#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pqc s THR 221 N 0.00 4.62 0.26 -5.08 -4.23 -1.26 -4.80 115.64 105.15 1pqc s THR 221 Ca 0.00 0.73 -0.02 0.00 -1.18 0.00 0.00 61.69 61.22 1pqc s THR 221 Cb 0.00 -3.83 0.24 0.00 1.34 0.00 0.00 72.50 70.25 1pqc s THR 221 CO 0.00 -1.05 1.72 0.00 -0.54 0.00 0.00 174.62 174.75 1pqc h ALA 222 N -0.26 1.15 -0.22 3.99 0.00 -2.05 0.20 119.26 122.07 1pqc h ALA 222 Ca -0.45 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1pqc h ALA 222 Cb 1.20 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1pqc h ALA 222 CO 0.62 -0.24 -0.24 0.00 0.00 0.00 0.00 179.25 179.40 1pqc h ALA 223 N 1.59 1.18 -0.25 0.00 0.00 -1.99 -0.97 119.26 118.83 1pqc h ALA 223 Ca 0.45 -0.32 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 1pqc h ALA 223 Cb 0.73 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1pqc h ALA 223 CO -0.44 0.52 -0.60 1.96 0.00 0.00 0.00 179.25 180.69 1pqc h GLN 224 N 0.37 0.85 -0.35 0.00 4.20 -1.07 -1.88 115.11 117.23 1pqc h GLN 224 Ca 0.06 -0.58 -0.02 0.00 0.06 0.00 0.00 58.65 58.17 1pqc h GLN 224 Cb 0.62 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 1pqc h GLN 224 CO 0.04 1.21 0.15 0.93 -0.67 0.00 0.00 178.83 180.50 1pqc h GLU 225 N 0.62 0.51 -0.96 1.46 5.08 -0.67 -2.34 114.58 118.29 1pqc h GLU 225 Ca -0.00 -0.08 0.12 0.00 -1.00 0.00 0.00 59.36 58.39 1pqc h GLU 225 Cb 1.22 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 30.30 1pqc h GLU 225 CO 0.13 0.48 0.61 1.25 -1.00 0.00 0.00 179.01 180.48 1pqc h LEU 226 N 0.42 0.84 -0.09 1.33 5.85 -1.14 0.28 115.31 122.79 1pqc h LEU 226 Ca 0.12 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.77 1pqc h LEU 226 Cb 0.15 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1pqc h LEU 226 CO -0.01 0.45 -0.38 -0.03 -0.34 0.00 0.00 178.44 178.13 1pqc h MET 227 N 0.90 0.42 -0.18 1.25 4.05 -1.03 -2.98 114.93 117.34 1pqc h MET 227 Ca 0.47 -0.33 -0.10 0.00 -0.28 0.00 0.00 59.70 59.46 1pqc h MET 227 Cb 0.54 0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1pqc h MET 227 CO -0.23 0.96 -0.28 0.82 0.23 0.00 0.00 176.91 178.40 1pqc h ILE 228 N -0.03 1.34 -0.77 1.77 2.04 -1.26 -2.33 117.51 118.28 1pqc h ILE 228 Ca -0.02 -1.49 0.15 0.00 1.00 0.00 0.00 64.86 64.49 1pqc h ILE 228 Cb 1.02 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 38.91 1pqc h ILE 228 CO 0.08 0.45 0.51 1.56 0.00 0.00 0.00 178.15 180.75 1pqc h GLN 229 N 0.17 0.44 -0.04 2.37 4.20 -1.05 -1.98 115.11 119.22 1pqc h GLN 229 Ca 0.02 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1pqc h GLN 229 Cb 0.86 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.53 1pqc h GLN 229 CO 0.06 0.29 -0.04 0.37 -0.67 0.00 0.00 178.83 178.85 1pqc h GLN 230 N 0.46 0.10 -0.46 1.46 5.75 -1.34 -0.75 115.11 120.33 1pqc h GLN 230 Ca 0.38 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.83 1pqc h GLN 230 Cb 0.82 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.34 1pqc h GLN 230 CO -0.13 0.55 0.30 -0.07 -2.65 0.00 0.00 178.83 176.83 1pqc h LEU 231 N -0.34 0.54 -0.66 -2.39 3.38 -1.21 0.12 115.31 114.74 1pqc h LEU 231 Ca 0.01 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1pqc h LEU 231 Cb 0.53 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1pqc h LEU 231 CO 0.01 0.40 0.22 0.58 0.09 0.00 0.00 178.44 179.75 1pqc h VAL 232 N 0.62 1.25 -0.17 1.22 2.07 -1.36 -1.54 116.25 118.33 1pqc h VAL 232 Ca 0.17 -0.83 -0.11 0.00 0.82 0.00 0.00 66.70 66.75 1pqc h VAL 232 Cb -0.05 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1pqc h VAL 232 CO -0.03 0.32 -0.36 0.00 0.02 0.00 0.00 177.57 177.52 1pqc h ALA 233 N 1.09 1.07 -0.16 1.67 0.00 -0.77 -1.37 119.26 120.80 1pqc h ALA 233 Ca 0.22 -0.39 -0.20 0.00 0.00 0.00 0.00 54.91 54.53 1pqc h ALA 233 Cb 0.27 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1pqc h ALA 233 CO -0.01 0.58 -0.69 0.00 0.00 0.00 0.00 179.25 179.13 1pqc h ALA 234 N 1.32 0.29 -0.47 0.00 0.00 -0.81 -2.15 119.26 117.44 1pqc h ALA 234 Ca 0.03 -0.57 0.03 0.00 0.00 0.00 0.00 54.91 54.41 1pqc h ALA 234 Cb 0.78 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1pqc h ALA 234 CO 0.06 0.61 0.26 0.37 0.00 0.00 0.00 179.25 180.55 1pqc h GLN 235 N 0.46 0.50 -0.80 0.00 4.15 -1.15 0.44 115.11 118.70 1pqc h GLN 235 Ca -0.04 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.34 1pqc h GLN 235 Cb 1.32 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.86 1pqc h GLN 235 CO 0.14 0.33 0.46 1.25 -1.93 0.00 0.00 178.83 179.08 1pqc h LEU 236 N 0.51 0.99 -0.54 -2.39 5.85 -1.25 -1.60 115.31 116.87 1pqc h LEU 236 Ca 0.20 -0.09 -0.16 0.00 0.84 0.00 0.00 57.88 58.67 1pqc h LEU 236 Cb 0.06 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 1pqc h LEU 236 CO -0.11 0.79 -0.73 1.56 -0.34 0.00 0.00 178.44 179.61 1pqc h GLN 237 N 1.11 0.04 -0.42 1.25 4.20 -1.00 -2.18 115.11 118.11 1pqc h GLN 237 Ca 0.29 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.81 1pqc h GLN 237 Cb 0.00 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1pqc h GLN 237 CO -0.05 0.75 -0.33 0.00 -0.67 0.00 0.00 178.83 178.53 1pqc h ASN 239 N 0.80 0.54 -0.68 0.00 -0.73 -1.18 -0.21 115.58 114.13 1pqc h ASN 239 Ca 0.08 -0.39 0.02 0.00 1.87 0.00 0.00 56.30 57.88 1pqc h ASN 239 Cb 0.92 -0.15 -0.04 0.00 0.27 0.00 0.00 38.32 39.32 1pqc h ASN 239 CO 0.09 0.81 0.43 0.50 -0.37 0.00 0.00 177.43 178.89 1pqc h LYS 240 N 0.27 0.82 -0.03 6.67 3.64 -1.31 0.28 116.57 126.91 1pqc h LYS 240 Ca 0.06 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1pqc h LYS 240 Cb 0.59 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1pqc h LYS 240 CO 0.03 0.54 -0.00 -0.09 -2.27 0.00 0.00 179.45 177.66 1pqc h ARG 241 N 0.85 0.06 0.00 1.90 2.43 -1.11 -2.74 114.38 115.78 1pqc h ARG 241 Ca 0.27 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.33 1pqc h ARG 241 Cb -0.01 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1pqc h ARG 241 CO -0.10 0.39 -0.59 0.77 -1.51 0.00 0.00 179.97 178.94 1pqc h SER 242 N -0.27 0.00 -0.23 -3.80 0.02 -0.94 -3.41 113.55 104.92 1pqc h SER 242 Ca 0.01 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.75 1pqc h SER 242 Cb 0.36 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 62.55 1pqc h SER 242 CO 0.00 0.38 -0.95 0.49 -1.14 0.00 0.00 176.83 175.61 1pqc n PHE 243 N -3.10 0.44 -0.08 3.45 0.99 0.08 -4.81 117.46 114.42 1pqc n PHE 243 Ca 0.00 -1.54 -0.10 0.00 -0.00 0.00 0.00 57.45 55.82 1pqc n PHE 243 Cb 0.70 0.05 -0.04 0.00 -1.00 0.00 0.00 39.48 39.18 1pqc n PHE 243 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1pqc n SER 244 N -0.37 1.83 -4.85 4.37 7.64 -1.03 -4.84 113.62 116.37 1pqc n SER 244 Ca 0.02 0.56 -0.30 0.00 1.01 0.00 0.00 58.87 60.15 1pqc n SER 244 Cb 0.90 -0.89 0.05 0.00 -1.01 0.00 0.00 64.21 63.27 1pqc n SER 244 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1pqc s ASP 245 N -6.08 5.31 0.30 6.43 1.01 -1.26 -4.99 116.67 117.38 1pqc s ASP 245 Ca -0.20 1.34 -0.29 0.00 0.71 0.00 0.00 52.55 54.11 1pqc s ASP 245 Cb 0.04 -2.18 -0.10 0.00 1.01 0.00 0.00 42.92 41.68 1pqc s ASP 245 CO 0.33 -1.45 1.39 -1.10 0.21 0.00 0.00 175.17 174.56 1pqc s GLN 246 N -5.20 4.28 0.53 8.23 -1.52 -1.26 -4.95 119.66 119.77 1pqc s GLN 246 Ca 0.58 2.30 -0.20 0.00 -1.95 0.00 0.00 55.36 56.10 1pqc s GLN 246 Cb -0.13 -3.08 -0.07 0.00 -0.22 0.00 0.00 33.01 29.52 1pqc s GLN 246 CO 0.54 -0.34 1.10 -1.25 -0.25 0.00 0.00 175.29 175.09 1pqc s PRO 247 N -1.17 3.49 -0.59 2.91 0.04 -1.26 -4.96 135.00 133.45 1pqc s PRO 247 Ca 0.54 1.53 -0.25 0.00 0.04 0.00 0.00 61.00 62.87 1pqc s PRO 247 Cb -0.42 -2.03 0.04 0.00 0.04 0.00 0.00 34.50 32.13 1pqc s PRO 247 CO 0.50 -0.72 1.03 0.15 0.04 0.00 0.00 177.00 177.99 1pqc s LYS 248 N -3.27 3.33 -0.11 4.56 1.02 -1.26 -4.99 119.74 119.01 1pqc s LYS 248 Ca 0.71 -0.23 -0.10 0.00 0.02 0.00 0.00 55.97 56.37 1pqc s LYS 248 Cb -0.22 -4.08 0.03 0.00 -0.52 0.00 0.00 37.83 33.04 1pqc s LYS 248 CO 0.25 -1.63 0.28 0.08 -0.92 0.00 0.00 175.35 173.41 1pqc s VAL 249 N 4.34 -0.00 -0.36 3.17 1.01 -1.26 -4.91 120.40 122.40 1pqc s VAL 249 Ca 0.32 0.01 -0.44 0.00 0.00 0.00 0.00 61.98 61.87 1pqc s VAL 249 Cb -0.12 -0.40 -0.18 0.00 0.00 0.00 0.00 36.38 35.68 1pqc s VAL 249 CO 0.19 0.00 1.59 0.41 0.00 0.00 0.00 175.10 177.30 1pqc n THR 250 N 2.99 0.11 -1.66 3.92 -1.04 -1.26 -4.80 114.28 112.54 1pqc n THR 250 Ca -0.13 -0.02 -0.50 0.00 -2.04 0.00 0.00 64.05 61.36 1pqc n THR 250 Cb 0.58 -0.72 -0.05 0.00 -1.82 0.00 0.00 70.33 68.32 1pqc n THR 250 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1pqc n PRO 251 N 4.20 1.78 -1.96 -2.82 -0.02 -1.26 -4.65 135.00 130.26 1pqc n PRO 251 Ca 0.28 0.64 -0.43 0.00 -2.02 0.00 0.00 63.50 61.98 1pqc n PRO 251 Cb 0.03 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.09 1pqc n PRO 251 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1pqc s TRP 252 N 1.86 1.78 0.00 6.00 -0.11 -1.26 -4.93 118.94 122.28 1pqc s TRP 252 Ca 0.86 0.49 0.00 0.00 1.22 0.00 0.00 56.10 58.67 1pqc s TRP 252 Cb -0.80 -4.05 0.00 0.00 -1.50 0.00 0.00 33.47 27.12 1pqc s TRP 252 CO 0.47 -3.34 0.00 -2.30 -4.62 0.00 0.00 176.95 167.16 1pqc n PRO 253 N 8.11 0.00 -0.13 5.86 -0.02 -1.26 -5.14 135.00 142.41 1pqc n PRO 253 Ca 0.22 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.81 1pqc n PRO 253 Cb 0.45 0.00 0.18 0.00 -0.02 0.00 0.00 33.50 34.12 1pqc n PRO 253 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1pqc n ARG 261 N 0.00 -0.01 -0.20 -0.52 -4.01 -1.26 -5.18 116.66 105.48 1pqc n ARG 261 Ca 0.00 0.34 -0.06 0.00 -1.04 0.00 0.00 57.85 57.09 1pqc n ARG 261 Cb 0.00 -0.67 -0.01 0.00 -3.04 0.00 0.00 32.46 28.74 1pqc n ARG 261 CO 0.00 0.00 0.00 -0.44 -3.04 0.00 0.00 177.63 174.15 1pqc h ASP 262 N 0.00 -1.24 -0.39 2.89 5.19 -2.05 -2.56 116.42 118.26 1pqc h ASP 262 Ca 0.24 0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.88 1pqc h ASP 262 Cb 0.78 0.60 0.00 0.00 0.18 0.00 0.00 39.33 40.88 1pqc h ASP 262 CO -0.12 -0.32 0.00 0.00 -3.12 0.00 0.00 179.24 175.68 1pqc n ALA 263 N -3.14 2.41 0.24 3.45 0.00 -1.26 -3.80 120.51 118.41 1pqc n ALA 263 Ca 0.03 -1.00 -0.14 0.00 0.00 0.00 0.00 53.44 52.33 1pqc n ALA 263 Cb 0.35 -0.83 -0.08 0.00 0.00 0.00 0.00 19.45 18.89 1pqc n ALA 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pqc h ARG 264 N 4.29 -0.58 -0.30 0.00 2.47 -1.74 -1.84 114.38 116.67 1pqc h ARG 264 Ca 0.00 0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.69 1pqc h ARG 264 Cb 0.96 0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 29.40 1pqc h ARG 264 CO 0.00 -0.29 -0.11 1.96 0.56 0.00 0.00 179.97 182.10 1pqc h GLN 265 N -0.86 0.51 -0.33 0.04 4.20 -1.70 -2.92 115.11 114.04 1pqc h GLN 265 Ca -0.06 -0.14 -0.14 0.00 0.06 0.00 0.00 58.65 58.37 1pqc h GLN 265 Cb 0.57 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 1pqc h GLN 265 CO 0.10 0.61 -0.35 0.37 -0.67 0.00 0.00 178.83 178.89 1pqc h GLN 266 N 0.47 0.75 -0.04 1.46 4.15 -1.65 -0.41 115.11 119.85 1pqc h GLN 266 Ca 0.09 -0.37 -0.22 0.00 0.77 0.00 0.00 58.65 58.93 1pqc h GLN 266 Cb 0.47 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1pqc h GLN 266 CO 0.03 0.99 -0.87 0.00 -1.93 0.00 0.00 178.83 177.04 1pqc h ARG 267 N 0.63 0.46 0.13 1.69 3.08 -1.32 -2.33 114.38 116.71 1pqc h ARG 267 Ca 0.06 -0.45 -0.01 0.00 0.07 0.00 0.00 59.98 59.66 1pqc h ARG 267 Cb 0.89 0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.06 1pqc h ARG 267 CO 0.08 1.09 -0.06 0.35 -1.07 0.00 0.00 179.97 180.36 1pqc h PHE 268 N 0.28 -0.16 -0.34 3.04 3.57 -1.45 -1.19 116.94 120.69 1pqc h PHE 268 Ca -0.07 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.48 1pqc h PHE 268 Cb 1.49 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 40.24 1pqc h PHE 268 CO 0.06 0.00 0.06 0.00 -2.23 0.00 0.00 178.31 176.20 1pqc h ALA 269 N 0.56 0.35 -0.56 2.41 0.00 -1.08 0.23 119.26 121.17 1pqc h ALA 269 Ca -0.02 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1pqc h ALA 269 Cb 0.23 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.01 1pqc h ALA 269 CO 0.03 -0.35 -0.17 1.25 0.00 0.00 0.00 179.25 180.01 1pqc h HIS 270 N 0.17 -0.40 -0.68 0.00 -0.00 -1.32 -0.44 115.15 112.48 1pqc h HIS 270 Ca 0.16 0.05 -0.01 0.00 -0.00 0.00 0.00 60.37 60.57 1pqc h HIS 270 Cb 0.19 0.26 -0.03 0.00 -0.00 0.00 0.00 27.41 27.82 1pqc h HIS 270 CO -0.19 -0.27 0.39 0.74 -0.00 0.00 0.00 177.93 178.60 1pqc h PHE 271 N -0.04 0.92 0.00 5.26 -1.00 0.47 -2.06 116.94 120.49 1pqc h PHE 271 Ca 0.27 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 61.00 1pqc h PHE 271 Cb 0.44 -0.30 -0.00 0.00 3.61 0.00 0.00 35.95 39.70 1pqc h PHE 271 CO -0.49 0.64 -0.13 0.00 -1.61 0.00 0.00 178.31 176.72 1pqc h THR 272 N 0.93 0.86 0.06 -1.55 1.03 0.25 -0.55 112.91 113.94 1pqc h THR 272 Ca 0.24 -0.48 -0.32 0.00 -0.01 0.00 0.00 66.41 65.85 1pqc h THR 272 Cb 0.01 1.28 -0.03 0.00 -1.07 0.00 0.00 68.15 68.34 1pqc h THR 272 CO -0.04 0.13 -1.76 -0.33 -0.01 0.00 0.00 175.52 173.51 1pqc h GLU 273 N 0.00 0.13 -0.36 0.00 5.08 -0.46 -2.61 114.58 116.35 1pqc h GLU 273 Ca -0.00 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1pqc h GLU 273 Cb 0.27 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1pqc h GLU 273 CO 0.02 0.85 0.22 -0.07 -1.00 0.00 0.00 179.01 179.03 1pqc h LEU 274 N 0.04 0.44 -0.80 1.33 3.38 -1.30 -2.54 115.31 115.85 1pqc h LEU 274 Ca -0.32 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 57.71 1pqc h LEU 274 Cb 2.01 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 42.58 1pqc h LEU 274 CO 0.10 0.35 0.44 0.00 0.09 0.00 0.00 178.44 179.42 1pqc h ALA 275 N 1.10 1.14 -0.53 1.53 0.00 -1.09 -1.57 119.26 119.84 1pqc h ALA 275 Ca 0.13 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1pqc h ALA 275 Cb -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1pqc h ALA 275 CO -0.03 0.04 0.19 0.82 0.00 0.00 0.00 179.25 180.28 1pqc h ILE 276 N 0.73 1.22 -0.42 0.00 2.04 -1.46 -0.19 117.51 119.43 1pqc h ILE 276 Ca 0.39 -0.72 -0.07 0.00 1.00 0.00 0.00 64.86 65.46 1pqc h ILE 276 Cb 0.39 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1pqc h ILE 276 CO -0.26 0.27 -0.03 0.40 0.00 0.00 0.00 178.15 178.53 1pqc h ILE 277 N 0.72 1.23 -0.47 -0.67 2.04 -0.92 -1.75 117.51 117.70 1pqc h ILE 277 Ca 0.17 -0.98 -0.13 0.00 1.00 0.00 0.00 64.86 64.92 1pqc h ILE 277 Cb 0.23 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 1pqc h ILE 277 CO -0.01 0.34 -0.24 0.28 0.00 0.00 0.00 178.15 178.52 1pqc h SER 278 N 0.65 1.01 -1.00 1.72 0.02 -0.81 -1.58 113.55 113.56 1pqc h SER 278 Ca 0.13 -0.39 0.08 0.00 -0.84 0.00 0.00 61.79 60.77 1pqc h SER 278 Cb 0.44 -0.28 -0.07 0.00 0.14 0.00 0.00 62.40 62.63 1pqc h SER 278 CO 0.02 1.19 0.64 0.58 -1.14 0.00 0.00 176.83 178.12 1pqc h VAL 279 N 0.84 1.03 -0.37 2.27 2.07 -0.72 -0.21 116.25 121.15 1pqc h VAL 279 Ca 0.10 -0.38 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 1pqc h VAL 279 Cb 0.82 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1pqc h VAL 279 CO 0.07 0.20 -0.10 -0.61 0.02 0.00 0.00 177.57 177.15 1pqc h GLN 280 N 1.10 0.72 -0.69 1.57 4.15 -0.73 -1.19 115.11 120.04 1pqc h GLN 280 Ca 0.45 -0.28 0.02 0.00 0.77 0.00 0.00 58.65 59.61 1pqc h GLN 280 Cb 0.28 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.90 1pqc h GLN 280 CO -0.20 0.88 0.44 1.49 -1.93 0.00 0.00 178.83 179.51 1pqc h GLU 281 N 0.52 0.86 -0.28 1.69 4.81 -0.71 -0.68 114.58 120.79 1pqc h GLU 281 Ca 0.09 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.13 1pqc h GLU 281 Cb 0.62 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1pqc h GLU 281 CO 0.04 0.57 -0.38 0.82 -0.73 0.00 0.00 179.01 179.32 1pqc h ILE 282 N 0.88 1.30 -0.56 2.32 2.04 -0.88 -1.52 117.51 121.09 1pqc h ILE 282 Ca 0.27 -1.57 -0.04 0.00 1.00 0.00 0.00 64.86 64.52 1pqc h ILE 282 Cb -0.04 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1pqc h ILE 282 CO -0.08 0.50 0.20 0.58 0.00 0.00 0.00 178.15 179.35 1pqc h VAL 283 N 0.51 1.23 -0.86 1.67 2.07 -1.01 -0.01 116.25 119.85 1pqc h VAL 283 Ca 0.03 -0.74 0.07 0.00 0.82 0.00 0.00 66.70 66.89 1pqc h VAL 283 Cb 0.97 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.35 1pqc h VAL 283 CO 0.09 0.28 0.56 0.44 0.02 0.00 0.00 177.57 178.96 1pqc h ASP 284 N 0.77 0.82 -0.05 0.57 3.45 -0.91 -2.36 116.42 118.71 1pqc h ASP 284 Ca 0.18 0.01 -0.21 0.00 0.43 0.00 0.00 57.03 57.44 1pqc h ASP 284 Cb 0.23 -0.17 0.01 0.00 -0.56 0.00 0.00 39.33 38.85 1pqc h ASP 284 CO -0.01 0.52 -0.79 0.15 -1.57 0.00 0.00 179.24 177.54 1pqc h PHE 285 N 0.93 0.89 -1.01 4.55 3.57 -0.74 -3.24 116.94 121.89 1pqc h PHE 285 Ca 0.37 -0.45 0.12 0.00 3.53 0.00 0.00 57.97 61.54 1pqc h PHE 285 Cb 0.25 -0.11 -0.08 0.00 2.79 0.00 0.00 35.95 38.80 1pqc h PHE 285 CO -0.00 1.27 0.64 0.00 -2.23 0.00 0.00 178.31 177.99 1pqc h ALA 286 N 0.42 1.51 0.00 2.41 0.00 -0.68 -0.84 119.26 122.09 1pqc h ALA 286 Ca -0.08 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1pqc h ALA 286 Cb 1.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1pqc h ALA 286 CO 0.16 0.25 -0.19 0.87 0.00 0.00 0.00 179.25 180.34 1pqc h LYS 287 N 1.01 0.00 -0.08 0.00 1.57 -1.46 -2.20 116.57 115.41 1pqc h LYS 287 Ca 0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1pqc h LYS 287 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1pqc h LYS 287 CO -0.26 0.19 0.00 1.04 -0.57 0.00 0.00 179.45 179.85 1pqc n GLN 288 N -4.13 2.17 -2.68 3.15 6.02 -0.35 -4.49 117.38 117.07 1pqc n GLN 288 Ca -0.02 -1.72 -0.43 0.00 -0.01 0.00 0.00 57.00 54.82 1pqc n GLN 288 Cb 0.26 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.03 1pqc n GLN 288 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1pqc s VAL 289 N -1.92 4.54 0.18 5.09 1.01 -0.83 -4.94 120.40 123.53 1pqc s VAL 289 Ca 0.32 1.65 -0.33 0.00 0.00 0.00 0.00 61.98 63.62 1pqc s VAL 289 Cb 0.20 -4.38 -0.14 0.00 0.00 0.00 0.00 36.38 32.06 1pqc s VAL 289 CO 0.31 -0.46 1.47 -2.65 0.00 0.00 0.00 175.10 173.77 1pqc n PRO 290 N 6.80 1.93 0.00 2.72 -0.02 -1.26 -1.27 135.00 143.90 1pqc n PRO 290 Ca 0.11 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1pqc n PRO 290 Cb 0.47 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1pqc n PRO 290 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pqc n GLY 291 N 2.80 2.71 0.29 -1.23 0.00 -1.26 -4.96 105.19 103.54 1pqc n GLY 291 Ca 0.15 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1pqc n GLY 291 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1pqc h PHE 292 N 0.00 -0.62 0.00 1.61 3.57 -1.46 -2.76 116.94 117.28 1pqc h PHE 292 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1pqc h PHE 292 Cb 0.00 0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.95 1pqc h PHE 292 CO 0.00 -0.33 0.00 1.28 -2.23 0.00 0.00 178.31 177.03 1pqc n LEU 293 N -5.23 0.00 -0.73 0.59 4.77 -1.26 -0.88 117.00 114.26 1pqc n LEU 293 Ca -0.09 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.95 1pqc n LEU 293 Cb 0.29 0.00 0.18 0.00 -2.33 0.00 0.00 43.42 41.56 1pqc n LEU 293 CO 0.24 0.00 0.65 0.00 -1.33 0.00 0.00 177.39 176.95 1pqc n GLN 294 N -0.93 2.89 -2.55 3.23 3.00 -1.05 -4.95 117.38 117.01 1pqc n GLN 294 Ca 0.09 -2.18 -0.25 0.00 -0.01 0.00 0.00 57.00 54.65 1pqc n GLN 294 Cb 0.04 -1.35 0.03 0.00 0.00 0.00 0.00 30.24 28.96 1pqc n GLN 294 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1pqc s LEU 295 N -1.17 3.31 0.41 1.08 1.43 -0.06 -5.06 118.68 118.61 1pqc s LEU 295 Ca 0.27 0.52 -0.25 0.00 -1.03 0.00 0.00 54.13 53.64 1pqc s LEU 295 Cb 0.15 -3.35 -0.08 0.00 0.03 0.00 0.00 46.19 42.93 1pqc s LEU 295 CO 0.17 -1.02 1.23 -0.83 0.23 0.00 0.00 176.35 176.13 1pqc s GLY 296 N -4.31 2.90 0.38 -3.19 0.00 -1.26 -4.80 107.32 97.04 1pqc s GLY 296 Ca 0.53 1.10 0.17 0.00 0.00 0.00 0.00 44.72 46.51 1pqc s GLY 296 CO 0.43 1.64 1.76 -0.09 0.00 0.00 0.00 173.10 176.84 1pqc h ARG 297 N 2.63 0.42 -0.49 2.90 2.43 -1.96 -1.31 114.38 119.00 1pqc h ARG 297 Ca -0.49 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 58.57 1pqc h ARG 297 Cb 1.24 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1pqc h ARG 297 CO 0.62 0.28 -0.04 0.93 -1.51 0.00 0.00 179.97 180.25 1pqc h GLU 298 N 0.43 0.89 -0.28 0.20 3.07 -1.99 -1.81 114.58 115.09 1pqc h GLU 298 Ca 0.61 -0.30 -0.08 0.00 -0.50 0.00 0.00 59.36 59.09 1pqc h GLU 298 Cb 1.46 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 29.28 1pqc h GLU 298 CO -0.34 0.94 -0.16 -0.44 -1.40 0.00 0.00 179.01 177.62 1pqc h ASP 299 N 0.74 0.49 -0.74 1.42 3.32 -1.59 -0.22 116.42 119.84 1pqc h ASP 299 Ca 0.13 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1pqc h ASP 299 Cb 0.57 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 1pqc h ASP 299 CO 0.03 0.67 0.46 1.56 -1.72 0.00 0.00 179.24 180.25 1pqc h GLN 300 N 0.46 0.99 -0.34 3.56 4.20 -1.01 -1.21 115.11 121.76 1pqc h GLN 300 Ca 0.08 -0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 1pqc h GLN 300 Cb 0.55 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 1pqc h GLN 300 CO 0.04 0.69 -0.35 0.82 -0.67 0.00 0.00 178.83 179.35 1pqc h ILE 301 N 1.01 1.28 -0.29 2.54 2.04 -1.18 -2.52 117.51 120.39 1pqc h ILE 301 Ca 0.27 -1.52 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 1pqc h ILE 301 Cb -0.06 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1pqc h ILE 301 CO -0.05 0.50 0.10 0.00 0.00 0.00 0.00 178.15 178.70 1pqc h ALA 302 N 0.74 0.38 -0.32 1.87 0.00 -0.78 0.59 119.26 121.75 1pqc h ALA 302 Ca 0.05 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 1pqc h ALA 302 Cb 0.94 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1pqc h ALA 302 CO 0.09 0.00 -0.39 -0.07 0.00 0.00 0.00 179.25 178.88 1pqc h LEU 303 N 0.32 0.90 -0.73 0.00 3.38 -1.28 -2.84 115.31 115.06 1pqc h LEU 303 Ca 0.10 -0.49 -0.08 0.00 0.09 0.00 0.00 57.88 57.50 1pqc h LEU 303 Cb 0.22 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1pqc h LEU 303 CO -0.00 1.21 0.11 -0.07 0.09 0.00 0.00 178.44 179.77 1pqc h LEU 304 N 0.61 1.03 -0.64 1.67 3.38 -1.39 -1.83 115.31 118.14 1pqc h LEU 304 Ca 0.04 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.81 1pqc h LEU 304 Cb 0.99 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 1pqc h LEU 304 CO 0.09 1.02 0.37 0.11 0.09 0.00 0.00 178.44 180.13 1pqc h LYS 305 N 1.01 0.70 0.08 1.13 1.57 -0.69 -1.48 116.57 118.89 1pqc h LYS 305 Ca 0.20 -0.04 -0.25 0.00 -1.87 0.00 0.00 60.65 58.69 1pqc h LYS 305 Cb 0.43 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1pqc h LYS 305 CO 0.01 0.46 -1.12 0.00 -0.57 0.00 0.00 179.45 178.23 1pqc h ALA 306 N 1.30 0.22 0.01 3.86 0.00 -1.47 -3.34 119.26 119.84 1pqc h ALA 306 Ca 0.27 -0.84 -0.19 0.00 0.00 0.00 0.00 54.91 54.14 1pqc h ALA 306 Cb 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1pqc h ALA 306 CO -0.14 0.98 -0.88 0.77 0.00 0.00 0.00 179.25 179.99 1pqc h SER 307 N 0.09 0.19 -0.19 0.00 0.02 -1.08 -3.39 113.55 109.19 1pqc h SER 307 Ca -0.10 -0.16 0.05 0.00 -0.84 0.00 0.00 61.79 60.75 1pqc h SER 307 Cb 1.83 -0.06 -0.07 0.00 0.14 0.00 0.00 62.40 64.24 1pqc h SER 307 CO 0.18 0.98 -0.27 0.74 -1.14 0.00 0.00 176.83 177.32 1pqc h THR 308 N 0.08 0.36 -0.29 -2.27 2.02 -1.40 0.35 112.91 111.76 1pqc h THR 308 Ca -0.04 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.09 1pqc h THR 308 Cb 1.52 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1pqc h THR 308 CO 0.13 0.00 -0.05 -0.29 0.37 0.00 0.00 175.52 175.68 1pqc h ILE 309 N -0.31 1.20 -0.36 3.11 6.09 -1.83 -0.95 117.51 124.46 1pqc h ILE 309 Ca 0.12 -0.82 -0.13 0.00 -1.37 0.00 0.00 64.86 62.65 1pqc h ILE 309 Cb 0.49 1.03 -0.01 0.00 0.47 0.00 0.00 36.82 38.80 1pqc h ILE 309 CO -0.36 0.27 -0.31 -0.33 -3.07 0.00 0.00 178.15 174.36 1pqc h GLU 310 N 0.44 0.79 -0.01 2.19 5.08 -1.22 -1.54 114.58 120.31 1pqc h GLU 310 Ca 0.09 -0.37 -0.15 0.00 -1.00 0.00 0.00 59.36 57.94 1pqc h GLU 310 Cb 0.37 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1pqc h GLU 310 CO 0.02 0.99 -0.68 0.82 -1.00 0.00 0.00 179.01 179.16 1pqc h ILE 311 N 0.67 1.47 -0.06 3.13 2.04 0.07 -2.21 117.51 122.63 1pqc h ILE 311 Ca 0.07 -2.30 -0.07 0.00 1.00 0.00 0.00 64.86 63.57 1pqc h ILE 311 Cb 0.85 2.23 -0.01 0.00 -0.74 0.00 0.00 36.82 39.15 1pqc h ILE 311 CO 0.07 0.66 -0.30 0.24 0.00 0.00 0.00 178.15 178.83 1pqc h MET 312 N 0.03 0.10 0.08 2.37 2.86 -0.74 -0.04 114.93 119.60 1pqc h MET 312 Ca -0.01 -0.03 -0.22 0.00 -2.06 0.00 0.00 59.70 57.37 1pqc h MET 312 Cb 1.21 -0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.88 1pqc h MET 312 CO 0.09 0.40 -0.92 -0.07 1.06 0.00 0.00 176.91 177.46 1pqc h LEU 313 N 0.09 0.67 -0.11 1.22 3.38 -0.83 -0.04 115.31 119.69 1pqc h LEU 313 Ca 0.01 -0.83 0.03 0.00 0.09 0.00 0.00 57.88 57.18 1pqc h LEU 313 Cb 0.58 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1pqc h LEU 313 CO 0.04 1.43 -0.06 -0.07 0.09 0.00 0.00 178.44 179.88 1pqc h LEU 314 N -0.00 -0.19 -0.94 1.67 4.07 -1.31 -1.64 115.31 116.97 1pqc h LEU 314 Ca -0.14 0.05 -0.04 0.00 0.08 0.00 0.00 57.88 57.83 1pqc h LEU 314 Cb 1.65 0.10 -0.03 0.00 1.08 0.00 0.00 40.66 43.46 1pqc h LEU 314 CO 0.18 -0.08 0.31 -0.33 -1.08 0.00 0.00 178.44 177.44 1pqc h GLU 315 N -0.05 1.08 -0.56 1.13 4.39 -0.98 0.11 114.58 119.70 1pqc h GLU 315 Ca 0.06 -0.18 -0.04 0.00 0.34 0.00 0.00 59.36 59.55 1pqc h GLU 315 Cb 0.15 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1pqc h GLU 315 CO -0.14 0.86 0.20 1.15 -1.16 0.00 0.00 179.01 179.93 1pqc h THR 316 N 1.06 1.23 -0.54 1.13 2.02 -0.89 -1.11 112.91 115.80 1pqc h THR 316 Ca 0.25 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.66 1pqc h THR 316 Cb 0.18 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 1pqc h THR 316 CO -0.02 0.28 0.19 0.00 0.37 0.00 0.00 175.52 176.34 1pqc h ALA 317 N 1.06 1.32 -0.22 6.16 0.00 -0.40 -0.77 119.26 126.40 1pqc h ALA 317 Ca 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pqc h ALA 317 Cb 0.23 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1pqc h ALA 317 CO -0.01 0.50 0.14 -0.09 0.00 0.00 0.00 179.25 179.79 1pqc h ARG 318 N 0.78 0.28 0.00 0.00 2.43 -0.27 -2.62 114.38 114.99 1pqc h ARG 318 Ca 0.18 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1pqc h ARG 318 Cb 0.20 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1pqc h ARG 318 CO -0.01 0.18 0.00 0.54 -1.51 0.00 0.00 179.97 179.17 1pqc n ARG 319 N -4.94 0.81 -2.55 0.20 1.74 -0.47 -4.84 116.66 106.61 1pqc n ARG 319 Ca -0.03 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.69 1pqc n ARG 319 Cb 0.03 -1.46 -0.04 0.00 -1.02 0.00 0.00 32.46 29.97 1pqc n ARG 319 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1pqc s TYR 320 N -2.00 3.20 -0.25 -1.55 5.04 -0.35 -1.52 117.35 119.91 1pqc s TYR 320 Ca 0.36 1.62 -0.02 0.00 -2.44 0.00 0.00 57.07 56.59 1pqc s TYR 320 Cb 0.16 -3.10 0.08 0.00 0.35 0.00 0.00 41.96 39.45 1pqc s TYR 320 CO 0.27 -0.67 0.06 1.21 -1.34 0.00 0.00 175.55 175.09 1pqc s ASN 321 N -1.69 3.43 0.22 4.32 2.47 -0.82 -4.96 114.94 117.90 1pqc s ASN 321 Ca 0.60 -1.19 -0.05 0.00 0.42 0.00 0.00 52.86 52.64 1pqc s ASN 321 Cb -0.20 -0.69 0.19 0.00 -1.45 0.00 0.00 41.25 39.10 1pqc s ASN 321 CO 0.25 -0.36 1.67 -0.74 -3.72 0.00 0.00 177.10 174.21 1pqc h HIS 322 N 8.19 0.98 -0.72 0.43 -0.00 -1.96 0.22 115.15 122.30 1pqc h HIS 322 Ca -0.16 -0.18 0.16 0.00 -0.00 0.00 0.00 60.37 60.20 1pqc h HIS 322 Cb 1.07 -0.25 -0.12 0.00 -0.00 0.00 0.00 27.41 28.10 1pqc h HIS 322 CO 0.32 0.92 0.02 0.93 -0.00 0.00 0.00 177.93 180.12 1pqc h GLU 323 N 0.81 0.12 0.00 5.26 5.08 -1.99 -3.21 114.58 120.65 1pqc h GLU 323 Ca 0.14 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1pqc h GLU 323 Cb 0.58 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1pqc h GLU 323 CO 0.04 0.08 -1.34 0.25 -1.00 0.00 0.00 179.01 177.04 1pqc n THR 324 N -5.31 0.00 -2.97 1.13 -2.24 -0.83 -5.02 114.28 99.04 1pqc n THR 324 Ca 0.12 -0.17 -0.22 0.00 -2.27 0.00 0.00 64.05 61.51 1pqc n THR 324 Cb 0.44 0.66 0.03 0.00 -2.10 0.00 0.00 70.33 69.36 1pqc n THR 324 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pqc n GLU 325 N -1.76 -4.67 -4.25 -0.78 4.71 0.70 -5.02 120.64 109.58 1pqc n GLU 325 Ca 0.01 0.89 -0.14 0.00 -0.01 0.00 0.00 57.16 57.92 1pqc n GLU 325 Cb 0.41 -5.69 -0.10 0.00 -1.01 0.00 0.00 31.44 25.05 1pqc n GLU 325 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1pqc s ILE 327 N -3.72 3.36 -0.49 0.00 1.01 -0.70 -1.94 121.20 118.72 1pqc s ILE 327 Ca 0.27 -1.18 -0.12 0.00 0.00 0.00 0.00 60.65 59.62 1pqc s ILE 327 Cb 0.06 -2.87 0.12 0.00 0.01 0.00 0.00 42.46 39.78 1pqc s ILE 327 CO 0.06 -0.07 0.40 -0.89 0.00 0.00 0.00 174.94 174.43 1pqc s THR 328 N 1.34 4.60 0.05 2.92 2.01 -0.58 -2.62 115.64 123.37 1pqc s THR 328 Ca -0.03 -1.63 -0.25 0.00 0.31 0.00 0.00 61.69 60.10 1pqc s THR 328 Cb -0.19 -3.97 -0.17 0.00 0.01 0.00 0.00 72.50 68.18 1pqc s THR 328 CO 0.00 -0.78 1.55 -0.26 -0.69 0.00 0.00 174.62 174.44 1pqc h PHE 329 N 8.61 -0.09 -2.16 4.92 -1.00 -1.72 -3.46 116.94 122.04 1pqc h PHE 329 Ca -0.25 -0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.52 1pqc h PHE 329 Cb 1.08 0.03 -0.00 0.00 3.61 0.00 0.00 35.95 40.67 1pqc h PHE 329 CO 0.67 0.10 0.01 1.47 -1.61 0.00 0.00 178.31 178.94 1pqc n LEU 330 N -5.05 0.00 -4.64 1.54 -0.00 -1.25 -5.02 117.00 102.58 1pqc n LEU 330 Ca -0.08 -0.31 -0.48 0.00 -0.00 0.00 0.00 56.01 55.14 1pqc n LEU 330 Cb 0.14 0.37 -0.05 0.00 -0.00 0.00 0.00 43.42 43.88 1pqc n LEU 330 CO 0.33 -0.09 1.06 0.29 -0.00 0.00 0.00 177.39 178.98 1pqc n LYS 331 N -0.06 1.77 -0.98 1.47 4.76 -1.26 -2.15 118.16 121.71 1pqc n LYS 331 Ca -0.01 0.64 0.00 0.00 -2.87 0.00 0.00 58.31 56.07 1pqc n LYS 331 Cb 0.07 -2.34 0.00 0.00 -1.84 0.00 0.00 35.03 30.92 1pqc n LYS 331 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1pqc n ASP 332 N 2.93 -3.40 -3.75 4.39 8.00 -1.26 -4.94 116.55 118.52 1pqc n ASP 332 Ca 0.17 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.38 1pqc n ASP 332 Cb 0.26 -1.37 -0.12 0.00 -0.02 0.00 0.00 41.12 39.87 1pqc n ASP 332 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1pqc s PHE 333 N -1.87 2.49 0.11 1.24 0.40 -0.92 -5.08 117.98 114.34 1pqc s PHE 333 Ca 0.00 -2.80 0.08 0.00 -0.60 0.00 0.00 56.93 53.61 1pqc s PHE 333 Cb 0.00 -2.10 -0.03 0.00 0.51 0.00 0.00 43.02 41.39 1pqc s PHE 333 CO 0.00 -0.71 -0.19 0.99 0.70 0.00 0.00 175.22 176.01 1pqc s THR 334 N -0.36 1.60 -0.05 0.64 2.01 -1.26 -1.99 115.64 116.23 1pqc s THR 334 Ca 0.23 -1.56 -0.02 0.00 0.31 0.00 0.00 61.69 60.65 1pqc s THR 334 Cb -0.13 -1.51 0.04 0.00 0.01 0.00 0.00 72.50 70.91 1pqc s THR 334 CO -0.09 -0.14 0.09 -0.31 -0.69 0.00 0.00 174.62 173.49 1pqc s TYR 335 N -1.34 -0.06 0.33 4.92 1.51 -1.08 -4.91 117.35 116.73 1pqc s TYR 335 Ca 0.06 0.36 0.06 0.00 -1.01 0.00 0.00 57.07 56.53 1pqc s TYR 335 Cb -0.09 -0.26 -0.01 0.00 -0.11 0.00 0.00 41.96 41.48 1pqc s TYR 335 CO 0.04 -0.17 0.47 -1.54 -1.11 0.00 0.00 175.55 173.24 1pqc s SER 336 N 1.63 6.03 0.57 2.29 1.04 -1.26 -1.72 113.70 122.28 1pqc s SER 336 Ca -0.03 -0.09 0.33 0.00 0.48 0.00 0.00 55.95 56.64 1pqc s SER 336 Cb -0.12 -1.38 1.41 0.00 0.10 0.00 0.00 66.02 66.02 1pqc s SER 336 CO -0.04 -0.39 1.72 0.11 0.98 0.00 0.00 173.24 175.62 1pqc h LYS 337 N 0.89 0.00 0.02 4.02 1.57 -1.98 -0.45 116.57 120.64 1pqc h LYS 337 Ca -0.47 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1pqc h LYS 337 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1pqc h LYS 337 CO 0.55 0.00 -0.01 -0.44 -0.57 0.00 0.00 179.45 178.98 1pqc h ASP 338 N 0.00 -0.02 -1.01 0.86 5.19 -1.95 -3.17 116.42 116.31 1pqc h ASP 338 Ca 0.45 -0.75 0.28 0.00 -0.62 0.00 0.00 57.03 56.39 1pqc h ASP 338 Cb 2.10 0.01 -0.13 0.00 0.18 0.00 0.00 39.33 41.49 1pqc h ASP 338 CO -0.00 0.79 0.60 0.44 -3.12 0.00 0.00 179.24 177.95 1pqc h ASP 339 N -0.89 0.59 0.09 6.45 3.32 -1.46 0.36 116.42 124.87 1pqc h ASP 339 Ca -0.00 0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1pqc h ASP 339 Cb 0.77 0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.39 1pqc h ASP 339 CO 0.00 0.01 -0.04 -0.26 -1.72 0.00 0.00 179.24 177.23 1pqc h PHE 340 N 0.46 -0.11 -0.90 4.55 -1.00 -1.55 -2.81 116.94 115.58 1pqc h PHE 340 Ca 0.68 -0.00 0.14 0.00 2.81 0.00 0.00 57.97 61.60 1pqc h PHE 340 Cb 1.45 0.04 -0.07 0.00 3.61 0.00 0.00 35.95 40.97 1pqc h PHE 340 CO -0.01 -0.01 0.58 1.25 -1.61 0.00 0.00 178.31 178.51 1pqc h HIS 341 N -0.18 0.85 0.00 -0.55 2.76 -0.94 -1.87 115.15 115.23 1pqc h HIS 341 Ca -0.01 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.09 1pqc h HIS 341 Cb 0.14 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.82 1pqc h HIS 341 CO -0.05 0.32 -0.42 0.00 -1.30 0.00 0.00 177.93 176.48 1pqc h ARG 342 N 0.73 0.00 0.00 5.26 3.08 -1.04 -2.59 114.38 119.82 1pqc h ARG 342 Ca 0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.50 1pqc h ARG 342 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1pqc h ARG 342 CO -0.21 0.42 0.00 0.00 -1.07 0.00 0.00 179.97 179.11 1pqc n ALA 343 N -2.44 2.50 0.00 0.04 0.00 -0.71 -4.73 120.51 115.17 1pqc n ALA 343 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1pqc n ALA 343 Cb 0.45 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1pqc n ALA 343 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pqc n GLY 344 N 0.62 0.25 3.71 0.00 0.00 -0.98 -4.07 105.19 104.72 1pqc n GLY 344 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1pqc n GLY 344 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pqc s LEU 345 N 0.00 4.35 0.72 0.99 1.43 -1.18 -4.99 118.68 120.00 1pqc s LEU 345 Ca 0.00 2.01 -0.16 0.00 -1.03 0.00 0.00 54.13 54.95 1pqc s LEU 345 Cb 0.00 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 1pqc s LEU 345 CO 0.00 -0.52 0.32 0.00 0.23 0.00 0.00 176.35 176.38 1pqc n GLN 346 N 4.26 0.22 -0.23 1.70 6.02 -1.26 -4.37 117.38 123.71 1pqc n GLN 346 Ca 0.10 0.11 -0.08 0.00 -0.01 0.00 0.00 57.00 57.12 1pqc n GLN 346 Cb 0.46 -1.64 0.04 0.00 1.02 0.00 0.00 30.24 30.11 1pqc n GLN 346 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1pqc h VAL 347 N -0.40 1.25 -0.66 5.09 2.07 -1.99 -2.73 116.25 118.89 1pqc h VAL 347 Ca -0.45 -0.88 0.19 0.00 0.82 0.00 0.00 66.70 66.38 1pqc h VAL 347 Cb 1.36 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1pqc h VAL 347 CO 0.41 0.34 0.55 -0.33 0.02 0.00 0.00 177.57 178.56 1pqc h GLU 348 N 0.94 0.00 0.01 1.57 3.07 -1.99 -2.93 114.58 115.25 1pqc h GLU 348 Ca 0.21 0.00 -0.41 0.00 -0.50 0.00 0.00 59.36 58.66 1pqc h GLU 348 Cb 0.32 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.16 1pqc h GLU 348 CO -0.00 0.00 -2.41 0.34 -1.40 0.00 0.00 179.01 175.53 1pqc n PHE 349 N -4.01 0.15 -0.05 4.33 7.35 -1.19 -4.63 117.46 119.40 1pqc n PHE 349 Ca 0.13 0.04 -0.10 0.00 -0.76 0.00 0.00 57.45 56.76 1pqc n PHE 349 Cb 0.80 -1.02 -0.03 0.00 0.35 0.00 0.00 39.48 39.58 1pqc n PHE 349 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1pqc h ILE 350 N -0.38 1.08 -0.13 -2.13 2.04 -1.30 -2.51 117.51 114.18 1pqc h ILE 350 Ca -0.60 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 1pqc h ILE 350 Cb 1.79 0.80 -0.00 0.00 -0.74 0.00 0.00 36.82 38.67 1pqc h ILE 350 CO -0.20 0.07 -0.01 0.78 0.00 0.00 0.00 178.15 178.79 1pqc h ASN 351 N 0.28 0.23 -0.91 1.72 2.35 -1.83 -1.63 115.58 115.78 1pqc h ASN 351 Ca 0.08 -0.34 0.23 0.00 -0.55 0.00 0.00 56.30 55.72 1pqc h ASN 351 Cb 0.00 -0.06 -0.13 0.00 0.05 0.00 0.00 38.32 38.18 1pqc h ASN 351 CO -0.02 0.52 0.41 -0.65 -1.65 0.00 0.00 177.43 176.05 1pqc h PRO 352 N -0.05 0.38 -0.50 0.81 0.11 -1.82 0.95 132.00 131.88 1pqc h PRO 352 Ca 0.03 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.15 1pqc h PRO 352 Cb 0.41 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.39 1pqc h PRO 352 CO 0.01 0.25 0.28 0.82 -0.21 0.00 0.00 178.00 179.15 1pqc h ILE 353 N 0.40 1.01 0.08 4.15 1.08 -0.86 -0.10 117.51 123.27 1pqc h ILE 353 Ca 0.58 -0.19 -0.26 0.00 -0.39 0.00 0.00 64.86 64.61 1pqc h ILE 353 Cb 1.13 0.41 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 1pqc h ILE 353 CO -0.54 0.10 -1.22 -0.26 -0.69 0.00 0.00 178.15 175.54 1pqc h PHE 354 N 0.55 0.31 0.12 1.37 -1.00 -0.70 -2.40 116.94 115.18 1pqc h PHE 354 Ca 0.21 -0.23 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 1pqc h PHE 354 Cb 0.07 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.62 1pqc h PHE 354 CO -0.08 1.19 -0.06 0.93 -1.61 0.00 0.00 178.31 178.68 1pqc h GLU 355 N 0.05 -0.15 -0.80 1.51 3.07 -0.70 -1.58 114.58 115.97 1pqc h GLU 355 Ca -0.11 0.01 0.15 0.00 -0.50 0.00 0.00 59.36 58.91 1pqc h GLU 355 Cb 1.91 0.03 -0.10 0.00 -0.84 0.00 0.00 28.75 29.76 1pqc h GLU 355 CO 0.17 0.07 0.36 0.35 -1.40 0.00 0.00 179.01 178.56 1pqc h PHE 356 N -0.36 0.62 -0.40 4.33 3.57 -1.08 -1.14 116.94 122.48 1pqc h PHE 356 Ca -0.02 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.41 1pqc h PHE 356 Cb 0.29 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1pqc h PHE 356 CO -0.01 0.10 -0.19 0.77 -2.23 0.00 0.00 178.31 176.75 1pqc h SER 357 N 0.50 0.87 1.83 0.41 0.02 -1.21 -0.81 113.55 115.16 1pqc h SER 357 Ca 0.45 -0.40 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1pqc h SER 357 Cb 0.68 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1pqc h SER 357 CO -0.40 1.08 0.00 0.08 -1.14 0.00 0.00 176.83 176.45 1pqc h ARG 358 N 0.65 0.00 0.02 3.45 0.11 -1.15 -2.44 114.38 115.03 1pqc h ARG 358 Ca 0.09 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.17 1pqc h ARG 358 Cb 0.75 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.83 1pqc h ARG 358 CO 0.06 0.00 -0.01 0.00 0.10 0.00 0.00 179.97 180.12 1pqc h ALA 359 N 2.04 -0.03 -0.36 0.08 0.00 -1.07 -2.95 119.26 116.97 1pqc h ALA 359 Ca 0.00 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.77 1pqc h ALA 359 Cb 0.91 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1pqc h ALA 359 CO 0.00 -0.33 0.24 0.52 0.00 0.00 0.00 179.25 179.68 1pqc h MET 360 N -0.39 0.31 -0.35 0.00 2.86 -0.99 -1.33 114.93 115.05 1pqc h MET 360 Ca -0.00 -0.02 -0.16 0.00 -2.06 0.00 0.00 59.70 57.46 1pqc h MET 360 Cb 0.37 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 1pqc h MET 360 CO 0.00 0.21 -0.41 -0.09 1.06 0.00 0.00 176.91 177.68 1pqc h ARG 361 N 0.32 0.89 0.00 1.72 9.65 -1.47 -2.61 114.38 122.88 1pqc h ARG 361 Ca 0.15 -0.49 0.00 0.00 -1.10 0.00 0.00 59.98 58.54 1pqc h ARG 361 Cb 0.20 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 1pqc h ARG 361 CO -0.03 1.14 0.00 0.00 2.80 0.00 0.00 179.97 183.87 1pqc h ARG 362 N 0.69 0.00 0.00 0.20 3.08 -1.06 0.15 114.38 117.43 1pqc h ARG 362 Ca 0.05 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 1pqc h ARG 362 Cb 1.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 1pqc h ARG 362 CO 0.10 0.00 -0.47 -0.07 -1.07 0.00 0.00 179.97 178.46 1pqc h LEU 363 N 0.00 0.00 -1.35 3.04 3.38 -1.19 -3.48 115.31 115.70 1pqc h LEU 363 Ca 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.65 1pqc h LEU 363 Cb 0.24 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.14 1pqc h LEU 363 CO 0.00 0.47 -0.66 0.61 0.09 0.00 0.00 178.44 178.95 1pqc n GLY 364 N 0.75 -0.33 3.78 0.83 0.00 0.52 -4.95 105.19 105.79 1pqc n GLY 364 Ca 0.01 0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1pqc n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pqc s LEU 365 N -6.26 3.46 0.00 0.99 1.43 -1.26 -5.04 118.68 111.99 1pqc s LEU 365 Ca 0.22 1.94 0.03 0.00 -1.03 0.00 0.00 54.13 55.28 1pqc s LEU 365 Cb -0.10 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 41.60 1pqc s LEU 365 CO 0.66 -1.42 0.21 -0.90 0.23 0.00 0.00 176.35 175.13 1pqc n ASP 366 N -2.19 1.70 -0.03 2.29 5.68 -1.26 -4.93 116.55 117.82 1pqc n ASP 366 Ca 0.10 -1.86 -0.08 0.00 -0.50 0.00 0.00 54.79 52.45 1pqc n ASP 366 Cb 0.52 -0.04 0.10 0.00 -1.14 0.00 0.00 41.12 40.56 1pqc n ASP 366 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1pqc h ASP 367 N 0.27 0.66 -0.18 -1.12 3.32 -1.99 -2.15 116.42 115.22 1pqc h ASP 367 Ca -0.16 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 56.54 1pqc h ASP 367 Cb 0.59 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1pqc h ASP 367 CO 0.24 0.96 -0.11 0.00 -1.72 0.00 0.00 179.24 178.61 1pqc h ALA 368 N 1.08 1.19 0.11 3.45 0.00 -1.96 -2.20 119.26 120.93 1pqc h ALA 368 Ca 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1pqc h ALA 368 Cb 0.86 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1pqc h ALA 368 CO 0.07 0.52 -0.05 0.93 0.00 0.00 0.00 179.25 180.72 1pqc h GLU 369 N 0.52 -0.14 -0.62 0.00 5.08 -1.88 -2.03 114.58 115.51 1pqc h GLU 369 Ca 0.09 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.59 1pqc h GLU 369 Cb 0.51 0.03 -0.11 0.00 0.50 0.00 0.00 28.75 29.68 1pqc h GLU 369 CO 0.03 0.36 -0.10 1.88 -1.00 0.00 0.00 179.01 180.18 1pqc h TYR 370 N -0.82 -0.23 -0.31 4.33 -1.99 -1.47 -0.18 116.97 116.30 1pqc h TYR 370 Ca -0.01 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1pqc h TYR 370 Cb 0.57 0.20 -0.02 0.00 2.00 0.00 0.00 36.73 39.48 1pqc h TYR 370 CO 0.11 -0.24 0.20 0.00 -0.00 0.00 0.00 178.16 178.23 1pqc h ALA 371 N 1.60 0.40 -0.55 3.88 0.00 -1.40 -1.76 119.26 121.43 1pqc h ALA 371 Ca 0.31 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1pqc h ALA 371 Cb 0.48 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1pqc h ALA 371 CO -0.60 -0.12 0.14 -0.07 0.00 0.00 0.00 179.25 178.59 1pqc h LEU 372 N 0.41 0.78 -1.04 0.00 3.38 -0.95 -1.46 115.31 116.44 1pqc h LEU 372 Ca 0.11 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1pqc h LEU 372 Cb -0.02 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1pqc h LEU 372 CO -0.02 0.76 0.00 -0.07 0.09 0.00 0.00 178.44 179.20 1pqc h LEU 373 N 0.81 0.65 -0.33 1.67 3.38 -0.66 -0.82 115.31 120.02 1pqc h LEU 373 Ca 0.18 -0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 1pqc h LEU 373 Cb 0.29 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1pqc h LEU 373 CO -0.00 0.72 -0.44 0.40 0.09 0.00 0.00 178.44 179.21 1pqc h ILE 374 N 0.65 1.28 -0.75 1.22 2.04 -0.80 -0.33 117.51 120.82 1pqc h ILE 374 Ca 0.13 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 1pqc h ILE 374 Cb 0.40 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.97 1pqc h ILE 374 CO 0.02 0.53 0.44 0.00 0.00 0.00 0.00 178.15 179.14 1pqc h ALA 375 N 0.72 0.96 -0.44 1.87 0.00 -0.66 -1.67 119.26 120.03 1pqc h ALA 375 Ca 0.04 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1pqc h ALA 375 Cb 1.04 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1pqc h ALA 375 CO 0.10 0.43 -0.12 0.82 0.00 0.00 0.00 179.25 180.49 1pqc h ILE 376 N 1.03 1.26 -0.22 0.00 2.04 -0.90 -2.58 117.51 118.14 1pqc h ILE 376 Ca 0.27 -1.19 -0.10 0.00 1.00 0.00 0.00 64.86 64.84 1pqc h ILE 376 Cb -0.02 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1pqc h ILE 376 CO -0.05 0.41 -0.28 -1.13 0.00 0.00 0.00 178.15 177.10 1pqc h ASN 377 N 0.73 0.44 -0.23 1.72 -0.73 -0.74 -2.89 115.58 113.87 1pqc h ASN 377 Ca 0.12 -0.15 -0.15 0.00 1.87 0.00 0.00 56.30 57.99 1pqc h ASN 377 Cb 0.61 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.07 1pqc h ASN 377 CO 0.04 0.71 -0.41 0.40 -0.37 0.00 0.00 177.43 177.80 1pqc h ILE 378 N 0.38 1.28 -1.88 2.57 2.04 -0.95 -3.25 117.51 117.70 1pqc h ILE 378 Ca 0.05 -1.59 -0.74 0.00 1.00 0.00 0.00 64.86 63.58 1pqc h ILE 378 Cb 0.69 1.47 -0.25 0.00 -0.74 0.00 0.00 36.82 37.99 1pqc h ILE 378 CO 0.05 0.52 1.07 0.49 0.00 0.00 0.00 178.15 180.28 1pqc n PHE 379 N -4.04 2.70 -3.13 1.37 3.01 -1.01 -4.82 117.46 111.54 1pqc n PHE 379 Ca -0.02 -2.38 -0.43 0.00 1.01 0.00 0.00 57.45 55.63 1pqc n PHE 379 Cb 0.54 -1.27 -0.06 0.00 -0.01 0.00 0.00 39.48 38.68 1pqc n PHE 379 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1pqc s SER 380 N -0.85 6.26 0.47 4.37 0.01 -1.23 -4.44 113.70 118.29 1pqc s SER 380 Ca 0.49 -0.70 0.30 0.00 1.31 0.00 0.00 55.95 57.35 1pqc s SER 380 Cb 0.34 -2.30 1.63 0.00 0.21 0.00 0.00 66.02 65.90 1pqc s SER 380 CO -0.28 -0.86 1.91 0.00 0.41 0.00 0.00 173.24 174.42 1pqc h ALA 381 N 8.97 1.03 -0.67 1.44 0.00 -1.85 -3.20 119.26 124.98 1pqc h ALA 381 Ca -0.27 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.43 1pqc h ALA 381 Cb 1.09 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.76 1pqc h ALA 381 CO 0.94 -0.03 0.23 -0.40 0.00 0.00 0.00 179.25 179.99 1pqc n ASP 382 N -2.58 4.47 -4.82 0.00 5.75 -1.26 -4.68 116.55 113.43 1pqc n ASP 382 Ca -0.02 -3.28 -0.32 0.00 -0.01 0.00 0.00 54.79 51.16 1pqc n ASP 382 Cb 0.08 -0.72 0.02 0.00 -1.03 0.00 0.00 41.12 39.47 1pqc n ASP 382 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1pqc s ARG 383 N -3.02 3.25 0.62 0.11 1.81 -1.21 -4.99 118.95 115.52 1pqc s ARG 383 Ca 0.53 1.05 -0.18 0.00 -1.72 0.00 0.00 55.73 55.41 1pqc s ARG 383 Cb 0.43 -2.03 -0.03 0.00 -0.45 0.00 0.00 34.95 32.87 1pqc s ARG 383 CO 0.12 -0.85 1.13 -2.30 -0.68 0.00 0.00 175.30 172.72 1pqc n PRO 384 N -2.46 1.05 -1.32 3.54 -0.02 -1.26 -3.53 135.00 131.00 1pqc n PRO 384 Ca 0.08 0.41 -0.11 0.00 -2.02 0.00 0.00 63.50 61.86 1pqc n PRO 384 Cb 0.53 -2.35 -0.05 0.00 -0.02 0.00 0.00 33.50 31.61 1pqc n PRO 384 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pqc n ASN 385 N -1.27 -5.22 -4.64 2.55 3.02 -1.26 -4.85 115.26 103.58 1pqc n ASN 385 Ca 0.14 0.27 -0.43 0.00 -0.03 0.00 0.00 54.58 54.53 1pqc n ASN 385 Cb 0.47 -3.69 -0.02 0.00 -0.61 0.00 0.00 39.78 35.94 1pqc n ASN 385 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1pqc s VAL 386 N -2.10 4.51 0.13 2.41 1.01 -1.23 -4.82 120.40 120.30 1pqc s VAL 386 Ca 0.00 1.75 0.02 0.00 0.00 0.00 0.00 61.98 63.75 1pqc s VAL 386 Cb 0.00 -4.38 -0.20 0.00 0.00 0.00 0.00 36.38 31.79 1pqc s VAL 386 CO 0.00 -0.43 1.28 1.56 0.00 0.00 0.00 175.10 177.51 1pqc h GLN 387 N 8.07 0.16 -2.21 2.72 4.20 -1.93 -3.38 115.11 122.73 1pqc h GLN 387 Ca -0.21 -0.23 -0.60 0.00 0.06 0.00 0.00 58.65 57.68 1pqc h GLN 387 Cb 1.06 0.08 -0.42 0.00 0.30 0.00 0.00 27.48 28.50 1pqc h GLN 387 CO 1.03 1.04 -0.59 0.39 -0.67 0.00 0.00 178.83 180.03 1pqc n GLU 388 N -3.54 2.70 0.08 1.46 1.02 -1.26 -4.93 120.64 116.17 1pqc n GLU 388 Ca -0.04 -4.72 0.01 0.00 -0.02 0.00 0.00 57.16 52.39 1pqc n GLU 388 Cb 0.91 -2.26 0.34 0.00 -0.02 0.00 0.00 31.44 30.41 1pqc n GLU 388 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1pqc h PRO 389 N 3.94 0.32 -0.60 3.49 0.13 -1.83 -2.40 132.00 135.05 1pqc h PRO 389 Ca 0.19 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1pqc h PRO 389 Cb 0.63 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.69 1pqc h PRO 389 CO 0.84 0.46 0.35 0.78 -0.23 0.00 0.00 178.00 180.20 1pqc h GLY 390 N 0.82 0.89 1.65 1.56 0.00 -1.92 -0.85 103.07 105.21 1pqc h GLY 390 Ca 0.06 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 1pqc h GLY 390 CO 0.02 0.37 -0.34 3.21 0.00 0.00 0.00 176.54 179.80 1pqc h ARG 391 N 0.82 0.40 -0.25 4.80 3.08 -1.90 -2.49 114.38 118.84 1pqc h ARG 391 Ca 0.22 -0.18 -0.17 0.00 0.07 0.00 0.00 59.98 59.92 1pqc h ARG 391 Cb 0.01 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1pqc h ARG 391 CO -0.04 0.70 -0.49 0.28 -1.07 0.00 0.00 179.97 179.35 1pqc h VAL 392 N 0.34 1.29 -0.22 2.04 2.07 -1.27 -2.52 116.25 117.99 1pqc h VAL 392 Ca 0.04 -1.69 -0.07 0.00 0.82 0.00 0.00 66.70 65.80 1pqc h VAL 392 Cb 0.77 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 1pqc h VAL 392 CO 0.06 0.54 -0.17 -0.08 0.02 0.00 0.00 177.57 177.94 1pqc h GLU 393 N 0.53 0.37 -0.21 1.57 4.81 -1.02 -1.65 114.58 118.98 1pqc h GLU 393 Ca 0.01 -0.11 -0.13 0.00 -0.13 0.00 0.00 59.36 59.00 1pqc h GLU 393 Cb 1.10 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1pqc h GLU 393 CO 0.11 0.54 -0.43 0.00 -0.73 0.00 0.00 179.01 178.50 1pqc h ALA 394 N 1.48 0.86 -0.37 2.92 0.00 -1.41 -2.48 119.26 120.26 1pqc h ALA 394 Ca 0.06 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 1pqc h ALA 394 Cb 0.51 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1pqc h ALA 394 CO 0.03 0.65 -0.13 -0.07 0.00 0.00 0.00 179.25 179.72 1pqc h LEU 395 N 0.41 0.65 -0.42 0.00 3.38 -0.95 -3.11 115.31 115.28 1pqc h LEU 395 Ca 0.03 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1pqc h LEU 395 Cb 0.93 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1pqc h LEU 395 CO 0.08 0.81 0.26 -0.61 0.09 0.00 0.00 178.44 179.07 1pqc h GLN 396 N 0.60 0.56 -0.67 1.13 4.15 -1.03 -3.34 115.11 116.51 1pqc h GLN 396 Ca 0.10 -0.04 0.10 0.00 0.77 0.00 0.00 58.65 59.58 1pqc h GLN 396 Cb 0.58 -0.12 -0.12 0.00 0.21 0.00 0.00 27.48 28.03 1pqc h GLN 396 CO 0.04 0.39 -0.41 0.37 -1.93 0.00 0.00 178.83 177.29 1pqc h GLN 397 N 0.55 -0.16 -0.25 1.69 4.15 -1.38 -0.38 115.11 119.34 1pqc h GLN 397 Ca 0.15 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.57 1pqc h GLN 397 Cb -0.03 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1pqc h GLN 397 CO -0.03 -0.11 0.09 -1.00 -1.93 0.00 0.00 178.83 175.85 1pqc h PRO 398 N -0.16 0.35 -0.31 -2.39 0.13 -1.73 -1.03 132.00 126.85 1pqc h PRO 398 Ca 0.22 -0.04 -0.15 0.00 -0.87 0.00 0.00 66.00 65.16 1pqc h PRO 398 Cb 0.56 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.62 1pqc h PRO 398 CO -0.75 0.30 -0.39 1.88 -0.23 0.00 0.00 178.00 178.81 1pqc h TYR 399 N 0.35 1.00 -0.15 1.56 -1.99 -1.26 0.54 116.97 117.03 1pqc h TYR 399 Ca 0.09 -0.32 0.03 0.00 2.00 0.00 0.00 58.73 60.52 1pqc h TYR 399 Cb 0.10 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 38.60 1pqc h TYR 399 CO 0.00 1.12 -0.02 0.28 -0.00 0.00 0.00 178.16 179.54 1pqc h VAL 400 N 0.59 0.87 -0.75 -2.88 2.07 -1.04 0.60 116.25 115.72 1pqc h VAL 400 Ca 0.04 -0.01 0.15 0.00 0.82 0.00 0.00 66.70 67.70 1pqc h VAL 400 Cb 0.99 0.85 -0.10 0.00 -1.52 0.00 0.00 31.29 31.51 1pqc h VAL 400 CO 0.09 0.00 0.27 -0.33 0.02 0.00 0.00 177.57 177.62 1pqc h GLU 401 N 0.02 0.37 -0.23 1.57 5.08 -1.11 0.29 114.58 120.57 1pqc h GLU 401 Ca 0.07 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 1pqc h GLU 401 Cb 0.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1pqc h GLU 401 CO -0.13 0.25 -0.44 0.00 -1.00 0.00 0.00 179.01 177.68 1pqc h ALA 402 N 1.57 0.80 -0.27 3.43 0.00 -0.34 -1.23 119.26 123.22 1pqc h ALA 402 Ca 0.42 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1pqc h ALA 402 Cb 0.67 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1pqc h ALA 402 CO -0.44 0.66 -0.26 1.25 0.00 0.00 0.00 179.25 180.46 1pqc h LEU 403 N 0.47 0.69 0.82 0.00 5.85 -0.46 -0.96 115.31 121.73 1pqc h LEU 403 Ca 0.03 -0.47 -0.04 0.00 0.84 0.00 0.00 57.88 58.24 1pqc h LEU 403 Cb 0.96 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1pqc h LEU 403 CO 0.09 1.02 -0.44 0.25 -0.34 0.00 0.00 178.44 179.02 1pqc h LEU 404 N 0.37 -1.06 -0.77 2.25 5.85 -0.81 0.40 115.31 121.54 1pqc h LEU 404 Ca 0.04 0.05 0.18 0.00 0.84 0.00 0.00 57.88 58.99 1pqc h LEU 404 Cb 0.83 0.29 -0.12 0.00 0.37 0.00 0.00 40.66 42.02 1pqc h LEU 404 CO 0.07 -0.71 0.12 0.28 -0.34 0.00 0.00 178.44 177.86 1pqc h SER 405 N -1.16 -0.13 -0.49 1.25 0.02 -1.30 -1.76 113.55 109.98 1pqc h SER 405 Ca -0.11 0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1pqc h SER 405 Cb 0.90 0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.69 1pqc h SER 405 CO 0.16 -0.12 0.11 0.22 -1.14 0.00 0.00 176.83 176.06 1pqc h TYR 406 N 0.19 0.84 0.00 3.45 3.20 -0.44 -2.33 116.97 121.89 1pqc h TYR 406 Ca 0.44 -0.11 -0.12 0.00 3.14 0.00 0.00 58.73 62.09 1pqc h TYR 406 Cb 0.80 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 1pqc h TYR 406 CO -0.32 0.76 -0.57 1.79 -1.64 0.00 0.00 178.16 178.17 1pqc h THR 407 N 0.68 1.15 0.28 1.81 1.35 -0.71 -1.48 112.91 115.99 1pqc h THR 407 Ca 0.15 -2.17 -0.01 0.00 -0.55 0.00 0.00 66.41 63.83 1pqc h THR 407 Cb 0.35 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 1pqc h THR 407 CO 0.00 0.56 -0.13 -0.09 -0.25 0.00 0.00 175.52 175.61 1pqc h ARG 408 N 0.00 -0.36 0.79 4.72 2.43 -1.02 -2.77 114.38 118.17 1pqc h ARG 408 Ca -0.01 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 1pqc h ARG 408 Cb 1.22 0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.86 1pqc h ARG 408 CO 0.07 -0.19 -0.38 0.82 -1.51 0.00 0.00 179.97 178.78 1pqc h ILE 409 N -0.43 0.06 -0.08 1.20 2.04 -1.35 -2.13 117.51 116.82 1pqc h ILE 409 Ca -0.04 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.67 1pqc h ILE 409 Cb 0.33 0.08 -0.06 0.00 -0.74 0.00 0.00 36.82 36.42 1pqc h ILE 409 CO 0.06 0.01 -0.35 0.50 0.00 0.00 0.00 178.15 178.36 1pqc h LYS 410 N -1.24 -0.44 -3.27 2.37 3.64 -1.35 -3.26 116.57 113.00 1pqc h LYS 410 Ca -0.11 0.03 -0.63 0.00 -1.27 0.00 0.00 60.65 58.67 1pqc h LYS 410 Cb 0.82 0.10 -0.41 0.00 -0.41 0.00 0.00 32.23 32.34 1pqc h LYS 410 CO 0.18 -0.30 -0.64 1.03 -2.27 0.00 0.00 179.45 177.45 1pqc s ARG 411 N -5.97 1.91 0.38 1.90 1.81 -1.05 -4.97 118.95 112.98 1pqc s ARG 411 Ca -0.15 -2.61 0.11 0.00 -1.72 0.00 0.00 55.73 51.36 1pqc s ARG 411 Cb 0.10 -3.15 0.77 0.00 -0.45 0.00 0.00 34.95 32.21 1pqc s ARG 411 CO 0.65 -1.14 1.88 -1.00 -0.68 0.00 0.00 175.30 175.01 1pqc h PRO 412 N 6.39 0.13 -0.78 3.54 0.13 -1.43 -3.20 132.00 136.77 1pqc h PRO 412 Ca -0.04 -0.04 -0.46 0.00 -0.87 0.00 0.00 66.00 64.60 1pqc h PRO 412 Cb 0.88 -0.01 -0.26 0.00 0.13 0.00 0.00 31.00 31.74 1pqc h PRO 412 CO 0.66 0.37 0.35 1.04 -0.23 0.00 0.00 178.00 180.18 1pqc n GLN 413 N -4.21 2.34 -3.42 0.86 3.00 -1.26 -4.68 117.38 110.02 1pqc n GLN 413 Ca -0.01 -3.23 -0.27 0.00 -0.01 0.00 0.00 57.00 53.47 1pqc n GLN 413 Cb 0.33 -2.10 -0.11 0.00 0.00 0.00 0.00 30.24 28.35 1pqc n GLN 413 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1pqc s ASP 414 N -2.00 2.24 0.31 1.08 2.15 -1.21 -5.01 116.67 114.23 1pqc s ASP 414 Ca 0.55 -2.49 0.17 0.00 0.43 0.00 0.00 52.55 51.20 1pqc s ASP 414 Cb 0.46 -0.34 0.20 0.00 -0.30 0.00 0.00 42.92 42.94 1pqc s ASP 414 CO 0.04 -0.25 1.51 1.56 -0.17 0.00 0.00 175.17 177.86 1pqc h GLN 415 N 6.47 0.00 0.00 4.34 4.20 -1.84 -3.18 115.11 125.10 1pqc h GLN 415 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1pqc h GLN 415 Cb 0.95 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.73 1pqc h GLN 415 CO 0.30 0.44 -0.32 1.28 -0.67 0.00 0.00 178.83 179.86 1pqc n LEU 416 N -3.25 0.35 -0.11 1.46 4.77 -1.26 -4.13 117.00 114.83 1pqc n LEU 416 Ca 0.02 0.21 -0.09 0.00 -0.03 0.00 0.00 56.01 56.12 1pqc n LEU 416 Cb 0.68 -0.34 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 1pqc n LEU 416 CO 0.39 0.06 0.60 -0.09 -1.33 0.00 0.00 177.39 177.02 1pqc h ARG 417 N 0.00 -0.31 0.04 3.23 2.43 -1.96 -1.05 114.38 116.76 1pqc h ARG 417 Ca 0.00 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1pqc h ARG 417 Cb 0.52 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1pqc h ARG 417 CO 0.00 -0.20 -0.02 0.35 -1.51 0.00 0.00 179.97 178.59 1pqc h PHE 418 N -0.32 -0.05 -0.89 2.20 3.57 -1.81 -1.76 116.94 117.88 1pqc h PHE 418 Ca 0.14 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.85 1pqc h PHE 418 Cb 0.57 0.02 -0.12 0.00 2.79 0.00 0.00 35.95 39.21 1pqc h PHE 418 CO -0.57 0.16 0.43 -1.35 -2.23 0.00 0.00 178.31 174.74 1pqc h PRO 419 N -0.25 0.47 -0.67 6.41 0.11 -1.76 -1.78 132.00 134.54 1pqc h PRO 419 Ca -0.01 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 1pqc h PRO 419 Cb 0.23 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.20 1pqc h PRO 419 CO 0.01 0.31 0.24 0.00 -0.21 0.00 0.00 178.00 178.35 1pqc h ARG 420 N 0.48 1.01 -0.14 1.05 3.08 -0.43 -1.33 114.38 118.10 1pqc h ARG 420 Ca 0.54 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.40 1pqc h ARG 420 Cb 0.97 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 1pqc h ARG 420 CO -0.48 0.84 0.03 0.52 -1.07 0.00 0.00 179.97 179.82 1pqc h MET 421 N 0.98 0.22 -0.91 0.04 2.86 -0.53 -2.80 114.93 114.79 1pqc h MET 421 Ca 0.22 -0.05 0.03 0.00 -2.06 0.00 0.00 59.70 57.84 1pqc h MET 421 Cb 0.23 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.81 1pqc h MET 421 CO -0.01 0.37 0.59 -0.07 1.06 0.00 0.00 176.91 178.85 1pqc h LEU 422 N 0.02 0.98 -2.37 1.22 3.38 -1.04 -2.13 115.31 115.37 1pqc h LEU 422 Ca 0.04 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.01 1pqc h LEU 422 Cb 0.25 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1pqc h LEU 422 CO 0.00 0.68 0.03 0.24 0.09 0.00 0.00 178.44 179.48 1pqc h MET 423 N 1.15 0.00 -0.10 1.13 2.86 -0.99 0.67 114.93 119.65 1pqc h MET 423 Ca 0.36 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.90 1pqc h MET 423 Cb -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1pqc h MET 423 CO -0.12 0.00 -0.41 0.87 1.06 0.00 0.00 176.91 178.31 1pqc h LYS 424 N 0.00 0.21 -0.87 1.72 1.79 -1.22 -2.33 116.57 115.87 1pqc h LYS 424 Ca 0.01 -0.10 0.12 0.00 -2.18 0.00 0.00 60.65 58.51 1pqc h LYS 424 Cb 0.07 -0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.65 1pqc h LYS 424 CO -0.00 0.60 0.56 -0.07 -1.08 0.00 0.00 179.45 179.46 1pqc h LEU 425 N 0.18 0.68 -0.21 2.94 3.38 -0.87 0.46 115.31 121.87 1pqc h LEU 425 Ca 0.02 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1pqc h LEU 425 Cb 0.81 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1pqc h LEU 425 CO 0.06 0.37 0.12 0.58 0.09 0.00 0.00 178.44 179.67 1pqc h VAL 426 N 0.74 1.09 -0.49 1.22 2.07 -1.42 -3.03 116.25 116.44 1pqc h VAL 426 Ca 0.42 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.74 1pqc h VAL 426 Cb 0.59 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1pqc h VAL 426 CO -0.18 0.09 0.27 0.28 0.02 0.00 0.00 177.57 178.05 1pqc h SER 427 N 0.25 0.41 -0.16 0.57 0.02 -0.93 -2.50 113.55 111.21 1pqc h SER 427 Ca 0.08 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.09 1pqc h SER 427 Cb 0.04 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1pqc h SER 427 CO -0.01 0.29 0.13 -0.07 -1.14 0.00 0.00 176.83 176.02 1pqc h LEU 428 N 0.53 0.00 -0.05 5.07 3.38 -0.83 -0.60 115.31 122.81 1pqc h LEU 428 Ca 0.21 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1pqc h LEU 428 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1pqc h LEU 428 CO -0.12 0.00 -0.07 0.03 0.09 0.00 0.00 178.44 178.37 1pqc h ARG 429 N 0.00 0.13 -0.99 1.13 2.47 -1.36 -0.86 114.38 114.90 1pqc h ARG 429 Ca 0.08 -0.08 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 1pqc h ARG 429 Cb 0.33 0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 28.60 1pqc h ARG 429 CO -0.00 0.62 0.65 1.15 0.56 0.00 0.00 179.97 182.95 1pqc h THR 430 N -0.35 1.23 -0.50 2.04 2.02 -1.37 -3.06 112.91 112.92 1pqc h THR 430 Ca 0.01 -0.45 -0.07 0.00 0.77 0.00 0.00 66.41 66.67 1pqc h THR 430 Cb 0.61 -0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 1pqc h THR 430 CO 0.02 0.24 0.03 -0.07 0.37 0.00 0.00 175.52 176.10 1pqc h LEU 431 N 1.31 0.78 -0.89 2.58 4.07 -0.97 -2.06 115.31 120.12 1pqc h LEU 431 Ca 0.37 -0.18 0.06 0.00 0.08 0.00 0.00 57.88 58.21 1pqc h LEU 431 Cb -0.11 -0.21 -0.06 0.00 1.08 0.00 0.00 40.66 41.36 1pqc h LEU 431 CO -0.09 0.82 0.56 -1.28 -1.08 0.00 0.00 178.44 177.38 1pqc h SER 432 N 0.76 0.90 -0.51 -0.43 0.87 -1.06 -1.26 113.55 112.83 1pqc h SER 432 Ca 0.15 0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.61 1pqc h SER 432 Cb 0.42 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1pqc h SER 432 CO 0.02 0.59 -0.12 0.28 -0.53 0.00 0.00 176.83 177.07 1pqc h SER 433 N 1.04 0.98 -0.07 6.23 0.02 -1.39 -1.83 113.55 118.54 1pqc h SER 433 Ca 0.38 -0.36 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1pqc h SER 433 Cb 0.14 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1pqc h SER 433 CO -0.16 1.11 0.04 0.58 -1.14 0.00 0.00 176.83 177.26 1pqc h VAL 434 N 0.84 1.04 -0.16 2.27 2.07 -1.08 -2.19 116.25 119.03 1pqc h VAL 434 Ca 0.13 -0.12 -0.19 0.00 0.82 0.00 0.00 66.70 67.35 1pqc h VAL 434 Cb 0.68 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1pqc h VAL 434 CO 0.05 0.04 -0.66 -0.74 0.02 0.00 0.00 177.57 176.28 1pqc h HIS 435 N 0.13 0.81 -0.33 1.57 6.17 -0.81 -2.71 115.15 119.98 1pqc h HIS 435 Ca 0.03 -0.33 -0.04 0.00 0.71 0.00 0.00 60.37 60.75 1pqc h HIS 435 Cb 0.02 -0.14 -0.02 0.00 2.52 0.00 0.00 27.41 29.80 1pqc h HIS 435 CO 0.00 1.11 0.03 0.77 0.71 0.00 0.00 177.93 180.55 1pqc h SER 436 N 0.45 0.46 -0.06 3.26 0.02 -0.76 -2.35 113.55 114.57 1pqc h SER 436 Ca -0.02 -0.08 -0.11 0.00 -0.84 0.00 0.00 61.79 60.75 1pqc h SER 436 Cb 1.24 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 1pqc h SER 436 CO 0.13 0.51 -0.29 -0.33 -1.14 0.00 0.00 176.83 175.71 1pqc h GLU 437 N 0.49 0.52 -0.53 3.45 5.08 -1.38 -2.35 114.58 119.87 1pqc h GLU 437 Ca 0.11 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 1pqc h GLU 437 Cb 0.27 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1pqc h GLU 437 CO 0.00 0.76 0.07 0.37 -1.00 0.00 0.00 179.01 179.22 1pqc h GLN 438 N 0.45 0.89 -0.24 2.33 5.75 -1.16 -1.51 115.11 121.62 1pqc h GLN 438 Ca 0.06 -0.25 -0.02 0.00 -0.15 0.00 0.00 58.65 58.29 1pqc h GLN 438 Cb 0.74 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.18 1pqc h GLN 438 CO 0.06 0.88 0.08 0.28 -2.65 0.00 0.00 178.83 177.48 1pqc h VAL 439 N 0.77 1.19 -0.17 2.39 2.07 -1.25 -1.89 116.25 119.36 1pqc h VAL 439 Ca 0.16 -0.59 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 1pqc h VAL 439 Cb 0.43 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1pqc h VAL 439 CO 0.01 0.19 -0.16 0.15 0.02 0.00 0.00 177.57 177.79 1pqc h PHE 440 N 0.23 0.30 -0.23 1.57 3.57 -1.45 -2.25 116.94 118.68 1pqc h PHE 440 Ca 0.08 -0.04 -0.17 0.00 3.53 0.00 0.00 57.97 61.37 1pqc h PHE 440 Cb 0.22 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1pqc h PHE 440 CO -0.00 0.43 -0.56 0.00 -2.23 0.00 0.00 178.31 175.96 1pqc h ALA 441 N 1.58 0.59 -0.32 2.41 0.00 -1.08 -3.19 119.26 119.25 1pqc h ALA 441 Ca 0.05 -0.52 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 1pqc h ALA 441 Cb 0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1pqc h ALA 441 CO 0.03 0.69 -0.07 -0.07 0.00 0.00 0.00 179.25 179.83 1pqc h LEU 442 N 0.53 0.61 -1.26 0.00 3.38 -1.01 -2.87 115.31 114.69 1pqc h LEU 442 Ca 0.01 -0.36 0.24 0.00 0.09 0.00 0.00 57.88 57.86 1pqc h LEU 442 Cb 1.13 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.62 1pqc h LEU 442 CO 0.11 0.83 0.64 0.03 0.09 0.00 0.00 178.44 180.14 1pqc h ARG 443 N 0.38 0.49 -0.34 1.13 2.47 -1.42 0.15 114.38 117.24 1pqc h ARG 443 Ca 0.08 -0.03 0.04 0.00 -1.26 0.00 0.00 59.98 58.81 1pqc h ARG 443 Cb 0.56 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.75 1pqc h ARG 443 CO 0.03 0.32 0.23 -0.07 0.56 0.00 0.00 179.97 181.04 1pqc h LEU 444 N 0.50 0.25 -3.97 3.04 4.07 -1.49 -2.00 115.31 115.72 1pqc h LEU 444 Ca 0.58 -0.00 -0.58 0.00 0.08 0.00 0.00 57.88 57.96 1pqc h LEU 444 Cb 1.28 -0.06 -0.24 0.00 1.08 0.00 0.00 40.66 42.72 1pqc h LEU 444 CO -0.32 0.17 0.74 0.00 -1.08 0.00 0.00 178.44 177.95 1pqc n GLN 445 N -4.48 2.43 -3.25 1.13 6.02 0.44 -4.90 117.38 114.76 1pqc n GLN 445 Ca 0.03 -2.77 -0.22 0.00 -0.01 0.00 0.00 57.00 54.04 1pqc n GLN 445 Cb 0.20 -2.09 -0.05 0.00 1.02 0.00 0.00 30.24 29.32 1pqc n GLN 445 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1pqc n ASP 446 N -0.43 -0.61 -4.06 1.08 3.85 -0.75 -4.88 116.55 110.76 1pqc n ASP 446 Ca 0.52 -0.69 -0.36 0.00 -0.71 0.00 0.00 54.79 53.55 1pqc n ASP 446 Cb 0.59 -0.87 -0.06 0.00 -1.35 0.00 0.00 41.12 39.43 1pqc n ASP 446 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1pqc n LYS 447 N -2.58 2.77 -3.07 0.11 5.02 -0.73 -4.99 118.16 114.70 1pqc n LYS 447 Ca 0.00 -4.50 -0.39 0.00 -2.02 0.00 0.00 58.31 51.40 1pqc n LYS 447 Cb 0.28 -2.41 -0.06 0.00 -0.02 0.00 0.00 35.03 32.82 1pqc n LYS 447 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1pqc s LYS 448 N -1.56 4.46 0.39 1.97 1.02 -1.26 -3.69 119.74 121.07 1pqc s LYS 448 Ca 0.29 1.03 -0.27 0.00 0.02 0.00 0.00 55.97 57.04 1pqc s LYS 448 Cb -0.05 -3.26 -0.11 0.00 -0.52 0.00 0.00 37.83 33.89 1pqc s LYS 448 CO -0.10 0.57 1.35 1.28 -0.92 0.00 0.00 175.35 177.53 1pqc n LEU 449 N 1.74 4.25 -4.72 3.17 4.77 -1.26 -5.02 117.00 119.93 1pqc n LEU 449 Ca -0.07 1.17 -0.29 0.00 -0.03 0.00 0.00 56.01 56.79 1pqc n LEU 449 Cb 0.49 -1.54 0.15 0.00 -2.33 0.00 0.00 43.42 40.19 1pqc n LEU 449 CO 0.45 -0.33 0.67 -2.16 -1.33 0.00 0.00 177.39 174.69 1pqc s PRO 450 N -2.13 1.04 0.22 3.23 0.04 -1.26 -4.66 135.00 131.49 1pqc s PRO 450 Ca 0.57 0.62 -0.07 0.00 0.04 0.00 0.00 61.00 62.16 1pqc s PRO 450 Cb -0.51 -1.80 0.36 0.00 0.04 0.00 0.00 34.50 32.59 1pqc s PRO 450 CO 0.61 -2.34 1.73 -1.35 0.04 0.00 0.00 177.00 175.69 1pqc h PRO 451 N -1.61 0.39 -0.12 0.56 0.11 -1.98 0.45 132.00 129.80 1pqc h PRO 451 Ca -0.51 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.49 1pqc h PRO 451 Cb 1.30 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1pqc h PRO 451 CO 0.57 0.26 -0.31 -0.07 -0.21 0.00 0.00 178.00 178.24 1pqc h LEU 452 N 0.40 0.23 0.00 2.35 3.38 -2.01 -2.10 115.31 117.57 1pqc h LEU 452 Ca 0.35 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 58.09 1pqc h LEU 452 Cb 0.50 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1pqc h LEU 452 CO -0.36 0.54 -1.10 -0.07 0.09 0.00 0.00 178.44 177.53 1pqc h LEU 453 N 0.21 0.00 -0.56 1.67 3.38 -1.77 -3.36 115.31 114.88 1pqc h LEU 453 Ca 0.03 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 1pqc h LEU 453 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1pqc h LEU 453 CO 0.05 0.61 -0.41 0.28 0.09 0.00 0.00 178.44 179.05 1pqc h SER 454 N 0.00 0.75 -0.99 -0.43 0.02 -0.29 -2.16 113.55 110.46 1pqc h SER 454 Ca -0.11 -0.34 0.30 0.00 -0.84 0.00 0.00 61.79 60.81 1pqc h SER 454 Cb 1.56 -0.21 -0.15 0.00 0.14 0.00 0.00 62.40 63.74 1pqc h SER 454 CO 0.06 1.07 0.53 -0.33 -1.14 0.00 0.00 176.83 177.02 1pqc h GLU 455 N 0.57 0.32 0.13 3.45 5.08 -1.57 -3.05 114.58 119.52 1pqc h GLU 455 Ca 0.05 -0.02 -0.36 0.00 -1.00 0.00 0.00 59.36 58.02 1pqc h GLU 455 Cb 0.95 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1pqc h GLU 455 CO 0.09 0.21 -1.98 0.82 -1.00 0.00 0.00 179.01 177.15 1pqc h ILE 456 N 0.33 0.64 -0.00 3.13 2.04 -1.66 -3.44 117.51 118.56 1pqc h ILE 456 Ca 0.70 -2.35 0.00 0.00 1.00 0.00 0.00 64.86 64.21 1pqc h ILE 456 Cb 1.57 2.52 0.00 0.00 -0.74 0.00 0.00 36.82 40.17 1pqc h ILE 456 CO -0.60 0.90 -0.03 0.79 0.00 0.00 0.00 178.15 179.21 1pqc n TRP 457 N -3.49 0.00 -1.25 1.37 8.01 -0.85 -4.97 117.44 116.27 1pqc n TRP 457 Ca -0.31 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 55.88 1pqc n TRP 457 Cb 1.05 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.35 1pqc n TRP 457 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28