#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 0.49 -3.93 8.00 5.75 -1.26 -5.11 116.55 120.49 1r8u n ASP 221 Ca 0.00 -1.19 -0.10 0.00 -0.01 0.00 0.00 54.79 53.49 1r8u n ASP 221 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 1r8u n ASP 221 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1r8u s PHE 222 N -0.19 0.49 0.85 2.11 5.36 -1.26 -5.17 117.98 120.17 1r8u s PHE 222 Ca 0.00 -0.83 -0.12 0.00 -0.96 0.00 0.00 56.93 55.02 1r8u s PHE 222 Cb 0.00 0.11 0.10 0.00 -0.34 0.00 0.00 43.02 42.90 1r8u s PHE 222 CO 0.00 -0.99 1.15 -0.89 -1.46 0.00 0.00 175.22 173.03 1r8u n ILE 223 N -0.39 1.25 -4.36 3.12 5.41 -1.26 -5.08 119.36 118.05 1r8u n ILE 223 Ca -0.01 -0.14 -0.21 0.00 1.00 0.00 0.00 62.75 63.39 1r8u n ILE 223 Cb 0.62 -1.10 -0.13 0.00 -0.71 0.00 0.00 39.64 38.32 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 -2.29 1.94 0.41 4.38 -1.08 -1.26 -5.05 116.67 113.72 1r8u s ASP 224 Ca 0.70 -0.53 0.10 0.00 -0.52 0.00 0.00 52.55 52.30 1r8u s ASP 224 Cb -0.27 -0.12 0.91 0.00 -1.46 0.00 0.00 42.92 41.98 1r8u s ASP 224 CO 0.54 0.04 2.00 1.05 0.52 0.00 0.00 175.17 179.32 1r8u h GLU 225 N 4.67 0.52 0.00 4.34 4.11 -2.00 -0.73 114.58 125.50 1r8u h GLU 225 Ca -0.41 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 58.97 1r8u h GLU 225 Cb 1.18 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1r8u h GLU 225 CO 0.42 0.35 -0.12 0.93 0.07 0.00 0.00 179.01 180.66 1r8u h GLU 226 N 0.54 0.00 -0.24 1.06 5.08 -1.98 -1.16 114.58 117.88 1r8u h GLU 226 Ca 0.25 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.42 1r8u h GLU 226 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1r8u h GLU 226 CO -0.07 0.12 -0.59 0.28 -1.00 0.00 0.00 179.01 177.75 1r8u h VAL 227 N 0.00 1.29 -0.50 3.13 2.07 -1.56 -0.60 116.25 120.07 1r8u h VAL 227 Ca -0.00 -1.79 -0.09 0.00 0.82 0.00 0.00 66.70 65.63 1r8u h VAL 227 Cb 0.77 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 1r8u h VAL 227 CO 0.02 0.58 -0.04 -0.07 0.02 0.00 0.00 177.57 178.07 1r8u h LEU 228 N 0.59 0.90 -1.33 2.57 -0.00 -1.06 -1.94 115.31 115.04 1r8u h LEU 228 Ca 0.00 -0.33 0.05 0.00 -0.00 0.00 0.00 57.88 57.60 1r8u h LEU 228 Cb 1.19 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 41.56 1r8u h LEU 228 CO 0.12 1.01 0.49 0.24 -0.00 0.00 0.00 178.44 180.31 1r8u h MET 229 N 0.77 0.82 -0.65 1.13 2.86 -1.10 0.12 114.93 118.87 1r8u h MET 229 Ca 0.14 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.65 1r8u h MET 229 Cb 0.58 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.03 1r8u h MET 229 CO 0.03 0.54 0.09 0.77 1.06 0.00 0.00 176.91 179.41 1r8u h SER 230 N 0.84 1.05 0.29 1.22 0.02 -0.76 -1.83 113.55 114.38 1r8u h SER 230 Ca 0.31 -0.27 -0.14 0.00 -0.84 0.00 0.00 61.79 60.85 1r8u h SER 230 Cb 0.15 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1r8u h SER 230 CO -0.10 1.05 -0.56 0.25 -1.14 0.00 0.00 176.83 176.34 1r8u h LEU 231 N 1.01 0.32 -0.49 5.07 6.46 -0.53 -0.30 115.31 126.85 1r8u h LEU 231 Ca 0.20 -0.17 0.03 0.00 -0.12 0.00 0.00 57.88 57.81 1r8u h LEU 231 Cb 0.46 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.26 1r8u h LEU 231 CO 0.02 0.81 0.28 0.58 -0.62 0.00 0.00 178.44 179.51 1r8u h VAL 232 N 0.22 1.03 -0.35 1.05 2.07 -0.60 -0.09 116.25 119.58 1r8u h VAL 232 Ca 0.00 -0.19 -0.16 0.00 0.82 0.00 0.00 66.70 67.17 1r8u h VAL 232 Cb 1.05 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1r8u h VAL 232 CO 0.09 0.10 -0.42 0.40 0.02 0.00 0.00 177.57 177.77 1r8u h ILE 233 N 0.56 1.28 -0.36 4.57 2.04 -1.18 0.17 117.51 124.58 1r8u h ILE 233 Ca 0.20 -1.59 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 1r8u h ILE 233 Cb 0.04 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1r8u h ILE 233 CO -0.10 0.53 0.22 -0.08 0.00 0.00 0.00 178.15 178.71 1r8u h GLU 234 N 0.71 0.49 0.00 2.37 4.57 -0.69 -3.11 114.58 118.92 1r8u h GLU 234 Ca 0.05 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 1r8u h GLU 234 Cb 1.00 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.47 1r8u h GLU 234 CO 0.10 0.38 -0.69 0.52 -1.18 0.00 0.00 179.01 178.13 1r8u h MET 235 N 0.47 0.00 0.00 1.92 2.86 -1.03 -3.49 114.93 115.67 1r8u h MET 235 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1r8u h MET 235 Cb 0.01 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1r8u h MET 235 CO -0.02 0.67 0.00 0.41 1.06 0.00 0.00 176.91 179.03 1r8u n GLY 236 N 1.27 0.68 0.04 8.32 0.00 0.41 -4.99 105.19 110.93 1r8u n GLY 236 Ca 0.01 -0.73 0.08 0.00 0.00 0.00 0.00 46.02 45.38 1r8u n GLY 236 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r8u n LEU 237 N 0.00 0.21 0.17 0.99 4.77 -0.18 -2.67 117.00 120.29 1r8u n LEU 237 Ca 0.00 0.56 0.12 0.00 -0.03 0.00 0.00 56.01 56.67 1r8u n LEU 237 Cb 0.30 -0.54 0.61 0.00 -2.33 0.00 0.00 43.42 41.46 1r8u n LEU 237 CO 0.00 -0.41 0.87 -2.24 -1.33 0.00 0.00 177.39 174.28 1r8u h ASP 238 N 0.00 0.00 -0.09 -1.43 2.03 -1.95 -2.49 116.42 112.50 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 0.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.73 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 -2.35 1.73 -0.81 4.15 1.74 -1.09 -4.97 116.66 115.06 1r8u n ARG 239 Ca -0.00 -1.08 -0.32 0.00 -0.77 0.00 0.00 57.85 55.68 1r8u n ARG 239 Cb 0.11 -1.44 0.16 0.00 -1.02 0.00 0.00 32.46 30.26 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 0.30 0.63 0.00 0.55 2.08 -0.94 -4.98 119.36 117.00 1r8u n ILE 240 Ca 0.18 -0.07 0.00 0.00 0.56 0.00 0.00 62.75 63.41 1r8u n ILE 240 Cb 0.36 -1.05 0.00 0.00 -0.75 0.00 0.00 39.64 38.20 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 -3.86 0.00 -3.82 0.38 4.81 -1.26 -5.11 118.16 109.31 1r8u n LYS 241 Ca 0.12 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.44 1r8u n LYS 241 Cb 0.52 -0.38 -0.13 0.00 0.02 0.00 0.00 35.03 35.06 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 -1.14 0.17 -0.20 1.64 0.41 -1.26 -5.15 118.70 113.17 1r8u s GLU 242 Ca 0.00 0.22 -0.25 0.00 -0.41 0.00 0.00 54.97 54.52 1r8u s GLU 242 Cb 0.00 0.07 -0.01 0.00 -1.78 0.00 0.00 34.13 32.41 1r8u s GLU 242 CO 0.00 -0.03 0.84 -1.17 -0.49 0.00 0.00 175.26 174.42 1r8u s LEU 243 N 0.15 4.13 0.96 1.80 2.96 -1.26 -5.07 118.68 122.35 1r8u s LEU 243 Ca -0.01 1.14 -0.13 0.00 -0.22 0.00 0.00 54.13 54.91 1r8u s LEU 243 Cb -0.02 -3.24 0.17 0.00 0.50 0.00 0.00 46.19 43.60 1r8u s LEU 243 CO -0.00 -0.46 1.13 -2.16 -1.32 0.00 0.00 176.35 173.54 1r8u s PRO 244 N 2.48 0.72 0.19 0.98 0.04 -1.26 -5.07 135.00 133.09 1r8u s PRO 244 Ca 0.37 0.29 -0.02 0.00 0.04 0.00 0.00 61.00 61.69 1r8u s PRO 244 Cb -0.16 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 1r8u s PRO 244 CO 0.10 -2.48 0.39 -1.21 0.04 0.00 0.00 177.00 173.84 1r8u s GLU 245 N -5.22 3.54 0.05 4.56 2.02 -1.26 -5.12 118.70 117.27 1r8u s GLU 245 Ca 0.65 -0.29 -0.10 0.00 0.02 0.00 0.00 54.97 55.25 1r8u s GLU 245 Cb -0.15 -2.83 0.01 0.00 0.10 0.00 0.00 34.13 31.25 1r8u s GLU 245 CO 0.55 0.40 0.22 -0.51 0.02 0.00 0.00 175.26 175.95 1r8u s LEU 246 N -3.22 1.24 -0.45 1.80 1.02 -1.26 -5.12 118.68 112.69 1r8u s LEU 246 Ca 0.39 -0.38 0.09 0.00 0.02 0.00 0.00 54.13 54.25 1r8u s LEU 246 Cb -0.11 1.09 0.35 0.00 0.02 0.00 0.00 46.19 47.54 1r8u s LEU 246 CO 0.28 -0.61 0.83 0.79 0.02 0.00 0.00 176.35 177.66 1r8u n TRP 247 N 0.49 1.76 0.29 0.29 7.02 -1.26 -4.91 117.44 121.12 1r8u n TRP 247 Ca -0.18 -3.82 0.17 0.00 -1.02 0.00 0.00 57.50 52.66 1r8u n TRP 247 Cb 0.60 -0.43 0.85 0.00 -2.42 0.00 0.00 31.31 29.91 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 2.98 0.00 -1.23 -0.99 4.07 -1.98 -2.11 115.31 116.05 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 0.80 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.54 1r8u h LEU 248 CO 0.63 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.60 1r8u n GLY 249 N -0.72 0.71 3.28 0.83 0.00 -1.26 -4.85 105.19 103.18 1r8u n GLY 249 Ca -0.01 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.64 1.09 0.64 1.61 -1.52 -0.79 -5.05 119.66 114.00 1r8u s GLN 250 Ca 0.19 -1.26 0.41 0.00 -1.95 0.00 0.00 55.36 52.75 1r8u s GLN 250 Cb 0.11 0.34 2.22 0.00 -0.22 0.00 0.00 33.01 35.45 1r8u s GLN 250 CO 0.11 -0.38 2.31 -0.97 -0.25 0.00 0.00 175.29 176.11 1r8u h ASN 251 N 2.64 0.00 -0.70 5.90 -1.24 -1.91 -3.15 115.58 117.12 1r8u h ASN 251 Ca -0.33 0.00 0.14 0.00 0.71 0.00 0.00 56.30 56.82 1r8u h ASN 251 Cb 1.22 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.23 1r8u h ASN 251 CO 0.51 0.01 0.47 -0.33 -1.29 0.00 0.00 177.43 176.80 1r8u h GLU 252 N 0.00 0.36 -1.64 6.67 4.39 -1.97 -3.33 114.58 119.05 1r8u h GLU 252 Ca -0.00 -0.02 -0.37 0.00 0.34 0.00 0.00 59.36 59.30 1r8u h GLU 252 Cb 0.07 -0.08 -0.27 0.00 -0.10 0.00 0.00 28.75 28.37 1r8u h GLU 252 CO 0.00 0.24 -0.74 0.34 -1.16 0.00 0.00 179.01 177.68 1r8u n PHE 253 N -4.46 -2.35 -2.12 4.33 7.35 -1.19 -4.99 117.46 114.03 1r8u n PHE 253 Ca 0.13 -2.36 -0.42 0.00 -0.76 0.00 0.00 57.45 54.04 1r8u n PHE 253 Cb 0.51 0.85 -0.00 0.00 0.35 0.00 0.00 39.48 41.20 1r8u n PHE 253 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1r8u n ASP 254 N 2.79 4.31 0.28 -2.13 -0.08 -1.25 -4.10 116.55 116.37 1r8u n ASP 254 Ca 0.23 -2.87 0.00 0.00 -1.51 0.00 0.00 54.79 50.65 1r8u n ASP 254 Cb 0.52 -1.69 0.00 0.00 2.34 0.00 0.00 41.12 42.30 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 7.47 0.00 -0.89 -0.67 -1.74 -1.26 -0.96 117.46 119.41 1r8u n PHE 255 Ca 0.50 0.00 0.01 0.00 -0.56 0.00 0.00 57.45 57.41 1r8u n PHE 255 Cb 0.43 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.44 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 -2.23 1.07 -0.40 3.97 2.81 -1.26 -5.10 117.12 115.98 1r8u n MET 256 Ca 0.00 -1.16 -0.13 0.00 -1.81 0.00 0.00 57.70 54.60 1r8u n MET 256 Cb 0.87 -0.78 0.11 0.00 -0.71 0.00 0.00 33.22 32.71 1r8u n MET 256 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1r8u n THR 257 N -0.34 0.00 -4.29 2.03 5.66 -0.14 -5.11 114.28 112.10 1r8u n THR 257 Ca 0.02 -0.18 -0.25 0.00 -3.05 0.00 0.00 64.05 60.60 1r8u n THR 257 Cb 0.48 -1.01 -0.08 0.00 -1.55 0.00 0.00 70.33 68.17 1r8u n THR 257 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1r8u s ASP 258 N -2.71 4.26 0.00 1.09 2.15 -1.26 -5.03 116.67 115.16 1r8u s ASP 258 Ca 0.30 -1.02 0.00 0.00 0.43 0.00 0.00 52.55 52.25 1r8u s ASP 258 Cb -0.03 -0.53 0.00 0.00 -0.30 0.00 0.00 42.92 42.06 1r8u s ASP 258 CO 0.23 -0.33 1.04 0.33 -0.17 0.00 0.00 175.17 176.27 1r8u n PHE 259 N -1.04 0.00 0.32 -5.34 -0.00 -1.26 -4.56 117.46 105.58 1r8u n PHE 259 Ca -0.03 -0.52 0.21 0.00 -0.00 0.00 0.00 57.45 57.10 1r8u n PHE 259 Cb 0.63 -0.37 1.09 0.00 -0.00 0.00 0.00 39.48 40.83 1r8u n PHE 259 CO 0.00 0.00 0.00 -0.39 -0.00 0.00 0.00 176.76 176.37 1r8u h VAL 260 N 1.40 0.00 0.00 -2.13 -1.51 -2.05 -3.13 116.25 108.83 1r8u h VAL 260 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1r8u h VAL 260 Cb 0.54 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 1r8u h VAL 260 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.34 1r8u n LYS 262 N -1.80 2.48 -3.81 0.00 2.85 -1.18 -4.95 118.16 111.75 1r8u n LYS 262 Ca 0.03 0.85 -0.07 0.00 -1.05 0.00 0.00 58.31 58.06 1r8u n LYS 262 Cb 0.17 -3.02 -0.02 0.00 -0.65 0.00 0.00 35.03 31.51 1r8u n LYS 262 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1r8u s GLN 263 N 5.03 1.71 -0.04 -1.58 0.74 -1.26 -5.19 119.66 119.07 1r8u s GLN 263 Ca 0.94 -0.92 0.03 0.00 0.05 0.00 0.00 55.36 55.46 1r8u s GLN 263 Cb -0.45 0.60 0.00 0.00 1.10 0.00 0.00 33.01 34.26 1r8u s GLN 263 CO 0.41 -0.78 -0.14 -0.65 -0.55 0.00 0.00 175.29 173.58 1r8u s GLN 264 N -3.87 1.60 0.83 1.67 -0.21 -1.26 -5.15 119.66 113.26 1r8u s GLN 264 Ca 0.10 -0.50 -0.14 0.00 0.02 0.00 0.00 55.36 54.84 1r8u s GLN 264 Cb -0.05 -1.38 0.03 0.00 1.00 0.00 0.00 33.01 32.61 1r8u s GLN 264 CO 0.05 0.17 0.73 -2.30 -2.12 0.00 0.00 175.29 171.82 1r8u n PRO 265 N 3.31 0.04 0.33 2.91 -0.02 -1.26 -4.91 135.00 135.41 1r8u n PRO 265 Ca -0.19 0.07 0.21 0.00 -2.02 0.00 0.00 63.50 61.57 1r8u n PRO 265 Cb 0.53 -2.06 1.11 0.00 -0.02 0.00 0.00 33.50 33.06 1r8u n PRO 265 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1r8u h SER 266 N -1.00 0.00 0.57 2.55 0.02 -2.03 -2.21 113.55 111.44 1r8u h SER 266 Ca -0.45 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1r8u h SER 266 Cb 1.31 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.85 1r8u h SER 266 CO 0.41 0.00 -0.02 0.03 -1.14 0.00 0.00 176.83 176.11 1r8u h ARG 267 N 0.00 0.00 0.00 3.45 2.47 -2.07 -2.91 114.38 115.32 1r8u h ARG 267 Ca 0.00 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.57 1r8u h ARG 267 Cb 0.17 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.47 1r8u h ARG 267 CO -0.00 0.02 -0.74 0.28 0.56 0.00 0.00 179.97 180.09 1r8u h VAL 268 N 0.00 1.43 0.00 2.04 2.07 -1.75 -3.56 116.25 116.48 1r8u h VAL 268 Ca -0.00 -2.64 0.00 0.00 0.82 0.00 0.00 66.70 64.88 1r8u h VAL 268 Cb 0.31 2.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1r8u h VAL 268 CO 0.00 0.73 0.00 -1.20 0.02 0.00 0.00 177.57 177.12