#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8u h ASP 221 N 0.00 0.00 -5.42 8.00 3.58 -2.14 -3.45 116.42 117.00 1r8u h ASP 221 Ca 0.00 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.28 1r8u h ASP 221 Cb 0.00 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 40.95 1r8u h ASP 221 CO 0.00 0.05 -0.27 0.12 -2.88 0.00 0.00 179.24 176.26 1r8u s PHE 222 N -4.50 0.77 0.77 0.28 5.36 -1.26 -5.17 117.98 114.24 1r8u s PHE 222 Ca -0.04 -1.06 -0.14 0.00 -0.96 0.00 0.00 56.93 54.73 1r8u s PHE 222 Cb 0.15 -0.09 0.06 0.00 -0.34 0.00 0.00 43.02 42.80 1r8u s PHE 222 CO 0.57 -0.94 1.22 0.42 -1.46 0.00 0.00 175.22 175.03 1r8u s ILE 223 N -3.78 2.06 0.06 3.12 1.01 -1.26 -5.06 121.20 117.35 1r8u s ILE 223 Ca 0.29 0.03 0.09 0.00 0.00 0.00 0.00 60.65 61.05 1r8u s ILE 223 Cb 0.01 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 1r8u s ILE 223 CO 0.13 -0.02 -0.24 -0.62 0.00 0.00 0.00 174.94 174.20 1r8u s ASP 224 N -1.99 2.85 0.33 3.58 -1.08 -1.26 -5.05 116.67 114.05 1r8u s ASP 224 Ca 0.75 -0.58 0.05 0.00 -0.52 0.00 0.00 52.55 52.25 1r8u s ASP 224 Cb -0.31 -0.24 0.69 0.00 -1.46 0.00 0.00 42.92 41.61 1r8u s ASP 224 CO 0.48 0.20 1.90 1.05 0.52 0.00 0.00 175.17 179.32 1r8u h GLU 225 N 4.69 0.81 0.00 4.34 9.09 -2.00 -0.63 114.58 130.89 1r8u h GLU 225 Ca -0.45 -0.05 -0.05 0.00 0.05 0.00 0.00 59.36 58.86 1r8u h GLU 225 Cb 1.15 -0.18 -0.01 0.00 -1.65 0.00 0.00 28.75 28.06 1r8u h GLU 225 CO 0.43 0.53 -0.25 0.93 0.05 0.00 0.00 179.01 180.71 1r8u h GLU 226 N 0.83 0.00 -0.33 1.06 5.08 -1.98 -2.04 114.58 117.20 1r8u h GLU 226 Ca 0.41 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.66 1r8u h GLU 226 Cb 0.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1r8u h GLU 226 CO -0.17 0.25 -0.21 0.28 -1.00 0.00 0.00 179.01 178.16 1r8u h VAL 227 N 0.00 1.29 -0.49 3.13 2.07 -1.55 -0.43 116.25 120.27 1r8u h VAL 227 Ca -0.00 -1.35 -0.08 0.00 0.82 0.00 0.00 66.70 66.09 1r8u h VAL 227 Cb 0.89 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1r8u h VAL 227 CO 0.03 0.44 0.00 -0.07 0.02 0.00 0.00 177.57 177.99 1r8u h LEU 228 N 0.49 0.84 -1.32 2.57 -0.00 -1.24 -1.08 115.31 115.56 1r8u h LEU 228 Ca 0.07 -0.31 -0.01 0.00 -0.00 0.00 0.00 57.88 57.64 1r8u h LEU 228 Cb 0.76 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 41.17 1r8u h LEU 228 CO 0.06 0.94 0.35 0.24 -0.00 0.00 0.00 178.44 180.03 1r8u h MET 229 N 0.72 0.81 -0.48 1.13 2.86 -1.29 0.95 114.93 119.63 1r8u h MET 229 Ca 0.14 -0.07 -0.10 0.00 -2.06 0.00 0.00 59.70 57.60 1r8u h MET 229 Cb 0.51 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1r8u h MET 229 CO 0.02 0.58 -0.11 0.77 1.06 0.00 0.00 176.91 179.23 1r8u h SER 230 N 0.83 0.89 0.12 1.22 0.02 -0.78 -2.51 113.55 113.33 1r8u h SER 230 Ca 0.22 -0.28 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 1r8u h SER 230 Cb -0.01 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1r8u h SER 230 CO -0.04 1.02 -0.49 -0.07 -1.14 0.00 0.00 176.83 176.11 1r8u h LEU 231 N 0.80 0.47 -0.55 5.07 3.38 -0.29 0.47 115.31 124.66 1r8u h LEU 231 Ca 0.13 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1r8u h LEU 231 Cb 0.64 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 1r8u h LEU 231 CO 0.04 0.88 0.29 0.58 0.09 0.00 0.00 178.44 180.33 1r8u h VAL 232 N 0.34 0.97 -0.23 1.22 2.07 -0.72 -0.01 116.25 119.89 1r8u h VAL 232 Ca 0.02 -0.19 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 1r8u h VAL 232 Cb 0.99 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1r8u h VAL 232 CO 0.09 0.10 -0.22 0.40 0.02 0.00 0.00 177.57 177.96 1r8u h ILE 233 N 0.56 1.32 -0.45 4.57 2.04 -1.27 0.19 117.51 124.47 1r8u h ILE 233 Ca 0.24 -1.37 0.04 0.00 1.00 0.00 0.00 64.86 64.76 1r8u h ILE 233 Cb 0.13 1.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1r8u h ILE 233 CO -0.15 0.43 0.21 -0.08 0.00 0.00 0.00 178.15 178.56 1r8u h GLU 234 N 0.25 0.42 0.00 2.37 4.57 -0.55 -2.29 114.58 119.35 1r8u h GLU 234 Ca 0.04 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1r8u h GLU 234 Cb 0.77 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1r8u h GLU 234 CO 0.05 0.28 0.00 -1.33 -1.18 0.00 0.00 179.01 176.83 1r8u n MET 235 N -4.92 0.18 -2.20 1.92 2.81 -0.05 -4.96 117.12 109.90 1r8u n MET 235 Ca 0.03 0.15 -0.11 0.00 -1.81 0.00 0.00 57.70 55.96 1r8u n MET 235 Cb 0.12 -1.71 -0.01 0.00 -0.71 0.00 0.00 33.22 30.92 1r8u n MET 235 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1r8u n GLY 236 N 1.37 -0.07 0.19 3.03 0.00 -0.57 -4.94 105.19 104.20 1r8u n GLY 236 Ca 0.06 -0.43 0.14 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 0.00 -1.66 0.99 3.38 -1.28 -2.54 115.31 114.20 1r8u h LEU 237 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1r8u h LEU 237 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1r8u h LEU 237 CO 0.30 0.00 0.00 -2.24 0.09 0.00 0.00 178.44 176.59 1r8u h ASP 238 N 0.00 0.00 -0.30 -0.43 2.03 -1.92 -2.41 116.42 113.39 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 0.21 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 1r8u h ASP 238 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 179.24 178.75 1r8u n ARG 239 N -2.51 2.46 -0.85 4.15 1.74 -0.95 -4.98 116.66 115.71 1r8u n ARG 239 Ca -0.01 -2.18 -0.31 0.00 -0.77 0.00 0.00 57.85 54.58 1r8u n ARG 239 Cb 0.10 -1.50 0.15 0.00 -1.02 0.00 0.00 32.46 30.18 1r8u n ARG 239 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1r8u s ILE 240 N -1.63 2.37 0.00 0.55 -1.09 -0.91 -5.00 121.20 115.49 1r8u s ILE 240 Ca 0.36 0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.90 1r8u s ILE 240 Cb 0.22 -2.27 0.00 0.00 -1.58 0.00 0.00 42.46 38.83 1r8u s ILE 240 CO 0.31 -0.16 0.00 1.17 -1.23 0.00 0.00 174.94 175.04 1r8u n LYS 241 N -4.02 0.00 -3.76 2.79 4.81 -1.26 -5.07 118.16 111.64 1r8u n LYS 241 Ca 0.11 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.42 1r8u n LYS 241 Cb 0.52 -0.60 -0.14 0.00 0.02 0.00 0.00 35.03 34.84 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 -1.76 0.15 -0.07 1.64 0.41 -1.26 -5.14 118.70 112.66 1r8u s GLU 242 Ca 0.00 0.36 -0.30 0.00 -0.41 0.00 0.00 54.97 54.63 1r8u s GLU 242 Cb 0.00 -0.09 -0.04 0.00 -1.78 0.00 0.00 34.13 32.22 1r8u s GLU 242 CO 0.00 -0.12 1.48 -1.17 -0.49 0.00 0.00 175.26 174.96 1r8u s LEU 243 N 0.87 4.28 0.89 1.80 2.96 -1.26 -5.02 118.68 123.20 1r8u s LEU 243 Ca -0.06 2.05 -0.12 0.00 -0.22 0.00 0.00 54.13 55.77 1r8u s LEU 243 Cb -0.08 -3.54 0.13 0.00 0.50 0.00 0.00 46.19 43.19 1r8u s LEU 243 CO -0.05 -0.83 1.12 -2.16 -1.32 0.00 0.00 176.35 173.11 1r8u s PRO 244 N 3.50 1.28 0.14 0.98 0.04 -1.26 -5.08 135.00 134.61 1r8u s PRO 244 Ca 0.66 0.40 0.03 0.00 0.04 0.00 0.00 61.00 62.13 1r8u s PRO 244 Cb -0.29 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1r8u s PRO 244 CO 0.24 -2.13 0.24 -1.21 0.04 0.00 0.00 177.00 174.19 1r8u s GLU 245 N -5.21 3.32 0.10 4.56 8.01 -1.26 -5.13 118.70 123.09 1r8u s GLU 245 Ca 0.63 -0.64 -0.07 0.00 0.01 0.00 0.00 54.97 54.91 1r8u s GLU 245 Cb -0.15 -2.90 -0.01 0.00 -4.31 0.00 0.00 34.13 26.75 1r8u s GLU 245 CO 0.54 0.52 0.15 -0.51 0.01 0.00 0.00 175.26 175.98 1r8u s LEU 246 N -3.13 1.58 -0.43 1.80 1.02 -1.26 -5.12 118.68 113.14 1r8u s LEU 246 Ca 0.34 -0.81 0.10 0.00 0.02 0.00 0.00 54.13 53.78 1r8u s LEU 246 Cb -0.11 0.84 0.37 0.00 0.02 0.00 0.00 46.19 47.31 1r8u s LEU 246 CO 0.27 -0.73 0.88 0.79 0.02 0.00 0.00 176.35 177.58 1r8u n TRP 247 N -0.06 1.93 0.32 0.29 7.02 -1.26 -4.88 117.44 120.79 1r8u n TRP 247 Ca -0.13 -3.61 0.19 0.00 -1.02 0.00 0.00 57.50 52.94 1r8u n TRP 247 Cb 0.62 -0.39 1.06 0.00 -2.42 0.00 0.00 31.31 30.18 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 2.94 0.00 0.00 -0.99 4.07 -1.98 -2.02 115.31 117.33 1r8u h LEU 248 Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 1r8u h LEU 248 Cb 0.86 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.60 1r8u h LEU 248 CO 0.64 0.01 0.00 0.61 -1.08 0.00 0.00 178.44 178.62 1r8u n GLY 249 N -1.04 -0.94 3.18 0.83 0.00 -1.26 -4.83 105.19 101.13 1r8u n GLY 249 Ca -0.03 -0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.00 0.82 0.61 1.61 -1.52 -0.76 -5.05 119.66 113.38 1r8u s GLN 250 Ca 0.01 -1.16 0.39 0.00 -1.95 0.00 0.00 55.36 52.65 1r8u s GLN 250 Cb 0.01 0.29 1.97 0.00 -0.22 0.00 0.00 33.01 35.05 1r8u s GLN 250 CO 0.01 -0.24 2.22 -0.97 -0.25 0.00 0.00 175.29 176.06 1r8u h ASN 251 N 2.87 0.00 0.04 5.90 -1.24 -1.88 -3.20 115.58 118.08 1r8u h ASN 251 Ca -0.34 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.67 1r8u h ASN 251 Cb 1.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.23 1r8u h ASN 251 CO 0.59 0.02 0.00 -0.33 -1.29 0.00 0.00 177.43 176.41 1r8u h GLU 252 N 0.00 0.00 -2.55 6.67 5.08 -1.97 -3.36 114.58 118.45 1r8u h GLU 252 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 1r8u h GLU 252 Cb 0.20 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.06 1r8u h GLU 252 CO 0.00 0.00 -0.87 0.12 -1.00 0.00 0.00 179.01 177.26 1r8u s PHE 253 N -3.83 0.87 -0.92 4.33 5.36 -1.21 -5.02 117.98 117.57 1r8u s PHE 253 Ca -0.03 -1.83 -0.14 0.00 -0.96 0.00 0.00 56.93 53.96 1r8u s PHE 253 Cb 0.09 -0.96 -0.10 0.00 -0.34 0.00 0.00 43.02 41.71 1r8u s PHE 253 CO 0.31 -0.83 2.07 -0.40 -1.46 0.00 0.00 175.22 174.91 1r8u n ASP 254 N 3.73 3.84 -0.06 6.13 5.75 -1.26 -4.51 116.55 130.17 1r8u n ASP 254 Ca 0.16 -2.55 0.23 0.00 -0.01 0.00 0.00 54.79 52.62 1r8u n ASP 254 Cb 0.39 -1.17 0.49 0.00 -1.03 0.00 0.00 41.12 39.80 1r8u n ASP 254 CO 0.00 0.00 0.00 2.19 -0.11 0.00 0.00 177.20 179.28 1r8u h PHE 255 N 6.99 0.00 0.00 2.11 -0.00 -1.96 0.23 116.94 124.31 1r8u h PHE 255 Ca 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.45 1r8u h PHE 255 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.40 1r8u h PHE 255 CO 1.57 0.00 -0.09 -1.33 -0.00 0.00 0.00 178.31 178.46 1r8u n MET 256 N -3.26 1.05 -0.54 6.09 2.81 -1.26 -5.08 117.12 116.93 1r8u n MET 256 Ca 0.16 -2.27 0.00 0.00 -1.81 0.00 0.00 57.70 53.78 1r8u n MET 256 Cb 1.20 -1.31 0.00 0.00 -0.71 0.00 0.00 33.22 32.41 1r8u n MET 256 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1r8u n THR 257 N -1.16 0.00 -3.00 2.03 -1.04 0.07 -4.94 114.28 106.23 1r8u n THR 257 Ca 0.13 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 62.00 1r8u n THR 257 Cb 0.65 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.13 1r8u n THR 257 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1r8u n ASP 258 N 0.78 -2.20 -3.93 8.00 2.03 -1.26 -5.14 116.55 114.83 1r8u n ASP 258 Ca 0.00 -2.74 -0.10 0.00 0.52 0.00 0.00 54.79 52.46 1r8u n ASP 258 Cb 0.00 0.83 -0.12 0.00 -0.72 0.00 0.00 41.12 41.11 1r8u n ASP 258 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1r8u s PHE 259 N 0.47 0.13 -0.00 -0.67 -0.12 -1.26 -5.05 117.98 111.48 1r8u s PHE 259 Ca 0.31 -0.27 0.00 0.00 -0.05 0.00 0.00 56.93 56.93 1r8u s PHE 259 Cb 0.04 -0.10 0.00 0.00 -0.63 0.00 0.00 43.02 42.33 1r8u s PHE 259 CO -0.12 -0.10 0.57 1.33 -0.05 0.00 0.00 175.22 176.85 1r8u n VAL 260 N 2.30 0.05 -1.74 -2.49 0.24 -1.26 -5.13 118.33 110.31 1r8u n VAL 260 Ca -0.18 -0.06 -0.42 0.00 -2.04 0.00 0.00 64.34 61.64 1r8u n VAL 260 Cb 0.57 0.93 -0.01 0.00 -1.47 0.00 0.00 33.84 33.87 1r8u n VAL 260 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r8u n LYS 262 N 0.76 0.53 -4.02 0.00 4.76 -1.26 -5.12 118.16 113.80 1r8u n LYS 262 Ca 0.04 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.39 1r8u n LYS 262 Cb 0.37 -0.58 -0.09 0.00 -1.84 0.00 0.00 35.03 32.90 1r8u n LYS 262 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1r8u s GLN 263 N -1.15 0.81 -0.18 1.97 -1.52 -1.26 -5.17 119.66 113.16 1r8u s GLN 263 Ca 0.00 -1.19 -0.05 0.00 -1.95 0.00 0.00 55.36 52.16 1r8u s GLN 263 Cb 0.00 0.27 0.09 0.00 -0.22 0.00 0.00 33.01 33.15 1r8u s GLN 263 CO 0.00 -0.23 0.34 -1.14 -0.25 0.00 0.00 175.29 174.02 1r8u s GLN 264 N -3.94 0.25 0.28 2.91 0.74 -1.26 -5.07 119.66 113.57 1r8u s GLN 264 Ca 0.12 0.81 -0.04 0.00 0.05 0.00 0.00 55.36 56.30 1r8u s GLN 264 Cb 0.06 -0.00 0.56 0.00 1.10 0.00 0.00 33.01 34.74 1r8u s GLN 264 CO -0.06 -0.34 1.59 -1.35 -0.55 0.00 0.00 175.29 174.58 1r8u h PRO 265 N 8.23 0.03 -0.14 1.67 0.11 -2.02 -2.10 132.00 137.78 1r8u h PRO 265 Ca -0.16 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.99 1r8u h PRO 265 Cb 1.12 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1r8u h PRO 265 CO 0.15 0.02 0.56 0.77 -0.21 0.00 0.00 178.00 179.30 1r8u h SER 266 N 0.03 0.00 0.69 -2.05 0.02 -1.98 -0.36 113.55 109.91 1r8u h SER 266 Ca 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.45 1r8u h SER 266 Cb 0.92 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1r8u h SER 266 CO -0.86 0.00 0.00 -2.11 -1.14 0.00 0.00 176.83 172.72 1r8u n ARG 267 N -2.96 0.16 0.00 3.45 1.85 -0.79 -4.28 116.66 114.09 1r8u n ARG 267 Ca 0.02 0.06 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 1r8u n ARG 267 Cb 0.64 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.55 1r8u n ARG 267 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1r8u n VAL 268 N -1.41 0.00 0.19 8.89 0.31 -0.40 -5.15 118.33 120.76 1r8u n VAL 268 Ca 0.09 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.43 1r8u n VAL 268 Cb 0.25 -0.46 0.09 0.00 -0.91 0.00 0.00 33.84 32.81 1r8u n VAL 268 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31