#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 0.54 -3.81 3.42 2.03 -1.26 -4.89 116.55 112.58 1r8u n ASP 221 Ca 0.00 0.61 -0.13 0.00 0.52 0.00 0.00 54.79 55.79 1r8u n ASP 221 Cb 0.00 -0.73 -0.07 0.00 -0.72 0.00 0.00 41.12 39.60 1r8u n ASP 221 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1r8u s PHE 222 N -3.19 1.00 0.79 -0.67 5.36 -1.26 -5.17 117.98 114.85 1r8u s PHE 222 Ca 0.07 -1.22 -0.15 0.00 -0.96 0.00 0.00 56.93 54.67 1r8u s PHE 222 Cb 0.11 -0.27 0.01 0.00 -0.34 0.00 0.00 43.02 42.53 1r8u s PHE 222 CO 0.42 -0.88 0.70 -0.89 -1.46 0.00 0.00 175.22 173.12 1r8u n ILE 223 N -0.41 1.55 -4.35 3.12 5.41 -1.26 -5.07 119.36 118.35 1r8u n ILE 223 Ca 0.02 -0.30 -0.19 0.00 1.00 0.00 0.00 62.75 63.27 1r8u n ILE 223 Cb 0.63 -0.86 -0.10 0.00 -0.71 0.00 0.00 39.64 38.60 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 -1.76 2.64 0.28 4.38 2.15 -1.26 -5.04 116.67 118.06 1r8u s ASP 224 Ca 0.66 -0.99 -0.00 0.00 0.43 0.00 0.00 52.55 52.65 1r8u s ASP 224 Cb -0.30 -0.15 0.49 0.00 -0.30 0.00 0.00 42.92 42.66 1r8u s ASP 224 CO 0.58 -0.13 1.87 1.05 -0.17 0.00 0.00 175.17 178.36 1r8u h GLU 225 N 2.68 1.04 0.00 4.34 4.11 -2.00 -1.10 114.58 123.65 1r8u h GLU 225 Ca -0.39 -0.06 -0.03 0.00 0.07 0.00 0.00 59.36 58.95 1r8u h GLU 225 Cb 1.22 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 1r8u h GLU 225 CO 0.60 0.69 -0.16 0.93 0.07 0.00 0.00 179.01 181.14 1r8u h GLU 226 N 1.08 0.00 -0.17 1.06 5.08 -1.98 -1.20 114.58 118.44 1r8u h GLU 226 Ca 0.45 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.74 1r8u h GLU 226 Cb 0.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1r8u h GLU 226 CO -0.20 0.16 -0.15 0.28 -1.00 0.00 0.00 179.01 178.10 1r8u h VAL 227 N 0.00 1.33 -0.49 3.13 2.07 -1.62 -0.49 116.25 120.18 1r8u h VAL 227 Ca -0.00 -1.29 -0.09 0.00 0.82 0.00 0.00 66.70 66.14 1r8u h VAL 227 Cb 0.48 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1r8u h VAL 227 CO 0.02 0.39 -0.03 -0.07 0.02 0.00 0.00 177.57 177.89 1r8u h LEU 228 N 0.06 0.88 -1.14 2.57 -0.00 -1.17 -1.74 115.31 114.77 1r8u h LEU 228 Ca 0.03 -0.32 -0.06 0.00 -0.00 0.00 0.00 57.88 57.52 1r8u h LEU 228 Cb 0.68 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 41.08 1r8u h LEU 228 CO 0.04 0.99 -0.07 0.24 -0.00 0.00 0.00 178.44 179.64 1r8u h MET 229 N 0.74 0.52 -0.67 1.13 2.86 -1.20 0.16 114.93 118.48 1r8u h MET 229 Ca 0.13 -0.13 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1r8u h MET 229 Cb 0.56 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 1r8u h MET 229 CO 0.03 0.60 0.11 0.77 1.06 0.00 0.00 176.91 179.48 1r8u h SER 230 N 0.49 1.06 0.22 1.22 0.02 -0.93 -2.01 113.55 113.63 1r8u h SER 230 Ca 0.10 -0.25 -0.14 0.00 -0.84 0.00 0.00 61.79 60.66 1r8u h SER 230 Cb 0.42 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1r8u h SER 230 CO 0.02 1.05 -0.52 0.25 -1.14 0.00 0.00 176.83 176.49 1r8u h LEU 231 N 1.04 0.37 -0.30 5.07 6.46 -0.53 0.14 115.31 127.56 1r8u h LEU 231 Ca 0.20 -0.19 0.03 0.00 -0.12 0.00 0.00 57.88 57.81 1r8u h LEU 231 Cb 0.44 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 1r8u h LEU 231 CO 0.01 0.83 0.11 0.58 -0.62 0.00 0.00 178.44 179.35 1r8u h VAL 232 N 0.26 0.93 -0.47 1.05 2.07 -0.51 0.05 116.25 119.62 1r8u h VAL 232 Ca 0.01 -0.08 -0.13 0.00 0.82 0.00 0.00 66.70 67.31 1r8u h VAL 232 Cb 1.01 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1r8u h VAL 232 CO 0.09 0.04 -0.21 0.40 0.02 0.00 0.00 177.57 177.91 1r8u h ILE 233 N 0.24 1.27 -0.41 4.57 2.04 -1.20 0.92 117.51 124.95 1r8u h ILE 233 Ca 0.13 -1.37 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 1r8u h ILE 233 Cb 0.10 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 1r8u h ILE 233 CO -0.13 0.47 0.21 -0.08 0.00 0.00 0.00 178.15 178.62 1r8u h GLU 234 N 0.84 0.58 0.00 2.37 4.57 -0.61 -3.09 114.58 119.24 1r8u h GLU 234 Ca 0.11 -0.08 -0.09 0.00 -1.18 0.00 0.00 59.36 58.12 1r8u h GLU 234 Cb 0.78 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.25 1r8u h GLU 234 CO 0.06 0.49 -0.45 0.52 -1.18 0.00 0.00 179.01 178.46 1r8u h MET 235 N 0.52 0.00 0.00 1.92 2.86 -0.99 -3.48 114.93 115.76 1r8u h MET 235 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1r8u h MET 235 Cb 0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1r8u h MET 235 CO -0.02 0.44 0.00 0.41 1.06 0.00 0.00 176.91 178.80 1r8u n GLY 236 N 1.21 0.87 0.02 8.32 0.00 -0.05 -4.99 105.19 110.57 1r8u n GLY 236 Ca 0.02 -0.55 0.07 0.00 0.00 0.00 0.00 46.02 45.56 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 0.11 0.05 0.99 4.32 0.12 -3.06 117.00 119.52 1r8u n LEU 237 Ca 0.00 0.53 0.04 0.00 -0.02 0.00 0.00 56.01 56.56 1r8u n LEU 237 Cb 0.13 -0.52 0.22 0.00 -1.62 0.00 0.00 43.42 41.63 1r8u n LEU 237 CO 0.00 -0.35 0.64 -0.90 -1.22 0.00 0.00 177.39 175.55 1r8u n ASP 238 N -1.62 0.18 -0.75 -1.43 5.75 -1.26 -1.90 116.55 115.53 1r8u n ASP 238 Ca 0.03 0.58 0.07 0.00 -0.01 0.00 0.00 54.79 55.45 1r8u n ASP 238 Cb 0.15 -0.60 0.17 0.00 -1.03 0.00 0.00 41.12 39.80 1r8u n ASP 238 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1r8u n ARG 239 N -1.74 2.53 -1.66 0.11 1.74 -1.17 -5.06 116.66 111.41 1r8u n ARG 239 Ca 0.00 -2.04 -0.39 0.00 -0.77 0.00 0.00 57.85 54.65 1r8u n ARG 239 Cb 0.05 -1.32 0.04 0.00 -1.02 0.00 0.00 32.46 30.20 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 0.75 3.35 -3.88 0.55 2.08 -0.80 -5.06 119.36 116.35 1r8u n ILE 240 Ca 0.13 -0.50 -0.10 0.00 0.56 0.00 0.00 62.75 62.84 1r8u n ILE 240 Cb 0.45 -1.33 -0.09 0.00 -0.75 0.00 0.00 39.64 37.92 1r8u n ILE 240 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1r8u s LYS 241 N -2.57 0.61 0.00 0.38 2.20 -1.26 -5.08 119.74 114.02 1r8u s LYS 241 Ca 0.70 -0.63 0.00 0.00 -0.36 0.00 0.00 55.97 55.69 1r8u s LYS 241 Cb -0.46 0.25 0.00 0.00 -1.51 0.00 0.00 37.83 36.11 1r8u s LYS 241 CO 0.51 -0.16 0.00 0.39 -0.36 0.00 0.00 175.35 175.73 1r8u n GLU 242 N 0.89 0.00 -1.66 4.03 -0.58 -1.26 -4.73 120.64 117.32 1r8u n GLU 242 Ca -0.20 0.00 -0.57 0.00 -0.42 0.00 0.00 57.16 55.97 1r8u n GLU 242 Cb 0.58 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.38 1r8u n GLU 242 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1r8u n LEU 243 N 0.02 1.81 -4.80 -4.62 7.94 -1.26 -4.99 117.00 111.10 1r8u n LEU 243 Ca 0.00 1.11 -0.29 0.00 -1.11 0.00 0.00 56.01 55.72 1r8u n LEU 243 Cb 0.00 -1.11 0.13 0.00 0.53 0.00 0.00 43.42 42.98 1r8u n LEU 243 CO 0.00 -0.80 0.72 -2.16 -1.11 0.00 0.00 177.39 174.04 1r8u s PRO 244 N 2.22 1.24 0.35 1.96 0.04 -1.26 -5.07 135.00 134.48 1r8u s PRO 244 Ca 0.94 0.29 -0.07 0.00 0.04 0.00 0.00 61.00 62.20 1r8u s PRO 244 Cb -1.10 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 31.53 1r8u s PRO 244 CO 0.61 -2.13 0.66 -1.21 0.04 0.00 0.00 177.00 174.97 1r8u s GLU 245 N -5.30 3.68 -0.03 4.56 2.02 -1.26 -5.12 118.70 117.25 1r8u s GLU 245 Ca 0.64 0.19 -0.08 0.00 0.02 0.00 0.00 54.97 55.74 1r8u s GLU 245 Cb -0.14 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.57 1r8u s GLU 245 CO 0.53 0.08 0.18 -0.51 0.02 0.00 0.00 175.26 175.56 1r8u s LEU 246 N -3.80 1.35 -0.46 1.80 1.02 -1.26 -5.11 118.68 112.21 1r8u s LEU 246 Ca 0.47 0.08 0.09 0.00 0.02 0.00 0.00 54.13 54.78 1r8u s LEU 246 Cb -0.10 0.74 0.33 0.00 0.02 0.00 0.00 46.19 47.18 1r8u s LEU 246 CO 0.32 -0.25 0.79 0.79 0.02 0.00 0.00 176.35 178.01 1r8u n TRP 247 N 2.06 1.70 0.19 0.29 7.02 -1.26 -4.94 117.44 122.51 1r8u n TRP 247 Ca -0.18 -3.88 0.15 0.00 -1.02 0.00 0.00 57.50 52.57 1r8u n TRP 247 Cb 0.57 -0.45 0.77 0.00 -2.42 0.00 0.00 31.31 29.78 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 3.16 0.00 -0.16 -0.99 4.07 -2.00 -1.38 115.31 118.01 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 0.78 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.52 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 -1.47 -1.44 3.80 0.83 0.00 -1.26 -4.69 105.19 100.95 1r8u n GLY 249 Ca 0.01 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.11 2.88 0.63 1.61 -1.52 -0.52 -5.03 119.66 114.61 1r8u s GLN 250 Ca 0.09 -0.97 0.40 0.00 -1.95 0.00 0.00 55.36 52.93 1r8u s GLN 250 Cb 0.13 -2.59 2.12 0.00 -0.22 0.00 0.00 33.01 32.45 1r8u s GLN 250 CO 0.48 0.44 2.28 -0.97 -0.25 0.00 0.00 175.29 177.27 1r8u h ASN 251 N 2.00 0.00 0.03 5.90 -1.24 -1.88 -3.02 115.58 117.38 1r8u h ASN 251 Ca -0.48 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.53 1r8u h ASN 251 Cb 1.22 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.27 1r8u h ASN 251 CO 0.62 0.01 -0.02 -0.33 -1.29 0.00 0.00 177.43 176.42 1r8u h GLU 252 N 0.00 0.00 -1.53 6.67 5.08 -1.96 -3.34 114.58 119.50 1r8u h GLU 252 Ca -0.00 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.95 1r8u h GLU 252 Cb 0.10 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 29.06 1r8u h GLU 252 CO 0.00 0.02 -0.81 0.34 -1.00 0.00 0.00 179.01 177.56 1r8u n PHE 253 N -4.11 -1.93 -1.50 4.33 7.35 -1.14 -5.03 117.46 115.44 1r8u n PHE 253 Ca -0.03 -2.62 -0.40 0.00 -0.76 0.00 0.00 57.45 53.63 1r8u n PHE 253 Cb 0.10 0.64 -0.02 0.00 0.35 0.00 0.00 39.48 40.56 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 2.30 6.26 -0.30 -2.13 -0.08 -1.26 -4.23 116.55 117.11 1r8u n ASP 254 Ca 0.21 -2.70 0.24 0.00 -1.51 0.00 0.00 54.79 51.04 1r8u n ASP 254 Cb 0.54 -1.59 0.39 0.00 2.34 0.00 0.00 41.12 42.79 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 4.86 0.22 -1.76 -0.67 -1.74 -1.26 -1.22 117.46 115.89 1r8u n PHE 255 Ca 0.65 0.23 0.03 0.00 -0.56 0.00 0.00 57.45 57.80 1r8u n PHE 255 Cb 0.31 -0.56 0.05 0.00 1.52 0.00 0.00 39.48 40.80 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 -3.44 0.42 -1.03 3.97 2.81 -1.26 -5.11 117.12 113.48 1r8u n MET 256 Ca 0.22 -1.61 -0.34 0.00 -1.81 0.00 0.00 57.70 54.16 1r8u n MET 256 Cb 0.93 -0.79 0.12 0.00 -0.71 0.00 0.00 33.22 32.77 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 -0.41 1.40 -1.72 2.03 5.66 -0.36 -4.93 114.28 115.95 1r8u n THR 257 Ca 0.06 -0.22 -0.42 0.00 -3.05 0.00 0.00 64.05 60.42 1r8u n THR 257 Cb 0.72 -0.99 -0.03 0.00 -1.55 0.00 0.00 70.33 68.49 1r8u n THR 257 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1r8u n ASP 258 N -2.46 3.85 -3.38 1.09 2.03 -1.26 -5.00 116.55 111.42 1r8u n ASP 258 Ca 0.11 1.09 -0.18 0.00 0.52 0.00 0.00 54.79 56.34 1r8u n ASP 258 Cb 0.51 -1.57 -0.09 0.00 -0.72 0.00 0.00 41.12 39.26 1r8u n ASP 258 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1r8u s PHE 259 N 0.73 -0.25 -0.04 -0.67 5.36 -1.26 -4.98 117.98 116.86 1r8u s PHE 259 Ca 0.72 -0.71 0.09 0.00 -0.96 0.00 0.00 56.93 56.07 1r8u s PHE 259 Cb -0.52 -0.47 0.16 0.00 -0.34 0.00 0.00 43.02 41.85 1r8u s PHE 259 CO 0.38 -0.94 1.08 1.33 -1.46 0.00 0.00 175.22 175.61 1r8u n VAL 260 N 4.54 0.59 0.23 3.12 0.24 -1.26 -4.90 118.33 120.89 1r8u n VAL 260 Ca 0.07 -0.89 0.12 0.00 -2.04 0.00 0.00 64.34 61.60 1r8u n VAL 260 Cb 0.45 0.35 0.58 0.00 -1.47 0.00 0.00 33.84 33.75 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 -2.29 1.13 0.27 0.00 5.02 -1.26 -4.61 118.16 116.42 1r8u n LYS 262 Ca -0.00 -0.36 0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1r8u n LYS 262 Cb 0.09 -1.47 0.88 0.00 -0.02 0.00 0.00 35.03 34.52 1r8u n LYS 262 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1r8u h GLN 263 N 2.60 0.00 -4.07 1.97 4.20 -2.02 -3.44 115.11 114.34 1r8u h GLN 263 Ca 0.07 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.63 1r8u h GLN 263 Cb 0.96 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 28.56 1r8u h GLN 263 CO 0.13 0.00 -0.67 -0.65 -0.67 0.00 0.00 178.83 176.97 1r8u s GLN 264 N -3.82 0.47 0.72 1.46 -1.52 -1.26 -5.16 119.66 110.55 1r8u s GLN 264 Ca -0.02 -0.89 -0.16 0.00 -1.95 0.00 0.00 55.36 52.35 1r8u s GLN 264 Cb 0.10 0.17 -0.00 0.00 -0.22 0.00 0.00 33.01 33.06 1r8u s GLN 264 CO 0.42 -0.09 0.87 -2.30 -0.25 0.00 0.00 175.29 173.94 1r8u n PRO 265 N 0.88 0.44 0.00 2.91 -0.02 -1.26 -4.94 135.00 133.00 1r8u n PRO 265 Ca -0.19 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1r8u n PRO 265 Cb 0.58 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1r8u n PRO 265 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1r8u n SER 266 N -1.39 0.00 0.00 2.55 7.64 -1.26 -5.01 113.62 116.15 1r8u n SER 266 Ca 0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1r8u n SER 266 Cb 0.50 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 64.02 1r8u n SER 266 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1r8u n ARG 267 N -2.23 0.00 0.22 1.43 0.00 -1.26 -4.93 116.66 109.89 1r8u n ARG 267 Ca 0.00 -0.08 0.07 0.00 -0.00 0.00 0.00 57.85 57.85 1r8u n ARG 267 Cb 0.00 -0.36 0.52 0.00 0.00 0.00 0.00 32.46 32.63 1r8u n ARG 267 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 1r8u h VAL 268 N 1.43 0.93 0.00 5.15 3.04 -1.97 -3.57 116.25 121.25 1r8u h VAL 268 Ca 0.00 -0.88 0.00 0.00 -1.01 0.00 0.00 66.70 64.81 1r8u h VAL 268 Cb 0.61 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 31.39 1r8u h VAL 268 CO 0.00 0.23 0.00 -0.24 -1.01 0.00 0.00 177.57 176.55