#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 2.70 -0.99 3.42 8.00 -1.26 -4.86 116.55 123.56 1r8u n ASP 221 Ca 0.00 -2.14 0.00 0.00 0.71 0.00 0.00 54.79 53.36 1r8u n ASP 221 Cb 0.00 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.57 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 0.28 -0.09 -1.23 1.24 -1.74 -1.26 -5.16 117.46 109.50 1r8u n PHE 222 Ca 0.05 0.00 -0.37 0.00 -0.56 0.00 0.00 57.45 56.57 1r8u n PHE 222 Cb 0.55 0.00 0.05 0.00 1.52 0.00 0.00 39.48 41.60 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 1.13 -4.41 1.97 5.41 -1.26 -5.05 119.36 117.16 1r8u n ILE 223 Ca 0.00 -0.44 -0.26 0.00 1.00 0.00 0.00 62.75 63.05 1r8u n ILE 223 Cb 0.00 -0.46 -0.12 0.00 -0.71 0.00 0.00 39.64 38.35 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 -1.28 3.28 0.35 4.38 -1.08 -1.26 -5.04 116.67 116.02 1r8u s ASP 224 Ca 0.60 -0.87 0.04 0.00 -0.52 0.00 0.00 52.55 51.80 1r8u s ASP 224 Cb -0.37 -0.24 0.69 0.00 -1.46 0.00 0.00 42.92 41.55 1r8u s ASP 224 CO 0.63 0.08 1.98 1.05 0.52 0.00 0.00 175.17 179.43 1r8u h GLU 225 N 3.17 0.79 0.00 4.34 4.11 -2.00 -1.36 114.58 123.62 1r8u h GLU 225 Ca -0.45 -0.05 -0.07 0.00 0.07 0.00 0.00 59.36 58.86 1r8u h GLU 225 Cb 1.21 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 1r8u h GLU 225 CO 0.49 0.52 -0.35 0.93 0.07 0.00 0.00 179.01 180.67 1r8u h GLU 226 N 0.81 0.00 -0.26 1.06 5.08 -1.98 -1.12 114.58 118.17 1r8u h GLU 226 Ca 0.28 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.56 1r8u h GLU 226 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1r8u h GLU 226 CO -0.08 0.35 -0.15 0.28 -1.00 0.00 0.00 179.01 178.41 1r8u h VAL 227 N 0.00 1.30 -0.46 3.13 2.07 -1.67 -0.58 116.25 120.05 1r8u h VAL 227 Ca -0.00 -1.26 -0.14 0.00 0.82 0.00 0.00 66.70 66.12 1r8u h VAL 227 Cb 0.66 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1r8u h VAL 227 CO 0.05 0.39 -0.25 -0.07 0.02 0.00 0.00 177.57 177.71 1r8u h LEU 228 N 0.29 1.00 -1.34 2.57 -0.00 -1.27 -1.78 115.31 114.78 1r8u h LEU 228 Ca 0.05 -0.39 0.00 0.00 -0.00 0.00 0.00 57.88 57.54 1r8u h LEU 228 Cb 0.67 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 41.03 1r8u h LEU 228 CO 0.04 1.19 0.40 0.24 -0.00 0.00 0.00 178.44 180.31 1r8u h MET 229 N 0.83 0.84 -0.59 1.13 2.86 -1.13 0.18 114.93 119.05 1r8u h MET 229 Ca 0.10 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.59 1r8u h MET 229 Cb 0.83 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.28 1r8u h MET 229 CO 0.07 0.58 0.00 0.77 1.06 0.00 0.00 176.91 179.39 1r8u h SER 230 N 0.86 1.00 0.28 1.22 0.02 -0.88 -2.22 113.55 113.83 1r8u h SER 230 Ca 0.23 -0.28 -0.13 0.00 -0.84 0.00 0.00 61.79 60.77 1r8u h SER 230 Cb -0.07 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.19 1r8u h SER 230 CO -0.05 1.05 -0.52 0.25 -1.14 0.00 0.00 176.83 176.43 1r8u h LEU 231 N 0.94 0.30 -0.47 5.07 6.46 -0.39 0.15 115.31 127.37 1r8u h LEU 231 Ca 0.17 -0.15 0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1r8u h LEU 231 Cb 0.54 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 1r8u h LEU 231 CO 0.03 0.76 0.28 0.58 -0.62 0.00 0.00 178.44 179.48 1r8u h VAL 232 N 0.21 1.06 -0.35 1.05 2.07 -0.51 0.21 116.25 119.99 1r8u h VAL 232 Ca 0.01 -0.20 -0.15 0.00 0.82 0.00 0.00 66.70 67.18 1r8u h VAL 232 Cb 0.99 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1r8u h VAL 232 CO 0.08 0.10 -0.36 0.40 0.02 0.00 0.00 177.57 177.81 1r8u h ILE 233 N 0.57 1.28 -0.29 4.57 2.04 -1.24 0.33 117.51 124.77 1r8u h ILE 233 Ca 0.19 -1.54 -0.00 0.00 1.00 0.00 0.00 64.86 64.51 1r8u h ILE 233 Cb 0.01 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1r8u h ILE 233 CO -0.08 0.51 0.18 -0.08 0.00 0.00 0.00 178.15 178.67 1r8u h GLU 234 N 0.65 0.39 0.00 2.37 4.57 -0.64 -3.13 114.58 118.79 1r8u h GLU 234 Ca 0.05 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 58.11 1r8u h GLU 234 Cb 0.95 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.45 1r8u h GLU 234 CO 0.09 0.29 -0.47 0.52 -1.18 0.00 0.00 179.01 178.26 1r8u h MET 235 N 0.37 0.00 -0.34 1.92 2.86 -0.99 -3.49 114.93 115.26 1r8u h MET 235 Ca 0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1r8u h MET 235 Cb -0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1r8u h MET 235 CO -0.02 0.42 0.00 0.41 1.06 0.00 0.00 176.91 178.78 1r8u n GLY 236 N 1.21 0.89 0.00 8.32 0.00 -0.12 -4.99 105.19 110.49 1r8u n GLY 236 Ca 0.02 -0.58 0.10 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 -0.17 0.00 0.27 0.99 4.32 -0.08 -2.34 117.00 119.98 1r8u n LEU 237 Ca 0.00 0.47 0.17 0.00 -0.02 0.00 0.00 56.01 56.63 1r8u n LEU 237 Cb 0.36 -0.47 0.72 0.00 -1.62 0.00 0.00 43.42 42.42 1r8u n LEU 237 CO 0.00 -0.15 1.00 -2.24 -1.22 0.00 0.00 177.39 174.78 1r8u h ASP 238 N 0.00 0.00 0.72 -1.43 2.03 -1.95 -2.90 116.42 112.90 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 0.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.82 1r8u h ASP 238 CO 0.00 0.00 -0.02 0.54 -1.03 0.00 0.00 179.24 178.73 1r8u n ARG 239 N -2.99 0.26 -0.68 4.15 5.12 -0.99 -4.93 116.66 116.61 1r8u n ARG 239 Ca 0.00 -0.01 -0.30 0.00 -1.93 0.00 0.00 57.85 55.61 1r8u n ARG 239 Cb 0.27 -1.50 0.19 0.00 -1.16 0.00 0.00 32.46 30.26 1r8u n ARG 239 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1r8u s ILE 240 N -2.75 2.11 0.00 0.55 -1.09 -1.10 -5.00 121.20 113.93 1r8u s ILE 240 Ca 0.22 0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.68 1r8u s ILE 240 Cb 0.20 -2.09 0.00 0.00 -1.58 0.00 0.00 42.46 38.98 1r8u s ILE 240 CO 0.50 -0.05 0.00 1.17 -1.23 0.00 0.00 174.94 175.33 1r8u n LYS 241 N -4.41 0.00 -3.83 2.79 3.00 -1.26 -5.11 118.16 109.33 1r8u n LYS 241 Ca 0.09 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.28 1r8u n LYS 241 Cb 0.53 -0.27 -0.12 0.00 0.00 0.00 0.00 35.03 35.17 1r8u n LYS 241 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1r8u s GLU 242 N -1.50 0.26 -0.13 1.64 2.02 -1.26 -5.16 118.70 114.57 1r8u s GLU 242 Ca 0.00 0.09 -0.26 0.00 0.02 0.00 0.00 54.97 54.81 1r8u s GLU 242 Cb 0.00 0.12 -0.02 0.00 0.10 0.00 0.00 34.13 34.33 1r8u s GLU 242 CO 0.00 -0.04 0.86 -1.17 0.02 0.00 0.00 175.26 174.93 1r8u s LEU 243 N -0.24 4.22 0.89 1.80 2.96 -1.26 -5.07 118.68 121.98 1r8u s LEU 243 Ca -0.03 1.28 -0.12 0.00 -0.22 0.00 0.00 54.13 55.04 1r8u s LEU 243 Cb -0.03 -3.30 0.12 0.00 0.50 0.00 0.00 46.19 43.49 1r8u s LEU 243 CO 0.01 -0.36 1.12 -2.16 -1.32 0.00 0.00 176.35 173.64 1r8u s PRO 244 N 1.84 1.33 0.39 0.98 0.04 -1.26 -5.06 135.00 133.25 1r8u s PRO 244 Ca 0.41 0.43 -0.11 0.00 0.04 0.00 0.00 61.00 61.77 1r8u s PRO 244 Cb -0.17 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 1r8u s PRO 244 CO 0.15 -2.10 0.76 -1.21 0.04 0.00 0.00 177.00 174.65 1r8u s GLU 245 N -5.20 3.81 -0.04 4.56 2.02 -1.26 -5.11 118.70 117.48 1r8u s GLU 245 Ca 0.63 0.50 -0.10 0.00 0.02 0.00 0.00 54.97 56.02 1r8u s GLU 245 Cb -0.15 -2.40 0.02 0.00 0.10 0.00 0.00 34.13 31.70 1r8u s GLU 245 CO 0.54 -0.00 0.24 -0.51 0.02 0.00 0.00 175.26 175.55 1r8u s LEU 246 N -3.70 1.11 -0.52 1.80 1.02 -1.26 -5.12 118.68 112.02 1r8u s LEU 246 Ca 0.52 0.18 0.07 0.00 0.02 0.00 0.00 54.13 54.92 1r8u s LEU 246 Cb -0.10 0.95 0.29 0.00 0.02 0.00 0.00 46.19 47.35 1r8u s LEU 246 CO 0.29 -0.29 0.75 0.79 0.02 0.00 0.00 176.35 177.91 1r8u n TRP 247 N 1.98 2.18 0.39 0.29 7.02 -1.26 -4.88 117.44 123.16 1r8u n TRP 247 Ca -0.18 -3.92 0.06 0.00 -1.02 0.00 0.00 57.50 52.44 1r8u n TRP 247 Cb 0.57 -0.47 0.25 0.00 -2.42 0.00 0.00 31.31 29.25 1r8u n TRP 247 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1r8u n LEU 248 N 0.57 0.03 -1.35 -0.99 4.32 -1.26 -2.21 117.00 116.11 1r8u n LEU 248 Ca 0.27 0.51 0.05 0.00 -0.02 0.00 0.00 56.01 56.82 1r8u n LEU 248 Cb 0.48 -0.51 0.27 0.00 -1.62 0.00 0.00 43.42 42.04 1r8u n LEU 248 CO 0.30 -0.32 0.68 0.61 -1.22 0.00 0.00 177.39 177.44 1r8u n GLY 249 N -0.32 2.28 3.22 -0.72 0.00 -1.26 -4.88 105.19 103.51 1r8u n GLY 249 Ca 0.03 -0.61 -0.09 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.03 0.89 0.53 1.61 -0.21 -0.94 -5.05 119.66 114.46 1r8u s GLN 250 Ca 0.36 -1.05 0.30 0.00 0.02 0.00 0.00 55.36 55.00 1r8u s GLN 250 Cb 0.26 0.33 1.44 0.00 1.00 0.00 0.00 33.01 36.04 1r8u s GLN 250 CO 0.13 -0.28 2.03 -0.97 -2.12 0.00 0.00 175.29 174.08 1r8u h ASN 251 N 2.75 0.00 -0.41 5.90 -0.00 -1.91 -3.20 115.58 118.71 1r8u h ASN 251 Ca -0.34 0.00 0.12 0.00 -0.00 0.00 0.00 56.30 56.08 1r8u h ASN 251 Cb 1.20 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.50 1r8u h ASN 251 CO 0.56 0.10 0.31 -0.33 -0.00 0.00 0.00 177.43 178.07 1r8u h GLU 252 N 0.00 0.00 -1.59 6.67 3.07 -1.97 -3.26 114.58 117.50 1r8u h GLU 252 Ca -0.00 0.00 -0.46 0.00 -0.50 0.00 0.00 59.36 58.39 1r8u h GLU 252 Cb 0.43 0.00 -0.32 0.00 -0.84 0.00 0.00 28.75 28.02 1r8u h GLU 252 CO 0.01 0.00 -0.91 0.34 -1.40 0.00 0.00 179.01 177.06 1r8u n PHE 253 N -4.26 -1.38 -1.90 4.33 7.35 -1.21 -5.03 117.46 115.36 1r8u n PHE 253 Ca 0.07 -2.96 -0.42 0.00 -0.76 0.00 0.00 57.45 53.38 1r8u n PHE 253 Cb 0.51 0.32 -0.01 0.00 0.35 0.00 0.00 39.48 40.64 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 1.89 3.97 -0.63 -2.13 2.03 -1.23 -4.12 116.55 116.32 1r8u n ASP 254 Ca 0.20 -2.84 0.48 0.00 0.52 0.00 0.00 54.79 53.15 1r8u n ASP 254 Cb 0.54 -1.63 0.74 0.00 -0.72 0.00 0.00 41.12 40.05 1r8u n ASP 254 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1r8u n PHE 255 N 7.14 0.05 -1.89 -0.67 -1.74 -1.26 -1.10 117.46 117.99 1r8u n PHE 255 Ca 0.51 0.05 0.05 0.00 -0.56 0.00 0.00 57.45 57.50 1r8u n PHE 255 Cb 0.41 -0.50 0.11 0.00 1.52 0.00 0.00 39.48 41.02 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 -3.81 0.78 -1.03 3.97 2.81 -1.26 -5.11 117.12 113.47 1r8u n MET 256 Ca 0.40 -2.45 -0.35 0.00 -1.81 0.00 0.00 57.70 53.50 1r8u n MET 256 Cb 1.81 -0.89 0.09 0.00 -0.71 0.00 0.00 33.22 33.52 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 -0.45 0.81 0.63 2.03 5.66 -0.26 -4.90 114.28 117.80 1r8u n THR 257 Ca 0.12 -0.31 -0.03 0.00 -3.05 0.00 0.00 64.05 60.77 1r8u n THR 257 Cb 0.85 -0.61 0.02 0.00 -1.55 0.00 0.00 70.33 69.03 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 -0.41 3.30 -3.74 1.09 2.03 -1.26 -4.83 116.55 112.74 1r8u n ASP 258 Ca 0.08 -2.22 -0.42 0.00 0.52 0.00 0.00 54.79 52.74 1r8u n ASP 258 Cb 0.52 -0.59 -0.04 0.00 -0.72 0.00 0.00 41.12 40.30 1r8u n ASP 258 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1r8u n PHE 259 N 0.38 2.60 -0.29 -0.67 7.35 -1.26 -4.23 117.46 121.34 1r8u n PHE 259 Ca 0.07 -2.24 0.00 0.00 -0.76 0.00 0.00 57.45 54.52 1r8u n PHE 259 Cb 0.63 -2.08 0.00 0.00 0.35 0.00 0.00 39.48 38.38 1r8u n PHE 259 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1r8u n VAL 260 N 5.78 0.00 -1.99 -2.13 0.24 -1.26 -5.09 118.33 113.87 1r8u n VAL 260 Ca 0.50 -0.24 -0.33 0.00 -2.04 0.00 0.00 64.34 62.23 1r8u n VAL 260 Cb 0.40 1.29 0.02 0.00 -1.47 0.00 0.00 33.84 34.08 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 -4.05 2.79 0.27 0.00 -0.14 -1.26 -4.99 119.74 112.36 1r8u s LYS 262 Ca 0.65 1.44 -0.30 0.00 -1.36 0.00 0.00 55.97 56.39 1r8u s LYS 262 Cb -0.17 -1.94 -0.11 0.00 -1.68 0.00 0.00 37.83 33.92 1r8u s LYS 262 CO 0.37 -1.27 1.55 -1.14 -0.76 0.00 0.00 175.35 174.10 1r8u s GLN 263 N -4.02 4.17 0.44 1.68 0.74 -1.26 -4.99 119.66 116.42 1r8u s GLN 263 Ca 0.68 2.48 -0.24 0.00 0.05 0.00 0.00 55.36 58.33 1r8u s GLN 263 Cb -0.21 -3.06 -0.08 0.00 1.10 0.00 0.00 33.01 30.76 1r8u s GLN 263 CO 0.41 -0.56 1.23 -0.65 -0.55 0.00 0.00 175.29 175.16 1r8u s GLN 264 N -0.39 3.84 0.72 1.67 -0.21 -1.26 -5.00 119.66 119.03 1r8u s GLN 264 Ca 0.62 1.96 -0.16 0.00 0.02 0.00 0.00 55.36 57.80 1r8u s GLN 264 Cb -0.46 -2.57 0.00 0.00 1.00 0.00 0.00 33.01 30.98 1r8u s GLN 264 CO 0.46 -0.54 0.93 -2.30 -2.12 0.00 0.00 175.29 171.72 1r8u n PRO 265 N -0.20 0.48 0.00 2.91 -0.02 -1.26 -4.96 135.00 131.96 1r8u n PRO 265 Ca 0.06 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1r8u n PRO 265 Cb 0.46 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1r8u n PRO 265 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1r8u n SER 266 N -1.56 -0.05 0.30 2.55 2.88 -1.26 -4.93 113.62 111.55 1r8u n SER 266 Ca 0.13 0.01 0.16 0.00 -1.33 0.00 0.00 58.87 57.84 1r8u n SER 266 Cb 0.49 0.31 0.94 0.00 -0.75 0.00 0.00 64.21 65.21 1r8u n SER 266 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1r8u h ARG 267 N 0.00 0.00 0.00 -1.46 2.43 -2.04 -2.86 114.38 110.45 1r8u h ARG 267 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1r8u h ARG 267 Cb 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1r8u h ARG 267 CO 0.00 0.02 -0.03 -0.39 -1.51 0.00 0.00 179.97 178.06 1r8u h VAL 268 N 0.00 0.10 0.00 0.20 -1.51 -2.01 -3.58 116.25 109.45 1r8u h VAL 268 Ca -0.00 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1r8u h VAL 268 Cb 0.06 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 30.61 1r8u h VAL 268 CO 0.00 0.03 0.00 -1.20 -1.23 0.00 0.00 177.57 175.17