#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 1.00 -4.73 8.00 5.75 -1.26 -5.04 116.55 120.27 1r8u n ASP 221 Ca 0.00 -1.00 -0.29 0.00 -0.01 0.00 0.00 54.79 53.49 1r8u n ASP 221 Cb 0.00 0.66 0.15 0.00 -1.03 0.00 0.00 41.12 40.90 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 -1.65 2.34 0.52 2.11 5.36 -1.26 -5.02 117.98 120.38 1r8u s PHE 222 Ca 0.07 1.07 -0.22 0.00 -0.96 0.00 0.00 56.93 56.90 1r8u s PHE 222 Cb 0.09 -3.23 -0.07 0.00 -0.34 0.00 0.00 43.02 39.46 1r8u s PHE 222 CO 0.33 -2.50 1.15 -0.89 -1.46 0.00 0.00 175.22 171.85 1r8u n ILE 223 N -3.91 3.30 -4.30 3.12 5.41 -1.26 -5.06 119.36 116.65 1r8u n ILE 223 Ca 0.06 -0.50 -0.20 0.00 1.00 0.00 0.00 62.75 63.12 1r8u n ILE 223 Cb 0.57 -1.38 -0.11 0.00 -0.71 0.00 0.00 39.64 38.01 1r8u n ILE 223 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1r8u s ASP 224 N -0.92 2.38 0.40 4.38 1.01 -1.26 -5.05 116.67 117.60 1r8u s ASP 224 Ca 0.69 -0.87 0.15 0.00 0.71 0.00 0.00 52.55 53.24 1r8u s ASP 224 Cb -0.46 -0.12 1.02 0.00 1.01 0.00 0.00 42.92 44.37 1r8u s ASP 224 CO 0.51 -0.10 1.84 1.05 0.21 0.00 0.00 175.17 178.68 1r8u h GLU 225 N 3.26 0.46 -0.07 8.23 9.09 -2.00 0.30 114.58 133.85 1r8u h GLU 225 Ca -0.41 -0.03 -0.07 0.00 0.05 0.00 0.00 59.36 58.91 1r8u h GLU 225 Cb 1.20 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 28.19 1r8u h GLU 225 CO 0.53 0.31 -0.26 0.93 0.05 0.00 0.00 179.01 180.56 1r8u h GLU 226 N 0.48 0.13 -0.34 1.06 5.08 -1.98 -1.21 114.58 117.79 1r8u h GLU 226 Ca 0.50 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.67 1r8u h GLU 226 Cb 1.14 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1r8u h GLU 226 CO -0.22 0.39 -0.39 0.28 -1.00 0.00 0.00 179.01 178.06 1r8u h VAL 227 N 0.11 1.28 -0.43 3.13 2.07 -1.36 -0.79 116.25 120.27 1r8u h VAL 227 Ca 0.02 -1.57 -0.10 0.00 0.82 0.00 0.00 66.70 65.87 1r8u h VAL 227 Cb 0.53 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1r8u h VAL 227 CO 0.04 0.52 -0.11 -0.07 0.02 0.00 0.00 177.57 177.97 1r8u h LEU 228 N 0.65 0.84 -1.45 2.57 -0.00 -1.20 -1.67 115.31 115.06 1r8u h LEU 228 Ca 0.05 -0.36 -0.02 0.00 -0.00 0.00 0.00 57.88 57.54 1r8u h LEU 228 Cb 0.99 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 41.40 1r8u h LEU 228 CO 0.09 1.01 0.11 0.24 -0.00 0.00 0.00 178.44 179.90 1r8u h MET 229 N 0.66 0.48 -0.52 1.13 2.86 -1.17 0.61 114.93 118.99 1r8u h MET 229 Ca 0.11 -0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 1r8u h MET 229 Cb 0.64 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 1r8u h MET 229 CO 0.04 0.42 -0.13 0.77 1.06 0.00 0.00 176.91 179.08 1r8u h SER 230 N 0.48 1.01 0.11 1.22 0.02 -0.90 -2.50 113.55 112.98 1r8u h SER 230 Ca 0.12 -0.34 -0.12 0.00 -0.84 0.00 0.00 61.79 60.61 1r8u h SER 230 Cb 0.14 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1r8u h SER 230 CO -0.01 1.13 -0.41 0.25 -1.14 0.00 0.00 176.83 176.65 1r8u h LEU 231 N 0.89 0.41 -0.39 5.07 6.46 -0.43 -0.09 115.31 127.23 1r8u h LEU 231 Ca 0.13 -0.18 0.05 0.00 -0.12 0.00 0.00 57.88 57.76 1r8u h LEU 231 Cb 0.69 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.47 1r8u h LEU 231 CO 0.05 0.78 0.14 0.58 -0.62 0.00 0.00 178.44 179.36 1r8u h VAL 232 N 0.32 0.88 -0.41 1.05 2.07 -0.78 -0.01 116.25 119.38 1r8u h VAL 232 Ca 0.03 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.33 1r8u h VAL 232 Cb 0.86 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1r8u h VAL 232 CO 0.07 0.05 -0.21 0.40 0.02 0.00 0.00 177.57 177.90 1r8u h ILE 233 N 0.29 1.28 -0.63 4.57 2.04 -1.24 -0.04 117.51 123.79 1r8u h ILE 233 Ca 0.18 -1.36 0.01 0.00 1.00 0.00 0.00 64.86 64.68 1r8u h ILE 233 Cb 0.16 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 1r8u h ILE 233 CO -0.18 0.46 0.41 -0.08 0.00 0.00 0.00 178.15 178.76 1r8u h GLU 234 N 0.68 0.83 0.00 2.37 4.57 -0.65 -2.65 114.58 119.73 1r8u h GLU 234 Ca 0.09 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1r8u h GLU 234 Cb 0.78 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 1r8u h GLU 234 CO 0.06 0.55 -0.01 0.52 -1.18 0.00 0.00 179.01 178.96 1r8u h MET 235 N 0.85 0.00 -1.45 1.92 2.86 -0.99 -3.48 114.93 114.63 1r8u h MET 235 Ca 0.23 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.74 1r8u h MET 235 Cb -0.09 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.58 1r8u h MET 235 CO -0.05 0.00 -0.19 0.41 1.06 0.00 0.00 176.91 178.15 1r8u n GLY 236 N 1.25 0.22 0.00 8.32 0.00 -0.44 -4.95 105.19 109.59 1r8u n GLY 236 Ca 0.05 -0.54 0.10 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.27 0.00 0.23 0.99 4.77 -0.16 -2.91 117.00 118.65 1r8u n LEU 237 Ca -0.05 0.05 0.16 0.00 -0.03 0.00 0.00 56.01 56.14 1r8u n LEU 237 Cb 0.55 -0.05 0.82 0.00 -2.33 0.00 0.00 43.42 42.41 1r8u n LEU 237 CO 0.13 -0.02 0.97 -2.24 -1.33 0.00 0.00 177.39 174.90 1r8u h ASP 238 N 0.00 0.00 0.94 -1.43 2.03 -1.93 -2.43 116.42 113.60 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 0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 1r8u h ASP 238 CO 0.00 0.00 -0.41 0.54 -1.03 0.00 0.00 179.24 178.34 1r8u n ARG 239 N -2.58 0.20 -1.82 4.15 1.74 -1.15 -4.94 116.66 112.27 1r8u n ARG 239 Ca -0.02 0.09 -0.42 0.00 -0.77 0.00 0.00 57.85 56.73 1r8u n ARG 239 Cb 0.06 -1.66 -0.03 0.00 -1.02 0.00 0.00 32.46 29.82 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 -3.11 2.29 -0.16 0.55 1.01 -0.92 -4.90 121.20 115.96 1r8u s ILE 240 Ca 0.09 0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.98 1r8u s ILE 240 Cb 0.14 -3.13 -0.13 0.00 0.01 0.00 0.00 42.46 39.36 1r8u s ILE 240 CO 0.67 0.02 -0.10 1.17 0.00 0.00 0.00 174.94 176.69 1r8u n LYS 241 N 4.00 0.77 -3.67 2.79 4.81 -1.26 -4.98 118.16 120.62 1r8u n LYS 241 Ca 0.15 0.07 -0.10 0.00 -0.87 0.00 0.00 58.31 57.57 1r8u n LYS 241 Cb 0.37 -1.35 -0.10 0.00 0.02 0.00 0.00 35.03 33.97 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 -2.34 0.33 -0.00 1.64 0.41 -1.26 -5.14 118.70 112.33 1r8u s GLU 242 Ca -0.19 0.91 -0.32 0.00 -0.41 0.00 0.00 54.97 54.96 1r8u s GLU 242 Cb 0.06 0.16 -0.10 0.00 -1.78 0.00 0.00 34.13 32.46 1r8u s GLU 242 CO 0.44 -0.22 1.92 -0.11 -0.49 0.00 0.00 175.26 176.80 1r8u n LEU 243 N 4.95 3.86 -4.76 1.80 7.94 -1.26 -4.99 117.00 124.54 1r8u n LEU 243 Ca -0.14 0.94 -0.29 0.00 -1.11 0.00 0.00 56.01 55.41 1r8u n LEU 243 Cb 0.52 -1.46 0.14 0.00 0.53 0.00 0.00 43.42 43.14 1r8u n LEU 243 CO 0.03 0.09 0.69 -2.16 -1.11 0.00 0.00 177.39 174.94 1r8u s PRO 244 N 4.11 1.20 0.27 1.96 0.04 -1.26 -5.06 135.00 136.25 1r8u s PRO 244 Ca 0.90 0.46 -0.07 0.00 0.04 0.00 0.00 61.00 62.33 1r8u s PRO 244 Cb -0.55 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.10 1r8u s PRO 244 CO 0.45 -2.20 0.56 -1.21 0.04 0.00 0.00 177.00 174.65 1r8u s GLU 245 N -5.15 3.71 -0.02 4.56 2.02 -1.26 -5.11 118.70 117.45 1r8u s GLU 245 Ca 0.63 0.14 -0.10 0.00 0.02 0.00 0.00 54.97 55.66 1r8u s GLU 245 Cb -0.16 -2.64 0.01 0.00 0.10 0.00 0.00 34.13 31.45 1r8u s GLU 245 CO 0.55 0.25 0.22 -0.51 0.02 0.00 0.00 175.26 175.79 1r8u s LEU 246 N -3.24 1.21 -0.46 1.80 1.02 -1.26 -5.12 118.68 112.63 1r8u s LEU 246 Ca 0.46 -0.00 0.09 0.00 0.02 0.00 0.00 54.13 54.69 1r8u s LEU 246 Cb -0.11 0.94 0.32 0.00 0.02 0.00 0.00 46.19 47.36 1r8u s LEU 246 CO 0.26 -0.37 0.76 0.79 0.02 0.00 0.00 176.35 177.82 1r8u n TRP 247 N 1.56 1.60 0.26 0.29 7.02 -1.26 -4.95 117.44 121.97 1r8u n TRP 247 Ca -0.21 -3.87 0.16 0.00 -1.02 0.00 0.00 57.50 52.57 1r8u n TRP 247 Cb 0.56 -0.44 0.89 0.00 -2.42 0.00 0.00 31.31 29.90 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 3.30 0.00 -0.85 -0.99 4.07 -2.00 -1.40 115.31 117.44 1r8u h LEU 248 Ca 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 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 0.62 0.00 -0.09 1.23 -1.08 0.00 0.00 178.44 179.13 1r8u h GLY 249 N 0.00 0.00 -2.80 0.83 0.00 -1.92 -3.44 103.07 95.75 1r8u h GLY 249 Ca 0.04 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.91 1r8u h GLY 249 CO -0.00 0.00 -0.28 1.20 0.00 0.00 0.00 176.54 177.46 1r8u s GLN 250 N -3.48 3.33 0.57 4.80 -1.52 -0.53 -5.02 119.66 117.82 1r8u s GLN 250 Ca 0.03 -0.63 0.33 0.00 -1.95 0.00 0.00 55.36 53.13 1r8u s GLN 250 Cb 0.08 -2.75 1.75 0.00 -0.22 0.00 0.00 33.01 31.86 1r8u s GLN 250 CO 0.62 0.15 2.17 -0.97 -0.25 0.00 0.00 175.29 177.01 1r8u h ASN 251 N 0.86 0.00 -0.18 5.90 -0.73 -1.88 -3.20 115.58 116.34 1r8u h ASN 251 Ca -0.49 0.00 0.05 0.00 1.87 0.00 0.00 56.30 57.73 1r8u h ASN 251 Cb 1.24 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.82 1r8u h ASN 251 CO 0.59 0.05 0.15 -0.33 -0.37 0.00 0.00 177.43 177.52 1r8u h GLU 252 N 0.00 0.00 -1.45 6.67 5.08 -1.95 -3.34 114.58 119.59 1r8u h GLU 252 Ca -0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.97 1r8u h GLU 252 Cb 0.21 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.19 1r8u h GLU 252 CO 0.01 0.00 -0.77 0.34 -1.00 0.00 0.00 179.01 177.59 1r8u n PHE 253 N -4.21 -2.13 -1.73 4.33 7.35 -1.21 -5.03 117.46 114.82 1r8u n PHE 253 Ca 0.01 -2.49 -0.41 0.00 -0.76 0.00 0.00 57.45 53.80 1r8u n PHE 253 Cb 0.28 0.75 -0.01 0.00 0.35 0.00 0.00 39.48 40.85 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 2.36 6.44 -0.08 -2.13 -0.08 -1.26 -4.19 116.55 117.62 1r8u n ASP 254 Ca 0.21 -2.84 0.07 0.00 -1.51 0.00 0.00 54.79 50.71 1r8u n ASP 254 Cb 0.54 -1.55 0.12 0.00 2.34 0.00 0.00 41.12 42.57 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 4.15 0.12 -0.69 -0.67 -1.74 -1.26 -1.25 117.46 116.11 1r8u n PHE 255 Ca 0.61 0.12 0.00 0.00 -0.56 0.00 0.00 57.45 57.62 1r8u n PHE 255 Cb 0.31 -0.44 0.00 0.00 1.52 0.00 0.00 39.48 40.87 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 -2.95 0.72 -0.04 3.97 2.81 -1.26 -4.78 117.12 115.60 1r8u n MET 256 Ca 0.07 -0.70 -0.03 0.00 -1.81 0.00 0.00 57.70 55.23 1r8u n MET 256 Cb 0.27 -0.65 0.22 0.00 -0.71 0.00 0.00 33.22 32.34 1r8u n MET 256 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1r8u h THR 257 N 1.87 1.23 0.00 2.03 1.03 -1.60 -3.40 112.91 114.07 1r8u h THR 257 Ca 0.00 -1.01 0.00 0.00 -0.01 0.00 0.00 66.41 65.39 1r8u h THR 257 Cb 0.77 1.04 0.00 0.00 -1.07 0.00 0.00 68.15 68.89 1r8u h THR 257 CO 0.00 0.34 0.00 -0.90 -0.01 0.00 0.00 175.52 174.95 1r8u n ASP 258 N -4.21 0.00 -1.52 0.00 5.75 -1.26 -4.93 116.55 110.37 1r8u n ASP 258 Ca 0.01 -0.55 0.00 0.00 -0.01 0.00 0.00 54.79 54.24 1r8u n ASP 258 Cb 0.31 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 1r8u n ASP 258 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1r8u n PHE 259 N 0.00 0.00 0.34 2.11 -0.00 -1.26 -4.27 117.46 114.38 1r8u n PHE 259 Ca 0.00 -0.88 0.14 0.00 -0.00 0.00 0.00 57.45 56.71 1r8u n PHE 259 Cb 0.14 -0.46 0.51 0.00 -0.00 0.00 0.00 39.48 39.67 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 1.05 0.00 0.00 -2.13 -1.51 -1.92 -3.37 116.25 108.37 1r8u h VAL 260 Ca 0.00 -0.51 -0.54 0.00 -1.23 0.00 0.00 66.70 64.42 1r8u h VAL 260 Cb 0.90 1.43 0.02 0.00 -2.13 0.00 0.00 31.29 31.52 1r8u h VAL 260 CO 0.00 0.00 3.01 0.00 -1.23 0.00 0.00 177.57 179.35 1r8u n LYS 262 N 4.60 0.66 -1.82 0.00 4.81 -1.26 -4.93 118.16 120.21 1r8u n LYS 262 Ca 0.57 0.24 -0.39 0.00 -0.87 0.00 0.00 58.31 57.86 1r8u n LYS 262 Cb 0.23 -1.82 0.03 0.00 0.02 0.00 0.00 35.03 33.48 1r8u n LYS 262 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1r8u s GLN 263 N 0.52 3.36 0.41 1.64 0.00 -1.26 -4.96 119.66 119.36 1r8u s GLN 263 Ca 0.88 2.26 -0.27 0.00 -0.00 0.00 0.00 55.36 58.23 1r8u s GLN 263 Cb -1.10 -2.40 -0.10 0.00 0.00 0.00 0.00 33.01 29.42 1r8u s GLN 263 CO 0.53 -1.02 1.46 -0.65 0.00 0.00 0.00 175.29 175.60 1r8u s GLN 264 N -2.74 3.94 0.96 9.60 -0.21 -1.26 -5.02 119.66 124.92 1r8u s GLN 264 Ca 0.68 2.50 -0.13 0.00 0.02 0.00 0.00 55.36 58.43 1r8u s GLN 264 Cb -0.41 -2.84 0.16 0.00 1.00 0.00 0.00 33.01 30.93 1r8u s GLN 264 CO 0.49 -0.64 1.14 -1.25 -2.12 0.00 0.00 175.29 172.91 1r8u s PRO 265 N -2.24 0.76 0.00 2.91 0.04 -1.26 -5.05 135.00 130.17 1r8u s PRO 265 Ca 0.56 0.27 0.00 0.00 0.04 0.00 0.00 61.00 61.87 1r8u s PRO 265 Cb -0.45 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1r8u s PRO 265 CO 0.60 -2.45 0.00 -1.13 0.04 0.00 0.00 177.00 174.06 1r8u n SER 266 N -3.94 0.24 0.00 6.66 3.41 -1.26 -4.97 113.62 113.76 1r8u n SER 266 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1r8u n SER 266 Cb 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1r8u n SER 266 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1r8u n ARG 267 N -1.57 0.76 -0.02 4.33 1.74 -1.26 -4.82 116.66 115.83 1r8u n ARG 267 Ca 0.00 -0.73 0.03 0.00 -0.77 0.00 0.00 57.85 56.38 1r8u n ARG 267 Cb 0.03 -0.64 0.03 0.00 -1.02 0.00 0.00 32.46 30.86 1r8u n ARG 267 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1r8u n VAL 268 N -0.13 0.20 0.00 1.55 0.24 -1.26 -5.37 118.33 113.55 1r8u n VAL 268 Ca 0.00 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.70 1r8u n VAL 268 Cb 0.41 0.99 0.00 0.00 -1.47 0.00 0.00 33.84 33.77 1r8u n VAL 268 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49