rxr n ASN 185 Ca 0.11 0.41 0.15 0.00 -0.60 0.00 0.00 54.58 54.64 1rxr n ASN 185 Cb 0.59 -0.41 0.43 0.00 -0.53 0.00 0.00 39.78 39.86 1rxr n ASN 185 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 1rxr h ARG 186 N 0.00 0.57 -2.11 1.20 0.11 -1.99 -2.92 114.38 109.23 1rxr h ARG 186 Ca 0.00 -0.03 -0.26 0.00 0.10 0.00 0.00 59.98 59.79 1rxr h ARG 186 Cb 0.07 -0.13 -0.06 0.00 1.11 0.00 0.00 29.97 30.96 1rxr h ARG 186 CO 0.00 0.37 0.13 0.00 0.10 0.00 0.00 179.97 180.58 1rxr h GLN 188 N 3.23 -0.38 -0.44 0.00 4.20 -1.78 -1.07 115.11 118.88 1rxr h GLN 188 Ca 0.28 0.03 0.08 0.00 0.06 0.00 0.00 58.65 59.10 1rxr h GLN 188 Cb 1.34 0.09 -0.10 0.00 0.30 0.00 0.00 27.48 29.11 1rxr h GLN 188 CO 0.44 -0.25 -0.33 -0.92 -0.67 0.00 0.00 178.83 177.09 1rxr h TYR 189 N -0.39 -0.92 -0.46 2.96 3.20 -1.84 0.91 116.97 120.42 1rxr h TYR 189 Ca 0.06 0.06 -0.13 0.00 3.14 0.00 0.00 58.73 61.86 1rxr h TYR 189 Cb 0.55 0.47 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 1rxr h TYR 189 CO -0.69 -0.38 -0.21 0.00 -1.64 0.00 0.00 178.16 175.24 1rxr h ARG 191 N 0.81 0.77 0.05 0.00 3.08 -0.57 0.37 114.38 118.89 1rxr h ARG 191 Ca 0.11 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1rxr h ARG 191 Cb 0.78 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1rxr h ARG 191 CO 0.06 0.51 -0.02 -0.92 -1.07 0.00 0.00 179.97 178.53 1rxr h TYR 192 N 0.79 -0.06 -0.32 3.04 3.20 -0.44 0.23 116.97 123.42 1rxr h TYR 192 Ca 0.29 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.23 1rxr h TYR 192 Cb 0.08 0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.30 1rxr h TYR 192 CO -0.05 0.05 -0.19 1.96 -1.64 0.00 0.00 178.16 178.29 1rxr h GLN 193 N -0.16 -0.15 -0.05 1.82 4.20 -0.40 -0.03 115.11 120.35 1rxr h GLN 193 Ca -0.01 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.74 1rxr h GLN 193 Cb 0.14 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 1rxr h GLN 193 CO 0.01 -0.10 -0.13 0.87 -0.67 0.00 0.00 178.83 178.81 1rxr h LYS 194 N -0.15 -0.19 -0.65 1.46 1.79 -0.71 0.26 116.57 118.39 1rxr h LYS 194 Ca 0.16 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.77 1rxr h LYS 194 Cb 0.40 0.04 -0.09 0.00 -1.58 0.00 0.00 32.23 31.00 1rxr h LYS 194 CO -0.41 -0.12 0.15 0.00 -1.08 0.00 0.00 179.45 177.99 1rxr h ALA 195 N 0.81 0.79 -0.48 3.86 0.00 -0.34 -0.10 119.26 123.79 1rxr h ALA 195 Ca 0.06 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 1rxr h ALA 195 Cb 0.28 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1rxr h ALA 195 CO -0.16 -0.31 -0.05 -0.07 0.00 0.00 0.00 179.25 178.66 1rxr h LEU 196 N 0.27 0.89 -0.18 0.00 3.38 -0.43 0.11 115.31 119.36 1rxr h LEU 196 Ca 0.35 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1rxr h LEU 196 Cb 0.53 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1rxr h LEU 196 CO -0.43 1.01 0.03 0.00 0.09 0.00 0.00 178.44 179.13 1rxr h ALA 197 N 0.91 0.17 -0.44 1.53 0.00 0.72 -1.75 119.26 120.40 1rxr h ALA 197 Ca 0.13 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1rxr h ALA 197 Cb 0.59 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1rxr h ALA 197 CO 0.04 -0.41 -0.15 0.52 0.00 0.00 0.00 179.25 179.24 1rxr h MET 198 N 0.09 0.82 0.00 0.00 2.86 -1.04 -3.48 114.93 114.18 1rxr h MET 198 Ca 0.08 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 1rxr h MET 198 Cb 0.08 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1rxr h MET 198 CO -0.12 0.92 0.00 0.41 1.06 0.00 0.00 176.91 179.18 1rxr n GLY 199 N -0.34 0.68 3.76 8.32 0.00 -0.15 -5.07 105.19 112.39 1rxr n GLY 199 Ca 0.01 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 0.00 2.61 -1.47 1.61 2.81 -0.20 -4.81 117.12 117.66 1rxr n MET 200 Ca 0.00 0.92 -0.38 0.00 -1.81 0.00 0.00 57.70 56.43 1rxr n MET 200 Cb 0.00 -2.65 -0.06 0.00 -0.71 0.00 0.00 33.22 29.80 1rxr n MET 200 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1rxr n LYS 201 N 1.00 1.49 -0.36 0.03 4.01 0.03 -4.78 118.16 119.59 1rxr n LYS 201 Ca 0.04 -2.05 0.01 0.00 -0.51 0.00 0.00 58.31 55.79 1rxr n LYS 201 Cb 0.38 -3.21 0.07 0.00 -0.51 0.00 0.00 35.03 31.75 1rxr n LYS 201 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1rxr n ARG 202 N 7.52 -0.18 -0.32 1.97 0.63 -1.26 -0.53 116.66 124.49 1rxr n ARG 202 Ca 0.48 1.46 0.15 0.00 -0.92 0.00 0.00 57.85 59.02 1rxr n ARG 202 Cb 0.43 -2.18 0.34 0.00 0.45 0.00 0.00 32.46 31.50 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 0.43 -0.23 -0.14 5.08 -2.00 -0.45 114.58 117.27 1rxr h GLU 203 Ca 0.37 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.77 1rxr h GLU 203 Cb 0.60 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1rxr h GLU 203 CO -0.95 0.29 0.20 0.00 -1.00 0.00 0.00 179.01 177.55 1rxr h ALA 204 N 1.73 2.02 -0.82 3.43 0.00 -1.21 -0.22 119.26 124.19 1rxr h ALA 204 Ca 0.60 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.64 1rxr h ALA 204 Cb 1.15 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1rxr h ALA 204 CO -0.52 -0.32 0.54 0.28 0.00 0.00 0.00 179.25 179.22 1rxr h VAL 205 N 0.00 0.82 0.00 0.00 2.07 -1.19 -0.62 116.25 117.34 1rxr h VAL 205 Ca 0.11 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1rxr h VAL 205 Cb 0.52 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1rxr h VAL 205 CO -0.00 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.69 1rxr n GLN 206 N -4.52 0.56 0.02 1.57 1.13 -0.09 -4.11 117.38 111.95 1rxr n GLN 206 Ca 0.16 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 55.10 1rxr n GLN 206 Cb 0.49 -1.08 -0.07 0.00 0.11 0.00 0.00 30.24 29.68 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 -0.46 0.00 -1.09 4.81 -1.28 -0.80 114.58 115.75 1rxr h GLU 207 Ca 0.00 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1rxr h GLU 207 Cb 0.00 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 1rxr h GLU 207 CO 0.00 -0.31 -0.01 0.93 -0.73 0.00 0.00 179.01 178.89 1rxr h GLU 208 N -0.48 0.00 0.00 1.92 5.08 -1.85 -1.31 114.58 117.94 1rxr h GLU 208 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1rxr h GLU 208 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1rxr h GLU 208 CO -0.29 0.01 0.00 0.54 -1.00 0.00 0.00 179.01 178.27 1rxr n ARG 209 N -3.13 0.11 -1.14 2.33 5.12 -0.35 -4.15 116.66 115.45 1rxr n ARG 209 Ca -0.01 0.26 -0.34 0.00 -1.93 0.00 0.00 57.85 55.83 1rxr n ARG 209 Cb 0.20 -1.68 -0.02 0.00 -1.16 0.00 0.00 32.46 29.80 1rxr n ARG 209 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1rxr n GLN 210 N -1.89 2.66 -1.13 5.56 1.13 -0.50 -4.81 117.38 118.41 1rxr n GLN 210 Ca 0.04 -1.94 -0.34 0.00 -1.94 0.00 0.00 57.00 52.82 1rxr n GLN 210 Cb 0.27 -2.76 -0.03 0.00 0.11 0.00 0.00 30.24 27.83 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 4.69 2.35 0.00 -1.09 1.85 -1.26 -5.11 116.66 118.09 1rxr n ARG 211 Ca 0.58 -1.90 0.00 0.00 -1.00 0.00 0.00 57.85 55.53 1rxr n ARG 211 Cb 0.24 -2.79 0.00 0.00 -1.05 0.00 0.00 32.46 28.86 1rxr n ARG 211 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03