#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rin s THR 189 N 0.00 1.57 0.13 2.52 2.01 -1.26 -5.15 115.64 115.47 1rin s THR 189 Ca 0.00 -0.68 0.05 0.00 0.31 0.00 0.00 61.69 61.37 1rin s THR 189 Cb 0.00 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 1rin s THR 189 CO 0.00 0.46 -0.12 -0.94 -0.69 0.00 0.00 174.62 173.32 1rin s SER 190 N 1.00 1.87 0.05 3.53 1.04 -1.26 -5.15 113.70 114.78 1rin s SER 190 Ca -0.06 -0.88 0.05 0.00 0.48 0.00 0.00 55.95 55.54 1rin s SER 190 Cb -0.15 -0.04 -0.02 0.00 0.10 0.00 0.00 66.02 65.91 1rin s SER 190 CO -0.02 -0.22 -0.14 -0.31 0.98 0.00 0.00 173.24 173.53 1rin s TYR 191 N -2.59 1.18 0.03 5.02 1.51 -1.26 -5.16 117.35 116.08 1rin s TYR 191 Ca 0.11 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 1rin s TYR 191 Cb -0.02 -0.69 -0.02 0.00 -0.11 0.00 0.00 41.96 41.12 1rin s TYR 191 CO 0.02 0.03 -0.07 0.99 -1.11 0.00 0.00 175.55 175.42 1rin s THR 192 N -0.95 0.47 -0.02 -0.71 2.01 -1.26 -5.14 115.64 110.04 1rin s THR 192 Ca 0.00 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.09 1rin s THR 192 Cb -0.08 -0.51 0.01 0.00 0.01 0.00 0.00 72.50 71.93 1rin s THR 192 CO 0.01 -0.24 0.21 -0.22 -0.69 0.00 0.00 174.62 173.69 1rin s LEU 193 N -1.15 1.25 -0.04 4.42 2.96 -1.26 -5.15 118.68 119.70 1rin s LEU 193 Ca -0.07 -0.00 -0.10 0.00 -0.22 0.00 0.00 54.13 53.73 1rin s LEU 193 Cb -0.08 0.90 0.02 0.00 0.50 0.00 0.00 46.19 47.53 1rin s LEU 193 CO 0.00 -0.35 0.24 -0.44 -1.32 0.00 0.00 176.35 174.48 1rin s SER 194 N -1.13 -0.16 -0.08 3.68 0.01 -1.26 -5.16 113.70 109.59 1rin s SER 194 Ca -0.12 0.19 -0.30 0.00 1.31 0.00 0.00 55.95 57.03 1rin s SER 194 Cb -0.06 0.37 0.10 0.00 0.21 0.00 0.00 66.02 66.65 1rin s SER 194 CO 0.02 -0.28 0.86 -0.62 0.41 0.00 0.00 173.24 173.63 1rin s ASP 195 N -0.75 -0.46 -0.02 2.44 -1.08 -1.26 -5.12 116.67 110.42 1rin s ASP 195 Ca -0.08 0.40 -0.30 0.00 -0.52 0.00 0.00 52.55 52.05 1rin s ASP 195 Cb -0.04 0.40 -0.04 0.00 -1.46 0.00 0.00 42.92 41.78 1rin s ASP 195 CO 0.02 -0.50 1.14 -0.69 0.52 0.00 0.00 175.17 175.66 1rin s VAL 196 N -1.62 4.36 -0.09 1.11 1.01 -1.26 -5.01 120.40 118.90 1rin s VAL 196 Ca -0.03 1.69 0.02 0.00 0.00 0.00 0.00 61.98 63.65 1rin s VAL 196 Cb -0.00 -4.08 0.01 0.00 0.00 0.00 0.00 36.38 32.31 1rin s VAL 196 CO 0.01 0.06 -0.13 -0.69 0.00 0.00 0.00 175.10 174.35 1rin s VAL 197 N 1.65 1.30 -1.27 2.92 1.01 -1.26 -5.05 120.40 119.70 1rin s VAL 197 Ca 0.55 -0.54 -0.13 0.00 0.00 0.00 0.00 61.98 61.87 1rin s VAL 197 Cb -0.25 -1.20 0.14 0.00 0.00 0.00 0.00 36.38 35.08 1rin s VAL 197 CO 0.25 0.40 1.71 -0.24 0.00 0.00 0.00 175.10 177.21 1rin n SER 198 N 4.13 5.01 -0.26 3.32 2.88 -1.26 -4.84 113.62 122.59 1rin n SER 198 Ca -0.20 -3.00 0.17 0.00 -1.33 0.00 0.00 58.87 54.51 1rin n SER 198 Cb 0.51 -1.57 0.47 0.00 -0.75 0.00 0.00 64.21 62.87 1rin n SER 198 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1rin h LEU 199 N 9.45 0.49 -2.54 2.46 3.38 -1.98 -0.63 115.31 125.95 1rin h LEU 199 Ca 0.39 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.40 1rin h LEU 199 Cb 0.76 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1rin h LEU 199 CO 1.47 0.20 -0.02 0.50 0.09 0.00 0.00 178.44 180.68 1rin h LYS 200 N 0.50 0.00 -0.02 1.13 3.64 -1.88 -1.33 116.57 118.61 1rin h LYS 200 Ca 0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1rin h LYS 200 Cb 1.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1rin h LYS 200 CO -0.21 0.02 -0.21 -0.25 -2.27 0.00 0.00 179.45 176.53 1rin n ASP 201 N -3.30 2.13 -0.05 4.20 8.00 -0.25 -4.69 116.55 122.58 1rin n ASP 201 Ca -0.02 -1.56 -0.11 0.00 0.71 0.00 0.00 54.79 53.80 1rin n ASP 201 Cb 0.13 0.26 -0.04 0.00 -0.02 0.00 0.00 41.12 41.46 1rin n ASP 201 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1rin n VAL 202 N 0.43 0.71 -3.88 2.53 0.31 -0.73 -5.09 118.33 112.62 1rin n VAL 202 Ca 0.09 -0.10 -0.21 0.00 -0.01 0.00 0.00 64.34 64.11 1rin n VAL 202 Cb 0.42 -1.68 -0.02 0.00 -0.91 0.00 0.00 33.84 31.64 1rin n VAL 202 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1rin s VAL 203 N -2.23 4.57 1.00 2.52 -7.23 -0.58 -5.11 120.40 113.34 1rin s VAL 203 Ca -0.15 -1.15 -0.12 0.00 -1.81 0.00 0.00 61.98 58.75 1rin s VAL 203 Cb 0.05 -3.56 0.19 0.00 0.56 0.00 0.00 36.38 33.63 1rin s VAL 203 CO 0.19 -0.28 1.09 -2.84 -0.31 0.00 0.00 175.10 172.96 1rin s PRO 204 N -3.99 0.38 0.38 4.82 0.02 -1.26 -4.79 135.00 130.57 1rin s PRO 204 Ca 0.37 0.53 0.07 0.00 0.02 0.00 0.00 61.00 61.99 1rin s PRO 204 Cb -0.08 -1.73 0.77 0.00 0.02 0.00 0.00 34.50 33.48 1rin s PRO 204 CO 0.28 -2.77 1.97 0.93 -0.33 0.00 0.00 177.00 177.09 1rin h GLU 205 N -1.92 0.46 -5.16 5.54 5.08 -1.97 -3.40 114.58 113.21 1rin h GLU 205 Ca -0.55 -0.06 -0.66 0.00 -1.00 0.00 0.00 59.36 57.09 1rin h GLU 205 Cb 1.33 -0.09 -0.30 0.00 0.50 0.00 0.00 28.75 30.19 1rin h GLU 205 CO 0.57 0.42 -0.79 -1.58 -1.00 0.00 0.00 179.01 176.63 1rin s TRP 206 N -5.17 2.82 0.22 4.33 0.52 -1.26 -5.13 118.94 115.28 1rin s TRP 206 Ca -0.07 -1.03 0.04 0.00 0.02 0.00 0.00 56.10 55.05 1rin s TRP 206 Cb 0.16 -1.93 -0.05 0.00 -1.15 0.00 0.00 33.47 30.50 1rin s TRP 206 CO 0.74 -0.49 -0.03 0.14 0.02 0.00 0.00 176.95 177.34 1rin s VAL 207 N 0.93 1.10 -0.02 4.03 -7.23 -1.26 -5.15 120.40 112.80 1rin s VAL 207 Ca -0.03 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.11 1rin s VAL 207 Cb -0.15 -2.25 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 1rin s VAL 207 CO -0.01 -0.41 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.20 1rin s ARG 208 N -3.83 2.72 0.21 4.82 0.52 -1.26 -5.14 118.95 116.99 1rin s ARG 208 Ca 0.26 -0.62 0.08 0.00 -0.52 0.00 0.00 55.73 54.93 1rin s ARG 208 Cb 0.05 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.86 1rin s ARG 208 CO 0.07 0.63 -0.02 0.96 0.02 0.00 0.00 175.30 176.96 1rin s ILE 209 N -1.00 3.53 -0.78 1.52 -4.36 -1.26 -5.12 121.20 113.73 1rin s ILE 209 Ca 0.17 -1.63 0.00 0.00 -0.26 0.00 0.00 60.65 58.93 1rin s ILE 209 Cb -0.11 -2.81 0.00 0.00 1.25 0.00 0.00 42.46 40.79 1rin s ILE 209 CO 0.07 -0.20 0.00 0.61 0.24 0.00 0.00 174.94 175.66 1rin n GLY 210 N -0.36 -1.28 3.43 6.27 0.00 -1.26 -5.16 105.19 106.83 1rin n GLY 210 Ca -0.09 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.73 1rin n GLY 210 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rin s PHE 211 N -2.81 2.44 0.04 1.61 0.08 -1.26 -5.14 117.98 112.94 1rin s PHE 211 Ca 0.00 -0.32 -0.02 0.00 0.12 0.00 0.00 56.93 56.71 1rin s PHE 211 Cb 0.00 -1.36 -0.03 0.00 -0.57 0.00 0.00 43.02 41.06 1rin s PHE 211 CO 0.00 0.29 -0.00 -1.54 -0.10 0.00 0.00 175.22 173.87 1rin s SER 212 N -1.77 0.37 -0.14 1.36 1.04 -1.26 -5.16 113.70 108.13 1rin s SER 212 Ca 0.15 -0.79 -0.19 0.00 0.48 0.00 0.00 55.95 55.60 1rin s SER 212 Cb -0.10 0.18 0.05 0.00 0.10 0.00 0.00 66.02 66.25 1rin s SER 212 CO 0.06 -0.51 0.50 0.00 0.98 0.00 0.00 173.24 174.27 1rin s ALA 213 N -3.09 -1.24 0.06 5.32 0.00 -1.26 -5.17 121.76 116.39 1rin s ALA 213 Ca -0.01 1.23 -0.01 0.00 0.00 0.00 0.00 51.96 53.18 1rin s ALA 213 Cb 0.02 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 1rin s ALA 213 CO -0.07 -0.26 -0.04 0.95 0.00 0.00 0.00 175.76 176.35 1rin s THR 214 N -0.18 0.30 0.16 0.00 -4.23 -1.26 -5.11 115.64 105.32 1rin s THR 214 Ca -0.04 -1.82 0.08 0.00 -1.18 0.00 0.00 61.69 58.73 1rin s THR 214 Cb -0.03 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 1rin s THR 214 CO 0.02 -0.97 -0.16 0.42 -0.54 0.00 0.00 174.62 173.39 1rin s THR 215 N -3.84 1.67 0.00 3.99 -4.23 -1.26 -4.92 115.64 107.05 1rin s THR 215 Ca 0.08 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 1rin s THR 215 Cb 0.07 -1.81 0.00 0.00 1.34 0.00 0.00 72.50 72.10 1rin s THR 215 CO -0.09 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.19 1rin n GLY 216 N 0.18 3.19 0.22 3.99 0.00 -1.26 -4.95 105.19 106.56 1rin n GLY 216 Ca -0.12 -0.35 0.09 0.00 0.00 0.00 0.00 46.02 45.63 1rin n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rin h ALA 217 N 1.00 1.08 -1.60 4.61 0.00 -2.08 -3.44 119.26 118.83 1rin h ALA 217 Ca 0.00 -0.24 -0.62 0.00 0.00 0.00 0.00 54.91 54.05 1rin h ALA 217 Cb 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 17.62 1rin h ALA 217 CO 0.00 0.32 -0.58 -1.21 0.00 0.00 0.00 179.25 177.78 1rin s GLU 218 N -3.77 2.00 0.26 0.00 2.02 -1.26 -5.16 118.70 112.79 1rin s GLU 218 Ca -0.00 -2.09 -0.21 0.00 0.02 0.00 0.00 54.97 52.68 1rin s GLU 218 Cb 0.11 -1.68 0.04 0.00 0.10 0.00 0.00 34.13 32.70 1rin s GLU 218 CO 0.65 -0.07 0.79 1.52 0.02 0.00 0.00 175.26 178.17 1rin s TYR 219 N -2.70 -0.14 0.00 1.61 -0.85 -1.26 -4.65 117.35 109.36 1rin s TYR 219 Ca 0.35 -0.31 -0.29 0.00 -0.52 0.00 0.00 57.07 56.30 1rin s TYR 219 Cb 0.09 0.71 0.10 0.00 0.38 0.00 0.00 41.96 43.24 1rin s TYR 219 CO 0.18 -1.16 0.96 0.00 -1.52 0.00 0.00 175.55 174.01 1rin s ALA 220 N -3.56 -1.84 0.17 9.51 0.00 -1.26 -5.11 121.76 119.67 1rin s ALA 220 Ca 0.12 0.90 -0.26 0.00 0.00 0.00 0.00 51.96 52.72 1rin s ALA 220 Cb -0.05 0.39 -0.08 0.00 0.00 0.00 0.00 23.12 23.38 1rin s ALA 220 CO 0.06 -0.76 0.81 0.00 0.00 0.00 0.00 175.76 175.87 1rin s ALA 221 N -3.03 3.42 -0.15 0.00 0.00 -1.26 -4.93 121.76 115.82 1rin s ALA 221 Ca 0.07 0.41 0.01 0.00 0.00 0.00 0.00 51.96 52.45 1rin s ALA 221 Cb -0.01 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 20.12 1rin s ALA 221 CO -0.06 0.26 -0.17 -1.01 0.00 0.00 0.00 175.76 174.78 1rin s HIS 222 N -1.08 2.37 -0.00 0.00 3.76 -1.26 -5.13 115.29 113.94 1rin s HIS 222 Ca 0.37 -1.31 0.00 0.00 -0.15 0.00 0.00 55.06 53.98 1rin s HIS 222 Cb -0.24 -1.68 -0.00 0.00 1.11 0.00 0.00 32.58 31.77 1rin s HIS 222 CO 0.27 -0.67 -0.01 -1.21 -0.85 0.00 0.00 174.74 172.27 1rin s GLU 223 N 1.27 0.07 -0.07 1.40 2.02 -1.26 -5.07 118.70 117.07 1rin s GLU 223 Ca 0.02 -0.03 -0.00 0.00 0.02 0.00 0.00 54.97 54.98 1rin s GLU 223 Cb -0.14 -0.08 -0.03 0.00 0.10 0.00 0.00 34.13 33.99 1rin s GLU 223 CO -0.09 0.02 -0.04 0.14 0.02 0.00 0.00 175.26 175.31 1rin s VAL 224 N 0.00 3.97 -0.12 2.63 -7.23 -1.26 -5.03 120.40 113.37 1rin s VAL 224 Ca 0.00 -0.41 0.20 0.00 -1.81 0.00 0.00 61.98 59.96 1rin s VAL 224 Cb -0.01 -2.66 -0.23 0.00 0.56 0.00 0.00 36.38 34.04 1rin s VAL 224 CO -0.00 0.58 0.53 0.18 -0.31 0.00 0.00 175.10 176.07 1rin n LEU 225 N 2.10 0.29 -3.51 1.32 4.77 -1.26 -5.02 117.00 115.69 1rin n LEU 225 Ca -0.18 0.12 -0.11 0.00 -0.03 0.00 0.00 56.01 55.81 1rin n LEU 225 Cb 0.53 0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.72 1rin n LEU 225 CO 0.28 0.12 0.37 -0.94 -1.33 0.00 0.00 177.39 175.90 1rin s SER 226 N -5.11 -0.48 -0.24 -1.43 1.04 -1.26 -5.18 113.70 101.04 1rin s SER 226 Ca -0.06 -0.13 -0.17 0.00 0.48 0.00 0.00 55.95 56.07 1rin s SER 226 Cb 0.10 0.60 0.07 0.00 0.10 0.00 0.00 66.02 66.89 1rin s SER 226 CO 0.86 -1.00 0.60 0.86 0.98 0.00 0.00 173.24 175.54 1rin s TRP 227 N -3.78 -0.81 0.03 5.02 -0.00 -1.26 -5.16 118.94 112.98 1rin s TRP 227 Ca 0.03 1.76 0.01 0.00 -0.00 0.00 0.00 56.10 57.91 1rin s TRP 227 Cb -0.01 0.39 -0.02 0.00 -0.00 0.00 0.00 33.47 33.83 1rin s TRP 227 CO -0.10 -0.41 -0.06 -1.54 -0.00 0.00 0.00 176.95 174.84 1rin s SER 228 N 1.04 0.65 0.00 5.86 1.04 -1.26 -5.16 113.70 115.87 1rin s SER 228 Ca -0.06 -0.53 -0.05 0.00 0.48 0.00 0.00 55.95 55.79 1rin s SER 228 Cb -0.05 0.06 -0.00 0.00 0.10 0.00 0.00 66.02 66.12 1rin s SER 228 CO -0.10 -0.24 0.09 0.12 0.98 0.00 0.00 173.24 174.10 1rin s PHE 229 N -1.41 0.07 -0.13 5.02 5.36 -1.26 -5.15 117.98 120.49 1rin s PHE 229 Ca -0.12 -0.17 -0.07 0.00 -0.96 0.00 0.00 56.93 55.62 1rin s PHE 229 Cb -0.10 -0.07 0.05 0.00 -0.34 0.00 0.00 43.02 42.56 1rin s PHE 229 CO -0.00 -0.23 0.30 -1.58 -1.46 0.00 0.00 175.22 172.25 1rin s HIS 230 N -1.19 -0.43 0.05 10.12 5.65 -1.26 -5.16 115.29 123.07 1rin s HIS 230 Ca -0.13 0.97 0.02 0.00 0.25 0.00 0.00 55.06 56.17 1rin s HIS 230 Cb -0.07 0.12 -0.03 0.00 -1.18 0.00 0.00 32.58 31.42 1rin s HIS 230 CO 0.01 -0.28 -0.08 -1.54 -0.65 0.00 0.00 174.74 172.20 1rin s SER 231 N 1.35 0.96 -0.12 9.88 1.04 -1.26 -5.14 113.70 120.41 1rin s SER 231 Ca -0.09 -0.61 -0.05 0.00 0.48 0.00 0.00 55.95 55.68 1rin s SER 231 Cb -0.10 0.04 0.06 0.00 0.10 0.00 0.00 66.02 66.11 1rin s SER 231 CO -0.10 -0.23 0.25 -1.83 0.98 0.00 0.00 173.24 172.32 1rin s GLU 232 N -1.87 0.17 0.10 4.02 -1.05 -1.26 -5.14 118.70 113.67 1rin s GLU 232 Ca -0.07 0.65 0.02 0.00 -0.15 0.00 0.00 54.97 55.42 1rin s GLU 232 Cb -0.08 -0.08 -0.04 0.00 -0.44 0.00 0.00 34.13 33.49 1rin s GLU 232 CO -0.00 -0.23 0.20 -1.17 0.95 0.00 0.00 175.26 175.01 1rin s LEU 233 N 1.90 4.21 0.00 1.83 2.96 -1.26 -5.37 118.68 122.96 1rin s LEU 233 Ca -0.03 0.16 0.22 0.00 -0.22 0.00 0.00 54.13 54.26 1rin s LEU 233 Cb -0.11 -2.82 0.18 0.00 0.50 0.00 0.00 46.19 43.94 1rin s LEU 233 CO -0.08 0.13 1.21 -1.20 -1.32 0.00 0.00 176.35 175.08