#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8u n ASP 221 N 0.00 0.00 -1.23 3.42 8.00 -1.26 -4.80 116.55 120.68 1r8u n ASP 221 Ca 0.00 -0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.28 1r8u n ASP 221 Cb 0.00 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 40.94 1r8u n ASP 221 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1r8u n PHE 222 N -1.16 0.00 -1.38 1.24 -1.74 -1.26 -5.13 117.46 108.03 1r8u n PHE 222 Ca 0.10 0.00 -0.46 0.00 -0.56 0.00 0.00 57.45 56.53 1r8u n PHE 222 Cb 0.10 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.08 1r8u n PHE 222 CO 0.00 0.00 0.00 -0.89 -0.56 0.00 0.00 176.76 175.31 1r8u n ILE 223 N 0.00 1.63 -4.43 1.97 5.41 -1.26 -5.02 119.36 117.67 1r8u n ILE 223 Ca 0.00 -0.50 -0.24 0.00 1.00 0.00 0.00 62.75 63.01 1r8u n ILE 223 Cb 0.00 -0.06 -0.09 0.00 -0.71 0.00 0.00 39.64 38.78 1r8u n ILE 223 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1r8u s ASP 224 N -0.98 3.81 0.29 4.38 2.15 -1.26 -4.89 116.67 120.17 1r8u s ASP 224 Ca 0.63 -0.94 0.02 0.00 0.43 0.00 0.00 52.55 52.68 1r8u s ASP 224 Cb -0.83 -0.42 0.58 0.00 -0.30 0.00 0.00 42.92 41.94 1r8u s ASP 224 CO 0.58 0.03 1.85 1.05 -0.17 0.00 0.00 175.17 178.51 1r8u h GLU 225 N 2.18 0.94 0.00 4.34 4.11 -2.00 -1.03 114.58 123.12 1r8u h GLU 225 Ca -0.41 -0.06 -0.05 0.00 0.07 0.00 0.00 59.36 58.91 1r8u h GLU 225 Cb 1.26 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 1r8u h GLU 225 CO 0.60 0.62 -0.25 0.93 0.07 0.00 0.00 179.01 180.98 1r8u h GLU 226 N 0.97 0.00 -0.27 1.06 5.08 -1.98 -0.42 114.58 119.02 1r8u h GLU 226 Ca 0.48 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.71 1r8u h GLU 226 Cb 0.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1r8u h GLU 226 CO -0.25 0.25 -0.38 0.28 -1.00 0.00 0.00 179.01 177.92 1r8u h VAL 227 N 0.00 1.30 -0.38 3.13 2.07 -1.61 -0.61 116.25 120.16 1r8u h VAL 227 Ca -0.00 -1.57 -0.12 0.00 0.82 0.00 0.00 66.70 65.84 1r8u h VAL 227 Cb 0.53 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1r8u h VAL 227 CO 0.03 0.50 -0.21 -0.07 0.02 0.00 0.00 177.57 177.84 1r8u h LEU 228 N 0.46 0.85 -1.29 2.57 -0.00 -1.12 -2.15 115.31 114.62 1r8u h LEU 228 Ca 0.03 -0.42 0.01 0.00 -0.00 0.00 0.00 57.88 57.50 1r8u h LEU 228 Cb 0.97 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 41.36 1r8u h LEU 228 CO 0.09 1.08 0.46 0.24 -0.00 0.00 0.00 178.44 180.31 1r8u h MET 229 N 0.62 0.93 -0.62 1.13 2.86 -1.04 0.14 114.93 118.95 1r8u h MET 229 Ca 0.08 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 1r8u h MET 229 Cb 0.77 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 1r8u h MET 229 CO 0.06 0.62 0.07 0.77 1.06 0.00 0.00 176.91 179.49 1r8u h SER 230 N 0.96 1.00 0.18 1.22 0.02 -0.98 -2.18 113.55 113.77 1r8u h SER 230 Ca 0.26 -0.25 -0.15 0.00 -0.84 0.00 0.00 61.79 60.82 1r8u h SER 230 Cb -0.10 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.17 1r8u h SER 230 CO -0.05 1.01 -0.55 0.25 -1.14 0.00 0.00 176.83 176.35 1r8u h LEU 231 N 0.96 0.43 -0.51 5.07 6.46 -0.61 0.24 115.31 127.36 1r8u h LEU 231 Ca 0.19 -0.23 0.04 0.00 -0.12 0.00 0.00 57.88 57.76 1r8u h LEU 231 Cb 0.46 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 40.23 1r8u h LEU 231 CO 0.02 0.89 0.27 0.58 -0.62 0.00 0.00 178.44 179.58 1r8u h VAL 232 N 0.30 0.98 -0.29 1.05 2.07 -0.60 0.20 116.25 119.96 1r8u h VAL 232 Ca 0.01 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.24 1r8u h VAL 232 Cb 1.05 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1r8u h VAL 232 CO 0.09 0.10 -0.24 0.40 0.02 0.00 0.00 177.57 177.94 1r8u h ILE 233 N 0.53 1.30 -0.42 4.57 2.04 -1.25 -0.04 117.51 124.23 1r8u h ILE 233 Ca 0.22 -1.39 0.02 0.00 1.00 0.00 0.00 64.86 64.70 1r8u h ILE 233 Cb 0.11 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1r8u h ILE 233 CO -0.14 0.45 0.25 -0.08 0.00 0.00 0.00 178.15 178.62 1r8u h GLU 234 N 0.41 0.49 0.00 2.37 4.57 -0.58 -2.66 114.58 119.18 1r8u h GLU 234 Ca 0.05 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1r8u h GLU 234 Cb 0.80 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1r8u h GLU 234 CO 0.06 0.33 -0.01 0.52 -1.18 0.00 0.00 179.01 178.73 1r8u h MET 235 N 0.51 0.00 -1.41 1.92 2.86 -1.01 -3.48 114.93 114.32 1r8u h MET 235 Ca 0.17 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.63 1r8u h MET 235 Cb 0.01 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 1r8u h MET 235 CO -0.08 0.00 -0.23 0.41 1.06 0.00 0.00 176.91 178.07 1r8u n GLY 236 N 1.23 0.03 0.21 8.32 0.00 -0.35 -4.94 105.19 109.70 1r8u n GLY 236 Ca 0.05 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.72 1r8u n GLY 236 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1r8u h LEU 237 N -0.10 0.00 -2.22 0.99 3.38 -1.36 -1.87 115.31 114.13 1r8u h LEU 237 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1r8u h LEU 237 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1r8u h LEU 237 CO 0.25 0.00 0.00 -2.24 0.09 0.00 0.00 178.44 176.54 1r8u h ASP 238 N 0.00 0.00 0.51 -0.43 2.03 -1.93 -2.54 116.42 114.07 1r8u h ASP 238 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1r8u h ASP 238 Cb 0.16 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.66 1r8u h ASP 238 CO 0.00 0.00 -0.11 0.54 -1.03 0.00 0.00 179.24 178.64 1r8u n ARG 239 N -2.97 0.46 -1.06 4.15 1.74 -0.70 -4.92 116.66 113.37 1r8u n ARG 239 Ca -0.01 -0.13 -0.33 0.00 -0.77 0.00 0.00 57.85 56.60 1r8u n ARG 239 Cb 0.16 -1.50 0.13 0.00 -1.02 0.00 0.00 32.46 30.23 1r8u n ARG 239 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1r8u n ILE 240 N -1.15 1.80 0.00 0.55 2.08 -0.96 -4.99 119.36 116.69 1r8u n ILE 240 Ca 0.12 -0.19 0.00 0.00 0.56 0.00 0.00 62.75 63.25 1r8u n ILE 240 Cb 0.29 -1.17 0.00 0.00 -0.75 0.00 0.00 39.64 38.01 1r8u n ILE 240 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1r8u n LYS 241 N -3.33 0.00 -3.77 0.38 4.81 -1.26 -5.06 118.16 109.93 1r8u n LYS 241 Ca 0.13 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.45 1r8u n LYS 241 Cb 0.51 -0.70 -0.13 0.00 0.02 0.00 0.00 35.03 34.73 1r8u n LYS 241 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1r8u s GLU 242 N -1.92 0.18 0.03 1.64 2.02 -1.26 -5.14 118.70 114.26 1r8u s GLU 242 Ca 0.00 0.38 -0.30 0.00 0.02 0.00 0.00 54.97 55.06 1r8u s GLU 242 Cb 0.00 -0.04 -0.07 0.00 0.10 0.00 0.00 34.13 34.12 1r8u s GLU 242 CO 0.00 -0.11 1.57 -1.17 0.02 0.00 0.00 175.26 175.57 1r8u s LEU 243 N 0.76 4.34 0.91 1.80 2.96 -1.26 -5.01 118.68 123.18 1r8u s LEU 243 Ca -0.05 2.33 -0.12 0.00 -0.22 0.00 0.00 54.13 56.07 1r8u s LEU 243 Cb -0.07 -3.56 0.14 0.00 0.50 0.00 0.00 46.19 43.20 1r8u s LEU 243 CO -0.04 -0.83 1.11 -2.16 -1.32 0.00 0.00 176.35 173.10 1r8u s PRO 244 N 2.68 1.14 0.18 0.98 0.04 -1.26 -5.07 135.00 133.69 1r8u s PRO 244 Ca 0.70 0.50 -0.03 0.00 0.04 0.00 0.00 61.00 62.21 1r8u s PRO 244 Cb -0.36 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 1r8u s PRO 244 CO 0.30 -2.24 0.39 -1.21 0.04 0.00 0.00 177.00 174.28 1r8u s GLU 245 N -5.12 3.57 0.01 4.56 2.02 -1.26 -5.12 118.70 117.35 1r8u s GLU 245 Ca 0.64 -0.21 -0.06 0.00 0.02 0.00 0.00 54.97 55.35 1r8u s GLU 245 Cb -0.16 -2.84 -0.00 0.00 0.10 0.00 0.00 34.13 31.23 1r8u s GLU 245 CO 0.55 0.42 0.12 -0.51 0.02 0.00 0.00 175.26 175.86 1r8u s LEU 246 N -3.03 1.64 -0.46 1.80 1.02 -1.26 -5.11 118.68 113.29 1r8u s LEU 246 Ca 0.40 -0.26 0.09 0.00 0.02 0.00 0.00 54.13 54.38 1r8u s LEU 246 Cb -0.12 0.61 0.36 0.00 0.02 0.00 0.00 46.19 47.07 1r8u s LEU 246 CO 0.27 -0.38 0.86 0.79 0.02 0.00 0.00 176.35 177.92 1r8u n TRP 247 N 1.41 2.05 0.25 0.29 7.02 -1.26 -4.92 117.44 122.27 1r8u n TRP 247 Ca -0.23 -3.78 0.15 0.00 -1.02 0.00 0.00 57.50 52.63 1r8u n TRP 247 Cb 0.56 -0.42 0.85 0.00 -2.42 0.00 0.00 31.31 29.87 1r8u n TRP 247 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1r8u h LEU 248 N 2.97 0.00 0.00 -0.99 4.07 -1.99 -1.82 115.31 117.55 1r8u h LEU 248 Ca 0.11 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.07 1r8u h LEU 248 Cb 0.79 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.53 1r8u h LEU 248 CO 0.65 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.62 1r8u n GLY 249 N -1.38 -1.08 3.44 0.83 0.00 -1.26 -4.78 105.19 100.96 1r8u n GLY 249 Ca -0.01 -0.15 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 1r8u n GLY 249 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1r8u s GLN 250 N -2.33 1.59 0.62 1.61 -0.21 -0.68 -5.04 119.66 115.23 1r8u s GLN 250 Ca 0.34 -1.70 0.35 0.00 0.02 0.00 0.00 55.36 54.36 1r8u s GLN 250 Cb 0.19 -1.66 2.00 0.00 1.00 0.00 0.00 33.01 34.54 1r8u s GLN 250 CO 0.39 0.31 2.24 -0.97 -2.12 0.00 0.00 175.29 175.14 1r8u h ASN 251 N 2.45 0.00 -0.18 5.90 -1.24 -1.89 -2.83 115.58 117.80 1r8u h ASN 251 Ca -0.40 0.00 0.05 0.00 0.71 0.00 0.00 56.30 56.66 1r8u h ASN 251 Cb 1.25 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.29 1r8u h ASN 251 CO 0.59 0.00 0.14 -0.33 -1.29 0.00 0.00 177.43 176.54 1r8u h GLU 252 N 0.00 0.00 -1.81 6.67 4.39 -1.96 -3.35 114.58 118.51 1r8u h GLU 252 Ca 0.02 0.00 -0.41 0.00 0.34 0.00 0.00 59.36 59.31 1r8u h GLU 252 Cb 0.15 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 28.51 1r8u h GLU 252 CO -0.00 0.00 -0.78 0.12 -1.16 0.00 0.00 179.01 177.19 1r8u s PHE 253 N -4.91 -0.03 -1.32 4.33 5.36 -1.07 -5.04 117.98 115.30 1r8u s PHE 253 Ca -0.05 -1.58 -0.16 0.00 -0.96 0.00 0.00 56.93 54.17 1r8u s PHE 253 Cb 0.17 -0.41 0.02 0.00 -0.34 0.00 0.00 43.02 42.46 1r8u s PHE 253 CO 0.65 -1.01 2.05 -3.47 -1.46 0.00 0.00 175.22 171.97 1r8u n ASP 254 N 2.94 3.95 0.23 6.13 -0.08 -1.26 -4.24 116.55 124.22 1r8u n ASP 254 Ca 0.25 -2.84 0.00 0.00 -1.51 0.00 0.00 54.79 50.69 1r8u n ASP 254 Cb 0.51 -1.62 0.00 0.00 2.34 0.00 0.00 41.12 42.35 1r8u n ASP 254 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 1r8u n PHE 255 N 7.28 0.00 -0.56 -0.67 -1.74 -1.26 -0.92 117.46 119.59 1r8u n PHE 255 Ca 0.51 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.40 1r8u n PHE 255 Cb 0.41 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.41 1r8u n PHE 255 CO 0.00 0.00 0.00 -1.33 -0.56 0.00 0.00 176.76 174.87 1r8u n MET 256 N -1.98 0.76 -0.96 3.97 2.81 -1.26 -5.10 117.12 115.36 1r8u n MET 256 Ca 0.00 -0.71 -0.30 0.00 -1.81 0.00 0.00 57.70 54.87 1r8u n MET 256 Cb 0.79 -0.72 0.14 0.00 -0.71 0.00 0.00 33.22 32.72 1r8u n MET 256 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1r8u s THR 257 N -0.30 2.59 -0.26 2.03 -1.32 -0.09 -5.08 115.64 113.21 1r8u s THR 257 Ca 0.00 0.19 -0.15 0.00 -1.21 0.00 0.00 61.69 60.52 1r8u s THR 257 Cb 0.00 -2.46 0.08 0.00 -1.51 0.00 0.00 72.50 68.61 1r8u s THR 257 CO 0.00 -0.25 0.64 -0.62 -2.21 0.00 0.00 174.62 172.18 1r8u s ASP 258 N -3.04 -0.87 -0.05 8.08 2.15 -1.26 -5.11 116.67 116.57 1r8u s ASP 258 Ca 0.64 1.41 0.01 0.00 0.43 0.00 0.00 52.55 55.04 1r8u s ASP 258 Cb -0.20 1.28 0.02 0.00 -0.30 0.00 0.00 42.92 43.72 1r8u s ASP 258 CO 0.58 -0.23 -0.04 -0.36 -0.17 0.00 0.00 175.17 174.94 1r8u s PHE 259 N 1.58 0.83 -0.01 -5.34 0.08 -1.26 -5.02 117.98 108.84 1r8u s PHE 259 Ca -0.10 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 56.71 1r8u s PHE 259 Cb -0.06 -0.75 0.02 0.00 -0.57 0.00 0.00 43.02 41.66 1r8u s PHE 259 CO -0.18 -0.24 0.97 1.33 -0.10 0.00 0.00 175.22 177.00 1r8u n VAL 260 N 4.26 0.11 0.27 -0.44 0.24 -1.26 -4.93 118.33 116.58 1r8u n VAL 260 Ca -0.21 -0.13 0.11 0.00 -2.04 0.00 0.00 64.34 62.07 1r8u n VAL 260 Cb 0.51 0.49 0.74 0.00 -1.47 0.00 0.00 33.84 34.11 1r8u n VAL 260 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r8u s LYS 262 N -4.87 4.17 0.49 0.00 2.47 -1.26 -4.99 119.74 115.75 1r8u s LYS 262 Ca -0.05 2.36 -0.23 0.00 -1.56 0.00 0.00 55.97 56.49 1r8u s LYS 262 Cb 0.16 -3.95 -0.06 0.00 -1.46 0.00 0.00 37.83 32.52 1r8u s LYS 262 CO 0.63 -0.86 1.25 -0.65 0.16 0.00 0.00 175.35 175.88 1r8u s GLN 263 N 3.84 3.52 -0.05 4.03 1.11 -1.26 -5.07 119.66 125.78 1r8u s GLN 263 Ca 0.78 1.99 -0.07 0.00 0.01 0.00 0.00 55.36 58.08 1r8u s GLN 263 Cb -0.38 -2.37 0.01 0.00 -1.01 0.00 0.00 33.01 29.27 1r8u s GLN 263 CO 0.34 -0.81 0.17 -0.65 0.01 0.00 0.00 175.29 174.35 1r8u s GLN 264 N -2.75 0.29 0.23 2.91 -0.21 -1.26 -5.07 119.66 113.80 1r8u s GLN 264 Ca 0.66 0.07 -0.15 0.00 0.02 0.00 0.00 55.36 55.96 1r8u s GLN 264 Cb -0.34 0.13 0.27 0.00 1.00 0.00 0.00 33.01 34.07 1r8u s GLN 264 CO 0.41 -0.05 1.58 -1.35 -2.12 0.00 0.00 175.29 173.76 1r8u h PRO 265 N 5.41 -0.04 0.00 2.91 0.11 -1.98 -0.19 132.00 138.22 1r8u h PRO 265 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1r8u h PRO 265 Cb 1.20 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1r8u h PRO 265 CO 0.40 -0.03 0.00 0.43 -0.21 0.00 0.00 178.00 178.59 1r8u n SER 266 N -5.50 0.01 -0.01 -2.05 7.64 -1.26 -1.85 113.62 110.60 1r8u n SER 266 Ca 0.10 0.50 -0.00 0.00 1.01 0.00 0.00 58.87 60.48 1r8u n SER 266 Cb 0.40 -0.50 -0.02 0.00 -1.01 0.00 0.00 64.21 63.08 1r8u n SER 266 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1r8u n ARG 267 N -1.51 2.36 0.08 1.43 5.12 -0.22 -4.71 116.66 119.21 1r8u n ARG 267 Ca 0.00 -0.01 -0.04 0.00 -1.93 0.00 0.00 57.85 55.88 1r8u n ARG 267 Cb 0.01 -1.07 -0.07 0.00 -1.16 0.00 0.00 32.46 30.18 1r8u n ARG 267 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1r8u h VAL 268 N 0.00 1.28 0.00 1.55 2.07 -0.90 -3.48 116.25 116.76 1r8u h VAL 268 Ca -0.04 -2.87 0.00 0.00 0.82 0.00 0.00 66.70 64.61 1r8u h VAL 268 Cb 0.80 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.18 1r8u h VAL 268 CO 0.00 0.73 0.00 -1.54 0.02 0.00 0.00 177.57 176.78