#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pq6 s THR 221 N 0.00 1.71 0.09 -5.08 -4.23 -1.26 -5.04 115.64 101.82 1pq6 s THR 221 Ca 0.00 -1.69 -0.21 0.00 -1.18 0.00 0.00 61.69 58.61 1pq6 s THR 221 Cb 0.00 -2.39 -0.11 0.00 1.34 0.00 0.00 72.50 71.34 1pq6 s THR 221 CO 0.00 0.00 1.67 0.00 -0.54 0.00 0.00 174.62 175.75 1pq6 h ALA 222 N 1.11 0.17 0.00 3.99 0.00 -2.06 -2.87 119.26 119.60 1pq6 h ALA 222 Ca -0.40 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1pq6 h ALA 222 Cb 1.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1pq6 h ALA 222 CO 0.65 -0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.63 1pq6 n ALA 223 N -2.19 1.50 -0.00 0.00 0.00 -1.26 -1.31 120.51 117.25 1pq6 n ALA 223 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 53.44 53.38 1pq6 n ALA 223 Cb 0.09 -1.04 -0.00 0.00 0.00 0.00 0.00 19.45 18.50 1pq6 n ALA 223 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1pq6 n GLN 224 N -1.09 0.00 -0.31 0.00 6.02 -1.20 -4.41 117.38 116.39 1pq6 n GLN 224 Ca 0.02 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.12 1pq6 n GLN 224 Cb 0.01 -0.97 0.29 0.00 1.02 0.00 0.00 30.24 30.59 1pq6 n GLN 224 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1pq6 h GLU 225 N -0.00 0.54 -0.12 -1.09 5.08 -0.97 0.21 114.58 118.23 1pq6 h GLU 225 Ca -0.00 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1pq6 h GLU 225 Cb 1.00 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.10 1pq6 h GLU 225 CO -0.00 0.36 -0.04 1.25 -1.00 0.00 0.00 179.01 179.58 1pq6 h LEU 226 N 0.56 -0.14 -0.33 1.33 5.85 -1.58 -3.18 115.31 117.81 1pq6 h LEU 226 Ca 0.54 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.30 1pq6 h LEU 226 Cb 0.90 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.02 1pq6 h LEU 226 CO -0.44 -0.05 0.00 1.15 -0.34 0.00 0.00 178.44 178.76 1pq6 n MET 227 N -5.17 0.19 0.03 1.25 0.00 0.52 -2.55 117.12 111.39 1pq6 n MET 227 Ca -0.04 0.30 -0.21 0.00 0.00 0.00 0.00 57.70 57.75 1pq6 n MET 227 Cb 0.10 -1.79 -0.14 0.00 0.00 0.00 0.00 33.22 31.39 1pq6 n MET 227 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 175.97 176.79 1pq6 h ILE 228 N 0.00 1.34 -0.11 3.17 2.04 -0.90 -2.55 117.51 120.49 1pq6 h ILE 228 Ca 0.00 -2.49 -0.07 0.00 1.00 0.00 0.00 64.86 63.30 1pq6 h ILE 228 Cb 0.50 3.03 -0.01 0.00 -0.74 0.00 0.00 36.82 39.59 1pq6 h ILE 228 CO 0.00 0.71 -0.27 1.56 0.00 0.00 0.00 178.15 180.15 1pq6 h GLN 229 N -0.36 0.20 0.50 2.37 1.08 -1.63 -2.31 115.11 114.96 1pq6 h GLN 229 Ca -0.20 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 56.91 1pq6 h GLN 229 Cb 1.68 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 29.09 1pq6 h GLN 229 CO 0.12 0.46 -0.29 0.37 -0.95 0.00 0.00 178.83 178.54 1pq6 h GLN 230 N 0.18 -0.71 -0.28 1.46 4.15 -1.49 1.80 115.11 120.21 1pq6 h GLN 230 Ca 0.03 0.05 -0.08 0.00 0.77 0.00 0.00 58.65 59.42 1pq6 h GLN 230 Cb 0.58 0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.41 1pq6 h GLN 230 CO 0.04 -0.47 -0.15 -0.07 -1.93 0.00 0.00 178.83 176.25 1pq6 h LEU 231 N -0.74 0.47 0.60 -2.39 3.38 -1.44 -2.59 115.31 112.59 1pq6 h LEU 231 Ca -0.06 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1pq6 h LEU 231 Cb 0.59 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1pq6 h LEU 231 CO 0.08 0.64 -0.29 0.58 0.09 0.00 0.00 178.44 179.54 1pq6 h VAL 232 N 0.44 0.06 -0.93 1.22 2.07 -0.76 -2.13 116.25 116.22 1pq6 h VAL 232 Ca 0.08 -0.41 0.11 0.00 0.82 0.00 0.00 66.70 67.30 1pq6 h VAL 232 Cb 0.52 0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 30.31 1pq6 h VAL 232 CO 0.03 0.01 0.60 0.00 0.02 0.00 0.00 177.57 178.23 1pq6 h ALA 233 N -1.14 1.62 -0.18 1.67 0.00 0.27 -1.19 119.26 120.31 1pq6 h ALA 233 Ca -0.08 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1pq6 h ALA 233 Cb 0.63 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1pq6 h ALA 233 CO 0.13 0.17 -0.45 0.00 0.00 0.00 0.00 179.25 179.10 1pq6 h ALA 234 N 1.55 0.89 0.00 0.00 0.00 -1.54 -2.50 119.26 117.67 1pq6 h ALA 234 Ca 0.45 -0.45 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1pq6 h ALA 234 Cb 0.47 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1pq6 h ALA 234 CO -0.21 0.65 -0.36 0.37 0.00 0.00 0.00 179.25 179.70 1pq6 h GLN 235 N 0.37 0.00 0.00 0.00 4.15 -0.54 -2.87 115.11 116.22 1pq6 h GLN 235 Ca 0.03 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.32 1pq6 h GLN 235 Cb 0.93 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.60 1pq6 h GLN 235 CO 0.08 0.36 -0.82 -0.07 -1.93 0.00 0.00 178.83 176.46 1pq6 h LEU 236 N 0.00 0.00 -0.05 -2.39 3.38 -1.17 -2.50 115.31 112.58 1pq6 h LEU 236 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pq6 h LEU 236 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1pq6 h LEU 236 CO 0.05 0.52 -0.34 0.00 0.09 0.00 0.00 178.44 178.75 1pq6 n GLN 237 N -3.10 0.11 0.07 1.13 10.64 -0.95 -1.79 117.38 123.49 1pq6 n GLN 237 Ca -0.02 -0.05 -0.20 0.00 -1.83 0.00 0.00 57.00 54.90 1pq6 n GLN 237 Cb 0.77 -1.50 -0.15 0.00 -0.86 0.00 0.00 30.24 28.50 1pq6 n GLN 237 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1pq6 h ASN 239 N 0.09 1.05 0.00 0.00 -0.73 -1.23 -3.18 115.58 111.57 1pq6 h ASN 239 Ca -0.29 -0.01 -0.09 0.00 1.87 0.00 0.00 56.30 57.78 1pq6 h ASN 239 Cb 2.06 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 40.39 1pq6 h ASN 239 CO 0.17 0.73 -0.64 0.11 -0.37 0.00 0.00 177.43 177.43 1pq6 h LYS 240 N 1.22 0.00 -0.86 6.67 1.57 -1.52 -3.33 116.57 120.33 1pq6 h LYS 240 Ca 0.37 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 59.39 1pq6 h LYS 240 Cb -0.04 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.11 1pq6 h LYS 240 CO -0.11 0.51 0.01 -2.13 -0.57 0.00 0.00 179.45 177.17 1pq6 n ARG 241 N -4.57 -0.07 -3.38 3.15 0.63 -1.13 -0.61 116.66 110.67 1pq6 n ARG 241 Ca -0.16 1.29 -0.30 0.00 -0.92 0.00 0.00 57.85 57.75 1pq6 n ARG 241 Cb 0.41 -2.04 -0.07 0.00 0.45 0.00 0.00 32.46 31.21 1pq6 n ARG 241 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1pq6 n SER 242 N -5.24 4.23 0.00 6.15 7.64 -1.20 -4.65 113.62 120.55 1pq6 n SER 242 Ca 0.20 -3.42 0.00 0.00 1.01 0.00 0.00 58.87 56.66 1pq6 n SER 242 Cb 0.66 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 1pq6 n SER 242 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1pq6 n PHE 243 N 1.06 0.00 -3.63 1.43 7.35 0.22 -4.89 117.46 118.99 1pq6 n PHE 243 Ca 0.28 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.87 1pq6 n PHE 243 Cb 0.39 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 40.15 1pq6 n PHE 243 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1pq6 s SER 244 N -0.99 -0.76 -0.13 -2.13 1.04 -1.26 -4.82 113.70 104.64 1pq6 s SER 244 Ca 0.00 1.37 -0.00 0.00 0.48 0.00 0.00 55.95 57.79 1pq6 s SER 244 Cb 0.00 1.36 0.00 0.00 0.10 0.00 0.00 66.02 67.48 1pq6 s SER 244 CO 0.00 -0.23 0.11 2.29 0.98 0.00 0.00 173.24 176.39 1pq6 n LYS 248 N 3.21 -0.72 -3.18 4.02 2.85 -1.26 -5.19 118.16 117.89 1pq6 n LYS 248 Ca -0.16 0.08 -0.28 0.00 -1.05 0.00 0.00 58.31 56.90 1pq6 n LYS 248 Cb 0.57 -2.84 -0.03 0.00 -0.65 0.00 0.00 35.03 32.08 1pq6 n LYS 248 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1pq6 s VAL 249 N -3.03 4.97 -0.03 0.58 1.01 -1.26 -5.03 120.40 117.60 1pq6 s VAL 249 Ca 0.02 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.85 1pq6 s VAL 249 Cb -0.01 -3.76 -0.08 0.00 0.00 0.00 0.00 36.38 32.54 1pq6 s VAL 249 CO 0.07 -0.43 1.99 -0.89 0.00 0.00 0.00 175.10 175.84 1pq6 s THR 250 N -2.23 3.08 0.65 3.92 2.01 -1.26 -4.87 115.64 116.95 1pq6 s THR 250 Ca 0.45 0.10 -0.18 0.00 0.31 0.00 0.00 61.69 62.37 1pq6 s THR 250 Cb -0.10 -3.07 -0.01 0.00 0.01 0.00 0.00 72.50 69.32 1pq6 s THR 250 CO 0.32 -0.02 1.23 -2.65 -0.69 0.00 0.00 174.62 172.81 1pq6 n PRO 251 N 7.78 1.01 -2.58 4.92 -0.02 -1.26 -4.43 135.00 140.42 1pq6 n PRO 251 Ca 0.22 0.40 -0.42 0.00 -2.02 0.00 0.00 63.50 61.68 1pq6 n PRO 251 Cb 0.42 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 1pq6 n PRO 251 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1pq6 s TRP 252 N -1.45 3.44 0.14 6.00 -0.11 -1.26 -4.83 118.94 120.86 1pq6 s TRP 252 Ca 0.81 1.46 -0.30 0.00 1.22 0.00 0.00 56.10 59.29 1pq6 s TRP 252 Cb -0.38 -3.28 -0.07 0.00 -1.50 0.00 0.00 33.47 28.24 1pq6 s TRP 252 CO 0.42 -0.67 1.24 -1.25 -4.62 0.00 0.00 176.95 172.08 1pq6 s PRO 253 N 1.71 4.43 -0.33 5.86 0.04 -1.26 -5.11 135.00 140.34 1pq6 s PRO 253 Ca 0.53 1.90 0.17 0.00 0.04 0.00 0.00 61.00 63.65 1pq6 s PRO 253 Cb -0.22 -3.26 0.45 0.00 0.04 0.00 0.00 34.50 31.50 1pq6 s PRO 253 CO 0.23 -0.21 0.97 -0.11 0.04 0.00 0.00 177.00 177.92 1pq6 n LEU 254 N 3.14 1.22 0.14 -3.56 0.00 -1.26 -5.07 117.00 111.62 1pq6 n LEU 254 Ca 0.07 -3.73 0.00 0.00 0.00 0.00 0.00 56.01 52.35 1pq6 n LEU 254 Cb 0.44 0.41 0.00 0.00 0.00 0.00 0.00 43.42 44.28 1pq6 n LEU 254 CO 0.56 1.60 0.00 0.00 0.00 0.00 0.00 177.39 179.55 1pq6 n ALA 263 N -0.08 2.00 -0.14 1.96 0.00 -1.26 -5.30 120.51 117.69 1pq6 n ALA 263 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.43 1pq6 n ALA 263 Cb 0.82 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.31 1pq6 n ALA 263 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1pq6 h ARG 264 N 0.00 0.91 -0.61 0.00 2.43 -1.96 -2.92 114.38 112.24 1pq6 h ARG 264 Ca 0.00 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 58.80 1pq6 h ARG 264 Cb 0.00 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 1pq6 h ARG 264 CO 0.00 1.02 0.35 0.37 -1.51 0.00 0.00 179.97 180.19 1pq6 h GLN 265 N 0.80 0.84 -0.02 0.20 5.75 -1.89 -2.67 115.11 118.11 1pq6 h GLN 265 Ca 0.11 -0.09 -0.15 0.00 -0.15 0.00 0.00 58.65 58.37 1pq6 h GLN 265 Cb 0.73 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 1pq6 h GLN 265 CO 0.06 0.62 -0.69 0.37 -2.65 0.00 0.00 178.83 176.54 1pq6 h GLN 266 N 0.82 0.12 -0.49 1.69 4.15 -1.93 0.35 115.11 119.82 1pq6 h GLN 266 Ca 0.22 -0.10 -0.00 0.00 0.77 0.00 0.00 58.65 59.53 1pq6 h GLN 266 Cb 0.02 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1pq6 h GLN 266 CO -0.04 0.76 0.29 0.00 -1.93 0.00 0.00 178.83 177.91 1pq6 h ARG 267 N 0.08 0.68 -0.23 1.69 3.08 -1.49 -1.81 114.38 116.39 1pq6 h ARG 267 Ca -0.01 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.83 1pq6 h ARG 267 Cb 1.22 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 1pq6 h ARG 267 CO 0.10 0.50 -0.43 0.35 -1.07 0.00 0.00 179.97 179.43 1pq6 h PHE 268 N 0.66 0.66 -0.21 3.04 3.57 -0.60 -1.62 116.94 122.44 1pq6 h PHE 268 Ca 0.18 -0.20 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 1pq6 h PHE 268 Cb 0.01 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1pq6 h PHE 268 CO -0.03 0.88 -0.08 0.00 -2.23 0.00 0.00 178.31 176.86 1pq6 h ALA 269 N 1.09 0.29 -0.50 2.41 0.00 -0.36 -1.60 119.26 120.57 1pq6 h ALA 269 Ca 0.03 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.72 1pq6 h ALA 269 Cb 0.93 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1pq6 h ALA 269 CO 0.08 0.10 -0.49 1.25 0.00 0.00 0.00 179.25 180.19 1pq6 h HIS 270 N 0.13 -1.52 -0.46 0.00 -0.00 -1.35 -2.33 115.15 109.61 1pq6 h HIS 270 Ca 0.05 0.08 -0.06 0.00 -0.00 0.00 0.00 60.37 60.44 1pq6 h HIS 270 Cb 0.55 0.73 -0.02 0.00 -0.00 0.00 0.00 27.41 28.67 1pq6 h HIS 270 CO 0.06 -0.39 0.04 0.74 -0.00 0.00 0.00 177.93 178.38 1pq6 h PHE 271 N -0.24 0.76 0.00 5.26 0.04 -1.16 -1.30 116.94 120.30 1pq6 h PHE 271 Ca 0.08 -0.09 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 1pq6 h PHE 271 Cb 0.46 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1pq6 h PHE 271 CO -0.80 0.69 -0.48 1.79 -0.60 0.00 0.00 178.31 178.91 1pq6 h THR 272 N 0.69 0.98 -0.22 -1.55 1.35 -1.28 -1.31 112.91 111.58 1pq6 h THR 272 Ca 0.14 -1.90 -0.16 0.00 -0.55 0.00 0.00 66.41 63.95 1pq6 h THR 272 Cb 0.37 2.15 -0.01 0.00 -1.73 0.00 0.00 68.15 68.93 1pq6 h THR 272 CO 0.01 0.47 -0.52 -0.33 -0.25 0.00 0.00 175.52 174.90 1pq6 h GLU 273 N 0.00 0.61 -0.41 4.72 5.08 -0.93 -0.72 114.58 122.93 1pq6 h GLU 273 Ca -0.00 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 57.93 1pq6 h GLU 273 Cb 1.11 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 1pq6 h GLU 273 CO 0.06 0.98 0.04 -0.07 -1.00 0.00 0.00 179.01 179.02 1pq6 h LEU 274 N 0.48 0.60 -0.51 1.33 3.38 -0.95 -2.68 115.31 116.96 1pq6 h LEU 274 Ca 0.02 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1pq6 h LEU 274 Cb 1.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1pq6 h LEU 274 CO 0.10 0.65 -0.40 0.00 0.09 0.00 0.00 178.44 178.88 1pq6 h ALA 275 N 1.43 0.84 -0.10 1.53 0.00 -0.88 -1.78 119.26 120.31 1pq6 h ALA 275 Ca 0.13 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1pq6 h ALA 275 Cb 0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1pq6 h ALA 275 CO 0.01 0.50 -0.12 0.82 0.00 0.00 0.00 179.25 180.46 1pq6 h ILE 276 N 0.00 1.37 -0.77 0.00 2.04 -0.91 -2.68 117.51 116.56 1pq6 h ILE 276 Ca -0.00 -1.32 0.12 0.00 1.00 0.00 0.00 64.86 64.66 1pq6 h ILE 276 Cb 1.10 2.02 -0.08 0.00 -0.74 0.00 0.00 36.82 39.11 1pq6 h ILE 276 CO 0.05 0.37 0.37 0.40 0.00 0.00 0.00 178.15 179.35 1pq6 h ILE 277 N -0.17 0.76 -0.05 -0.67 1.08 -1.18 -2.06 117.51 115.22 1pq6 h ILE 277 Ca 0.01 -0.20 -0.01 0.00 -0.39 0.00 0.00 64.86 64.28 1pq6 h ILE 277 Cb 0.66 0.14 -0.00 0.00 -3.07 0.00 0.00 36.82 34.54 1pq6 h ILE 277 CO 0.03 0.10 0.01 0.77 -0.69 0.00 0.00 178.15 178.37 1pq6 h SER 278 N 0.57 0.07 -0.99 1.72 4.64 -1.29 -2.13 113.55 116.14 1pq6 h SER 278 Ca 0.41 -0.26 0.15 0.00 -0.47 0.00 0.00 61.79 61.62 1pq6 h SER 278 Cb 0.53 -0.02 -0.10 0.00 -0.31 0.00 0.00 62.40 62.50 1pq6 h SER 278 CO -0.33 0.32 0.61 0.58 -0.87 0.00 0.00 176.83 177.13 1pq6 h VAL 279 N -0.17 0.80 -0.42 0.95 2.07 -1.18 -0.96 116.25 117.34 1pq6 h VAL 279 Ca 0.01 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 1pq6 h VAL 279 Cb 0.28 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 1pq6 h VAL 279 CO 0.00 0.16 -0.05 1.56 0.02 0.00 0.00 177.57 179.25 1pq6 h GLN 280 N 0.86 0.70 -0.21 1.57 4.20 -0.90 -2.08 115.11 119.24 1pq6 h GLN 280 Ca 0.53 -0.20 -0.13 0.00 0.06 0.00 0.00 58.65 58.92 1pq6 h GLN 280 Cb 0.69 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 1pq6 h GLN 280 CO -0.33 0.75 -0.41 0.93 -0.67 0.00 0.00 178.83 179.11 1pq6 h GLU 281 N 0.65 0.50 -0.37 1.46 5.08 -0.59 -2.40 114.58 118.91 1pq6 h GLU 281 Ca 0.12 -0.25 -0.15 0.00 -1.00 0.00 0.00 59.36 58.08 1pq6 h GLU 281 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1pq6 h GLU 281 CO 0.03 0.82 -0.35 0.82 -1.00 0.00 0.00 179.01 179.33 1pq6 h ILE 282 N 0.41 1.28 -0.52 3.13 2.04 -0.96 -0.92 117.51 121.96 1pq6 h ILE 282 Ca 0.04 -1.52 -0.12 0.00 1.00 0.00 0.00 64.86 64.26 1pq6 h ILE 282 Cb 0.89 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.31 1pq6 h ILE 282 CO 0.08 0.51 -0.14 0.58 0.00 0.00 0.00 178.15 179.17 1pq6 h VAL 283 N 0.72 1.27 -0.67 1.67 2.07 -1.41 -2.98 116.25 116.92 1pq6 h VAL 283 Ca 0.07 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 1pq6 h VAL 283 Cb 0.92 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1pq6 h VAL 283 CO 0.08 0.46 0.27 0.44 0.02 0.00 0.00 177.57 178.84 1pq6 h ASP 284 N 0.89 0.90 -0.04 0.57 3.45 -1.28 -3.30 116.42 117.61 1pq6 h ASP 284 Ca 0.13 -0.13 -0.10 0.00 0.43 0.00 0.00 57.03 57.37 1pq6 h ASP 284 Cb 0.71 -0.23 0.01 0.00 -0.56 0.00 0.00 39.33 39.25 1pq6 h ASP 284 CO 0.05 0.80 -0.36 0.15 -1.57 0.00 0.00 179.24 178.32 1pq6 h PHE 285 N 0.96 0.43 0.00 4.55 3.57 -1.08 -3.27 116.94 122.11 1pq6 h PHE 285 Ca 0.23 -0.21 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1pq6 h PHE 285 Cb 0.19 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.87 1pq6 h PHE 285 CO 0.01 0.98 0.00 0.00 -2.23 0.00 0.00 178.31 177.08 1pq6 h ALA 286 N 0.36 1.00 0.00 2.41 0.00 -1.61 0.21 119.26 121.64 1pq6 h ALA 286 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1pq6 h ALA 286 Cb 1.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1pq6 h ALA 286 CO 0.07 0.00 -0.30 0.87 0.00 0.00 0.00 179.25 179.90 1pq6 h LYS 287 N 0.00 0.00 -0.00 0.00 1.57 -1.64 -3.13 116.57 113.37 1pq6 h LYS 287 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1pq6 h LYS 287 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1pq6 h LYS 287 CO 0.00 0.30 -0.50 1.04 -0.57 0.00 0.00 179.45 179.72 1pq6 n GLN 288 N -3.51 0.12 -2.55 3.15 1.13 0.73 -4.70 117.38 111.74 1pq6 n GLN 288 Ca -0.00 -0.07 -0.43 0.00 -1.94 0.00 0.00 57.00 54.56 1pq6 n GLN 288 Cb 0.45 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.28 1pq6 n GLN 288 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1pq6 s VAL 289 N -2.93 4.48 -0.05 5.09 1.01 -1.09 -4.95 120.40 121.96 1pq6 s VAL 289 Ca 0.13 1.77 -0.30 0.00 0.00 0.00 0.00 61.98 63.58 1pq6 s VAL 289 Cb 0.18 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 32.30 1pq6 s VAL 289 CO 0.69 -0.21 1.85 -2.16 0.00 0.00 0.00 175.10 175.27 1pq6 s PRO 290 N 3.42 4.01 0.00 2.72 0.04 -1.26 -2.02 135.00 141.91 1pq6 s PRO 290 Ca 0.49 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.84 1pq6 s PRO 290 Cb -0.17 -4.11 0.00 0.00 0.04 0.00 0.00 34.50 30.25 1pq6 s PRO 290 CO 0.11 -1.08 0.00 0.41 0.04 0.00 0.00 177.00 176.48 1pq6 n GLY 291 N 4.55 0.98 0.14 0.56 0.00 -1.26 -4.96 105.19 105.20 1pq6 n GLY 291 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 1pq6 n GLY 291 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1pq6 h PHE 292 N 0.00 0.54 -0.26 1.61 3.57 -1.68 -3.33 116.94 117.40 1pq6 h PHE 292 Ca 0.00 -0.40 -0.11 0.00 3.53 0.00 0.00 57.97 60.99 1pq6 h PHE 292 Cb 0.00 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1pq6 h PHE 292 CO 0.00 1.71 -0.30 -0.07 -2.23 0.00 0.00 178.31 177.42 1pq6 h LEU 293 N -0.01 0.55 -2.67 0.59 3.38 -1.84 -2.71 115.31 112.60 1pq6 h LEU 293 Ca -0.38 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1pq6 h LEU 293 Cb 1.99 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.59 1pq6 h LEU 293 CO 0.10 0.82 0.00 -0.61 0.09 0.00 0.00 178.44 178.85 1pq6 h GLN 294 N 0.46 0.00 -7.55 1.13 4.15 -1.93 -3.44 115.11 107.93 1pq6 h GLN 294 Ca 0.06 0.00 -0.44 0.00 0.77 0.00 0.00 58.65 59.04 1pq6 h GLN 294 Cb 0.76 0.00 0.17 0.00 0.21 0.00 0.00 27.48 28.61 1pq6 h GLN 294 CO 0.06 0.00 0.27 -0.51 -1.93 0.00 0.00 178.83 176.72 1pq6 s LEU 295 N -6.11 1.69 0.65 -2.39 1.43 -1.02 -5.06 118.68 107.86 1pq6 s LEU 295 Ca -0.04 0.62 -0.16 0.00 -1.03 0.00 0.00 54.13 53.52 1pq6 s LEU 295 Cb 0.12 -2.62 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 1pq6 s LEU 295 CO 0.43 -3.26 1.16 -0.83 0.23 0.00 0.00 176.35 174.08 1pq6 s GLY 296 N -4.22 2.38 0.09 -3.19 0.00 -1.26 -4.99 107.32 96.12 1pq6 s GLY 296 Ca 0.70 0.76 -0.06 0.00 0.00 0.00 0.00 44.72 46.11 1pq6 s GLY 296 CO 0.54 1.13 1.19 -0.09 0.00 0.00 0.00 173.10 175.87 1pq6 h ARG 297 N 0.26 0.39 -0.18 2.90 2.43 -1.92 -2.57 114.38 115.69 1pq6 h ARG 297 Ca -0.48 -0.54 -0.08 0.00 -0.81 0.00 0.00 59.98 58.07 1pq6 h ARG 297 Cb 1.27 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.99 1pq6 h ARG 297 CO 0.53 1.22 -0.24 0.93 -1.51 0.00 0.00 179.97 180.90 1pq6 h GLU 298 N 0.16 0.32 -0.01 0.20 5.08 -2.00 -2.77 114.58 115.56 1pq6 h GLU 298 Ca -0.13 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 1pq6 h GLU 298 Cb 1.84 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.06 1pq6 h GLU 298 CO 0.20 0.55 -0.21 -0.44 -1.00 0.00 0.00 179.01 178.10 1pq6 h ASP 299 N 0.29 0.01 0.23 1.42 3.32 -1.86 -2.14 116.42 117.68 1pq6 h ASP 299 Ca 0.05 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1pq6 h ASP 299 Cb 0.59 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1pq6 h ASP 299 CO 0.04 0.22 -0.43 1.56 -1.72 0.00 0.00 179.24 178.92 1pq6 h GLN 300 N 0.01 0.26 -0.49 3.56 4.20 -1.16 -3.14 115.11 118.35 1pq6 h GLN 300 Ca 0.00 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.51 1pq6 h GLN 300 Cb 0.38 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.14 1pq6 h GLN 300 CO 0.03 0.64 0.01 0.82 -0.67 0.00 0.00 178.83 179.66 1pq6 h ILE 301 N 0.21 1.26 -0.02 2.54 2.04 -1.34 -2.74 117.51 119.47 1pq6 h ILE 301 Ca 0.02 -1.06 -0.22 0.00 1.00 0.00 0.00 64.86 64.59 1pq6 h ILE 301 Cb 0.84 0.98 0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1pq6 h ILE 301 CO 0.07 0.37 -0.86 0.00 0.00 0.00 0.00 178.15 177.72 1pq6 h ALA 302 N 0.93 0.13 -0.85 1.87 0.00 -1.57 0.11 119.26 119.88 1pq6 h ALA 302 Ca 0.14 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1pq6 h ALA 302 Cb 0.51 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1pq6 h ALA 302 CO 0.02 0.57 0.55 -0.07 0.00 0.00 0.00 179.25 180.32 1pq6 h LEU 303 N 0.24 1.00 -0.12 0.00 3.38 -1.66 -1.91 115.31 116.24 1pq6 h LEU 303 Ca -0.10 -0.04 -0.24 0.00 0.09 0.00 0.00 57.88 57.59 1pq6 h LEU 303 Cb 1.53 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 42.04 1pq6 h LEU 303 CO 0.17 0.74 -0.94 -0.07 0.09 0.00 0.00 178.44 178.43 1pq6 h LEU 304 N 1.16 0.74 -1.10 1.67 -0.00 -1.26 0.90 115.31 117.43 1pq6 h LEU 304 Ca 0.31 -0.57 0.02 0.00 -0.00 0.00 0.00 57.88 57.64 1pq6 h LEU 304 Cb -0.10 -0.22 -0.05 0.00 -0.00 0.00 0.00 40.66 40.29 1pq6 h LEU 304 CO -0.06 1.36 0.61 0.11 -0.00 0.00 0.00 178.44 180.46 1pq6 h LYS 305 N 0.35 1.19 0.00 1.13 1.57 -0.86 -1.49 116.57 118.45 1pq6 h LYS 305 Ca -0.09 -0.07 -0.18 0.00 -1.87 0.00 0.00 60.65 58.43 1pq6 h LYS 305 Cb 1.58 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 33.59 1pq6 h LYS 305 CO 0.18 0.79 -1.20 0.00 -0.57 0.00 0.00 179.45 178.64 1pq6 h ALA 306 N 1.44 0.64 0.00 3.86 0.00 -1.28 -3.39 119.26 120.52 1pq6 h ALA 306 Ca 0.35 -0.88 -0.20 0.00 0.00 0.00 0.00 54.91 54.18 1pq6 h ALA 306 Cb -0.09 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1pq6 h ALA 306 CO -0.09 1.02 -1.29 1.03 0.00 0.00 0.00 179.25 179.92 1pq6 h SER 307 N 0.00 0.00 -0.12 0.00 0.87 -0.67 -3.41 113.55 110.23 1pq6 h SER 307 Ca -0.13 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.44 1pq6 h SER 307 Cb 1.65 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.60 1pq6 h SER 307 CO 0.07 0.74 0.06 0.74 -0.53 0.00 0.00 176.83 177.90 1pq6 h THR 308 N 0.00 1.00 -0.54 2.23 2.02 -1.48 -0.62 112.91 115.53 1pq6 h THR 308 Ca -0.15 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 1pq6 h THR 308 Cb 1.69 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 68.94 1pq6 h THR 308 CO 0.07 0.02 0.24 -0.29 0.37 0.00 0.00 175.52 175.94 1pq6 h ILE 309 N 0.13 1.18 -0.47 3.11 6.09 -1.85 -0.50 117.51 125.20 1pq6 h ILE 309 Ca 0.05 -0.54 -0.12 0.00 -1.37 0.00 0.00 64.86 62.88 1pq6 h ILE 309 Cb 0.01 0.51 -0.02 0.00 0.47 0.00 0.00 36.82 37.79 1pq6 h ILE 309 CO -0.03 0.22 -0.16 -0.33 -3.07 0.00 0.00 178.15 174.77 1pq6 h GLU 310 N 0.76 0.92 -0.08 2.19 5.08 -1.39 -0.72 114.58 121.34 1pq6 h GLU 310 Ca 0.19 -0.35 -0.19 0.00 -1.00 0.00 0.00 59.36 58.01 1pq6 h GLU 310 Cb 0.10 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1pq6 h GLU 310 CO -0.02 1.01 -0.74 0.82 -1.00 0.00 0.00 179.01 179.07 1pq6 h ILE 311 N 0.81 1.38 -0.23 3.13 2.04 -0.89 -1.42 117.51 122.33 1pq6 h ILE 311 Ca 0.12 -2.15 0.01 0.00 1.00 0.00 0.00 64.86 63.84 1pq6 h ILE 311 Cb 0.71 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 1pq6 h ILE 311 CO 0.05 0.65 0.12 0.24 0.00 0.00 0.00 178.15 179.21 1pq6 h MET 312 N 0.28 0.25 -0.53 2.37 2.86 -0.95 0.49 114.93 119.70 1pq6 h MET 312 Ca -0.03 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.63 1pq6 h MET 312 Cb 1.32 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.88 1pq6 h MET 312 CO 0.13 0.16 0.28 -0.07 1.06 0.00 0.00 176.91 178.47 1pq6 h LEU 313 N 0.26 0.42 -0.68 1.22 3.38 -1.00 0.13 115.31 119.04 1pq6 h LEU 313 Ca 0.09 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1pq6 h LEU 313 Cb 0.01 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1pq6 h LEU 313 CO -0.05 0.29 0.43 0.25 0.09 0.00 0.00 178.44 179.45 1pq6 h LEU 314 N 0.55 0.73 -0.76 1.67 5.85 -0.95 -0.54 115.31 121.85 1pq6 h LEU 314 Ca 0.23 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 1pq6 h LEU 314 Cb 0.12 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1pq6 h LEU 314 CO -0.15 0.51 -0.59 -0.33 -0.34 0.00 0.00 178.44 177.55 1pq6 h GLU 315 N 0.86 0.11 0.02 1.25 4.39 -0.39 -2.34 114.58 118.49 1pq6 h GLU 315 Ca 0.26 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 1pq6 h GLU 315 Cb -0.03 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1pq6 h GLU 315 CO -0.08 0.66 -0.01 1.15 -1.16 0.00 0.00 179.01 179.57 1pq6 h THR 316 N 0.08 1.11 -0.85 1.13 2.02 -0.41 -2.74 112.91 113.25 1pq6 h THR 316 Ca -0.00 -0.40 0.14 0.00 0.77 0.00 0.00 66.41 66.91 1pq6 h THR 316 Cb 1.05 1.38 -0.09 0.00 -1.74 0.00 0.00 68.15 68.75 1pq6 h THR 316 CO 0.08 0.10 0.45 0.00 0.37 0.00 0.00 175.52 176.52 1pq6 h ALA 317 N 0.77 1.27 0.00 6.16 0.00 -0.98 -0.26 119.26 126.21 1pq6 h ALA 317 Ca -0.00 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1pq6 h ALA 317 Cb 0.19 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1pq6 h ALA 317 CO 0.00 -0.06 -0.08 -0.09 0.00 0.00 0.00 179.25 179.02 1pq6 h ARG 318 N 0.65 0.00 -0.36 0.00 2.43 -1.29 -1.60 114.38 114.22 1pq6 h ARG 318 Ca 0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.62 1pq6 h ARG 318 Cb 0.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1pq6 h ARG 318 CO -0.34 0.08 0.00 0.54 -1.51 0.00 0.00 179.97 178.74 1pq6 n ARG 319 N -3.81 2.28 -3.01 0.20 1.74 -0.14 -4.89 116.66 109.03 1pq6 n ARG 319 Ca -0.02 -1.94 -0.40 0.00 -0.77 0.00 0.00 57.85 54.71 1pq6 n ARG 319 Cb 0.18 -1.47 -0.05 0.00 -1.02 0.00 0.00 32.46 30.10 1pq6 n ARG 319 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1pq6 s TYR 320 N -1.53 3.49 -0.29 -1.55 5.04 -0.60 -0.85 117.35 121.06 1pq6 s TYR 320 Ca 0.37 1.19 -0.04 0.00 -2.44 0.00 0.00 57.07 56.16 1pq6 s TYR 320 Cb 0.21 -2.87 0.03 0.00 0.35 0.00 0.00 41.96 39.68 1pq6 s TYR 320 CO 0.29 -0.06 0.02 1.21 -1.34 0.00 0.00 175.55 175.67 1pq6 s ASN 321 N 0.98 4.83 0.31 4.32 2.47 -0.08 -4.99 114.94 122.79 1pq6 s ASN 321 Ca 0.36 -1.00 0.26 0.00 0.42 0.00 0.00 52.86 52.90 1pq6 s ASN 321 Cb -0.17 -1.76 1.01 0.00 -1.45 0.00 0.00 41.25 38.88 1pq6 s ASN 321 CO 0.15 -0.21 1.77 -0.74 -3.72 0.00 0.00 177.10 174.34 1pq6 h HIS 322 N 8.09 0.00 -0.00 0.43 -0.00 -1.95 0.08 115.15 121.80 1pq6 h HIS 322 Ca -0.27 0.00 -0.15 0.00 -0.00 0.00 0.00 60.37 59.95 1pq6 h HIS 322 Cb 1.09 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.48 1pq6 h HIS 322 CO 0.60 0.00 -0.72 1.49 -0.00 0.00 0.00 177.93 179.30 1pq6 h GLU 323 N 0.00 0.00 0.00 5.26 4.81 -1.96 -3.23 114.58 119.47 1pq6 h GLU 323 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1pq6 h GLU 323 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1pq6 h GLU 323 CO 0.00 0.72 -0.76 0.25 -0.73 0.00 0.00 179.01 178.49 1pq6 n THR 324 N -3.69 0.00 -3.28 0.32 -2.24 -1.05 -4.99 114.28 99.34 1pq6 n THR 324 Ca -0.01 -0.16 -0.22 0.00 -2.27 0.00 0.00 64.05 61.39 1pq6 n THR 324 Cb 0.70 0.95 -0.00 0.00 -2.10 0.00 0.00 70.33 69.88 1pq6 n THR 324 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pq6 n GLU 325 N -1.39 -3.26 -4.36 -0.78 1.02 -0.01 -4.97 120.64 106.89 1pq6 n GLU 325 Ca 0.03 0.47 -0.28 0.00 -0.02 0.00 0.00 57.16 57.36 1pq6 n GLU 325 Cb 0.24 -5.16 -0.11 0.00 -0.02 0.00 0.00 31.44 26.38 1pq6 n GLU 325 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1pq6 s ILE 327 N -1.43 5.00 -0.41 0.00 1.01 -0.30 -0.90 121.20 124.17 1pq6 s ILE 327 Ca 0.20 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.76 1pq6 s ILE 327 Cb -0.09 -3.33 0.03 0.00 0.01 0.00 0.00 42.46 39.08 1pq6 s ILE 327 CO 0.10 0.36 0.30 -0.89 0.00 0.00 0.00 174.94 174.81 1pq6 s THR 328 N 1.12 5.19 0.09 2.92 2.01 -0.03 -1.89 115.64 125.05 1pq6 s THR 328 Ca 0.06 -0.71 -0.16 0.00 0.31 0.00 0.00 61.69 61.19 1pq6 s THR 328 Cb -0.14 -3.91 -0.07 0.00 0.01 0.00 0.00 72.50 68.40 1pq6 s THR 328 CO 0.04 -0.32 0.52 -0.36 -0.69 0.00 0.00 174.62 173.81 1pq6 s PHE 329 N 1.66 3.69 0.00 4.92 2.99 0.37 -4.79 117.98 126.83 1pq6 s PHE 329 Ca 0.05 1.10 0.00 0.00 0.00 0.00 0.00 56.93 58.08 1pq6 s PHE 329 Cb -0.19 -2.38 0.00 0.00 0.00 0.00 0.00 43.02 40.44 1pq6 s PHE 329 CO 0.09 0.53 0.00 1.28 -0.00 0.00 0.00 175.22 177.12 1pq6 n LEU 330 N 1.29 0.00 -0.07 -0.37 4.77 -1.26 -2.37 117.00 118.99 1pq6 n LEU 330 Ca -0.09 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.85 1pq6 n LEU 330 Cb 0.52 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 1pq6 n LEU 330 CO 0.41 0.00 -0.34 1.17 -1.33 0.00 0.00 177.39 177.30 1pq6 n LYS 331 N 13.79 0.44 0.00 3.23 4.81 -1.26 -4.83 118.16 134.34 1pq6 n LYS 331 Ca 0.00 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 57.96 1pq6 n LYS 331 Cb 0.00 -1.66 0.00 0.00 0.02 0.00 0.00 35.03 33.39 1pq6 n LYS 331 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1pq6 n ASP 332 N -4.55 1.00 -4.51 3.14 8.00 -1.25 -4.97 116.55 113.42 1pq6 n ASP 332 Ca -0.07 -1.11 -0.42 0.00 0.71 0.00 0.00 54.79 53.90 1pq6 n ASP 332 Cb 0.26 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.33 1pq6 n ASP 332 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1pq6 s PHE 333 N -0.11 2.55 -0.09 1.24 2.99 -1.00 -4.97 117.98 118.59 1pq6 s PHE 333 Ca 0.00 -0.49 0.04 0.00 0.00 0.00 0.00 56.93 56.48 1pq6 s PHE 333 Cb 0.00 -4.48 -0.01 0.00 0.00 0.00 0.00 43.02 38.53 1pq6 s PHE 333 CO 0.00 -1.84 -0.22 0.99 -0.00 0.00 0.00 175.22 174.15 1pq6 s THR 334 N 4.69 2.27 -0.03 0.64 2.01 -1.26 -0.48 115.64 123.49 1pq6 s THR 334 Ca 0.32 -0.96 -0.01 0.00 0.31 0.00 0.00 61.69 61.35 1pq6 s THR 334 Cb -0.10 -1.87 0.03 0.00 0.01 0.00 0.00 72.50 70.57 1pq6 s THR 334 CO 0.07 0.56 0.06 -0.31 -0.69 0.00 0.00 174.62 174.31 1pq6 s TYR 335 N 0.19 -0.04 0.64 4.92 1.51 -0.79 -4.95 117.35 118.82 1pq6 s TYR 335 Ca -0.13 0.21 -0.03 0.00 -1.01 0.00 0.00 57.07 56.12 1pq6 s TYR 335 Cb -0.16 -0.14 0.06 0.00 -0.11 0.00 0.00 41.96 41.60 1pq6 s TYR 335 CO 0.07 -0.09 0.91 -1.54 -1.11 0.00 0.00 175.55 173.78 1pq6 s SER 336 N 0.85 4.97 0.33 2.29 1.04 -1.26 -1.15 113.70 120.76 1pq6 s SER 336 Ca -0.07 0.17 0.11 0.00 0.48 0.00 0.00 55.95 56.64 1pq6 s SER 336 Cb -0.10 -0.90 0.99 0.00 0.10 0.00 0.00 66.02 66.11 1pq6 s SER 336 CO -0.03 -1.42 1.63 0.11 0.98 0.00 0.00 173.24 174.50 1pq6 h LYS 337 N -0.30 0.18 -0.81 4.02 1.57 -1.97 -1.91 116.57 117.35 1pq6 h LYS 337 Ca -0.43 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.30 1pq6 h LYS 337 Cb 1.30 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.54 1pq6 h LYS 337 CO 0.55 0.12 0.35 0.22 -0.57 0.00 0.00 179.45 180.11 1pq6 h ASP 338 N 0.18 1.10 -0.25 0.86 1.82 -1.96 -1.94 116.42 116.23 1pq6 h ASP 338 Ca 0.69 -0.16 -0.05 0.00 -0.39 0.00 0.00 57.03 57.12 1pq6 h ASP 338 Cb 1.57 -0.29 -0.02 0.00 0.68 0.00 0.00 39.33 41.28 1pq6 h ASP 338 CO -0.70 0.96 0.03 0.44 -1.61 0.00 0.00 179.24 178.36 1pq6 h ASP 339 N 1.18 0.50 -0.46 2.28 3.32 -1.72 -1.89 116.42 119.63 1pq6 h ASP 339 Ca 0.27 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 57.11 1pq6 h ASP 339 Cb 0.19 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1pq6 h ASP 339 CO -0.03 0.55 -0.22 -0.26 -1.72 0.00 0.00 179.24 177.56 1pq6 h PHE 340 N 0.52 1.11 -0.20 4.55 -1.00 -1.23 -2.85 116.94 117.83 1pq6 h PHE 340 Ca 0.12 -0.27 -0.11 0.00 2.81 0.00 0.00 57.97 60.51 1pq6 h PHE 340 Cb 0.30 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.59 1pq6 h PHE 340 CO 0.01 1.09 -0.34 1.25 -1.61 0.00 0.00 178.31 178.71 1pq6 h HIS 341 N 0.80 0.50 0.00 -0.55 2.76 -1.15 -2.63 115.15 114.88 1pq6 h HIS 341 Ca 0.10 -0.12 -0.03 0.00 -2.20 0.00 0.00 60.37 58.12 1pq6 h HIS 341 Cb 0.80 -0.11 -0.00 0.00 1.55 0.00 0.00 27.41 29.64 1pq6 h HIS 341 CO 0.06 0.72 -0.13 0.00 -1.30 0.00 0.00 177.93 177.28 1pq6 h ARG 342 N 0.37 0.00 -0.04 5.26 3.08 -1.26 -1.08 114.38 120.71 1pq6 h ARG 342 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1pq6 h ARG 342 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1pq6 h ARG 342 CO 0.06 0.13 0.00 0.00 -1.07 0.00 0.00 179.97 179.09 1pq6 n ALA 343 N -2.26 2.60 -0.33 0.04 0.00 -1.00 -4.44 120.51 115.12 1pq6 n ALA 343 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1pq6 n ALA 343 Cb 0.27 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1pq6 n ALA 343 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pq6 n GLY 344 N 0.97 0.73 3.78 0.00 0.00 -0.41 -4.39 105.19 105.88 1pq6 n GLY 344 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1pq6 n GLY 344 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pq6 s LEU 345 N 0.00 4.13 0.47 0.99 1.43 -1.17 -5.00 118.68 119.53 1pq6 s LEU 345 Ca 0.00 2.15 -0.22 0.00 -1.03 0.00 0.00 54.13 55.04 1pq6 s LEU 345 Cb 0.00 -4.15 -0.08 0.00 0.03 0.00 0.00 46.19 41.99 1pq6 s LEU 345 CO 0.00 -0.61 1.08 -1.10 0.23 0.00 0.00 176.35 175.95 1pq6 s GLN 346 N -2.48 3.82 0.28 1.70 -1.52 -1.26 -4.50 119.66 115.70 1pq6 s GLN 346 Ca 0.59 1.52 0.02 0.00 -1.95 0.00 0.00 55.36 55.53 1pq6 s GLN 346 Cb -0.25 -2.26 0.41 0.00 -0.22 0.00 0.00 33.01 30.69 1pq6 s GLN 346 CO 0.31 -0.45 1.73 0.28 -0.25 0.00 0.00 175.29 176.92 1pq6 h VAL 347 N 1.73 1.25 0.00 1.09 2.07 -1.98 -1.09 116.25 119.32 1pq6 h VAL 347 Ca -0.49 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 65.84 1pq6 h VAL 347 Cb 1.23 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1pq6 h VAL 347 CO 0.60 0.39 0.31 -0.33 0.02 0.00 0.00 177.57 178.55 1pq6 h GLU 348 N 0.49 0.00 0.00 1.57 3.07 -2.01 -0.82 114.58 116.88 1pq6 h GLU 348 Ca 0.08 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.60 1pq6 h GLU 348 Cb 0.61 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.46 1pq6 h GLU 348 CO 0.04 0.00 -2.28 0.34 -1.40 0.00 0.00 179.01 175.72 1pq6 n PHE 349 N -2.89 0.00 -0.07 4.33 7.35 -0.87 -4.50 117.46 120.80 1pq6 n PHE 349 Ca -0.02 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.54 1pq6 n PHE 349 Cb 0.36 -0.86 -0.06 0.00 0.35 0.00 0.00 39.48 39.28 1pq6 n PHE 349 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1pq6 h ILE 350 N -0.12 1.31 0.37 -2.13 2.04 -0.65 -3.26 117.51 115.08 1pq6 h ILE 350 Ca -0.51 -1.24 -0.02 0.00 1.00 0.00 0.00 64.86 64.09 1pq6 h ILE 350 Cb 1.74 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.49 1pq6 h ILE 350 CO -0.12 0.38 -0.18 0.78 0.00 0.00 0.00 178.15 179.01 1pq6 h ASN 351 N 0.15 -0.42 -0.34 1.72 2.35 -1.43 -2.49 115.58 115.13 1pq6 h ASN 351 Ca 0.04 -0.06 0.09 0.00 -0.55 0.00 0.00 56.30 55.82 1pq6 h ASN 351 Cb 0.65 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 1pq6 h ASN 351 CO 0.04 -0.20 0.24 -0.65 -1.65 0.00 0.00 177.43 175.20 1pq6 h PRO 352 N -0.61 0.05 0.01 0.81 0.11 -1.79 -2.03 132.00 128.54 1pq6 h PRO 352 Ca -0.05 -0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.80 1pq6 h PRO 352 Cb 0.45 -0.01 0.02 0.00 0.11 0.00 0.00 31.00 31.56 1pq6 h PRO 352 CO 0.08 0.04 -1.02 0.82 -0.21 0.00 0.00 178.00 177.71 1pq6 h ILE 353 N 0.06 1.32 -0.62 4.15 2.04 -1.55 -1.71 117.51 121.19 1pq6 h ILE 353 Ca 0.16 -2.33 -0.07 0.00 1.00 0.00 0.00 64.86 63.62 1pq6 h ILE 353 Cb 0.56 2.41 -0.02 0.00 -0.74 0.00 0.00 36.82 39.03 1pq6 h ILE 353 CO -0.01 0.71 0.12 -0.26 0.00 0.00 0.00 178.15 178.71 1pq6 h PHE 354 N 0.33 1.09 0.00 1.37 -1.00 -1.01 -0.72 116.94 117.00 1pq6 h PHE 354 Ca -0.12 -0.15 -0.12 0.00 2.81 0.00 0.00 57.97 60.40 1pq6 h PHE 354 Cb 1.67 -0.30 -0.02 0.00 3.61 0.00 0.00 35.95 40.91 1pq6 h PHE 354 CO 0.09 0.92 -0.59 1.05 -1.61 0.00 0.00 178.31 178.17 1pq6 h GLU 355 N 0.94 0.00 -0.41 1.51 4.11 -1.33 -0.83 114.58 118.56 1pq6 h GLU 355 Ca 0.19 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.60 1pq6 h GLU 355 Cb 0.41 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1pq6 h GLU 355 CO 0.01 0.59 0.19 0.35 0.07 0.00 0.00 179.01 180.21 1pq6 h PHE 356 N 0.00 0.61 -0.56 2.06 3.57 -1.20 -1.98 116.94 119.44 1pq6 h PHE 356 Ca -0.01 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1pq6 h PHE 356 Cb 1.24 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1pq6 h PHE 356 CO 0.00 0.52 0.24 0.77 -2.23 0.00 0.00 178.31 177.60 1pq6 h SER 357 N 0.53 0.73 -0.39 0.41 0.02 -0.62 -0.78 113.55 113.45 1pq6 h SER 357 Ca 0.14 -0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 60.91 1pq6 h SER 357 Cb 0.15 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1pq6 h SER 357 CO -0.02 0.65 -0.14 0.03 -1.14 0.00 0.00 176.83 176.21 1pq6 h ARG 358 N 0.80 0.78 -0.56 3.45 3.08 -0.92 -1.74 114.38 119.26 1pq6 h ARG 358 Ca 0.19 -0.32 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 1pq6 h ARG 358 Cb 0.14 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1pq6 h ARG 358 CO -0.02 0.94 -0.01 0.00 -1.07 0.00 0.00 179.97 179.81 1pq6 h ALA 359 N 0.82 0.76 -0.64 0.04 0.00 -0.91 -2.26 119.26 117.07 1pq6 h ALA 359 Ca 0.09 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1pq6 h ALA 359 Cb 0.68 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1pq6 h ALA 359 CO 0.05 0.60 0.41 0.52 0.00 0.00 0.00 179.25 180.83 1pq6 h MET 360 N 0.89 0.81 -0.16 0.00 2.86 -1.01 -2.44 114.93 115.88 1pq6 h MET 360 Ca 0.16 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.70 1pq6 h MET 360 Cb 0.56 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1pq6 h MET 360 CO 0.03 0.54 -0.14 -0.09 1.06 0.00 0.00 176.91 178.31 1pq6 h ARG 361 N 0.84 0.25 0.00 1.72 9.65 -1.10 -1.58 114.38 124.17 1pq6 h ARG 361 Ca 0.24 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 1pq6 h ARG 361 Cb -0.06 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.48 1pq6 h ARG 361 CO -0.07 0.40 0.00 0.00 2.80 0.00 0.00 179.97 183.10 1pq6 h ARG 362 N 0.24 0.00 0.02 0.20 3.08 -0.91 -2.84 114.38 114.17 1pq6 h ARG 362 Ca 0.05 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.88 1pq6 h ARG 362 Cb 0.39 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1pq6 h ARG 362 CO 0.02 0.00 -1.03 -0.07 -1.07 0.00 0.00 179.97 177.82 1pq6 h LEU 363 N 0.00 0.09 -1.65 3.04 3.38 -1.15 -3.49 115.31 115.54 1pq6 h LEU 363 Ca 0.00 -0.09 -0.24 0.00 0.09 0.00 0.00 57.88 57.64 1pq6 h LEU 363 Cb 0.49 -0.03 0.12 0.00 0.09 0.00 0.00 40.66 41.33 1pq6 h LEU 363 CO 0.00 1.06 -0.53 0.61 0.09 0.00 0.00 178.44 179.67 1pq6 n GLY 364 N 1.35 -0.12 3.72 0.83 0.00 -1.07 -4.96 105.19 104.94 1pq6 n GLY 364 Ca -0.02 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1pq6 n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pq6 s LEU 365 N -5.09 4.38 0.00 0.99 1.43 -1.26 -5.04 118.68 114.08 1pq6 s LEU 365 Ca 0.05 2.46 -0.08 0.00 -1.03 0.00 0.00 54.13 55.54 1pq6 s LEU 365 Cb -0.02 -3.60 0.11 0.00 0.03 0.00 0.00 46.19 42.71 1pq6 s LEU 365 CO 0.51 -0.67 0.54 -0.90 0.23 0.00 0.00 176.35 176.05 1pq6 n ASP 366 N 3.44 -0.44 -0.18 2.29 5.68 -1.26 -4.85 116.55 121.23 1pq6 n ASP 366 Ca 0.10 -1.07 -0.11 0.00 -0.50 0.00 0.00 54.79 53.21 1pq6 n ASP 366 Cb 0.41 -0.43 0.01 0.00 -1.14 0.00 0.00 41.12 39.96 1pq6 n ASP 366 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1pq6 h ASP 367 N -1.07 1.02 -0.75 -1.12 3.32 -2.00 -2.85 116.42 112.98 1pq6 h ASP 367 Ca -0.18 -0.36 0.05 0.00 0.02 0.00 0.00 57.03 56.56 1pq6 h ASP 367 Cb 0.52 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.73 1pq6 h ASP 367 CO 0.13 1.14 0.45 0.00 -1.72 0.00 0.00 179.24 179.24 1pq6 h ALA 368 N 0.91 1.01 -0.16 3.45 0.00 -1.93 -1.82 119.26 120.71 1pq6 h ALA 368 Ca 0.13 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1pq6 h ALA 368 Cb 0.69 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1pq6 h ALA 368 CO 0.05 0.17 0.01 0.93 0.00 0.00 0.00 179.25 180.41 1pq6 h GLU 369 N 0.83 0.28 -0.86 0.00 5.08 -1.88 -1.10 114.58 116.93 1pq6 h GLU 369 Ca 0.32 -0.09 0.05 0.00 -1.00 0.00 0.00 59.36 58.64 1pq6 h GLU 369 Cb 0.14 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.31 1pq6 h GLU 369 CO -0.16 0.49 0.57 1.88 -1.00 0.00 0.00 179.01 180.78 1pq6 h TYR 370 N 0.04 1.02 -0.01 4.33 -1.99 -1.33 -0.21 116.97 118.82 1pq6 h TYR 370 Ca 0.05 0.03 -0.15 0.00 2.00 0.00 0.00 58.73 60.65 1pq6 h TYR 370 Cb 0.36 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 38.73 1pq6 h TYR 370 CO 0.03 0.57 -0.71 0.00 -0.00 0.00 0.00 178.16 178.06 1pq6 h ALA 371 N 1.51 0.80 0.18 3.88 0.00 -0.91 -1.29 119.26 123.43 1pq6 h ALA 371 Ca 0.35 -0.63 -0.31 0.00 0.00 0.00 0.00 54.91 54.33 1pq6 h ALA 371 Cb 0.09 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1pq6 h ALA 371 CO -0.11 0.85 -1.34 -0.07 0.00 0.00 0.00 179.25 178.57 1pq6 h LEU 372 N 0.05 0.70 0.06 0.00 3.38 -0.90 -2.67 115.31 115.93 1pq6 h LEU 372 Ca -0.01 -0.72 -0.00 0.00 0.09 0.00 0.00 57.88 57.23 1pq6 h LEU 372 Cb 1.25 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1pq6 h LEU 372 CO 0.10 1.55 -0.03 0.25 0.09 0.00 0.00 178.44 180.40 1pq6 h LEU 373 N 0.15 -0.07 -0.74 1.67 6.46 -0.97 -0.80 115.31 121.01 1pq6 h LEU 373 Ca -0.20 -0.11 0.10 0.00 -0.12 0.00 0.00 57.88 57.56 1pq6 h LEU 373 Cb 2.04 0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 41.91 1pq6 h LEU 373 CO 0.24 0.06 0.36 0.40 -0.62 0.00 0.00 178.44 178.89 1pq6 h ILE 374 N -0.19 0.82 -0.56 4.05 2.04 -1.32 0.22 117.51 122.56 1pq6 h ILE 374 Ca -0.01 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1pq6 h ILE 374 Cb 0.17 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.39 1pq6 h ILE 374 CO 0.01 0.11 0.27 0.00 0.00 0.00 0.00 178.15 178.54 1pq6 h ALA 375 N 1.46 0.72 -0.83 1.87 0.00 -1.17 0.10 119.26 121.41 1pq6 h ALA 375 Ca 0.37 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1pq6 h ALA 375 Cb 0.43 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1pq6 h ALA 375 CO -0.29 0.28 0.55 0.82 0.00 0.00 0.00 179.25 180.61 1pq6 h ILE 376 N 0.75 1.20 -0.14 0.00 2.04 -0.01 -1.99 117.51 119.36 1pq6 h ILE 376 Ca 0.19 -0.38 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 1pq6 h ILE 376 Cb 0.12 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.17 1pq6 h ILE 376 CO -0.02 0.20 -0.37 -1.13 0.00 0.00 0.00 178.15 176.83 1pq6 h ASN 377 N 1.11 0.31 -0.33 1.72 -0.73 0.06 -2.05 115.58 115.67 1pq6 h ASN 377 Ca 0.31 -0.12 -0.03 0.00 1.87 0.00 0.00 56.30 58.33 1pq6 h ASN 377 Cb -0.11 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.38 1pq6 h ASN 377 CO -0.07 0.65 0.09 0.40 -0.37 0.00 0.00 177.43 178.13 1pq6 h ILE 378 N 0.25 1.22 -1.61 2.57 2.04 -0.75 -3.35 117.51 117.87 1pq6 h ILE 378 Ca 0.03 -0.72 -0.69 0.00 1.00 0.00 0.00 64.86 64.47 1pq6 h ILE 378 Cb 0.77 1.06 -0.21 0.00 -0.74 0.00 0.00 36.82 37.70 1pq6 h ILE 378 CO 0.06 0.24 1.12 0.49 0.00 0.00 0.00 178.15 180.07 1pq6 n PHE 379 N -4.64 2.45 -3.64 1.37 0.99 -0.77 -4.90 117.46 108.32 1pq6 n PHE 379 Ca -0.02 -2.36 -0.37 0.00 -0.00 0.00 0.00 57.45 54.71 1pq6 n PHE 379 Cb 0.19 -1.37 -0.10 0.00 -1.00 0.00 0.00 39.48 37.19 1pq6 n PHE 379 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 1pq6 s SER 380 N -0.43 6.01 0.16 4.37 0.01 -1.25 -4.55 113.70 118.02 1pq6 s SER 380 Ca 0.52 0.03 0.26 0.00 1.31 0.00 0.00 55.95 58.07 1pq6 s SER 380 Cb 0.32 -2.10 0.79 0.00 0.21 0.00 0.00 66.02 65.24 1pq6 s SER 380 CO -0.24 0.00 1.71 0.00 0.41 0.00 0.00 173.24 175.13 1pq6 n ALA 381 N 4.70 2.44 0.53 1.44 0.00 -1.26 -3.53 120.51 124.81 1pq6 n ALA 381 Ca -0.15 -0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.24 1pq6 n ALA 381 Cb 0.52 -1.41 0.15 0.00 0.00 0.00 0.00 19.45 18.71 1pq6 n ALA 381 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1pq6 n ASP 382 N -2.10 2.43 -4.77 0.00 5.75 -1.26 -4.84 116.55 111.76 1pq6 n ASP 382 Ca 0.05 -2.25 -0.34 0.00 -0.01 0.00 0.00 54.79 52.25 1pq6 n ASP 382 Cb 0.42 -0.45 0.03 0.00 -1.03 0.00 0.00 41.12 40.08 1pq6 n ASP 382 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1pq6 s ARG 383 N -1.66 3.03 0.45 0.11 1.81 -1.23 -5.02 118.95 116.43 1pq6 s ARG 383 Ca 0.20 1.50 -0.24 0.00 -1.72 0.00 0.00 55.73 55.48 1pq6 s ARG 383 Cb 0.14 -1.97 -0.08 0.00 -0.45 0.00 0.00 34.95 32.59 1pq6 s ARG 383 CO 0.08 -1.08 1.25 -1.25 -0.68 0.00 0.00 175.30 173.61 1pq6 s PRO 384 N -3.72 3.78 0.00 3.54 0.04 -1.26 -3.80 135.00 133.58 1pq6 s PRO 384 Ca 0.70 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.73 1pq6 s PRO 384 Cb -0.22 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.77 1pq6 s PRO 384 CO 0.35 -0.60 0.00 0.09 0.04 0.00 0.00 177.00 176.88 1pq6 n ASN 385 N -0.27 -4.32 -4.69 6.66 4.13 -1.26 -4.79 115.26 110.71 1pq6 n ASN 385 Ca 0.06 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.90 1pq6 n ASN 385 Cb 0.46 -1.92 -0.03 0.00 -1.54 0.00 0.00 39.78 36.75 1pq6 n ASN 385 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1pq6 s VAL 386 N -1.55 4.28 -0.35 2.41 1.01 -1.25 -4.88 120.40 120.08 1pq6 s VAL 386 Ca 0.00 1.61 0.22 0.00 0.00 0.00 0.00 61.98 63.81 1pq6 s VAL 386 Cb 0.00 -4.04 -0.22 0.00 0.00 0.00 0.00 36.38 32.13 1pq6 s VAL 386 CO 0.00 0.02 0.76 0.00 0.00 0.00 0.00 175.10 175.88 1pq6 n GLN 387 N 4.95 0.46 -3.18 2.72 3.00 -1.26 -4.51 117.38 119.57 1pq6 n GLN 387 Ca 0.10 -0.07 -0.26 0.00 -0.01 0.00 0.00 57.00 56.76 1pq6 n GLN 387 Cb 0.47 -1.58 -0.06 0.00 0.00 0.00 0.00 30.24 29.07 1pq6 n GLN 387 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1pq6 n GLU 388 N -2.13 2.45 0.22 -1.09 1.02 -1.26 -4.92 120.64 114.93 1pq6 n GLU 388 Ca -0.01 -4.45 0.08 0.00 -0.02 0.00 0.00 57.16 52.77 1pq6 n GLU 388 Cb 0.50 -2.08 0.47 0.00 -0.02 0.00 0.00 31.44 30.31 1pq6 n GLU 388 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1pq6 h PRO 389 N 3.54 0.00 -0.72 3.49 0.13 -1.89 -2.09 132.00 134.46 1pq6 h PRO 389 Ca 0.15 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.23 1pq6 h PRO 389 Cb 0.65 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.75 1pq6 h PRO 389 CO 0.75 0.26 0.27 0.78 -0.23 0.00 0.00 178.00 179.83 1pq6 h GLY 390 N 1.69 1.17 2.00 1.56 0.00 -1.96 -2.87 103.07 104.65 1pq6 h GLY 390 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.67 1pq6 h GLY 390 CO 0.03 0.61 0.00 3.21 0.00 0.00 0.00 176.54 180.40 1pq6 h ARG 391 N 1.04 0.00 0.04 4.80 3.08 -1.87 -3.29 114.38 118.17 1pq6 h ARG 391 Ca 0.24 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 60.01 1pq6 h ARG 391 Cb 0.24 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.32 1pq6 h ARG 391 CO -0.02 0.00 -1.12 0.28 -1.07 0.00 0.00 179.97 178.05 1pq6 h VAL 392 N 0.00 1.28 -0.77 2.04 2.07 -1.20 -3.04 116.25 116.62 1pq6 h VAL 392 Ca 0.00 -2.31 0.10 0.00 0.82 0.00 0.00 66.70 65.31 1pq6 h VAL 392 Cb 0.78 2.48 -0.08 0.00 -1.52 0.00 0.00 31.29 32.96 1pq6 h VAL 392 CO 0.00 0.71 0.40 -0.08 0.02 0.00 0.00 177.57 178.63 1pq6 h GLU 393 N 0.36 0.64 -0.17 1.57 4.81 -1.61 -2.42 114.58 117.76 1pq6 h GLU 393 Ca -0.15 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.93 1pq6 h GLU 393 Cb 1.78 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 31.00 1pq6 h GLU 393 CO 0.22 0.42 -0.36 0.00 -0.73 0.00 0.00 179.01 178.56 1pq6 h ALA 394 N 1.46 1.07 -0.02 2.92 0.00 -1.62 -0.44 119.26 122.63 1pq6 h ALA 394 Ca 0.38 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 1pq6 h ALA 394 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1pq6 h ALA 394 CO -0.28 0.58 -0.75 -0.07 0.00 0.00 0.00 179.25 178.74 1pq6 h LEU 395 N 0.31 0.21 -0.48 0.00 3.38 -1.39 -3.24 115.31 114.11 1pq6 h LEU 395 Ca 0.03 -0.15 -0.17 0.00 0.09 0.00 0.00 57.88 57.69 1pq6 h LEU 395 Cb 0.78 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1pq6 h LEU 395 CO 0.06 0.88 -0.74 -0.61 0.09 0.00 0.00 178.44 178.12 1pq6 h GLN 396 N 0.11 0.17 -0.04 1.13 4.15 -0.98 -3.37 115.11 116.28 1pq6 h GLN 396 Ca -0.02 -0.15 -0.00 0.00 0.77 0.00 0.00 58.65 59.24 1pq6 h GLN 396 Cb 1.32 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 29.04 1pq6 h GLN 396 CO 0.11 0.84 0.01 0.37 -1.93 0.00 0.00 178.83 178.23 1pq6 h GLN 397 N 0.11 0.06 -0.73 1.69 5.75 -1.11 -1.41 115.11 119.47 1pq6 h GLN 397 Ca -0.02 -0.01 0.13 0.00 -0.15 0.00 0.00 58.65 58.59 1pq6 h GLN 397 Cb 1.31 -0.01 -0.09 0.00 1.07 0.00 0.00 27.48 29.76 1pq6 h GLN 397 CO 0.11 0.24 0.30 -1.35 -2.65 0.00 0.00 178.83 175.48 1pq6 h PRO 398 N -0.12 0.45 -0.25 -2.39 0.11 -1.73 0.31 132.00 128.37 1pq6 h PRO 398 Ca 0.01 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.02 1pq6 h PRO 398 Cb 0.20 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 1pq6 h PRO 398 CO -0.00 0.30 -0.17 1.88 -0.21 0.00 0.00 178.00 179.80 1pq6 h TYR 399 N 0.46 0.47 -0.28 0.65 -1.99 -1.63 0.38 116.97 115.02 1pq6 h TYR 399 Ca 0.39 -0.08 -0.13 0.00 2.00 0.00 0.00 58.73 60.92 1pq6 h TYR 399 Cb 0.57 -0.12 -0.00 0.00 2.00 0.00 0.00 36.73 39.17 1pq6 h TYR 399 CO -0.16 0.58 -0.32 0.28 -0.00 0.00 0.00 178.16 178.54 1pq6 h VAL 400 N 0.40 1.30 0.00 -2.88 2.07 -0.58 -1.36 116.25 115.20 1pq6 h VAL 400 Ca 0.07 -1.50 -0.07 0.00 0.82 0.00 0.00 66.70 66.02 1pq6 h VAL 400 Cb 0.53 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1pq6 h VAL 400 CO 0.03 0.48 -0.33 -0.33 0.02 0.00 0.00 177.57 177.44 1pq6 h GLU 401 N 0.45 0.00 -0.14 1.57 5.08 -0.56 -1.80 114.58 119.20 1pq6 h GLU 401 Ca 0.04 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 1pq6 h GLU 401 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1pq6 h GLU 401 CO 0.08 0.33 -0.40 0.00 -1.00 0.00 0.00 179.01 178.02 1pq6 h ALA 402 N 1.67 0.23 0.00 3.43 0.00 -0.87 -3.21 119.26 120.51 1pq6 h ALA 402 Ca -0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 1pq6 h ALA 402 Cb 0.64 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1pq6 h ALA 402 CO 0.04 0.34 -0.38 1.25 0.00 0.00 0.00 179.25 180.50 1pq6 h LEU 403 N 0.13 0.00 -0.14 0.00 5.85 -1.04 -2.71 115.31 117.41 1pq6 h LEU 403 Ca -0.01 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.52 1pq6 h LEU 403 Cb 1.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.06 1pq6 h LEU 403 CO 0.09 0.38 -0.65 0.25 -0.34 0.00 0.00 178.44 178.18 1pq6 h LEU 404 N 0.00 0.80 -0.21 2.25 5.85 -1.42 -2.65 115.31 119.93 1pq6 h LEU 404 Ca -0.00 -0.63 -0.22 0.00 0.84 0.00 0.00 57.88 57.87 1pq6 h LEU 404 Cb 0.95 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1pq6 h LEU 404 CO 0.05 1.30 -0.88 0.28 -0.34 0.00 0.00 178.44 178.85 1pq6 h SER 405 N 0.36 0.61 -0.45 1.25 0.02 -1.59 -2.96 113.55 110.80 1pq6 h SER 405 Ca -0.04 -0.46 0.06 0.00 -0.84 0.00 0.00 61.79 60.51 1pq6 h SER 405 Cb 1.28 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 63.58 1pq6 h SER 405 CO 0.13 1.24 0.15 0.22 -1.14 0.00 0.00 176.83 177.43 1pq6 h TYR 406 N 0.30 0.26 0.00 3.45 3.20 -1.46 -2.16 116.97 120.57 1pq6 h TYR 406 Ca -0.07 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1pq6 h TYR 406 Cb 1.50 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 39.72 1pq6 h TYR 406 CO 0.06 0.09 -0.14 1.79 -1.64 0.00 0.00 178.16 178.32 1pq6 h THR 407 N 0.31 0.37 0.00 1.81 1.35 -1.48 -0.59 112.91 114.69 1pq6 h THR 407 Ca 0.21 -0.88 -0.12 0.00 -0.55 0.00 0.00 66.41 65.08 1pq6 h THR 407 Cb 0.22 1.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.27 1pq6 h THR 407 CO -0.22 0.14 -0.55 0.03 -0.25 0.00 0.00 175.52 174.67 1pq6 h ARG 408 N 0.00 0.00 0.01 4.72 3.08 -1.24 -2.96 114.38 118.00 1pq6 h ARG 408 Ca -0.00 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.73 1pq6 h ARG 408 Cb 0.64 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.64 1pq6 h ARG 408 CO 0.02 0.55 -1.93 -0.89 -1.07 0.00 0.00 179.97 176.65 1pq6 n ILE 409 N -3.63 1.56 0.00 2.04 5.41 -0.87 -3.19 119.36 120.67 1pq6 n ILE 409 Ca -0.01 -0.80 0.00 0.00 1.00 0.00 0.00 62.75 62.95 1pq6 n ILE 409 Cb 0.61 -0.95 0.00 0.00 -0.71 0.00 0.00 39.64 38.59 1pq6 n ILE 409 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1pq6 n LYS 410 N -3.00 0.00 -3.90 0.38 4.81 -0.27 -4.59 118.16 111.58 1pq6 n LYS 410 Ca -0.23 0.17 -0.32 0.00 -0.87 0.00 0.00 58.31 57.05 1pq6 n LYS 410 Cb 1.08 -1.09 -0.13 0.00 0.02 0.00 0.00 35.03 34.90 1pq6 n LYS 410 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1pq6 s ARG 411 N -1.47 1.91 0.00 1.64 0.52 -1.12 -4.94 118.95 115.50 1pq6 s ARG 411 Ca 0.00 -2.21 0.20 0.00 -0.52 0.00 0.00 55.73 53.20 1pq6 s ARG 411 Cb 0.00 -3.40 1.22 0.00 0.52 0.00 0.00 34.95 33.30 1pq6 s ARG 411 CO 0.00 -1.06 1.70 -0.35 0.02 0.00 0.00 175.30 175.61 1pq6 n PRO 412 N 3.82 0.85 -0.03 3.54 -0.05 -1.19 -3.20 135.00 138.75 1pq6 n PRO 412 Ca 0.04 0.00 0.05 0.00 -0.05 0.00 0.00 63.50 63.54 1pq6 n PRO 412 Cb 0.38 -1.37 -0.15 0.00 -0.05 0.00 0.00 33.50 32.30 1pq6 n PRO 412 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 175.50 176.49 1pq6 n GLN 413 N -0.87 0.70 -3.55 0.54 1.13 -1.26 -4.70 117.38 109.37 1pq6 n GLN 413 Ca 0.15 -0.14 -0.40 0.00 -1.94 0.00 0.00 57.00 54.68 1pq6 n GLN 413 Cb 0.07 -1.47 -0.05 0.00 0.11 0.00 0.00 30.24 28.90 1pq6 n GLN 413 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1pq6 s ASP 414 N -4.51 6.25 0.00 1.08 2.15 -1.19 -4.91 116.67 115.53 1pq6 s ASP 414 Ca -0.08 -3.40 0.22 0.00 0.43 0.00 0.00 52.55 49.72 1pq6 s ASP 414 Cb 0.11 -2.00 1.30 0.00 -0.30 0.00 0.00 42.92 42.02 1pq6 s ASP 414 CO 0.80 -0.29 1.84 1.67 -0.17 0.00 0.00 175.17 179.02 1pq6 n GLN 415 N 2.84 1.03 0.00 4.34 7.27 -1.26 -2.94 117.38 128.66 1pq6 n GLN 415 Ca 0.18 -0.04 0.12 0.00 0.07 0.00 0.00 57.00 57.33 1pq6 n GLN 415 Cb 0.39 -1.35 0.07 0.00 2.41 0.00 0.00 30.24 31.77 1pq6 n GLN 415 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1pq6 n LEU 416 N -0.80 2.35 -0.10 1.69 4.77 -1.26 -4.38 117.00 119.26 1pq6 n LEU 416 Ca 0.17 -0.82 -0.12 0.00 -0.03 0.00 0.00 56.01 55.20 1pq6 n LEU 416 Cb 0.09 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1pq6 n LEU 416 CO 0.12 0.41 0.67 -0.09 -1.33 0.00 0.00 177.39 177.18 1pq6 h ARG 417 N 3.28 0.62 0.14 3.23 2.43 -1.93 -2.39 114.38 119.76 1pq6 h ARG 417 Ca 0.00 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1pq6 h ARG 417 Cb 0.83 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 1pq6 h ARG 417 CO 0.00 0.84 -0.07 0.35 -1.51 0.00 0.00 179.97 179.59 1pq6 h PHE 418 N 0.38 -0.17 -0.50 2.20 3.57 -1.80 -1.79 116.94 118.83 1pq6 h PHE 418 Ca 0.07 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1pq6 h PHE 418 Cb 0.65 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 1pq6 h PHE 418 CO 0.06 -0.10 0.26 -1.35 -2.23 0.00 0.00 178.31 174.95 1pq6 h PRO 419 N -0.19 0.69 -0.57 6.41 0.11 -1.81 -2.26 132.00 134.36 1pq6 h PRO 419 Ca -0.02 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 1pq6 h PRO 419 Cb 0.15 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.09 1pq6 h PRO 419 CO 0.03 0.52 0.16 0.00 -0.21 0.00 0.00 178.00 178.50 1pq6 h ARG 420 N 0.69 0.87 -0.58 1.05 3.08 -1.10 0.96 114.38 119.35 1pq6 h ARG 420 Ca 0.18 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 1pq6 h ARG 420 Cb 0.04 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 1pq6 h ARG 420 CO -0.03 0.76 0.06 0.52 -1.07 0.00 0.00 179.97 180.21 1pq6 h MET 421 N 0.84 0.96 -0.01 0.04 2.86 -0.76 -2.42 114.93 116.43 1pq6 h MET 421 Ca 0.19 -0.26 -0.16 0.00 -2.06 0.00 0.00 59.70 57.41 1pq6 h MET 421 Cb 0.27 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 1pq6 h MET 421 CO -0.01 0.91 -0.71 -0.07 1.06 0.00 0.00 176.91 178.09 1pq6 h LEU 422 N 0.90 0.11 -2.27 1.22 3.38 -1.06 -2.82 115.31 114.76 1pq6 h LEU 422 Ca 0.18 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1pq6 h LEU 422 Cb 0.45 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1pq6 h LEU 422 CO 0.02 0.79 -0.05 0.24 0.09 0.00 0.00 178.44 179.52 1pq6 h MET 423 N 0.06 0.00 0.00 1.13 2.86 -0.35 -2.14 114.93 116.48 1pq6 h MET 423 Ca -0.01 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 1pq6 h MET 423 Cb 1.26 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.91 1pq6 h MET 423 CO 0.10 0.05 -0.40 0.87 1.06 0.00 0.00 176.91 178.59 1pq6 h LYS 424 N 0.00 0.00 -0.50 1.72 1.79 -1.20 -2.64 116.57 115.74 1pq6 h LYS 424 Ca -0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1pq6 h LYS 424 Cb 0.18 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1pq6 h LYS 424 CO 0.01 0.40 0.28 -0.07 -1.08 0.00 0.00 179.45 178.98 1pq6 h LEU 425 N 0.00 0.60 -0.50 2.94 3.38 -1.47 0.03 115.31 120.29 1pq6 h LEU 425 Ca -0.00 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1pq6 h LEU 425 Cb 1.00 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1pq6 h LEU 425 CO 0.05 0.48 -0.03 0.58 0.09 0.00 0.00 178.44 179.61 1pq6 h VAL 426 N 0.69 1.27 -0.61 1.22 2.07 -1.52 -2.81 116.25 116.55 1pq6 h VAL 426 Ca 0.18 -1.13 -0.05 0.00 0.82 0.00 0.00 66.70 66.51 1pq6 h VAL 426 Cb 0.01 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1pq6 h VAL 426 CO -0.03 0.40 0.17 0.28 0.02 0.00 0.00 177.57 178.41 1pq6 h SER 427 N 0.77 0.91 -0.76 0.57 0.02 -1.18 -2.68 113.55 111.19 1pq6 h SER 427 Ca 0.14 -0.22 0.07 0.00 -0.84 0.00 0.00 61.79 60.94 1pq6 h SER 427 Cb 0.56 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 62.81 1pq6 h SER 427 CO 0.03 0.89 0.50 -0.07 -1.14 0.00 0.00 176.83 177.04 1pq6 h LEU 428 N 0.88 0.68 -0.46 5.07 3.38 -0.86 -1.59 115.31 122.42 1pq6 h LEU 428 Ca 0.19 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1pq6 h LEU 428 Cb 0.32 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1pq6 h LEU 428 CO -0.00 0.43 0.22 0.03 0.09 0.00 0.00 178.44 179.21 1pq6 h ARG 429 N 0.77 0.66 -0.77 1.13 2.47 -1.23 -2.55 114.38 114.87 1pq6 h ARG 429 Ca 0.33 -0.10 -0.04 0.00 -1.26 0.00 0.00 59.98 58.91 1pq6 h ARG 429 Cb 0.31 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.48 1pq6 h ARG 429 CO -0.12 0.56 0.31 1.15 0.56 0.00 0.00 179.97 182.43 1pq6 h THR 430 N 0.59 1.26 0.00 2.04 2.02 -1.16 -2.58 112.91 115.08 1pq6 h THR 430 Ca 0.16 -0.81 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 1pq6 h THR 430 Cb 0.12 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1pq6 h THR 430 CO -0.02 0.33 -0.20 -0.07 0.37 0.00 0.00 175.52 175.93 1pq6 h LEU 431 N 1.12 0.00 -0.70 2.58 4.07 -1.20 -2.22 115.31 118.96 1pq6 h LEU 431 Ca 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.20 1pq6 h LEU 431 Cb 0.21 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.92 1pq6 h LEU 431 CO -0.02 0.20 0.36 0.28 -1.08 0.00 0.00 178.44 178.18 1pq6 h SER 432 N 0.00 0.90 -0.46 -0.43 0.02 -1.03 -0.93 113.55 111.61 1pq6 h SER 432 Ca -0.00 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 60.70 1pq6 h SER 432 Cb 0.40 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1pq6 h SER 432 CO 0.03 0.76 -0.23 0.28 -1.14 0.00 0.00 176.83 176.52 1pq6 h SER 433 N 0.97 1.01 -0.79 3.07 0.02 -1.41 -1.65 113.55 114.77 1pq6 h SER 433 Ca 0.24 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.83 1pq6 h SER 433 Cb 0.08 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 1pq6 h SER 433 CO -0.03 1.19 0.52 0.58 -1.14 0.00 0.00 176.83 177.95 1pq6 h VAL 434 N 0.85 1.13 -0.54 2.27 2.07 -1.36 -1.95 116.25 118.72 1pq6 h VAL 434 Ca 0.11 -0.33 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 1pq6 h VAL 434 Cb 0.81 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1pq6 h VAL 434 CO 0.07 0.18 -0.04 -0.74 0.02 0.00 0.00 177.57 177.06 1pq6 h HIS 435 N 0.98 1.09 0.00 1.57 6.17 -0.86 -2.32 115.15 121.77 1pq6 h HIS 435 Ca 0.31 -0.20 -0.04 0.00 0.71 0.00 0.00 60.37 61.15 1pq6 h HIS 435 Cb 0.03 -0.28 -0.01 0.00 2.52 0.00 0.00 27.41 29.68 1pq6 h HIS 435 CO -0.00 1.00 -0.19 0.77 0.71 0.00 0.00 177.93 180.22 1pq6 h SER 436 N 0.87 0.00 0.73 3.26 0.02 -0.79 -1.61 113.55 116.03 1pq6 h SER 436 Ca 0.15 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.91 1pq6 h SER 436 Cb 0.59 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.11 1pq6 h SER 436 CO 0.04 0.19 -0.88 -0.33 -1.14 0.00 0.00 176.83 174.71 1pq6 h GLU 437 N 0.00 0.09 -0.41 3.45 5.08 -1.12 -2.87 114.58 118.80 1pq6 h GLU 437 Ca -0.00 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.13 1pq6 h GLU 437 Cb 0.50 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1pq6 h GLU 437 CO 0.02 0.91 -0.23 0.37 -1.00 0.00 0.00 179.01 179.08 1pq6 h GLN 438 N 0.05 0.87 -0.13 2.33 5.75 -0.77 -1.76 115.11 121.45 1pq6 h GLN 438 Ca -0.03 -0.39 -0.08 0.00 -0.15 0.00 0.00 58.65 57.99 1pq6 h GLN 438 Cb 1.52 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 30.04 1pq6 h GLN 438 CO 0.12 1.04 -0.29 -0.39 -2.65 0.00 0.00 178.83 176.66 1pq6 h VAL 439 N 0.69 1.26 -0.06 2.39 -1.51 -1.39 -1.83 116.25 115.80 1pq6 h VAL 439 Ca 0.09 -1.23 -0.11 0.00 -1.23 0.00 0.00 66.70 64.22 1pq6 h VAL 439 Cb 0.79 1.49 -0.01 0.00 -2.13 0.00 0.00 31.29 31.43 1pq6 h VAL 439 CO 0.07 0.37 -0.45 0.15 -1.23 0.00 0.00 177.57 176.48 1pq6 h PHE 440 N 0.23 0.17 0.00 5.19 3.57 -1.44 -2.97 116.94 121.68 1pq6 h PHE 440 Ca 0.03 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.39 1pq6 h PHE 440 Cb 0.64 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1pq6 h PHE 440 CO 0.01 0.58 -0.44 0.00 -2.23 0.00 0.00 178.31 176.22 1pq6 h ALA 441 N 1.42 1.03 -0.23 2.41 0.00 -0.61 -3.00 119.26 120.29 1pq6 h ALA 441 Ca 0.01 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 1pq6 h ALA 441 Cb 0.85 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1pq6 h ALA 441 CO 0.07 0.56 -0.43 -0.07 0.00 0.00 0.00 179.25 179.37 1pq6 h LEU 442 N 0.00 0.59 0.93 0.00 3.38 -1.21 -3.31 115.31 115.69 1pq6 h LEU 442 Ca -0.00 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1pq6 h LEU 442 Cb 0.92 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.51 1pq6 h LEU 442 CO 0.06 0.95 -0.45 0.03 0.09 0.00 0.00 178.44 179.12 1pq6 h ARG 443 N 0.45 -1.20 -0.98 1.13 3.08 -1.42 -3.43 114.38 112.01 1pq6 h ARG 443 Ca 0.03 0.08 -0.49 0.00 0.07 0.00 0.00 59.98 59.68 1pq6 h ARG 443 Cb 0.94 0.27 -0.42 0.00 0.08 0.00 0.00 29.97 30.85 1pq6 h ARG 443 CO 0.08 -0.80 -0.89 1.28 -1.07 0.00 0.00 179.97 178.57 1pq6 n LEU 444 N -5.50 3.87 -4.00 3.04 4.32 -1.17 -5.14 117.00 112.41 1pq6 n LEU 444 Ca -0.15 -4.49 -0.13 0.00 -0.02 0.00 0.00 56.01 51.22 1pq6 n LEU 444 Cb 0.49 -0.15 -0.12 0.00 -1.62 0.00 0.00 43.42 42.02 1pq6 n LEU 444 CO 0.37 1.91 -0.39 -0.75 -1.22 0.00 0.00 177.39 177.31 1pq6 s LYS 448 N -3.55 0.40 0.09 3.23 2.20 -1.26 -4.82 119.74 116.03 1pq6 s LYS 448 Ca 0.43 -0.51 -0.03 0.00 -0.36 0.00 0.00 55.97 55.50 1pq6 s LYS 448 Cb 0.40 -0.21 -0.05 0.00 -1.51 0.00 0.00 37.83 36.47 1pq6 s LYS 448 CO -0.05 0.04 0.30 -0.51 -0.36 0.00 0.00 175.35 174.77 1pq6 s LEU 449 N -1.04 4.32 0.87 5.43 1.02 -1.26 -5.11 118.68 122.91 1pq6 s LEU 449 Ca -0.07 0.46 -0.12 0.00 0.02 0.00 0.00 54.13 54.42 1pq6 s LEU 449 Cb -0.07 -3.08 0.11 0.00 0.02 0.00 0.00 46.19 43.18 1pq6 s LEU 449 CO -0.00 0.13 1.10 -2.16 0.02 0.00 0.00 176.35 175.44 1pq6 s PRO 450 N -2.46 1.48 0.11 1.29 0.04 -1.26 -4.76 135.00 129.45 1pq6 s PRO 450 Ca 0.37 0.65 -0.20 0.00 0.04 0.00 0.00 61.00 61.86 1pq6 s PRO 450 Cb -0.13 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 1pq6 s PRO 450 CO 0.25 -2.04 1.72 -1.35 0.04 0.00 0.00 177.00 175.62 1pq6 h PRO 451 N -1.40 0.29 -0.64 0.56 0.11 -1.99 -1.58 132.00 127.35 1pq6 h PRO 451 Ca -0.49 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 1pq6 h PRO 451 Cb 1.29 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1pq6 h PRO 451 CO 0.58 0.25 0.27 1.25 -0.21 0.00 0.00 178.00 180.14 1pq6 h LEU 452 N 0.24 0.84 -0.32 2.35 5.85 -2.01 -2.35 115.31 119.90 1pq6 h LEU 452 Ca 0.07 -0.10 -0.19 0.00 0.84 0.00 0.00 57.88 58.50 1pq6 h LEU 452 Cb 0.04 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 1pq6 h LEU 452 CO -0.01 0.73 -0.84 -0.07 -0.34 0.00 0.00 178.44 177.91 1pq6 h LEU 453 N 0.91 0.26 -0.20 2.25 3.38 -1.93 -3.32 115.31 116.67 1pq6 h LEU 453 Ca 0.22 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pq6 h LEU 453 Cb 0.14 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1pq6 h LEU 453 CO -0.02 0.99 0.00 -0.24 0.09 0.00 0.00 178.44 179.26 1pq6 n SER 454 N -3.69 0.24 -0.03 -0.43 2.88 -0.60 -1.99 113.62 110.01 1pq6 n SER 454 Ca -0.03 0.55 0.03 0.00 -1.33 0.00 0.00 58.87 58.08 1pq6 n SER 454 Cb 0.78 -0.61 -0.11 0.00 -0.75 0.00 0.00 64.21 63.52 1pq6 n SER 454 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1pq6 n GLU 455 N -1.76 0.89 0.09 -1.46 -0.58 -1.13 -2.93 120.64 113.77 1pq6 n GLU 455 Ca 0.04 -0.09 -0.06 0.00 -0.42 0.00 0.00 57.16 56.62 1pq6 n GLU 455 Cb 0.22 -1.35 0.01 0.00 -0.57 0.00 0.00 31.44 29.75 1pq6 n GLU 455 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1pq6 h ILE 456 N 0.00 1.53 0.00 -3.67 2.04 -1.63 -3.40 117.51 112.39 1pq6 h ILE 456 Ca -0.13 -2.68 0.00 0.00 1.00 0.00 0.00 64.86 63.05 1pq6 h ILE 456 Cb 1.07 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.63 1pq6 h ILE 456 CO 0.01 0.77 -0.98 0.79 0.00 0.00 0.00 178.15 178.74 1pq6 n TRP 457 N -3.62 0.00 -0.80 1.37 8.01 -0.84 -4.65 117.44 116.90 1pq6 n TRP 457 Ca -0.02 0.00 -0.12 0.00 -1.31 0.00 0.00 57.50 56.05 1pq6 n TRP 457 Cb 0.79 0.00 0.02 0.00 -2.01 0.00 0.00 31.31 30.11 1pq6 n TRP 457 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1pq6 n ASP 458 N -1.99 6.15 -0.21 -0.99 -0.08 -1.15 -4.09 116.55 114.19 1pq6 n ASP 458 Ca 0.00 -2.88 -0.06 0.00 -1.51 0.00 0.00 54.79 50.34 1pq6 n ASP 458 Cb 0.49 -1.09 0.04 0.00 2.34 0.00 0.00 41.12 42.90 1pq6 n ASP 458 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1pq6 h VAL 459 N 1.04 1.16 0.00 5.18 2.07 -1.78 -3.45 116.25 120.47 1pq6 h VAL 459 Ca 0.21 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1pq6 h VAL 459 Cb 0.94 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1pq6 h VAL 459 CO 0.55 0.16 0.00 0.00 0.02 0.00 0.00 177.57 178.30