#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pex s PRO 275 N 0.00 4.75 -0.34 -2.82 0.02 -1.26 -5.02 135.00 130.34 1pex s PRO 275 Ca 0.00 1.62 -0.21 0.00 0.02 0.00 0.00 61.00 62.43 1pex s PRO 275 Cb 0.00 -3.25 -0.00 0.00 0.02 0.00 0.00 34.50 31.27 1pex s PRO 275 CO 0.00 0.36 0.65 0.34 -0.33 0.00 0.00 177.00 178.02 1pex s ASP 276 N -0.92 6.47 0.41 2.53 -1.08 -1.26 -4.94 116.67 117.88 1pex s ASP 276 Ca 0.43 0.28 0.23 0.00 -0.52 0.00 0.00 52.55 52.97 1pex s ASP 276 Cb -0.28 -2.34 1.22 0.00 -1.46 0.00 0.00 42.92 40.06 1pex s ASP 276 CO 0.35 -0.56 1.72 0.50 0.52 0.00 0.00 175.17 177.70 1pex h LYS 277 N 8.35 0.27 0.00 4.34 3.64 -1.99 -1.87 116.57 129.31 1pex h LYS 277 Ca -0.26 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1pex h LYS 277 Cb 1.11 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1pex h LYS 277 CO 0.83 0.18 -0.02 0.00 -2.27 0.00 0.00 179.45 178.17 1pex s ASP 279 N -2.19 5.75 0.00 0.00 2.15 -0.70 -4.73 116.67 116.95 1pex s ASP 279 Ca 0.21 2.14 0.00 0.00 0.43 0.00 0.00 52.55 55.32 1pex s ASP 279 Cb 0.18 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 1pex s ASP 279 CO 0.02 -1.69 0.22 -0.81 -0.17 0.00 0.00 175.17 172.73 1pex n PRO 280 N 8.40 0.35 0.00 4.34 -0.04 -1.26 0.25 135.00 147.04 1pex n PRO 280 Ca 0.27 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1pex n PRO 280 Cb 0.44 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 1pex n PRO 280 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1pex n SER 281 N 0.13 1.24 -4.74 3.54 2.88 -1.26 -5.00 113.62 110.42 1pex n SER 281 Ca 0.00 -1.42 -0.42 0.00 -1.33 0.00 0.00 58.87 55.70 1pex n SER 281 Cb 0.07 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.50 1pex n SER 281 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1pex s LEU 282 N -0.42 4.37 0.16 2.46 2.96 0.14 -4.75 118.68 123.59 1pex s LEU 282 Ca 0.00 2.76 0.10 0.00 -0.22 0.00 0.00 54.13 56.77 1pex s LEU 282 Cb 0.00 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.03 1pex s LEU 282 CO 0.00 -0.82 -0.23 -0.44 -1.32 0.00 0.00 176.35 173.54 1pex s SER 283 N 0.67 3.06 0.13 3.68 0.01 -1.26 -4.21 113.70 115.78 1pex s SER 283 Ca 0.65 -0.81 0.08 0.00 1.31 0.00 0.00 55.95 57.18 1pex s SER 283 Cb -0.45 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.54 1pex s SER 283 CO 0.41 0.08 -0.13 -0.76 0.41 0.00 0.00 173.24 173.25 1pex s LEU 284 N -2.40 2.91 -0.02 2.44 1.43 -1.26 -4.98 118.68 116.80 1pex s LEU 284 Ca 0.15 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 1pex s LEU 284 Cb -0.08 -1.69 -0.25 0.00 0.03 0.00 0.00 46.19 44.20 1pex s LEU 284 CO 0.07 0.16 0.76 0.44 0.23 0.00 0.00 176.35 178.01 1pex h ASP 285 N 3.46 0.20 -5.58 2.29 3.32 -1.28 -3.40 116.42 115.43 1pex h ASP 285 Ca -0.49 -0.34 0.26 0.00 0.02 0.00 0.00 57.03 56.48 1pex h ASP 285 Cb 1.18 -0.07 -0.10 0.00 0.22 0.00 0.00 39.33 40.56 1pex h ASP 285 CO 0.51 1.30 0.67 0.00 -1.72 0.00 0.00 179.24 180.00 1pex s ALA 286 N -2.61 -1.97 -0.27 3.45 0.00 -1.14 -4.39 121.76 114.81 1pex s ALA 286 Ca -0.08 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.15 1pex s ALA 286 Cb 0.08 0.49 0.08 0.00 0.00 0.00 0.00 23.12 23.77 1pex s ALA 286 CO 0.83 -1.05 0.67 0.42 0.00 0.00 0.00 175.76 176.63 1pex s ILE 287 N -2.81 -0.04 0.00 0.00 1.01 -1.26 -1.31 121.20 116.79 1pex s ILE 287 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.79 1pex s ILE 287 Cb 0.02 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1pex s ILE 287 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 174.94 175.34 1pex n THR 288 N 4.37 0.00 -3.81 2.92 -1.04 -0.84 -4.57 114.28 111.30 1pex n THR 288 Ca -0.20 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.69 1pex n THR 288 Cb 0.58 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.97 1pex n THR 288 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1pex s SER 289 N 0.24 -0.17 -0.21 8.00 0.15 -1.26 -2.71 113.70 117.74 1pex s SER 289 Ca 0.00 0.32 -0.02 0.00 0.70 0.00 0.00 55.95 56.95 1pex s SER 289 Cb 0.00 0.35 0.07 0.00 -1.71 0.00 0.00 66.02 64.72 1pex s SER 289 CO 0.00 -0.08 0.04 -0.22 1.20 0.00 0.00 173.24 174.18 1pex s LEU 290 N 0.01 1.33 -1.15 3.45 2.96 0.47 -4.55 118.68 121.20 1pex s LEU 290 Ca -0.01 -0.93 -0.29 0.00 -0.22 0.00 0.00 54.13 52.67 1pex s LEU 290 Cb -0.02 -0.64 0.04 0.00 0.50 0.00 0.00 46.19 46.07 1pex s LEU 290 CO 0.00 -0.32 0.67 -2.11 -1.32 0.00 0.00 176.35 173.28 1pex n ARG 291 N 5.02 -0.46 -1.74 1.98 1.85 -1.26 0.55 116.66 122.60 1pex n ARG 291 Ca -0.08 0.19 -0.20 0.00 -1.00 0.00 0.00 57.85 56.75 1pex n ARG 291 Cb 0.46 -2.51 -0.07 0.00 -1.05 0.00 0.00 32.46 29.29 1pex n ARG 291 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1pex n GLY 292 N -2.02 1.47 3.04 2.89 0.00 -1.26 -4.95 105.19 104.35 1pex n GLY 292 Ca -0.14 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 1pex n GLY 292 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pex s GLU 293 N -3.97 2.28 0.01 1.61 2.02 0.19 -4.62 118.70 116.22 1pex s GLU 293 Ca 0.00 -0.56 -0.27 0.00 0.02 0.00 0.00 54.97 54.16 1pex s GLU 293 Cb 0.00 -2.02 -0.04 0.00 0.10 0.00 0.00 34.13 32.16 1pex s GLU 293 CO 0.00 -0.16 0.84 0.99 0.02 0.00 0.00 175.26 176.94 1pex s THR 294 N 1.27 4.81 -0.19 3.63 2.01 -0.90 0.18 115.64 126.46 1pex s THR 294 Ca 0.00 1.76 -0.00 0.00 0.31 0.00 0.00 61.69 63.76 1pex s THR 294 Cb -0.14 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.20 1pex s THR 294 CO -0.07 0.27 -0.16 -0.04 -0.69 0.00 0.00 174.62 173.94 1pex s MET 295 N 0.45 3.10 -0.22 4.92 -1.94 -1.10 -0.20 119.30 124.31 1pex s MET 295 Ca 0.43 -0.77 -0.04 0.00 -1.71 0.00 0.00 55.69 53.59 1pex s MET 295 Cb -0.20 -2.69 -0.01 0.00 2.01 0.00 0.00 34.83 33.94 1pex s MET 295 CO 0.24 -0.20 -0.02 0.42 -0.01 0.00 0.00 175.02 175.45 1pex s ILE 296 N 1.32 3.57 -0.15 2.53 1.01 -0.39 -1.98 121.20 127.12 1pex s ILE 296 Ca 0.05 -0.43 -0.13 0.00 0.00 0.00 0.00 60.65 60.14 1pex s ILE 296 Cb -0.13 -2.63 -0.05 0.00 0.01 0.00 0.00 42.46 39.66 1pex s ILE 296 CO -0.10 0.41 0.27 -0.36 0.00 0.00 0.00 174.94 175.16 1pex s PHE 297 N 1.44 3.49 -0.19 3.97 0.40 -0.42 -0.01 117.98 126.66 1pex s PHE 297 Ca 0.05 0.59 -0.04 0.00 -0.60 0.00 0.00 56.93 56.93 1pex s PHE 297 Cb -0.14 -2.28 0.08 0.00 0.51 0.00 0.00 43.02 41.19 1pex s PHE 297 CO -0.02 0.32 0.19 0.21 0.70 0.00 0.00 175.22 176.63 1pex s LYS 298 N 0.19 0.15 7.76 0.44 2.47 -0.77 -0.96 119.74 129.03 1pex s LYS 298 Ca 0.16 0.15 0.00 0.00 -1.56 0.00 0.00 55.97 54.72 1pex s LYS 298 Cb -0.13 -1.32 0.00 0.00 -1.46 0.00 0.00 37.83 34.92 1pex s LYS 298 CO 0.04 -0.65 0.00 -0.25 0.16 0.00 0.00 175.35 174.65 1pex n ASP 299 N 5.31 0.00 -1.64 1.43 8.00 -1.26 -1.38 116.55 127.01 1pex n ASP 299 Ca -0.06 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.53 1pex n ASP 299 Cb 0.49 0.00 0.36 0.00 -0.02 0.00 0.00 41.12 41.96 1pex n ASP 299 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1pex n ARG 300 N 13.44 3.95 -4.26 -1.24 1.85 -1.24 -4.44 116.66 124.72 1pex n ARG 300 Ca 0.00 -2.85 -0.25 0.00 -1.00 0.00 0.00 57.85 53.75 1pex n ARG 300 Cb 0.00 -1.98 -0.08 0.00 -1.05 0.00 0.00 32.46 29.35 1pex n ARG 300 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1pex s PHE 301 N -2.06 2.58 -0.20 2.89 0.40 -0.48 -0.70 117.98 120.42 1pex s PHE 301 Ca 0.51 -0.55 -0.20 0.00 -0.60 0.00 0.00 56.93 56.09 1pex s PHE 301 Cb 0.34 -1.78 0.05 0.00 0.51 0.00 0.00 43.02 42.15 1pex s PHE 301 CO 0.22 0.32 0.56 -0.59 0.70 0.00 0.00 175.22 176.42 1pex s PHE 302 N -2.58 -0.60 -0.07 0.36 -0.12 -0.88 -1.85 117.98 112.23 1pex s PHE 302 Ca 0.38 1.44 -0.06 0.00 -0.05 0.00 0.00 56.93 58.64 1pex s PHE 302 Cb 0.03 0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 1pex s PHE 302 CO 0.21 -0.31 0.18 -1.58 -0.05 0.00 0.00 175.22 173.67 1pex s TRP 303 N 0.18 3.59 -0.11 3.49 0.52 0.99 -1.44 118.94 126.16 1pex s TRP 303 Ca -0.01 0.51 0.00 0.00 0.02 0.00 0.00 56.10 56.62 1pex s TRP 303 Cb -0.04 -1.93 -0.02 0.00 -1.15 0.00 0.00 33.47 30.33 1pex s TRP 303 CO 0.01 0.69 -0.12 0.50 0.02 0.00 0.00 176.95 178.05 1pex s ARG 304 N -1.37 3.19 0.11 4.98 3.52 0.97 -1.26 118.95 129.08 1pex s ARG 304 Ca 0.20 -0.67 0.10 0.00 -0.13 0.00 0.00 55.73 55.24 1pex s ARG 304 Cb -0.13 -2.59 -0.04 0.00 -1.56 0.00 0.00 34.95 30.63 1pex s ARG 304 CO 0.10 0.32 -0.26 -0.51 -0.81 0.00 0.00 175.30 174.15 1pex s LEU 305 N 0.06 2.29 0.30 -0.88 1.02 0.73 -2.73 118.68 119.46 1pex s LEU 305 Ca -0.05 -0.71 0.09 0.00 0.02 0.00 0.00 54.13 53.48 1pex s LEU 305 Cb -0.14 -1.17 -0.04 0.00 0.02 0.00 0.00 46.19 44.85 1pex s LEU 305 CO 0.04 0.17 0.07 -2.28 0.02 0.00 0.00 176.35 174.38 1pex s HIS 306 N -1.03 2.73 -0.91 0.29 2.46 -1.26 -2.11 115.29 115.46 1pex s HIS 306 Ca 0.12 -0.28 -0.21 0.00 0.47 0.00 0.00 55.06 55.16 1pex s HIS 306 Cb -0.10 -1.39 0.09 0.00 -0.13 0.00 0.00 32.58 31.05 1pex s HIS 306 CO 0.05 0.50 1.21 -1.25 -2.47 0.00 0.00 174.74 172.77 1pex s PRO 307 N -3.76 3.50 0.00 2.88 0.04 -1.26 -4.62 135.00 131.78 1pex s PRO 307 Ca 0.34 -1.35 0.00 0.00 0.04 0.00 0.00 61.00 60.03 1pex s PRO 307 Cb -0.05 -4.90 0.00 0.00 0.04 0.00 0.00 34.50 29.59 1pex s PRO 307 CO 0.21 -1.93 0.00 0.94 0.04 0.00 0.00 177.00 176.27 1pex n GLN 308 N 7.56 0.00 0.00 4.56 7.27 -1.26 -5.09 117.38 130.43 1pex n GLN 308 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.28 1pex n GLN 308 Cb 0.49 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.14 1pex n GLN 308 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 1pex n GLN 309 N 0.00 0.00 -3.49 3.69 1.13 -1.26 -5.15 117.38 112.30 1pex n GLN 309 Ca 0.00 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.85 1pex n GLN 309 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.34 1pex n GLN 309 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1pex s VAL 310 N -1.50 2.44 0.05 5.09 -7.23 -1.26 -5.01 120.40 112.98 1pex s VAL 310 Ca 0.00 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 58.88 1pex s VAL 310 Cb 0.00 -2.73 0.00 0.00 0.56 0.00 0.00 36.38 34.21 1pex s VAL 310 CO 0.00 0.00 0.00 -0.67 -0.31 0.00 0.00 175.10 174.12 1pex n ASP 311 N -1.71 -1.23 -2.74 4.85 -0.08 -1.26 -4.84 116.55 109.53 1pex n ASP 311 Ca 0.05 0.13 -0.03 0.00 -1.51 0.00 0.00 54.79 53.43 1pex n ASP 311 Cb 0.62 0.49 0.02 0.00 2.34 0.00 0.00 41.12 44.58 1pex n ASP 311 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1pex s ALA 312 N -3.05 -3.52 0.66 -1.67 0.00 -1.26 -4.68 121.76 108.24 1pex s ALA 312 Ca 0.00 0.27 -0.16 0.00 0.00 0.00 0.00 51.96 52.06 1pex s ALA 312 Cb 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 20.24 1pex s ALA 312 CO 0.00 -2.41 1.18 -1.21 0.00 0.00 0.00 175.76 173.32 1pex s GLU 313 N 1.07 2.62 -0.18 0.00 0.41 -1.11 -4.74 118.70 116.79 1pex s GLU 313 Ca 0.25 1.68 -0.00 0.00 -0.41 0.00 0.00 54.97 56.49 1pex s GLU 313 Cb 0.07 -1.90 0.04 0.00 -1.78 0.00 0.00 34.13 30.56 1pex s GLU 313 CO -0.09 -1.44 -0.06 -1.17 -0.49 0.00 0.00 175.26 172.00 1pex s LEU 314 N -4.67 1.81 0.41 1.80 2.96 -1.26 -0.02 118.68 119.71 1pex s LEU 314 Ca 0.73 -0.74 0.07 0.00 -0.22 0.00 0.00 54.13 53.98 1pex s LEU 314 Cb -0.27 -1.00 -0.06 0.00 0.50 0.00 0.00 46.19 45.36 1pex s LEU 314 CO 0.39 -0.18 0.15 -0.36 -1.32 0.00 0.00 176.35 175.04 1pex s PHE 315 N 1.57 2.60 0.35 5.38 0.40 -0.52 -4.94 117.98 122.80 1pex s PHE 315 Ca -0.00 -0.59 -0.15 0.00 -0.60 0.00 0.00 56.93 55.59 1pex s PHE 315 Cb -0.16 -1.92 -0.09 0.00 0.51 0.00 0.00 43.02 41.37 1pex s PHE 315 CO -0.08 0.23 0.77 -0.51 0.70 0.00 0.00 175.22 176.33 1pex s LEU 316 N -3.87 4.02 0.12 -0.37 1.02 -1.26 -2.08 118.68 116.25 1pex s LEU 316 Ca 0.40 1.32 -0.13 0.00 0.02 0.00 0.00 54.13 55.74 1pex s LEU 316 Cb 0.04 -4.14 -0.08 0.00 0.02 0.00 0.00 46.19 42.04 1pex s LEU 316 CO 0.22 -0.25 1.42 0.74 0.02 0.00 0.00 176.35 178.50 1pex h THR 317 N 1.85 1.29 0.00 5.49 2.02 -1.20 -3.08 112.91 119.29 1pex h THR 317 Ca -0.48 -1.57 0.00 0.00 0.77 0.00 0.00 66.41 65.13 1pex h THR 317 Cb 1.18 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 1pex h THR 317 CO 0.65 0.51 0.00 0.29 0.37 0.00 0.00 175.52 177.34 1pex n LYS 318 N -4.14 0.09 -0.13 6.66 4.76 -1.26 -1.24 118.16 122.90 1pex n LYS 318 Ca -0.04 0.19 -0.11 0.00 -2.87 0.00 0.00 58.31 55.49 1pex n LYS 318 Cb 0.54 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 32.21 1pex n LYS 318 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1pex h SER 319 N 0.00 0.70 0.09 4.39 0.87 -1.91 -3.22 113.55 114.46 1pex h SER 319 Ca 0.00 -0.35 -0.31 0.00 -1.23 0.00 0.00 61.79 59.91 1pex h SER 319 Cb 0.23 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 1pex h SER 319 CO 0.00 0.88 -1.65 -0.26 -0.53 0.00 0.00 176.83 175.27 1pex h PHE 320 N 0.50 0.34 -2.40 2.24 -1.00 -1.41 -3.45 116.94 111.77 1pex h PHE 320 Ca 0.10 -0.25 -0.57 0.00 2.81 0.00 0.00 57.97 60.06 1pex h PHE 320 Cb 0.56 -0.01 -0.38 0.00 3.61 0.00 0.00 35.95 39.73 1pex h PHE 320 CO 0.05 1.65 -0.91 -1.58 -1.61 0.00 0.00 178.31 175.90 1pex s TRP 321 N -2.48 0.85 0.44 -0.55 0.51 -0.38 -4.84 118.94 112.49 1pex s TRP 321 Ca -0.24 -1.99 0.24 0.00 -2.12 0.00 0.00 56.10 51.99 1pex s TRP 321 Cb 0.06 -0.87 1.37 0.00 -0.81 0.00 0.00 33.47 33.22 1pex s TRP 321 CO 0.72 -0.84 2.07 -1.35 -0.51 0.00 0.00 176.95 177.04 1pex h PRO 322 N 6.16 0.00 0.00 4.98 0.11 -1.79 -2.21 132.00 139.25 1pex h PRO 322 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1pex h PRO 322 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1pex h PRO 322 CO 0.32 0.12 0.00 1.49 -0.21 0.00 0.00 178.00 179.72 1pex h GLU 323 N 0.00 0.00 -7.26 1.05 4.81 -1.93 -3.45 114.58 107.80 1pex h GLU 323 Ca -0.00 0.00 -0.40 0.00 -0.13 0.00 0.00 59.36 58.82 1pex h GLU 323 Cb 0.29 0.00 0.20 0.00 0.63 0.00 0.00 28.75 29.87 1pex h GLU 323 CO 0.02 0.00 0.04 -0.51 -0.73 0.00 0.00 179.01 177.83 1pex s LEU 324 N -5.37 0.08 0.81 1.64 1.02 -0.83 -5.05 118.68 110.99 1pex s LEU 324 Ca -0.02 0.75 -0.07 0.00 0.02 0.00 0.00 54.13 54.81 1pex s LEU 324 Cb 0.10 -2.38 0.15 0.00 0.02 0.00 0.00 46.19 44.08 1pex s LEU 324 CO 0.35 -4.56 1.12 -2.16 0.02 0.00 0.00 176.35 171.12 1pex s PRO 325 N -5.25 1.30 0.20 1.29 0.04 -1.26 -5.00 135.00 126.32 1pex s PRO 325 Ca 0.70 -0.83 0.22 0.00 0.04 0.00 0.00 61.00 61.13 1pex s PRO 325 Cb -0.12 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1pex s PRO 325 CO 0.57 -1.81 1.05 -0.91 0.04 0.00 0.00 177.00 175.94 1pex h ASN 326 N -0.95 0.00 -4.50 6.66 4.21 -1.96 -3.45 115.58 115.58 1pex h ASN 326 Ca -0.40 0.00 -0.70 0.00 1.21 0.00 0.00 56.30 56.42 1pex h ASN 326 Cb 1.26 0.00 -0.29 0.00 -1.12 0.00 0.00 38.32 38.17 1pex h ASN 326 CO 0.40 0.06 -0.87 -0.60 -1.29 0.00 0.00 177.43 175.13 1pex s ARG 327 N -3.31 2.18 -0.19 0.81 3.52 -1.26 -3.67 118.95 117.03 1pex s ARG 327 Ca -0.00 -0.89 -0.06 0.00 -0.13 0.00 0.00 55.73 54.65 1pex s ARG 327 Cb 0.09 -2.10 -0.03 0.00 -1.56 0.00 0.00 34.95 31.35 1pex s ARG 327 CO 0.79 0.57 0.03 0.42 -0.81 0.00 0.00 175.30 176.30 1pex s ILE 328 N -0.63 4.37 -0.09 4.11 -1.09 -1.26 -4.80 121.20 121.81 1pex s ILE 328 Ca 0.10 -0.18 -0.19 0.00 -2.23 0.00 0.00 60.65 58.16 1pex s ILE 328 Cb -0.10 -2.97 -0.28 0.00 -1.58 0.00 0.00 42.46 37.52 1pex s ILE 328 CO -0.01 0.44 0.68 0.44 -1.23 0.00 0.00 174.94 175.26 1pex h ASP 329 N 7.08 0.39 -5.00 3.58 3.32 -0.95 -3.42 116.42 121.43 1pex h ASP 329 Ca -0.35 -0.88 0.03 0.00 0.02 0.00 0.00 57.03 55.85 1pex h ASP 329 Cb 1.18 -0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.52 1pex h ASP 329 CO 0.65 1.52 0.22 0.00 -1.72 0.00 0.00 179.24 179.91 1pex s ALA 330 N -2.45 -1.38 -0.22 3.45 0.00 -1.14 -4.15 121.76 115.87 1pex s ALA 330 Ca -0.18 0.02 -0.26 0.00 0.00 0.00 0.00 51.96 51.55 1pex s ALA 330 Cb 0.03 0.87 0.07 0.00 0.00 0.00 0.00 23.12 24.08 1pex s ALA 330 CO 0.78 -0.93 0.70 0.00 0.00 0.00 0.00 175.76 176.31 1pex s ALA 331 N -3.85 -1.74 0.00 0.00 0.00 -1.26 -2.04 121.76 112.87 1pex s ALA 331 Ca 0.07 1.85 -0.08 0.00 0.00 0.00 0.00 51.96 53.80 1pex s ALA 331 Cb -0.04 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 22.15 1pex s ALA 331 CO -0.01 -0.34 0.16 1.52 0.00 0.00 0.00 175.76 177.08 1pex s TYR 332 N 0.08 0.03 -0.13 0.00 -0.85 -1.07 -4.44 117.35 110.97 1pex s TYR 332 Ca -0.02 -0.11 -0.07 0.00 -0.52 0.00 0.00 57.07 56.35 1pex s TYR 332 Cb -0.04 -0.04 -0.04 0.00 0.38 0.00 0.00 41.96 42.22 1pex s TYR 332 CO 0.03 -0.31 0.12 -2.00 -1.52 0.00 0.00 175.55 171.87 1pex s GLU 333 N -1.46 3.54 -0.40 -3.49 2.12 -1.26 -1.27 118.70 116.48 1pex s GLU 333 Ca -0.14 -0.18 -0.10 0.00 0.36 0.00 0.00 54.97 54.90 1pex s GLU 333 Cb -0.07 -3.19 0.06 0.00 0.26 0.00 0.00 34.13 31.19 1pex s GLU 333 CO 0.02 0.67 0.24 -1.58 -0.54 0.00 0.00 175.26 174.07 1pex s HIS 334 N -0.72 3.29 0.36 5.30 5.65 0.24 -4.75 115.29 124.65 1pex s HIS 334 Ca 0.13 -1.26 0.04 0.00 0.25 0.00 0.00 55.06 54.23 1pex s HIS 334 Cb -0.12 -2.73 0.71 0.00 -1.18 0.00 0.00 32.58 29.25 1pex s HIS 334 CO 0.03 -0.76 1.99 -1.00 -0.65 0.00 0.00 174.74 174.35 1pex h PRO 335 N 8.44 0.76 0.00 2.88 0.13 -1.96 0.26 132.00 142.51 1pex h PRO 335 Ca -0.24 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 64.78 1pex h PRO 335 Cb 1.09 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 1pex h PRO 335 CO 0.72 0.50 -0.29 0.77 -0.23 0.00 0.00 178.00 179.48 1pex h SER 336 N 0.78 0.00 0.00 1.44 0.02 -1.97 -3.33 113.55 110.49 1pex h SER 336 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1pex h SER 336 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1pex h SER 336 CO -0.07 0.29 -1.02 1.41 -1.14 0.00 0.00 176.83 176.30 1pex n HIS 337 N -3.18 0.00 -3.30 3.45 8.25 -1.13 -5.02 115.22 114.30 1pex n HIS 337 Ca 0.03 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.35 1pex n HIS 337 Cb 0.65 -0.13 0.04 0.00 1.12 0.00 0.00 29.99 31.66 1pex n HIS 337 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1pex n ASP 338 N -1.58 -6.69 -4.18 0.41 2.03 0.86 -5.04 116.55 102.37 1pex n ASP 338 Ca -0.00 -0.56 -0.13 0.00 0.52 0.00 0.00 54.79 54.62 1pex n ASP 338 Cb 0.23 -4.66 -0.11 0.00 -0.72 0.00 0.00 41.12 35.87 1pex n ASP 338 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1pex s LEU 339 N -5.07 2.44 -0.13 -2.67 2.96 -0.92 -4.75 118.68 110.54 1pex s LEU 339 Ca 0.27 -0.87 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 1pex s LEU 339 Cb -0.06 -0.24 0.02 0.00 0.50 0.00 0.00 46.19 46.42 1pex s LEU 339 CO 0.78 -0.32 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.74 1pex s ILE 340 N -2.79 1.32 -0.19 6.68 1.01 -0.73 0.79 121.20 127.29 1pex s ILE 340 Ca 0.07 -0.48 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 1pex s ILE 340 Cb -0.01 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.15 1pex s ILE 340 CO -0.01 0.42 0.20 -0.36 0.00 0.00 0.00 174.94 175.19 1pex s PHE 341 N 1.53 3.42 -0.16 3.97 0.40 -0.39 -0.54 117.98 126.21 1pex s PHE 341 Ca 0.04 0.43 -0.01 0.00 -0.60 0.00 0.00 56.93 56.79 1pex s PHE 341 Cb -0.13 -2.25 -0.00 0.00 0.51 0.00 0.00 43.02 41.14 1pex s PHE 341 CO -0.09 0.24 -0.13 0.42 0.70 0.00 0.00 175.22 176.36 1pex s ILE 342 N 0.51 2.86 -0.18 0.64 1.01 0.81 -2.59 121.20 124.26 1pex s ILE 342 Ca 0.11 -0.70 -0.06 0.00 0.00 0.00 0.00 60.65 60.00 1pex s ILE 342 Cb -0.12 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1pex s ILE 342 CO 0.01 0.50 0.03 -0.36 0.00 0.00 0.00 174.94 175.13 1pex s PHE 343 N 0.85 3.16 -0.28 3.97 0.40 -0.87 -0.76 117.98 124.45 1pex s PHE 343 Ca -0.04 -0.12 -0.03 0.00 -0.60 0.00 0.00 56.93 56.15 1pex s PHE 343 Cb -0.15 -2.07 0.11 0.00 0.51 0.00 0.00 43.02 41.42 1pex s PHE 343 CO -0.00 0.02 0.18 0.50 0.70 0.00 0.00 175.22 176.62 1pex s ARG 344 N 0.56 0.22 7.77 0.44 6.06 -0.11 -0.33 118.95 133.56 1pex s ARG 344 Ca 0.01 -0.38 0.00 0.00 -2.50 0.00 0.00 55.73 52.87 1pex s ARG 344 Cb -0.13 -1.04 0.00 0.00 0.06 0.00 0.00 34.95 33.84 1pex s ARG 344 CO 0.02 -1.00 0.00 0.41 -2.50 0.00 0.00 175.30 172.23 1pex n GLY 345 N 5.27 2.42 0.07 8.12 0.00 -1.26 -2.74 105.19 117.07 1pex n GLY 345 Ca -0.05 -0.38 0.11 0.00 0.00 0.00 0.00 46.02 45.71 1pex n GLY 345 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pex n ARG 346 N 12.41 0.59 -3.39 1.61 0.00 -1.22 -4.38 116.66 122.27 1pex n ARG 346 Ca 0.00 0.01 -0.36 0.00 -0.00 0.00 0.00 57.85 57.49 1pex n ARG 346 Cb 0.00 -1.71 -0.06 0.00 -0.00 0.00 0.00 32.46 30.70 1pex n ARG 346 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1pex s LYS 347 N -3.40 3.99 0.03 2.89 1.02 -1.11 -0.55 119.74 122.62 1pex s LYS 347 Ca -0.02 0.49 0.06 0.00 0.02 0.00 0.00 55.97 56.51 1pex s LYS 347 Cb 0.11 -3.07 -0.02 0.00 -0.52 0.00 0.00 37.83 34.34 1pex s LYS 347 CO 0.83 0.57 -0.17 -0.59 -0.92 0.00 0.00 175.35 175.07 1pex s PHE 348 N -1.30 1.46 -0.03 3.18 -0.71 -0.13 -0.93 117.98 119.51 1pex s PHE 348 Ca 0.32 -0.34 0.06 0.00 -1.04 0.00 0.00 56.93 55.93 1pex s PHE 348 Cb -0.16 -0.88 -0.02 0.00 -1.21 0.00 0.00 43.02 40.75 1pex s PHE 348 CO 0.18 0.04 -0.22 -1.58 -1.34 0.00 0.00 175.22 172.30 1pex s TRP 349 N -0.74 2.47 -0.13 3.49 0.51 0.06 -1.02 118.94 123.57 1pex s TRP 349 Ca 0.04 -0.37 -0.07 0.00 -2.12 0.00 0.00 56.10 53.59 1pex s TRP 349 Cb -0.08 -1.55 -0.04 0.00 -0.81 0.00 0.00 33.47 30.99 1pex s TRP 349 CO 0.01 0.02 0.11 0.00 -0.51 0.00 0.00 176.95 176.59 1pex s ALA 350 N -0.61 3.73 -0.00 0.98 0.00 -1.26 -0.13 121.76 124.47 1pex s ALA 350 Ca 0.09 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.40 1pex s ALA 350 Cb -0.10 -1.92 -0.01 0.00 0.00 0.00 0.00 23.12 21.09 1pex s ALA 350 CO -0.00 0.52 -0.06 -0.51 0.00 0.00 0.00 175.76 175.70 1pex s LEU 351 N -0.72 2.02 -0.11 0.00 1.43 0.30 -2.40 118.68 119.21 1pex s LEU 351 Ca 0.13 -0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.07 1pex s LEU 351 Cb -0.12 -0.33 0.05 0.00 0.03 0.00 0.00 46.19 45.82 1pex s LEU 351 CO 0.03 0.07 0.07 0.21 0.23 0.00 0.00 176.35 176.96 1pex s ASN 352 N -0.19 1.83 1.01 2.29 3.04 -1.23 -1.77 114.94 119.92 1pex s ASN 352 Ca 0.02 -0.30 0.00 0.00 0.04 0.00 0.00 52.86 52.62 1pex s ASN 352 Cb -0.03 -0.23 0.00 0.00 -1.54 0.00 0.00 41.25 39.45 1pex s ASN 352 CO -0.00 -0.30 0.00 0.61 -3.04 0.00 0.00 177.10 174.37 1pex n GLY 353 N 5.27 1.88 0.76 1.21 0.00 -1.26 -1.21 105.19 111.84 1pex n GLY 353 Ca -0.05 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.56 1pex n GLY 353 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pex n TYR 354 N 13.05 0.29 -2.28 1.61 4.01 -1.26 -4.93 117.16 127.65 1pex n TYR 354 Ca 0.00 -0.15 -0.27 0.00 -0.16 0.00 0.00 57.90 57.33 1pex n TYR 354 Cb 0.00 0.00 0.15 0.00 -0.31 0.00 0.00 39.34 39.18 1pex n TYR 354 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1pex s ASP 355 N -1.56 3.70 -0.10 7.72 1.01 -0.35 -4.80 116.67 122.29 1pex s ASP 355 Ca 0.34 -0.10 -0.03 0.00 0.71 0.00 0.00 52.55 53.47 1pex s ASP 355 Cb 0.19 -0.09 0.04 0.00 1.01 0.00 0.00 42.92 44.07 1pex s ASP 355 CO 0.28 -2.32 0.07 -0.63 0.21 0.00 0.00 175.17 172.79 1pex s ILE 356 N -3.51 -0.10 0.46 0.77 1.01 -1.26 -3.48 121.20 115.08 1pex s ILE 356 Ca 0.70 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 61.28 1pex s ILE 356 Cb -0.04 -0.35 -0.10 0.00 0.01 0.00 0.00 42.46 41.98 1pex s ILE 356 CO 0.49 -0.03 0.90 0.18 0.00 0.00 0.00 174.94 176.48 1pex n LEU 357 N 5.29 2.25 -4.74 2.97 4.77 -1.01 -4.94 117.00 121.59 1pex n LEU 357 Ca -0.05 0.96 -0.35 0.00 -0.03 0.00 0.00 56.01 56.55 1pex n LEU 357 Cb 0.50 -1.31 0.06 0.00 -2.33 0.00 0.00 43.42 40.33 1pex n LEU 357 CO 0.08 -1.85 0.80 -1.61 -1.33 0.00 0.00 177.39 173.48 1pex s GLU 358 N -2.06 2.62 0.00 3.23 8.01 -1.26 -2.96 118.70 126.28 1pex s GLU 358 Ca 0.65 1.71 0.00 0.00 0.01 0.00 0.00 54.97 57.34 1pex s GLU 358 Cb -0.54 -1.90 0.00 0.00 -4.31 0.00 0.00 34.13 27.39 1pex s GLU 358 CO 0.55 -1.45 0.00 0.41 0.01 0.00 0.00 175.26 174.78 1pex n GLY 359 N 0.25 1.40 3.82 -1.39 0.00 -1.26 -5.04 105.19 102.97 1pex n GLY 359 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1pex n GLY 359 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pex s TYR 360 N -2.48 3.28 0.15 1.61 2.02 -1.15 -4.31 117.35 116.46 1pex s TYR 360 Ca 0.00 0.11 -0.28 0.00 -0.37 0.00 0.00 57.07 56.53 1pex s TYR 360 Cb 0.00 -1.65 -0.07 0.00 -0.40 0.00 0.00 41.96 39.84 1pex s TYR 360 CO 0.00 0.54 0.90 -1.25 -1.57 0.00 0.00 175.55 174.16 1pex s PRO 361 N -2.52 4.70 0.42 -1.71 0.04 -1.26 -4.98 135.00 129.69 1pex s PRO 361 Ca 0.31 1.36 0.06 0.00 0.04 0.00 0.00 61.00 62.77 1pex s PRO 361 Cb -0.12 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 31.10 1pex s PRO 361 CO 0.24 0.38 0.59 0.15 0.04 0.00 0.00 177.00 178.40 1pex s LYS 362 N -0.58 2.87 0.54 4.56 1.02 -0.19 -4.87 119.74 123.09 1pex s LYS 362 Ca 0.42 -1.04 -0.00 0.00 0.02 0.00 0.00 55.97 55.37 1pex s LYS 362 Cb -0.24 -2.71 0.02 0.00 -0.52 0.00 0.00 37.83 34.39 1pex s LYS 362 CO 0.29 -0.27 0.78 0.15 -0.92 0.00 0.00 175.35 175.38 1pex s LYS 363 N -4.40 2.67 0.00 1.68 1.02 -1.26 -0.96 119.74 118.49 1pex s LYS 363 Ca 0.52 -0.61 0.11 0.00 0.02 0.00 0.00 55.97 56.02 1pex s LYS 363 Cb -0.10 -2.46 0.43 0.00 -0.52 0.00 0.00 37.83 35.18 1pex s LYS 363 CO 0.34 -0.65 1.32 0.44 -0.92 0.00 0.00 175.35 175.88 1pex n ILE 364 N -2.34 0.24 0.05 2.17 -5.35 0.29 -3.69 119.36 110.73 1pex n ILE 364 Ca 0.06 -0.27 -0.20 0.00 -0.27 0.00 0.00 62.75 62.07 1pex n ILE 364 Cb 0.59 0.14 -0.14 0.00 -1.74 0.00 0.00 39.64 38.48 1pex n ILE 364 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1pex h SER 365 N 1.31 0.52 0.00 7.28 4.64 -1.86 -2.93 113.55 122.50 1pex h SER 365 Ca 0.00 -0.93 0.00 0.00 -0.47 0.00 0.00 61.79 60.39 1pex h SER 365 Cb 0.30 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1pex h SER 365 CO 0.00 1.40 0.03 -0.62 -0.87 0.00 0.00 176.83 176.77 1pex n GLU 366 N -4.10 0.00 0.00 4.77 4.71 -1.24 -0.04 120.64 124.74 1pex n GLU 366 Ca -0.14 0.39 0.12 0.00 -0.01 0.00 0.00 57.16 57.52 1pex n GLU 366 Cb 0.83 -1.53 0.25 0.00 -1.01 0.00 0.00 31.44 29.98 1pex n GLU 366 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1pex n LEU 368 N -1.38 0.92 0.00 -4.62 7.94 -1.11 -4.98 117.00 113.77 1pex n LEU 368 Ca 0.00 -0.23 0.00 0.00 -1.11 0.00 0.00 56.01 54.67 1pex n LEU 368 Cb 0.03 -0.15 0.00 0.00 0.53 0.00 0.00 43.42 43.83 1pex n LEU 368 CO 0.00 0.19 0.00 0.61 -1.11 0.00 0.00 177.39 177.08 1pex n GLY 369 N 1.42 0.77 3.78 -3.96 0.00 0.94 -4.87 105.19 103.26 1pex n GLY 369 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1pex n GLY 369 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pex s LEU 370 N 0.00 4.17 1.05 0.99 1.02 -1.24 -5.01 118.68 119.66 1pex s LEU 370 Ca 0.00 2.06 -0.12 0.00 0.02 0.00 0.00 54.13 56.09 1pex s LEU 370 Cb 0.00 -4.14 0.22 0.00 0.02 0.00 0.00 46.19 42.28 1pex s LEU 370 CO 0.00 -0.48 1.07 -2.16 0.02 0.00 0.00 176.35 174.80 1pex s PRO 371 N -2.42 -0.01 0.00 1.29 0.04 -1.26 -4.78 135.00 127.85 1pex s PRO 371 Ca 0.57 0.85 0.20 0.00 0.04 0.00 0.00 61.00 62.66 1pex s PRO 371 Cb -0.23 -1.66 0.54 0.00 0.04 0.00 0.00 34.50 33.19 1pex s PRO 371 CO 0.29 -3.12 1.45 1.63 0.04 0.00 0.00 177.00 177.29 1pex n LYS 372 N -4.49 2.38 -0.53 4.56 4.01 -1.26 -3.19 118.16 119.64 1pex n LYS 372 Ca 0.05 -2.13 0.10 0.00 -0.51 0.00 0.00 58.31 55.82 1pex n LYS 372 Cb 0.55 -1.48 0.33 0.00 -0.51 0.00 0.00 35.03 33.92 1pex n LYS 372 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 1pex n GLU 373 N 1.26 3.35 -3.98 1.97 0.00 -1.26 -4.79 120.64 117.19 1pex n GLU 373 Ca 0.20 -2.67 -0.34 0.00 0.00 0.00 0.00 57.16 54.35 1pex n GLU 373 Cb 0.52 -1.79 -0.14 0.00 0.00 0.00 0.00 31.44 30.03 1pex n GLU 373 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1pex s VAL 374 N -1.64 2.66 -0.16 3.84 1.01 -1.19 -5.00 120.40 119.92 1pex s VAL 374 Ca 0.48 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1pex s VAL 374 Cb 0.30 -2.45 -0.09 0.00 0.00 0.00 0.00 36.38 34.13 1pex s VAL 374 CO 0.26 0.05 -0.16 1.17 0.00 0.00 0.00 175.10 176.42 1pex n LYS 375 N 4.58 0.38 -3.95 2.72 3.00 -1.26 -4.91 118.16 118.72 1pex n LYS 375 Ca -0.15 0.11 -0.24 0.00 -0.00 0.00 0.00 58.31 58.02 1pex n LYS 375 Cb 0.45 -1.26 -0.03 0.00 0.00 0.00 0.00 35.03 34.19 1pex n LYS 375 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 1pex s LYS 376 N -2.31 3.44 -0.12 1.64 2.20 -1.26 -3.41 119.74 119.92 1pex s LYS 376 Ca -0.22 -0.65 0.01 0.00 -0.36 0.00 0.00 55.97 54.75 1pex s LYS 376 Cb 0.06 -2.94 0.02 0.00 -1.51 0.00 0.00 37.83 33.47 1pex s LYS 376 CO 0.34 0.49 -0.12 0.96 -0.36 0.00 0.00 175.35 176.66 1pex s ILE 377 N -1.83 1.32 -0.19 5.43 -0.00 -1.26 -4.70 121.20 119.97 1pex s ILE 377 Ca 0.34 -0.50 0.20 0.00 -0.00 0.00 0.00 60.65 60.69 1pex s ILE 377 Cb -0.10 -1.25 -0.06 0.00 -0.00 0.00 0.00 42.46 41.05 1pex s ILE 377 CO 0.29 0.41 0.94 -1.54 -0.00 0.00 0.00 174.94 175.04 1pex n SER 378 N 4.54 0.84 -3.75 4.36 3.41 -0.33 -4.14 113.62 118.56 1pex n SER 378 Ca -0.17 0.34 -0.06 0.00 -0.26 0.00 0.00 58.87 58.73 1pex n SER 378 Cb 0.51 0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 64.80 1pex n SER 378 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pex s ALA 379 N -3.19 -1.50 -0.27 7.33 0.00 -1.23 -4.18 121.76 118.71 1pex s ALA 379 Ca -0.02 0.06 -0.25 0.00 0.00 0.00 0.00 51.96 51.75 1pex s ALA 379 Cb 0.09 0.72 0.10 0.00 0.00 0.00 0.00 23.12 24.03 1pex s ALA 379 CO 0.80 -0.99 0.87 0.00 0.00 0.00 0.00 175.76 176.44 1pex s ALA 380 N -3.54 -1.87 -0.01 0.00 0.00 -1.26 -1.78 121.76 113.29 1pex s ALA 380 Ca 0.10 1.94 -0.05 0.00 0.00 0.00 0.00 51.96 53.96 1pex s ALA 380 Cb -0.03 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.81 1pex s ALA 380 CO 0.02 -0.29 0.09 0.54 0.00 0.00 0.00 175.76 176.12 1pex s VAL 381 N 0.27 0.06 -0.10 0.00 0.11 -0.87 -4.46 120.40 115.41 1pex s VAL 381 Ca 0.01 -0.47 0.02 0.00 -2.93 0.00 0.00 61.98 58.61 1pex s VAL 381 Cb -0.05 -0.30 0.01 0.00 -1.53 0.00 0.00 36.38 34.52 1pex s VAL 381 CO -0.02 -0.26 -0.15 -2.28 -3.33 0.00 0.00 175.10 169.06 1pex s HIS 382 N -0.85 1.89 -0.24 1.54 2.46 -1.26 0.11 115.29 118.94 1pex s HIS 382 Ca -0.09 -0.84 -0.10 0.00 0.47 0.00 0.00 55.06 54.50 1pex s HIS 382 Cb -0.06 -1.36 -0.05 0.00 -0.13 0.00 0.00 32.58 30.99 1pex s HIS 382 CO 0.01 -0.43 0.14 -0.06 -2.47 0.00 0.00 174.74 171.92 1pex s PHE 383 N 0.89 3.26 -0.41 3.88 0.40 0.96 -4.92 117.98 122.03 1pex s PHE 383 Ca -0.09 0.10 0.26 0.00 -0.60 0.00 0.00 56.93 56.60 1pex s PHE 383 Cb -0.15 -2.25 0.98 0.00 0.51 0.00 0.00 43.02 42.11 1pex s PHE 383 CO 0.00 -0.01 1.77 1.49 0.70 0.00 0.00 175.22 179.18 1pex h GLU 384 N 7.60 0.00 -0.40 0.44 4.81 -1.98 -2.67 114.58 122.39 1pex h GLU 384 Ca -0.37 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.78 1pex h GLU 384 Cb 1.17 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 1pex h GLU 384 CO 0.64 0.00 -0.06 0.22 -0.73 0.00 0.00 179.01 179.08 1pex h ASP 385 N 0.00 0.64 0.00 1.04 3.58 -1.95 -3.38 116.42 116.35 1pex h ASP 385 Ca 0.00 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.29 1pex h ASP 385 Cb 0.51 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1pex h ASP 385 CO 0.00 0.75 0.00 0.41 -2.88 0.00 0.00 179.24 177.52 1pex n THR 386 N -4.21 0.00 -0.43 2.25 -1.04 -1.12 -4.99 114.28 104.75 1pex n THR 386 Ca 0.02 -0.32 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1pex n THR 386 Cb 0.31 1.04 0.00 0.00 -1.82 0.00 0.00 70.33 69.86 1pex n THR 386 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1pex n GLY 387 N 0.57 1.59 3.69 3.41 0.00 -1.02 -4.93 105.19 108.51 1pex n GLY 387 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1pex n GLY 387 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pex s LYS 388 N -0.20 4.44 -0.30 1.61 3.01 -1.25 0.19 119.74 127.23 1pex s LYS 388 Ca 0.00 1.24 -0.07 0.00 -1.01 0.00 0.00 55.97 56.13 1pex s LYS 388 Cb 0.00 -3.51 0.01 0.00 -1.01 0.00 0.00 37.83 33.32 1pex s LYS 388 CO 0.00 -0.18 0.08 0.99 0.51 0.00 0.00 175.35 176.74 1pex s THR 389 N 1.57 3.90 -0.69 2.17 2.01 -1.00 -0.03 115.64 123.56 1pex s THR 389 Ca 0.45 -0.77 -0.17 0.00 0.31 0.00 0.00 61.69 61.52 1pex s THR 389 Cb -0.19 -3.04 0.14 0.00 0.01 0.00 0.00 72.50 69.43 1pex s THR 389 CO 0.20 0.05 0.75 -0.22 -0.69 0.00 0.00 174.62 174.70 1pex s LEU 390 N 1.48 5.85 -0.11 4.42 2.96 0.30 -1.12 118.68 132.46 1pex s LEU 390 Ca 0.02 -1.92 -0.16 0.00 -0.22 0.00 0.00 54.13 51.85 1pex s LEU 390 Cb -0.17 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 44.19 1pex s LEU 390 CO 0.02 -0.92 0.41 -0.76 -1.32 0.00 0.00 176.35 173.78 1pex s LEU 391 N 1.83 4.30 -0.07 -0.68 1.43 -0.99 -2.06 118.68 122.44 1pex s LEU 391 Ca 0.15 0.74 0.02 0.00 -1.03 0.00 0.00 54.13 54.01 1pex s LEU 391 Cb -0.19 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.44 1pex s LEU 391 CO -0.01 0.09 -0.12 -0.36 0.23 0.00 0.00 176.35 176.19 1pex s PHE 392 N 0.26 2.80 -0.14 0.29 0.40 -0.73 -1.54 117.98 119.31 1pex s PHE 392 Ca 0.23 -0.17 -0.02 0.00 -0.60 0.00 0.00 56.93 56.36 1pex s PHE 392 Cb -0.15 -1.69 0.05 0.00 0.51 0.00 0.00 43.02 41.74 1pex s PHE 392 CO 0.09 0.17 0.03 0.45 0.70 0.00 0.00 175.22 176.66 1pex s SER 393 N -0.58 2.33 0.00 1.36 0.15 -0.43 -1.18 113.70 115.35 1pex s SER 393 Ca 0.08 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.23 1pex s SER 393 Cb -0.11 -0.50 0.00 0.00 -1.71 0.00 0.00 66.02 63.69 1pex s SER 393 CO 0.01 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.80 1pex n GLY 394 N 5.11 0.55 0.00 9.45 0.00 -1.26 -1.83 105.19 117.21 1pex n GLY 394 Ca -0.08 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1pex n GLY 394 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1pex n ASN 395 N 3.26 0.05 -4.86 1.61 2.85 -1.26 -4.41 115.26 112.50 1pex n ASN 395 Ca 0.00 -0.43 -0.26 0.00 -0.11 0.00 0.00 54.58 53.78 1pex n ASN 395 Cb 0.00 0.72 0.00 0.00 1.24 0.00 0.00 39.78 41.75 1pex n ASN 395 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pex n GLN 396 N -0.72 0.67 -4.63 1.20 6.02 -0.76 -0.74 117.38 118.41 1pex n GLN 396 Ca 0.00 -3.45 -0.29 0.00 -0.01 0.00 0.00 57.00 53.25 1pex n GLN 396 Cb 0.00 0.35 -0.08 0.00 1.02 0.00 0.00 30.24 31.54 1pex n GLN 396 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1pex s VAL 397 N -2.75 0.95 -0.24 5.09 1.01 -0.42 -1.31 120.40 122.73 1pex s VAL 397 Ca 0.32 -2.00 -0.17 0.00 0.00 0.00 0.00 61.98 60.13 1pex s VAL 397 Cb -0.03 -2.31 0.07 0.00 0.00 0.00 0.00 36.38 34.12 1pex s VAL 397 CO 0.20 0.00 0.62 0.26 0.00 0.00 0.00 175.10 176.18 1pex s TRP 398 N -3.03 -0.84 -0.34 5.22 0.51 -0.59 -3.78 118.94 116.09 1pex s TRP 398 Ca 0.16 1.81 0.02 0.00 -2.12 0.00 0.00 56.10 55.97 1pex s TRP 398 Cb 0.03 0.41 0.09 0.00 -0.81 0.00 0.00 33.47 33.19 1pex s TRP 398 CO 0.09 -0.42 0.06 0.50 -0.51 0.00 0.00 176.95 176.67 1pex s ARG 399 N 1.07 1.75 0.74 4.98 3.52 -1.26 -2.33 118.95 127.42 1pex s ARG 399 Ca -0.06 -1.76 -0.11 0.00 -0.13 0.00 0.00 55.73 53.67 1pex s ARG 399 Cb -0.05 -3.24 0.03 0.00 -1.56 0.00 0.00 34.95 30.13 1pex s ARG 399 CO -0.10 -0.90 1.08 -0.47 -0.81 0.00 0.00 175.30 174.10 1pex s TYR 400 N 1.00 3.01 -0.41 5.12 6.14 -0.27 -0.69 117.35 131.25 1pex s TYR 400 Ca 0.07 1.29 0.03 0.00 0.64 0.00 0.00 57.07 59.09 1pex s TYR 400 Cb -0.20 -2.99 0.11 0.00 0.42 0.00 0.00 41.96 39.30 1pex s TYR 400 CO -0.06 -1.46 0.14 0.34 0.64 0.00 0.00 175.55 175.15 1pex s ASP 401 N -3.87 4.69 -0.23 4.32 2.15 0.38 -2.38 116.67 121.73 1pex s ASP 401 Ca 0.59 -2.42 -0.05 0.00 0.43 0.00 0.00 52.55 51.11 1pex s ASP 401 Cb -0.14 -1.66 -0.08 0.00 -0.30 0.00 0.00 42.92 40.74 1pex s ASP 401 CO 0.55 -0.35 3.11 -0.67 -0.17 0.00 0.00 175.17 177.64 1pex n ASP 402 N 3.92 5.88 0.00 -0.34 -0.08 0.50 0.11 116.55 126.54 1pex n ASP 402 Ca 0.04 -2.85 0.00 0.00 -1.51 0.00 0.00 54.79 50.47 1pex n ASP 402 Cb 0.39 -1.31 0.00 0.00 2.34 0.00 0.00 41.12 42.54 1pex n ASP 402 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1pex n THR 403 N 1.61 0.00 -0.30 5.18 -1.04 -1.25 -4.85 114.28 113.63 1pex n THR 403 Ca 0.44 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.45 1pex n THR 403 Cb 0.72 -0.08 0.00 0.00 -1.82 0.00 0.00 70.33 69.15 1pex n THR 403 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1pex n ASN 404 N -1.56 0.80 -3.46 8.00 3.02 -1.04 -5.05 115.26 115.98 1pex n ASN 404 Ca 0.00 -1.10 -0.19 0.00 -0.03 0.00 0.00 54.58 53.26 1pex n ASN 404 Cb 0.07 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.31 1pex n ASN 404 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1pex n HIS 405 N -0.05 -2.18 -3.97 3.10 8.25 0.31 -5.01 115.22 115.66 1pex n HIS 405 Ca 0.00 0.85 -0.10 0.00 -0.26 0.00 0.00 57.72 58.21 1pex n HIS 405 Cb 0.11 -4.51 -0.12 0.00 1.12 0.00 0.00 29.99 26.59 1pex n HIS 405 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1pex s ILE 406 N -3.45 0.14 -0.44 1.59 1.10 -1.10 -4.93 121.20 114.10 1pex s ILE 406 Ca 0.17 -0.70 -0.24 0.00 -0.51 0.00 0.00 60.65 59.37 1pex s ILE 406 Cb -0.03 -0.24 0.02 0.00 0.15 0.00 0.00 42.46 42.36 1pex s ILE 406 CO 0.76 -0.36 0.84 -0.04 -2.11 0.00 0.00 174.94 174.03 1pex s MET 407 N -1.10 3.50 -0.74 3.50 -1.94 -1.26 0.14 119.30 121.39 1pex s MET 407 Ca -0.11 0.05 -0.26 0.00 -1.71 0.00 0.00 55.69 53.66 1pex s MET 407 Cb -0.07 -3.92 -0.15 0.00 2.01 0.00 0.00 34.83 32.69 1pex s MET 407 CO -0.01 -1.12 2.47 -0.25 -0.01 0.00 0.00 175.02 176.11 1pex n ASP 408 N 6.84 1.24 0.26 3.03 8.00 0.13 -4.76 116.55 131.29 1pex n ASP 408 Ca 0.04 -0.48 0.01 0.00 0.71 0.00 0.00 54.79 55.07 1pex n ASP 408 Cb 0.48 -1.29 0.07 0.00 -0.02 0.00 0.00 41.12 40.36 1pex n ASP 408 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1pex h LYS 409 N 15.38 0.00 -0.95 -1.24 1.63 -1.93 -2.19 116.57 127.27 1pex h LYS 409 Ca -0.12 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.62 1pex h LYS 409 Cb 1.22 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.81 1pex h LYS 409 CO 1.25 0.00 0.08 -0.40 -3.45 0.00 0.00 179.45 176.93 1pex n ASP 410 N -2.22 2.66 -3.85 4.20 5.75 -1.26 -4.80 116.55 117.03 1pex n ASP 410 Ca -0.00 -2.30 -0.12 0.00 -0.01 0.00 0.00 54.79 52.36 1pex n ASP 410 Cb 0.84 -0.56 -0.12 0.00 -1.03 0.00 0.00 41.12 40.24 1pex n ASP 410 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1pex s TYR 411 N -1.07 -0.06 -0.71 2.11 1.51 -0.82 -4.52 117.35 113.78 1pex s TYR 411 Ca 0.13 0.15 -0.19 0.00 -1.01 0.00 0.00 57.07 56.15 1pex s TYR 411 Cb 0.10 0.01 0.12 0.00 -0.11 0.00 0.00 41.96 42.08 1pex s TYR 411 CO 0.03 -0.11 0.85 -2.14 -1.11 0.00 0.00 175.55 173.07 1pex s PRO 412 N -0.34 3.26 0.85 -1.71 0.02 -1.26 -4.90 135.00 130.92 1pex s PRO 412 Ca -0.04 -1.52 -0.12 0.00 0.02 0.00 0.00 61.00 59.34 1pex s PRO 412 Cb -0.03 -4.44 0.10 0.00 0.02 0.00 0.00 34.50 30.15 1pex s PRO 412 CO 0.00 -1.60 1.11 0.50 -0.33 0.00 0.00 177.00 176.68 1pex s ARG 413 N 2.53 1.64 0.11 5.54 6.06 -1.25 -4.72 118.95 128.87 1pex s ARG 413 Ca 0.19 0.54 -0.21 0.00 -2.50 0.00 0.00 55.73 53.75 1pex s ARG 413 Cb -0.17 -1.88 -0.07 0.00 0.06 0.00 0.00 34.95 32.90 1pex s ARG 413 CO 0.01 -1.90 0.63 -0.51 -2.50 0.00 0.00 175.30 171.03 1pex s LEU 414 N -5.92 4.52 0.26 -0.88 1.02 -1.26 -1.30 118.68 115.11 1pex s LEU 414 Ca 0.62 1.36 -0.02 0.00 0.02 0.00 0.00 54.13 56.11 1pex s LEU 414 Cb -0.15 -3.07 0.54 0.00 0.02 0.00 0.00 46.19 43.54 1pex s LEU 414 CO 0.54 0.23 1.70 0.40 0.02 0.00 0.00 176.35 179.25 1pex h ILE 415 N 3.38 0.54 -0.78 -0.59 1.08 -1.22 0.60 117.51 120.53 1pex h ILE 415 Ca -0.49 -0.12 -0.02 0.00 -0.39 0.00 0.00 64.86 63.83 1pex h ILE 415 Cb 1.21 0.15 -0.04 0.00 -3.07 0.00 0.00 36.82 35.07 1pex h ILE 415 CO 0.64 0.07 0.40 -0.33 -0.69 0.00 0.00 178.15 178.24 1pex h GLU 416 N 0.36 1.11 0.59 2.37 5.08 -1.80 -1.39 114.58 120.90 1pex h GLU 416 Ca 0.46 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.64 1pex h GLU 416 Cb 0.79 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.84 1pex h GLU 416 CO -0.49 0.84 -0.28 0.93 -1.00 0.00 0.00 179.01 179.01 1pex h GLU 417 N 1.09 -0.76 0.18 2.33 3.07 -1.30 -3.18 114.58 116.00 1pex h GLU 417 Ca 0.27 0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.17 1pex h GLU 417 Cb 0.08 0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1pex h GLU 417 CO -0.04 -0.51 -0.09 -0.44 -1.40 0.00 0.00 179.01 176.54 1pex h ASP 418 N -1.07 -0.20 -3.12 1.42 5.19 -1.33 -3.36 116.42 113.95 1pex h ASP 418 Ca -0.08 -0.17 -0.67 0.00 -0.62 0.00 0.00 57.03 55.49 1pex h ASP 418 Cb 0.61 0.05 -0.38 0.00 0.18 0.00 0.00 39.33 39.79 1pex h ASP 418 CO 0.13 0.06 -0.28 0.49 -3.12 0.00 0.00 179.24 176.52 1pex n PHE 419 N -5.09 3.77 -2.21 4.55 3.01 -0.53 -5.08 117.46 115.87 1pex n PHE 419 Ca -0.09 -4.16 -0.39 0.00 1.01 0.00 0.00 57.45 53.82 1pex n PHE 419 Cb 0.20 -0.90 -0.02 0.00 -0.01 0.00 0.00 39.48 38.75 1pex n PHE 419 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1pex s PRO 420 N -1.56 4.20 0.00 -1.08 0.04 -1.20 -3.86 135.00 131.53 1pex s PRO 420 Ca 0.28 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.33 1pex s PRO 420 Cb -0.04 -2.87 0.00 0.00 0.04 0.00 0.00 34.50 31.63 1pex s PRO 420 CO -0.13 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.07 1pex n GLY 421 N 0.76 3.15 0.00 0.56 0.00 -1.26 -4.83 105.19 103.57 1pex n GLY 421 Ca 0.02 -1.07 0.11 0.00 0.00 0.00 0.00 46.02 45.09 1pex n GLY 421 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1pex n ILE 422 N 0.00 0.09 0.00 -0.61 -5.35 -1.25 -5.00 119.36 107.23 1pex n ILE 422 Ca 0.00 0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.50 1pex n ILE 422 Cb 0.00 -0.67 0.00 0.00 -1.74 0.00 0.00 39.64 37.23 1pex n ILE 422 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pex n GLY 423 N 0.42 0.18 0.85 3.28 0.00 -1.26 -4.71 105.19 103.96 1pex n GLY 423 Ca 0.15 -1.91 0.02 0.00 0.00 0.00 0.00 46.02 44.29 1pex n GLY 423 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pex n ASP 424 N 0.00 0.61 -3.59 1.61 5.75 -1.26 -4.14 116.55 115.54 1pex n ASP 424 Ca 0.00 -2.16 -0.15 0.00 -0.01 0.00 0.00 54.79 52.47 1pex n ASP 424 Cb 0.00 -0.27 -0.06 0.00 -1.03 0.00 0.00 41.12 39.76 1pex n ASP 424 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1pex s LYS 425 N -0.34 0.87 -0.13 0.11 2.20 -1.26 -4.42 119.74 116.76 1pex s LYS 425 Ca 0.17 0.62 0.00 0.00 -0.36 0.00 0.00 55.97 56.40 1pex s LYS 425 Cb 0.18 0.42 0.02 0.00 -1.51 0.00 0.00 37.83 36.94 1pex s LYS 425 CO -0.07 -0.19 -0.12 0.08 -0.36 0.00 0.00 175.35 174.69 1pex s VAL 426 N -0.33 1.38 -0.13 4.02 1.01 -1.26 -4.69 120.40 120.40 1pex s VAL 426 Ca -0.04 -0.53 0.18 0.00 0.00 0.00 0.00 61.98 61.60 1pex s VAL 426 Cb -0.03 -1.32 -0.17 0.00 0.00 0.00 0.00 36.38 34.87 1pex s VAL 426 CO 0.04 0.43 0.69 0.47 0.00 0.00 0.00 175.10 176.72 1pex n ASP 427 N 4.70 0.61 -3.55 3.32 8.00 -0.48 -4.14 116.55 125.01 1pex n ASP 427 Ca -0.16 0.26 -0.16 0.00 0.71 0.00 0.00 54.79 55.45 1pex n ASP 427 Cb 0.50 0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 42.12 1pex n ASP 427 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1pex s ALA 428 N -3.00 -1.81 -0.12 2.24 0.00 -1.23 -4.21 121.76 113.64 1pex s ALA 428 Ca -0.04 1.50 -0.20 0.00 0.00 0.00 0.00 51.96 53.22 1pex s ALA 428 Cb 0.09 -0.38 0.05 0.00 0.00 0.00 0.00 23.12 22.88 1pex s ALA 428 CO 0.83 -0.35 0.51 0.54 0.00 0.00 0.00 175.76 177.29 1pex s VAL 429 N -0.86 0.01 0.08 0.00 0.11 -1.26 -2.39 120.40 116.09 1pex s VAL 429 Ca -0.07 -0.12 -0.22 0.00 -2.93 0.00 0.00 61.98 58.64 1pex s VAL 429 Cb -0.01 -0.77 0.05 0.00 -1.53 0.00 0.00 36.38 34.12 1pex s VAL 429 CO 0.06 -0.07 0.52 -0.72 -3.33 0.00 0.00 175.10 171.57 1pex s TYR 430 N -0.49 -0.42 -0.23 1.54 1.13 -0.96 -4.53 117.35 113.40 1pex s TYR 430 Ca -0.06 0.38 -0.00 0.00 -1.41 0.00 0.00 57.07 55.97 1pex s TYR 430 Cb -0.03 0.37 0.03 0.00 -1.10 0.00 0.00 41.96 41.23 1pex s TYR 430 CO 0.04 -0.69 -0.11 -2.00 -2.51 0.00 0.00 175.55 170.29 1pex s GLU 431 N -2.85 2.81 -0.20 -3.49 -6.30 -1.26 0.15 118.70 107.56 1pex s GLU 431 Ca -0.03 -0.98 0.01 0.00 -2.50 0.00 0.00 54.97 51.47 1pex s GLU 431 Cb -0.00 -2.86 0.03 0.00 0.00 0.00 0.00 34.13 31.29 1pex s GLU 431 CO -0.05 -0.37 -0.17 0.21 0.02 0.00 0.00 175.26 174.91 1pex s LYS 432 N 1.29 2.84 0.00 4.30 2.20 -0.87 -4.96 119.74 124.55 1pex s LYS 432 Ca 0.00 -0.94 0.00 0.00 -0.36 0.00 0.00 55.97 54.68 1pex s LYS 432 Cb -0.16 -2.67 0.00 0.00 -1.51 0.00 0.00 37.83 33.49 1pex s LYS 432 CO -0.07 -0.29 0.00 0.09 -0.36 0.00 0.00 175.35 174.72 1pex n ASN 433 N 4.59 0.00 0.00 1.43 4.13 -1.26 -2.32 115.26 121.83 1pex n ASN 433 Ca -0.19 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.07 1pex n ASN 433 Cb 0.48 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.72 1pex n ASN 433 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1pex n GLY 434 N 0.00 3.30 3.92 7.41 0.00 -1.26 -5.09 105.19 113.47 1pex n GLY 434 Ca 0.00 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 1pex n GLY 434 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pex s TYR 435 N -0.02 3.50 -0.17 1.61 2.02 -0.98 -3.95 117.35 119.35 1pex s TYR 435 Ca 0.00 0.33 -0.02 0.00 -0.37 0.00 0.00 57.07 57.02 1pex s TYR 435 Cb 0.00 -1.83 -0.01 0.00 -0.40 0.00 0.00 41.96 39.72 1pex s TYR 435 CO 0.00 0.50 -0.10 -1.50 -1.57 0.00 0.00 175.55 172.88 1pex s ILE 436 N -1.65 3.06 -0.33 2.71 2.07 -1.07 -2.04 121.20 123.96 1pex s ILE 436 Ca 0.37 -0.63 -0.10 0.00 -1.41 0.00 0.00 60.65 58.89 1pex s ILE 436 Cb -0.12 -2.33 0.00 0.00 0.13 0.00 0.00 42.46 40.14 1pex s ILE 436 CO 0.27 0.49 0.16 -0.31 -1.91 0.00 0.00 174.94 173.64 1pex s TYR 437 N 0.93 3.20 -0.17 3.50 1.51 0.12 -1.25 117.35 125.19 1pex s TYR 437 Ca -0.02 -0.71 -0.08 0.00 -1.01 0.00 0.00 57.07 55.25 1pex s TYR 437 Cb -0.15 -2.37 -0.04 0.00 -0.11 0.00 0.00 41.96 39.29 1pex s TYR 437 CO -0.00 -0.52 0.10 -0.06 -1.11 0.00 0.00 175.55 173.96 1pex s PHE 438 N 1.59 3.37 -0.26 2.71 0.08 -0.52 -2.27 117.98 122.68 1pex s PHE 438 Ca 0.04 0.26 0.01 0.00 0.12 0.00 0.00 56.93 57.36 1pex s PHE 438 Cb -0.18 -2.06 0.05 0.00 -0.57 0.00 0.00 43.02 40.26 1pex s PHE 438 CO 0.06 0.34 -0.08 -0.06 -0.10 0.00 0.00 175.22 175.38 1pex s PHE 439 N 0.01 3.17 -0.39 0.36 0.40 -1.00 0.58 117.98 121.10 1pex s PHE 439 Ca 0.08 -1.97 -0.04 0.00 -0.60 0.00 0.00 56.93 54.40 1pex s PHE 439 Cb -0.12 -2.00 0.10 0.00 0.51 0.00 0.00 43.02 41.51 1pex s PHE 439 CO 0.00 -0.82 0.19 1.21 0.70 0.00 0.00 175.22 176.50 1pex s ASN 440 N 1.21 5.27 0.75 1.36 3.84 0.19 -1.38 114.94 126.18 1pex s ASN 440 Ca -0.05 -1.82 0.00 0.00 0.21 0.00 0.00 52.86 51.20 1pex s ASN 440 Cb -0.18 -1.84 0.00 0.00 -0.55 0.00 0.00 41.25 38.67 1pex s ASN 440 CO -0.05 -0.50 0.00 0.61 -2.79 0.00 0.00 177.10 174.37 1pex n GLY 441 N 4.66 2.23 0.87 1.21 0.00 -1.26 -2.09 105.19 110.81 1pex n GLY 441 Ca -0.05 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1pex n GLY 441 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pex n PRO 442 N 12.52 0.86 -4.29 1.61 -0.04 -1.26 -4.54 135.00 139.86 1pex n PRO 442 Ca 0.00 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.28 1pex n PRO 442 Cb 0.00 -1.16 -0.13 0.00 -0.04 0.00 0.00 33.50 32.16 1pex n PRO 442 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1pex s ILE 443 N -0.14 0.84 -0.09 0.52 2.07 -0.89 -2.17 121.20 121.34 1pex s ILE 443 Ca 0.00 -0.77 0.04 0.00 -1.41 0.00 0.00 60.65 58.50 1pex s ILE 443 Cb 0.00 -0.77 0.00 0.00 0.13 0.00 0.00 42.46 41.83 1pex s ILE 443 CO 0.00 0.00 -0.21 -1.58 -1.91 0.00 0.00 174.94 171.25 1pex s GLN 444 N -0.87 2.62 -0.13 3.50 0.74 0.02 -0.64 119.66 124.91 1pex s GLN 444 Ca 0.00 -0.75 0.01 0.00 0.05 0.00 0.00 55.36 54.68 1pex s GLN 444 Cb -0.06 -2.03 -0.01 0.00 1.10 0.00 0.00 33.01 32.01 1pex s GLN 444 CO 0.01 0.15 -0.18 -0.06 -0.55 0.00 0.00 175.29 174.66 1pex s PHE 445 N 0.39 2.72 -0.55 1.67 0.40 0.20 -0.74 117.98 122.06 1pex s PHE 445 Ca -0.16 -0.92 -0.18 0.00 -0.60 0.00 0.00 56.93 55.07 1pex s PHE 445 Cb -0.17 -1.81 0.10 0.00 0.51 0.00 0.00 43.02 41.65 1pex s PHE 445 CO 0.07 -0.37 0.60 -2.00 0.70 0.00 0.00 175.22 174.22 1pex s GLU 446 N 0.50 3.03 0.13 0.44 2.12 -0.39 -1.44 118.70 123.08 1pex s GLU 446 Ca -0.12 -1.40 0.02 0.00 0.36 0.00 0.00 54.97 53.84 1pex s GLU 446 Cb -0.16 -4.24 -0.04 0.00 0.26 0.00 0.00 34.13 29.94 1pex s GLU 446 CO 0.05 -1.38 0.23 -0.47 -0.54 0.00 0.00 175.26 173.14 1pex s TYR 447 N 2.22 3.42 -0.30 5.30 5.04 -0.38 0.26 117.35 132.91 1pex s TYR 447 Ca 0.08 0.12 -0.06 0.00 -2.44 0.00 0.00 57.07 54.77 1pex s TYR 447 Cb -0.25 -1.66 0.02 0.00 0.35 0.00 0.00 41.96 40.41 1pex s TYR 447 CO 0.06 0.53 0.07 0.45 -1.34 0.00 0.00 175.55 175.33 1pex s SER 448 N -2.99 5.09 0.58 4.32 0.15 -0.78 -2.58 113.70 117.49 1pex s SER 448 Ca 0.34 -0.79 0.35 0.00 0.70 0.00 0.00 55.95 56.55 1pex s SER 448 Cb -0.11 -1.86 1.77 0.00 -1.71 0.00 0.00 66.02 64.10 1pex s SER 448 CO 0.27 -0.21 2.16 -0.29 1.20 0.00 0.00 173.24 176.37 1pex h ILE 449 N 5.94 0.23 0.00 6.45 2.10 -1.90 0.54 117.51 130.87 1pex h ILE 449 Ca -0.30 -0.33 0.00 0.00 1.08 0.00 0.00 64.86 65.31 1pex h ILE 449 Cb 1.12 1.26 0.00 0.00 -1.09 0.00 0.00 36.82 38.11 1pex h ILE 449 CO 0.60 0.04 -1.71 0.79 -1.08 0.00 0.00 178.15 176.80 1pex n TRP 450 N -3.32 0.25 0.15 2.19 8.01 -1.26 -4.10 117.44 119.36 1pex n TRP 450 Ca -0.02 0.07 0.02 0.00 -1.31 0.00 0.00 57.50 56.26 1pex n TRP 450 Cb 0.19 -0.60 0.02 0.00 -2.01 0.00 0.00 31.31 28.91 1pex n TRP 450 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 1pex n SER 451 N -2.34 1.32 -4.13 -0.99 3.41 -1.06 -5.00 113.62 104.83 1pex n SER 451 Ca -0.03 -1.16 -0.30 0.00 -0.26 0.00 0.00 58.87 57.11 1pex n SER 451 Cb 0.56 -0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.45 1pex n SER 451 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1pex n ASN 452 N 0.21 -0.32 -3.75 4.04 4.13 0.19 -4.96 115.26 114.80 1pex n ASN 452 Ca 0.02 -1.17 -0.13 0.00 1.68 0.00 0.00 54.58 54.98 1pex n ASN 452 Cb 0.10 -2.23 -0.10 0.00 -1.54 0.00 0.00 39.78 36.00 1pex n ASN 452 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pex s ARG 453 N -7.01 0.42 -0.31 3.52 1.70 -1.22 -4.91 118.95 111.14 1pex s ARG 453 Ca 0.07 0.51 -0.29 0.00 -0.47 0.00 0.00 55.73 55.56 1pex s ARG 453 Cb -0.04 0.20 -0.02 0.00 -0.57 0.00 0.00 34.95 34.52 1pex s ARG 453 CO 0.95 -0.05 1.76 0.42 -1.08 0.00 0.00 175.30 177.29 1pex s ILE 454 N 0.23 3.52 -0.00 4.99 1.01 -1.26 -1.87 121.20 127.82 1pex s ILE 454 Ca -0.00 0.54 -0.24 0.00 0.00 0.00 0.00 60.65 60.95 1pex s ILE 454 Cb -0.03 -3.67 -0.16 0.00 0.01 0.00 0.00 42.46 38.61 1pex s ILE 454 CO 0.00 -0.40 1.14 0.58 0.00 0.00 0.00 174.94 176.26 1pex h VAL 455 N 6.69 0.62 -3.26 2.92 2.07 -0.52 -3.48 116.25 121.29 1pex h VAL 455 Ca -0.34 -0.64 -0.12 0.00 0.82 0.00 0.00 66.70 66.42 1pex h VAL 455 Cb 1.16 0.91 -0.19 0.00 -1.52 0.00 0.00 31.29 31.65 1pex h VAL 455 CO 1.03 0.11 -0.33 0.00 0.02 0.00 0.00 177.57 178.40 1pex s ARG 456 N -4.43 0.66 -0.06 1.57 1.70 -1.15 -5.02 118.95 112.23 1pex s ARG 456 Ca -0.14 -0.36 0.04 0.00 -0.47 0.00 0.00 55.73 54.80 1pex s ARG 456 Cb 0.02 0.28 -0.02 0.00 -0.57 0.00 0.00 34.95 34.66 1pex s ARG 456 CO 0.51 -0.18 -0.17 0.08 -1.08 0.00 0.00 175.30 174.46 1pex s VAL 457 N -1.74 2.82 0.28 4.99 1.01 -1.26 -1.27 120.40 125.23 1pex s VAL 457 Ca -0.11 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1pex s VAL 457 Cb -0.04 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1pex s VAL 457 CO 0.01 0.58 0.34 -0.04 0.00 0.00 0.00 175.10 175.99 1pex s MET 458 N -0.50 1.62 0.31 2.72 -1.94 0.08 -4.99 119.30 116.60 1pex s MET 458 Ca 0.06 -1.67 -0.27 0.00 -1.71 0.00 0.00 55.69 52.10 1pex s MET 458 Cb -0.12 0.38 -0.09 0.00 2.01 0.00 0.00 34.83 37.01 1pex s MET 458 CO 0.01 -0.63 0.99 -2.14 -0.01 0.00 0.00 175.02 173.25 1pex s PRO 459 N -3.62 4.59 0.31 2.03 0.02 -1.26 -0.80 135.00 136.27 1pex s PRO 459 Ca 0.33 1.48 0.01 0.00 0.02 0.00 0.00 61.00 62.84 1pex s PRO 459 Cb 0.02 -2.93 0.56 0.00 0.02 0.00 0.00 34.50 32.17 1pex s PRO 459 CO 0.17 0.25 1.92 0.00 -0.33 0.00 0.00 177.00 179.01 1pex h ALA 460 N 3.40 1.54 0.00 -1.55 0.00 -1.67 -2.39 119.26 118.59 1pex h ALA 460 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1pex h ALA 460 Cb 1.20 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1pex h ALA 460 CO 0.66 0.32 0.00 0.27 0.00 0.00 0.00 179.25 180.50 1pex n ASN 461 N -4.49 0.00 0.14 0.00 0.23 -1.26 -2.75 115.26 107.13 1pex n ASN 461 Ca 0.13 -0.30 0.13 0.00 -0.53 0.00 0.00 54.58 54.01 1pex n ASN 461 Cb 0.21 -0.08 0.48 0.00 -2.08 0.00 0.00 39.78 38.31 1pex n ASN 461 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1pex h SER 462 N 0.00 0.00 0.45 0.53 4.64 -1.66 -1.30 113.55 116.21 1pex h SER 462 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1pex h SER 462 Cb 0.03 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1pex h SER 462 CO 0.00 0.00 -0.03 -0.29 -0.87 0.00 0.00 176.83 175.64 1pex h ILE 463 N 0.00 0.16 -0.49 0.95 2.10 -1.75 0.79 117.51 119.27 1pex h ILE 463 Ca 0.00 -0.32 0.00 0.00 1.08 0.00 0.00 64.86 65.62 1pex h ILE 463 Cb 0.50 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.50 1pex h ILE 463 CO 0.00 0.03 0.00 0.18 -1.08 0.00 0.00 178.15 177.28 1pex n LEU 464 N -3.24 3.31 -2.72 2.19 4.77 -0.51 -5.02 117.00 115.78 1pex n LEU 464 Ca -0.01 -1.95 -0.01 0.00 -0.03 0.00 0.00 56.01 54.00 1pex n LEU 464 Cb 0.20 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1pex n LEU 464 CO 0.25 0.82 -0.44 0.79 -1.33 0.00 0.00 177.39 177.48 1pex n TRP 465 N 0.98 -3.93 -1.21 -1.77 8.01 0.27 -5.02 117.44 114.77 1pex n TRP 465 Ca 0.17 1.73 0.00 0.00 -1.31 0.00 0.00 57.50 58.09 1pex n TRP 465 Cb 0.50 -4.01 0.00 0.00 -2.01 0.00 0.00 31.31 25.79 1pex n TRP 465 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68