#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3pcb s ALA 302 N 0.00 2.77 0.05 3.55 0.00 -1.26 -5.08 121.76 121.79 3pcb s ALA 302 Ca 0.00 0.17 0.06 0.00 0.00 0.00 0.00 51.96 52.19 3pcb s ALA 302 Cb 0.00 -3.18 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 3pcb s ALA 302 CO 0.00 -0.97 -0.17 -0.65 0.00 0.00 0.00 175.76 173.96 3pcb s GLN 303 N -4.68 1.13 -1.01 0.00 -0.21 -1.26 -5.07 119.66 108.55 3pcb s GLN 303 Ca 0.59 -0.88 -0.23 0.00 0.02 0.00 0.00 55.36 54.87 3pcb s GLN 303 Cb -0.14 -1.21 0.03 0.00 1.00 0.00 0.00 33.01 32.70 3pcb s GLN 303 CO 0.48 0.30 1.54 0.34 -2.12 0.00 0.00 175.29 175.82 3pcb s ASP 304 N -1.25 6.29 0.00 5.90 2.15 -1.26 -4.60 116.67 123.90 3pcb s ASP 304 Ca 0.04 -1.36 0.00 0.00 0.43 0.00 0.00 52.55 51.67 3pcb s ASP 304 Cb -0.09 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 3pcb s ASP 304 CO 0.02 -1.70 0.00 -0.46 -0.17 0.00 0.00 175.17 172.86 3pcb n ASN 305 N 9.69 1.00 -4.53 -0.34 0.23 -1.26 -5.03 115.26 115.02 3pcb n ASN 305 Ca 0.35 -0.39 -0.24 0.00 -0.53 0.00 0.00 54.58 53.76 3pcb n ASN 305 Cb 0.50 0.99 -0.09 0.00 -2.08 0.00 0.00 39.78 39.09 3pcb n ASN 305 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 3pcb s SER 306 N -1.19 3.85 0.02 0.53 0.01 -1.26 -3.53 113.70 112.13 3pcb s SER 306 Ca 0.00 -0.97 0.04 0.00 1.31 0.00 0.00 55.95 56.33 3pcb s SER 306 Cb 0.00 -0.43 -0.02 0.00 0.21 0.00 0.00 66.02 65.78 3pcb s SER 306 CO 0.00 -0.02 -0.13 -0.13 0.41 0.00 0.00 173.24 173.36 3pcb s ARG 307 N -3.57 0.95 -0.04 12.44 1.81 -0.28 -4.87 118.95 125.38 3pcb s ARG 307 Ca 0.31 -0.62 0.05 0.00 -1.72 0.00 0.00 55.73 53.74 3pcb s ARG 307 Cb -0.04 -0.93 -0.03 0.00 -0.45 0.00 0.00 34.95 33.51 3pcb s ARG 307 CO 0.17 0.24 -0.17 -0.06 -0.68 0.00 0.00 175.30 174.80 3pcb s PHE 308 N -0.63 2.62 0.15 -0.53 0.40 -1.26 -1.58 117.98 117.15 3pcb s PHE 308 Ca 0.03 -0.22 -0.32 0.00 -0.60 0.00 0.00 56.93 55.82 3pcb s PHE 308 Cb -0.07 -1.59 -0.12 0.00 0.51 0.00 0.00 43.02 41.75 3pcb s PHE 308 CO 0.00 0.15 1.76 0.28 0.70 0.00 0.00 175.22 178.11 3pcb n VAL 309 N 2.28 0.20 -1.61 -0.44 0.31 -0.43 -4.90 118.33 113.74 3pcb n VAL 309 Ca -0.17 -0.04 -0.46 0.00 -0.01 0.00 0.00 64.34 63.66 3pcb n VAL 309 Cb 0.52 -1.97 -0.03 0.00 -0.91 0.00 0.00 33.84 31.45 3pcb n VAL 309 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3pcb n ILE 310 N 4.27 1.28 -2.25 2.52 2.08 -1.26 -4.70 119.36 121.30 3pcb n ILE 310 Ca 0.17 -0.32 -0.37 0.00 0.56 0.00 0.00 62.75 62.80 3pcb n ILE 310 Cb 0.35 -1.08 -0.01 0.00 -0.75 0.00 0.00 39.64 38.15 3pcb n ILE 310 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 3pcb s ARG 311 N -0.79 3.65 -0.75 0.38 0.52 -1.26 -4.97 118.95 115.72 3pcb s ARG 311 Ca 0.67 1.74 -0.16 0.00 -0.52 0.00 0.00 55.73 57.47 3pcb s ARG 311 Cb -0.74 -2.31 0.17 0.00 0.52 0.00 0.00 34.95 32.59 3pcb s ARG 311 CO 0.54 -0.64 0.75 0.34 0.02 0.00 0.00 175.30 176.31 3pcb s ASP 312 N -1.45 6.54 0.00 0.23 -1.08 -1.26 -4.90 116.67 114.75 3pcb s ASP 312 Ca 0.66 -2.23 0.13 0.00 -0.52 0.00 0.00 52.55 50.59 3pcb s ASP 312 Cb -0.28 -2.25 0.77 0.00 -1.46 0.00 0.00 42.92 39.71 3pcb s ASP 312 CO 0.33 -0.78 1.21 0.54 0.52 0.00 0.00 175.17 176.99 3pcb n ARG 313 N 4.94 0.54 -0.01 4.34 1.74 -1.26 -1.27 116.66 125.68 3pcb n ARG 313 Ca 0.06 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.23 3pcb n ARG 313 Cb 0.45 -1.37 -0.14 0.00 -1.02 0.00 0.00 32.46 30.38 3pcb n ARG 313 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3pcb n ASN 314 N -0.87 0.75 -0.05 0.55 3.02 -1.26 -4.42 115.26 112.98 3pcb n ASN 314 Ca 0.10 -0.20 -0.19 0.00 -0.03 0.00 0.00 54.58 54.26 3pcb n ASN 314 Cb 0.04 1.67 -0.13 0.00 -0.61 0.00 0.00 39.78 40.75 3pcb n ASN 314 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3pcb h TRP 315 N 0.00 0.17 -4.31 3.10 2.91 -1.60 -3.44 115.95 112.78 3pcb h TRP 315 Ca 0.00 -0.13 -0.51 0.00 1.13 0.00 0.00 58.89 59.38 3pcb h TRP 315 Cb 0.76 -0.01 0.13 0.00 -0.51 0.00 0.00 29.16 29.53 3pcb h TRP 315 CO 0.00 1.32 0.32 -1.01 -1.03 0.00 0.00 178.44 178.05 3pcb s HIS 316 N -2.35 2.65 0.56 2.65 3.76 -0.97 -4.75 115.29 116.84 3pcb s HIS 316 Ca -0.22 1.53 -0.20 0.00 -0.15 0.00 0.00 55.06 56.02 3pcb s HIS 316 Cb 0.02 -3.02 -0.05 0.00 1.11 0.00 0.00 32.58 30.64 3pcb s HIS 316 CO 0.70 -1.72 1.23 -1.25 -0.85 0.00 0.00 174.74 172.84 3pcb s PRO 317 N -4.93 3.16 0.69 8.40 0.04 -1.26 -4.81 135.00 136.29 3pcb s PRO 317 Ca 0.61 1.89 -0.11 0.00 0.04 0.00 0.00 61.00 63.43 3pcb s PRO 317 Cb -0.17 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.30 3pcb s PRO 317 CO 0.56 -1.07 1.08 0.15 0.04 0.00 0.00 177.00 177.75 3pcb s LYS 318 N -3.13 2.93 0.03 4.56 -0.14 -1.25 -4.99 119.74 117.75 3pcb s LYS 318 Ca 0.74 0.45 -0.24 0.00 -1.36 0.00 0.00 55.97 55.55 3pcb s LYS 318 Cb -0.32 -2.05 -0.17 0.00 -1.68 0.00 0.00 37.83 33.61 3pcb s LYS 318 CO 0.36 -0.97 1.46 0.00 -0.76 0.00 0.00 175.35 175.44 3pcb h ALA 319 N -0.59 0.03 -2.08 5.17 0.00 -1.95 -3.41 119.26 116.44 3pcb h ALA 319 Ca -0.45 -0.15 -0.67 0.00 0.00 0.00 0.00 54.91 53.64 3pcb h ALA 319 Cb 1.25 -0.01 -0.17 0.00 0.00 0.00 0.00 17.79 18.86 3pcb h ALA 319 CO 0.63 -0.32 0.13 -1.17 0.00 0.00 0.00 179.25 178.52 3pcb s LEU 320 N -9.61 4.74 -0.40 0.00 2.96 -1.26 -4.76 118.68 110.35 3pcb s LEU 320 Ca -0.15 -0.71 0.03 0.00 -0.22 0.00 0.00 54.13 53.08 3pcb s LEU 320 Cb 0.04 -2.56 0.16 0.00 0.50 0.00 0.00 46.19 44.33 3pcb s LEU 320 CO 0.67 -0.91 0.30 0.42 -1.32 0.00 0.00 176.35 175.52 3pcb s THR 321 N 2.85 0.40 0.55 3.68 -4.23 -1.26 -5.04 115.64 112.59 3pcb s THR 321 Ca 0.19 -2.42 0.41 0.00 -1.18 0.00 0.00 61.69 58.69 3pcb s THR 321 Cb -0.17 -1.29 0.61 0.00 1.34 0.00 0.00 72.50 72.99 3pcb s THR 321 CO 0.14 -1.14 1.71 -0.65 -0.54 0.00 0.00 174.62 174.14 3pcb h PRO 322 N 6.08 0.00 0.00 3.99 0.11 -1.94 0.42 132.00 140.66 3pcb h PRO 322 Ca 0.19 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.29 3pcb h PRO 322 Cb 0.92 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 3pcb h PRO 322 CO 0.35 0.00 -0.08 -0.44 -0.21 0.00 0.00 178.00 177.62 3pcb h ASP 323 N 0.00 0.00 -3.45 -2.05 3.32 -1.96 -3.19 116.42 109.09 3pcb h ASP 323 Ca 0.69 0.00 -0.79 0.00 0.02 0.00 0.00 57.03 56.95 3pcb h ASP 323 Cb 2.80 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 42.10 3pcb h ASP 323 CO -0.01 0.08 0.45 -0.47 -1.72 0.00 0.00 179.24 177.58 3pcb s TYR 324 N -4.10 3.99 0.19 4.55 5.04 0.14 -4.85 117.35 122.31 3pcb s TYR 324 Ca -0.02 -2.37 -0.16 0.00 -2.44 0.00 0.00 57.07 52.08 3pcb s TYR 324 Cb 0.12 -3.90 0.18 0.00 0.35 0.00 0.00 41.96 38.71 3pcb s TYR 324 CO 0.55 -1.03 1.30 1.63 -1.34 0.00 0.00 175.55 176.66 3pcb n LYS 325 N 3.55 -0.21 0.21 4.97 5.02 -1.21 -1.16 118.16 129.33 3pcb n LYS 325 Ca 0.22 1.29 0.17 0.00 -2.02 0.00 0.00 58.31 57.97 3pcb n LYS 325 Cb 0.42 -1.91 0.82 0.00 -0.02 0.00 0.00 35.03 34.35 3pcb n LYS 325 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3pcb h THR 326 N 0.00 0.51 0.00 -0.18 2.02 -1.92 -1.34 112.91 112.00 3pcb h THR 326 Ca 0.28 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.46 3pcb h THR 326 Cb 0.49 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3pcb h THR 326 CO -0.83 0.00 0.00 0.77 0.37 0.00 0.00 175.52 175.83 3pcb h SER 327 N 0.00 0.00 0.45 4.18 4.64 -1.44 -3.13 113.55 118.24 3pcb h SER 327 Ca 0.08 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 3pcb h SER 327 Cb 0.43 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 3pcb h SER 327 CO -0.00 0.00 -0.28 0.40 -0.87 0.00 0.00 176.83 176.08 3pcb h ILE 328 N 0.00 0.41 -0.00 0.95 2.04 -1.38 -3.01 117.51 116.51 3pcb h ILE 328 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pcb h ILE 328 Cb 0.40 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 3pcb h ILE 328 CO 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 178.15 177.92 3pcb n ALA 329 N -2.49 3.00 -1.61 1.87 0.00 -1.24 -4.21 120.51 115.83 3pcb n ALA 329 Ca -0.11 -0.32 -0.11 0.00 0.00 0.00 0.00 53.44 52.90 3pcb n ALA 329 Cb 0.32 -1.23 0.14 0.00 0.00 0.00 0.00 19.45 18.68 3pcb n ALA 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3pcb n ARG 330 N -1.01 2.33 -4.45 0.00 1.74 -1.15 -4.97 116.66 109.16 3pcb n ARG 330 Ca 0.11 -3.46 -0.21 0.00 -0.77 0.00 0.00 57.85 53.51 3pcb n ARG 330 Cb 0.32 -1.96 -0.16 0.00 -1.02 0.00 0.00 32.46 29.64 3pcb n ARG 330 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3pcb s SER 331 N -2.81 1.36 0.75 0.55 1.04 -1.18 -4.94 113.70 108.46 3pcb s SER 331 Ca 0.48 -0.21 -0.13 0.00 0.48 0.00 0.00 55.95 56.56 3pcb s SER 331 Cb 0.42 -0.42 0.05 0.00 0.10 0.00 0.00 66.02 66.16 3pcb s SER 331 CO -0.00 0.06 1.14 -2.16 0.98 0.00 0.00 173.24 173.26 3pcb s PRO 332 N 0.28 2.18 -0.01 4.02 0.05 -1.26 -4.94 135.00 135.32 3pcb s PRO 332 Ca -0.05 1.48 0.10 0.00 0.05 0.00 0.00 61.00 62.59 3pcb s PRO 332 Cb -0.10 -1.87 -0.15 0.00 0.05 0.00 0.00 34.50 32.43 3pcb s PRO 332 CO 0.01 -1.75 0.28 0.54 0.05 0.00 0.00 177.00 176.14 3pcb n ARG 333 N -3.05 1.21 -3.30 4.56 5.12 -1.26 -4.93 116.66 115.01 3pcb n ARG 333 Ca 0.11 -0.07 -0.31 0.00 -1.93 0.00 0.00 57.85 55.66 3pcb n ARG 333 Cb 0.52 -1.18 -0.04 0.00 -1.16 0.00 0.00 32.46 30.60 3pcb n ARG 333 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3pcb s GLN 334 N -2.52 3.75 0.52 5.56 -1.52 -1.26 -5.06 119.66 119.13 3pcb s GLN 334 Ca -0.02 0.22 -0.20 0.00 -1.95 0.00 0.00 55.36 53.41 3pcb s GLN 334 Cb 0.07 -2.60 -0.06 0.00 -0.22 0.00 0.00 33.01 30.19 3pcb s GLN 334 CO 0.43 0.23 1.13 0.00 -0.25 0.00 0.00 175.29 176.82 3pcb s ALA 335 N -1.99 2.78 0.36 6.09 0.00 -1.26 -4.99 121.76 122.74 3pcb s ALA 335 Ca 0.47 0.82 -0.27 0.00 0.00 0.00 0.00 51.96 52.98 3pcb s ALA 335 Cb -0.11 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 3pcb s ALA 335 CO 0.25 -0.69 1.25 -0.51 0.00 0.00 0.00 175.76 176.06 3pcb s LEU 336 N -3.58 4.33 -0.23 0.00 1.43 -1.26 -5.00 118.68 114.37 3pcb s LEU 336 Ca 0.70 2.54 -0.18 0.00 -1.03 0.00 0.00 54.13 56.16 3pcb s LEU 336 Cb -0.24 -3.81 -0.03 0.00 0.03 0.00 0.00 46.19 42.14 3pcb s LEU 336 CO 0.28 -0.61 0.52 -0.69 0.23 0.00 0.00 176.35 176.08 3pcb s VAL 337 N -1.24 5.09 0.12 -1.59 1.01 -1.26 -5.04 120.40 117.48 3pcb s VAL 337 Ca 0.52 0.93 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 3pcb s VAL 337 Cb -0.36 -3.84 -0.07 0.00 0.00 0.00 0.00 36.38 32.11 3pcb s VAL 337 CO 0.47 0.13 1.13 -0.44 0.00 0.00 0.00 175.10 176.39 3pcb s SER 338 N 1.33 7.20 0.06 3.32 0.01 -1.26 -5.04 113.70 119.32 3pcb s SER 338 Ca 0.23 2.04 0.04 0.00 1.31 0.00 0.00 55.95 59.57 3pcb s SER 338 Cb -0.15 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.45 3pcb s SER 338 CO 0.09 -0.32 -0.12 0.27 0.41 0.00 0.00 173.24 173.58 3pcb s ILE 339 N 0.30 0.94 0.71 1.44 -4.36 -1.26 -5.15 121.20 113.83 3pcb s ILE 339 Ca 0.53 -1.26 -0.13 0.00 -0.26 0.00 0.00 60.65 59.52 3pcb s ILE 339 Cb -0.29 -0.96 0.03 0.00 1.25 0.00 0.00 42.46 42.49 3pcb s ILE 339 CO 0.33 -0.29 1.11 -2.16 0.24 0.00 0.00 174.94 174.16 3pcb s PRO 340 N -1.76 2.52 0.19 0.37 0.04 -1.26 -4.99 135.00 130.11 3pcb s PRO 340 Ca -0.04 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.03 3pcb s PRO 340 Cb -0.10 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 3pcb s PRO 340 CO 0.02 -1.46 1.00 -0.65 0.04 0.00 0.00 177.00 175.95 3pcb s GLN 341 N -4.41 4.73 0.33 4.56 -0.21 -1.26 -5.01 119.66 118.40 3pcb s GLN 341 Ca 0.65 1.56 0.03 0.00 0.02 0.00 0.00 55.36 57.63 3pcb s GLN 341 Cb -0.20 -3.30 -0.04 0.00 1.00 0.00 0.00 33.01 30.48 3pcb s GLN 341 CO 0.48 0.30 0.14 -1.54 -2.12 0.00 0.00 175.29 172.55 3pcb s SER 342 N -0.55 1.93 0.43 5.90 1.04 -1.26 -5.01 113.70 116.18 3pcb s SER 342 Ca 0.45 -1.57 0.17 0.00 0.48 0.00 0.00 55.95 55.48 3pcb s SER 342 Cb -0.27 0.37 1.08 0.00 0.10 0.00 0.00 66.02 67.31 3pcb s SER 342 CO 0.33 -0.87 1.91 -0.29 0.98 0.00 0.00 173.24 175.30 3pcb h ILE 343 N 2.10 0.77 -0.75 -1.02 2.10 -1.96 0.71 117.51 119.46 3pcb h ILE 343 Ca -0.35 -0.13 0.04 0.00 1.08 0.00 0.00 64.86 65.50 3pcb h ILE 343 Cb 1.25 0.35 -0.05 0.00 -1.09 0.00 0.00 36.82 37.29 3pcb h ILE 343 CO 0.55 0.07 0.47 0.28 -1.08 0.00 0.00 178.15 178.43 3pcb h SER 344 N 0.38 0.75 0.45 2.19 0.02 -1.96 -2.98 113.55 112.41 3pcb h SER 344 Ca 0.38 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 61.13 3pcb h SER 344 Cb 0.92 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.27 3pcb h SER 344 CO -0.12 0.51 -1.72 -0.62 -1.14 0.00 0.00 176.83 173.74 3pcb n GLU 345 N -4.65 0.64 0.00 3.45 4.71 -0.14 -4.41 120.64 120.24 3pcb n GLU 345 Ca 0.09 0.14 0.14 0.00 -0.01 0.00 0.00 57.16 57.52 3pcb n GLU 345 Cb 0.11 -1.71 0.60 0.00 -1.01 0.00 0.00 31.44 29.42 3pcb n GLU 345 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3pcb n THR 346 N -2.81 0.00 -4.17 2.62 -2.24 0.06 -3.00 114.28 104.73 3pcb n THR 346 Ca -0.15 -0.10 -0.25 0.00 -2.27 0.00 0.00 64.05 61.28 3pcb n THR 346 Cb 0.90 0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 69.12 3pcb n THR 346 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3pcb s THR 347 N -2.32 2.45 -0.11 4.28 -4.23 -1.13 -4.65 115.64 109.94 3pcb s THR 347 Ca 0.32 -1.75 -0.33 0.00 -1.18 0.00 0.00 61.69 58.75 3pcb s THR 347 Cb 0.20 -2.96 0.15 0.00 1.34 0.00 0.00 72.50 71.23 3pcb s THR 347 CO 0.44 -0.06 1.41 -0.83 -0.54 0.00 0.00 174.62 175.04 3pcb s GLY 348 N -3.86 -0.46 0.50 3.99 0.00 -1.24 -0.97 107.32 105.27 3pcb s GLY 348 Ca 0.39 1.03 -0.22 0.00 0.00 0.00 0.00 44.72 45.92 3pcb s GLY 348 CO 0.22 0.22 1.23 2.56 0.00 0.00 0.00 173.10 177.33 3pcb s PRO 349 N -2.08 3.51 -0.16 2.90 0.04 -1.26 -4.85 135.00 133.10 3pcb s PRO 349 Ca 0.14 1.94 -0.03 0.00 0.04 0.00 0.00 61.00 63.09 3pcb s PRO 349 Cb 0.06 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 3pcb s PRO 349 CO -0.06 -0.80 -0.06 1.21 0.04 0.00 0.00 177.00 177.33 3pcb s ASN 350 N -1.23 4.54 -0.13 6.66 3.84 -1.26 -4.91 114.94 122.45 3pcb s ASN 350 Ca 0.67 -0.21 0.16 0.00 0.21 0.00 0.00 52.86 53.68 3pcb s ASN 350 Cb -0.33 -1.73 0.58 0.00 -0.55 0.00 0.00 41.25 39.21 3pcb s ASN 350 CO 0.39 0.14 1.49 0.49 -2.79 0.00 0.00 177.10 176.82 3pcb n PHE 351 N 3.70 1.14 -0.32 0.43 3.72 -1.26 -4.64 117.46 120.24 3pcb n PHE 351 Ca -0.18 -0.70 0.06 0.00 -0.05 0.00 0.00 57.45 56.59 3pcb n PHE 351 Cb 0.52 -0.26 0.22 0.00 -0.94 0.00 0.00 39.48 39.03 3pcb n PHE 351 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3pcb h SER 352 N 2.80 0.73 -0.14 4.37 0.02 -1.96 -1.65 113.55 117.72 3pcb h SER 352 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3pcb h SER 352 Cb 1.36 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.83 3pcb h SER 352 CO 0.21 0.36 0.00 1.41 -1.14 0.00 0.00 176.83 177.67 3pcb n HIS 353 N -4.74 0.17 -2.23 3.45 8.25 -1.26 -4.89 115.22 113.97 3pcb n HIS 353 Ca 0.17 -0.09 -0.40 0.00 -0.26 0.00 0.00 57.72 57.15 3pcb n HIS 353 Cb 0.37 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.46 3pcb n HIS 353 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3pcb s LEU 354 N -1.55 4.35 -0.75 2.41 2.96 -0.62 -4.93 118.68 120.54 3pcb s LEU 354 Ca 0.31 2.49 -0.24 0.00 -0.22 0.00 0.00 54.13 56.47 3pcb s LEU 354 Cb 0.16 -3.80 0.06 0.00 0.50 0.00 0.00 46.19 43.11 3pcb s LEU 354 CO 0.25 -0.55 1.14 -0.83 -1.32 0.00 0.00 176.35 175.04 3pcb s GLY 355 N -0.81 1.24 0.10 7.98 0.00 -1.26 -5.02 107.32 109.56 3pcb s GLY 355 Ca 0.52 -1.81 -0.23 0.00 0.00 0.00 0.00 44.72 43.19 3pcb s GLY 355 CO 0.45 2.32 0.71 -1.36 0.00 0.00 0.00 173.10 175.22 3pcb s PHE 356 N 4.60 3.83 0.72 1.90 0.08 -1.26 -5.07 117.98 122.78 3pcb s PHE 356 Ca 0.30 1.47 -0.11 0.00 0.12 0.00 0.00 56.93 58.71 3pcb s PHE 356 Cb -0.11 -2.70 0.02 0.00 -0.57 0.00 0.00 43.02 39.67 3pcb s PHE 356 CO 0.08 0.47 1.07 0.20 -0.10 0.00 0.00 175.22 176.94 3pcb s GLY 357 N -0.82 1.65 0.49 4.36 0.00 -1.26 -4.95 107.32 106.79 3pcb s GLY 357 Ca 0.34 -0.01 0.18 0.00 0.00 0.00 0.00 44.72 45.23 3pcb s GLY 357 CO 0.23 0.33 2.06 0.00 0.00 0.00 0.00 173.10 175.72 3pcb h ALA 358 N -0.81 1.69 -0.04 3.20 0.00 -2.02 -2.96 119.26 118.31 3pcb h ALA 358 Ca -0.45 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 3pcb h ALA 358 Cb 1.23 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3pcb h ALA 358 CO 0.58 0.15 -0.29 0.72 0.00 0.00 0.00 179.25 180.41 3pcb n HIS 359 N -4.23 0.12 -0.28 0.00 8.25 -1.26 -4.78 115.22 113.06 3pcb n HIS 359 Ca -0.03 -1.33 0.09 0.00 -0.26 0.00 0.00 57.72 56.20 3pcb n HIS 359 Cb 0.20 -0.24 0.32 0.00 1.12 0.00 0.00 29.99 31.39 3pcb n HIS 359 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3pcb h ASP 360 N 0.71 0.75 -0.02 0.41 5.19 -1.80 -1.21 116.42 120.44 3pcb h ASP 360 Ca 0.02 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 3pcb h ASP 360 Cb 1.07 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.46 3pcb h ASP 360 CO 0.04 0.42 -0.01 0.00 -3.12 0.00 0.00 179.24 176.57 3pcb n HIS 361 N -4.54 0.00 -3.76 4.55 1.44 -1.12 -2.03 115.22 109.76 3pcb n HIS 361 Ca 0.16 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.51 3pcb n HIS 361 Cb 0.36 -0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.36 3pcb n HIS 361 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3pcb s ASP 362 N -2.01 5.16 0.50 4.39 -1.08 -0.46 -1.85 116.67 121.32 3pcb s ASP 362 Ca 0.32 -2.68 0.34 0.00 -0.52 0.00 0.00 52.55 50.01 3pcb s ASP 362 Cb 0.20 -1.83 1.65 0.00 -1.46 0.00 0.00 42.92 41.49 3pcb s ASP 362 CO 0.32 -0.40 2.02 -0.07 0.52 0.00 0.00 175.17 177.56 3pcb h LEU 363 N 7.22 0.00 -0.81 -1.34 4.07 -0.60 0.10 115.31 123.95 3pcb h LEU 363 Ca -0.05 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.84 3pcb h LEU 363 Cb 0.97 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.70 3pcb h LEU 363 CO 0.71 0.00 -0.35 -0.07 -1.08 0.00 0.00 178.44 177.65 3pcb h LEU 364 N 0.00 0.00 0.00 1.67 4.07 -1.91 -3.37 115.31 115.77 3pcb h LEU 364 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3pcb h LEU 364 Cb 0.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.94 3pcb h LEU 364 CO 0.00 0.35 -0.17 0.18 -1.08 0.00 0.00 178.44 177.72 3pcb n LEU 365 N -3.43 0.00 0.00 1.67 4.77 -0.41 -4.60 117.00 114.99 3pcb n LEU 365 Ca 0.00 -0.26 0.16 0.00 -0.03 0.00 0.00 56.01 55.88 3pcb n LEU 365 Cb 0.53 0.00 0.94 0.00 -2.33 0.00 0.00 43.42 42.55 3pcb n LEU 365 CO 0.36 0.00 1.10 -0.46 -1.33 0.00 0.00 177.39 177.07 3pcb n ASN 366 N -0.77 0.00 -0.01 -1.43 0.23 0.23 -5.04 115.26 108.47 3pcb n ASN 366 Ca 0.00 -0.95 -0.00 0.00 -0.53 0.00 0.00 54.58 53.09 3pcb n ASN 366 Cb 0.00 -0.01 -0.00 0.00 -2.08 0.00 0.00 39.78 37.68 3pcb n ASN 366 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 3pcb n PHE 367 N -1.01 0.04 -0.01 -2.53 7.35 -1.26 -4.97 117.46 115.06 3pcb n PHE 367 Ca 0.23 0.02 0.00 0.00 -0.76 0.00 0.00 57.45 56.94 3pcb n PHE 367 Cb 0.12 -0.18 0.00 0.00 0.35 0.00 0.00 39.48 39.76 3pcb n PHE 367 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3pcb n GLY 371 N 1.64 0.00 3.90 7.13 0.00 -1.26 -4.83 105.19 111.77 3pcb n GLY 371 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 3pcb n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3pcb s LEU 372 N -0.07 4.36 0.62 0.99 1.02 -1.26 -4.85 118.68 119.48 3pcb s LEU 372 Ca 0.00 0.45 -0.15 0.00 0.02 0.00 0.00 54.13 54.44 3pcb s LEU 372 Cb 0.00 -2.73 -0.02 0.00 0.02 0.00 0.00 46.19 43.45 3pcb s LEU 372 CO 0.00 0.23 1.08 -2.16 0.02 0.00 0.00 176.35 175.52 3pcb s PRO 373 N -1.98 3.14 -0.08 1.29 0.05 -1.26 -4.79 135.00 131.37 3pcb s PRO 373 Ca 0.29 1.27 -0.18 0.00 0.05 0.00 0.00 61.00 62.44 3pcb s PRO 373 Cb -0.13 -2.00 -0.05 0.00 0.05 0.00 0.00 34.50 32.37 3pcb s PRO 373 CO 0.19 -0.96 0.47 0.42 0.05 0.00 0.00 177.00 177.17 3pcb s ILE 374 N -2.41 5.11 0.00 0.56 1.01 -1.26 -4.99 121.20 119.22 3pcb s ILE 374 Ca 0.65 0.95 0.00 0.00 0.00 0.00 0.00 60.65 62.25 3pcb s ILE 374 Cb -0.18 -3.80 0.00 0.00 0.01 0.00 0.00 42.46 38.49 3pcb s ILE 374 CO 0.38 0.40 0.00 0.61 0.00 0.00 0.00 174.94 176.34 3pcb n GLY 375 N 2.82 1.83 3.60 6.18 0.00 -1.26 -4.52 105.19 113.84 3pcb n GLY 375 Ca -0.09 -1.89 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 3pcb n GLY 375 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3pcb s GLU 376 N -1.38 3.44 0.02 1.61 2.02 -1.26 -4.90 118.70 118.26 3pcb s GLU 376 Ca 0.00 1.00 -0.30 0.00 0.02 0.00 0.00 54.97 55.69 3pcb s GLU 376 Cb 0.00 -4.10 -0.06 0.00 0.10 0.00 0.00 34.13 30.07 3pcb s GLU 376 CO 0.00 -1.73 1.48 1.03 0.02 0.00 0.00 175.26 176.06 3pcb s ARG 377 N 5.28 4.25 0.05 1.61 0.52 -1.26 -0.82 118.95 128.58 3pcb s ARG 377 Ca 0.65 2.09 -0.05 0.00 -0.52 0.00 0.00 55.73 57.91 3pcb s ARG 377 Cb -0.16 -3.57 -0.02 0.00 0.52 0.00 0.00 34.95 31.72 3pcb s ARG 377 CO 0.32 -0.63 0.08 0.96 0.02 0.00 0.00 175.30 176.05 3pcb s ILE 378 N 2.46 0.15 -0.16 1.52 -4.36 -0.23 -2.50 121.20 118.07 3pcb s ILE 378 Ca 0.67 -1.23 -0.05 0.00 -0.26 0.00 0.00 60.65 59.78 3pcb s ILE 378 Cb -0.34 -1.04 -0.03 0.00 1.25 0.00 0.00 42.46 42.30 3pcb s ILE 378 CO 0.28 -0.68 0.01 -0.63 0.24 0.00 0.00 174.94 174.16 3pcb s ILE 379 N -2.96 4.31 -0.26 8.37 1.01 -0.06 -1.01 121.20 130.61 3pcb s ILE 379 Ca -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 60.65 60.41 3pcb s ILE 379 Cb 0.01 -2.91 0.03 0.00 0.01 0.00 0.00 42.46 39.60 3pcb s ILE 379 CO -0.06 0.49 -0.06 -0.69 0.00 0.00 0.00 174.94 174.61 3pcb s VAL 380 N 0.26 2.79 0.15 2.92 1.01 -0.46 -0.70 120.40 126.38 3pcb s VAL 380 Ca 0.00 -1.14 0.01 0.00 0.00 0.00 0.00 61.98 60.85 3pcb s VAL 380 Cb -0.13 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 3pcb s VAL 380 CO 0.02 0.14 0.02 0.00 0.00 0.00 0.00 175.10 175.27 3pcb s ALA 381 N 1.29 1.15 0.00 5.51 0.00 -0.70 -0.23 121.76 128.78 3pcb s ALA 381 Ca -0.01 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.41 3pcb s ALA 381 Cb -0.17 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.58 3pcb s ALA 381 CO -0.04 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 175.75 3pcb n GLY 382 N -0.17 -1.38 3.22 0.00 0.00 -1.04 -0.44 105.19 105.37 3pcb n GLY 382 Ca -0.07 -1.00 -0.24 0.00 0.00 0.00 0.00 46.02 44.72 3pcb n GLY 382 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pcb s ARG 383 N -0.98 1.27 -0.28 1.61 3.52 -1.25 -1.68 118.95 121.16 3pcb s ARG 383 Ca 0.00 -0.87 -0.09 0.00 -0.13 0.00 0.00 55.73 54.64 3pcb s ARG 383 Cb 0.00 -1.35 -0.03 0.00 -1.56 0.00 0.00 34.95 32.02 3pcb s ARG 383 CO 0.00 0.34 0.14 0.08 -0.81 0.00 0.00 175.30 175.05 3pcb s VAL 384 N -0.78 4.69 0.34 7.11 1.01 0.12 -1.72 120.40 131.17 3pcb s VAL 384 Ca 0.06 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.89 3pcb s VAL 384 Cb -0.08 -3.29 -0.06 0.00 0.00 0.00 0.00 36.38 32.95 3pcb s VAL 384 CO 0.01 0.20 0.06 0.68 0.00 0.00 0.00 175.10 176.06 3pcb s VAL 385 N 1.65 1.21 0.52 2.92 -7.23 -0.60 -0.75 120.40 118.13 3pcb s VAL 385 Ca 0.06 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.31 3pcb s VAL 385 Cb -0.16 -2.78 0.05 0.00 0.56 0.00 0.00 36.38 34.05 3pcb s VAL 385 CO 0.07 0.00 0.61 1.51 -0.31 0.00 0.00 175.10 176.97 3pcb s ASP 386 N -3.51 5.05 0.63 4.85 -4.77 0.61 -0.25 116.67 119.29 3pcb s ASP 386 Ca 0.35 -0.87 0.37 0.00 -3.30 0.00 0.00 52.55 49.10 3pcb s ASP 386 Cb 0.08 0.07 2.12 0.00 -1.09 0.00 0.00 42.92 44.10 3pcb s ASP 386 CO 0.15 -1.10 2.29 1.56 0.70 0.00 0.00 175.17 178.77 3pcb h GLN 387 N 0.51 0.00 0.00 2.11 4.20 -1.04 0.13 115.11 121.01 3pcb h GLN 387 Ca -0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.36 3pcb h GLN 387 Cb 1.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.07 3pcb h GLN 387 CO 0.48 0.00 -0.24 0.66 -0.67 0.00 0.00 178.83 179.06 3pcb n TYR 388 N -3.42 0.28 -0.15 2.96 4.01 -1.26 -4.92 117.16 114.66 3pcb n TYR 388 Ca -0.03 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 3pcb n TYR 388 Cb 0.11 -0.55 0.00 0.00 -0.31 0.00 0.00 39.34 38.59 3pcb n TYR 388 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3pcb n GLY 389 N 1.43 0.87 3.71 2.72 0.00 0.03 -5.07 105.19 108.89 3pcb n GLY 389 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3pcb n GLY 389 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3pcb s LYS 390 N -0.85 4.42 0.72 1.61 2.20 -1.26 -4.74 119.74 121.83 3pcb s LYS 390 Ca 0.00 0.93 -0.16 0.00 -0.36 0.00 0.00 55.97 56.39 3pcb s LYS 390 Cb 0.00 -3.47 0.03 0.00 -1.51 0.00 0.00 37.83 32.88 3pcb s LYS 390 CO 0.00 -0.02 1.22 -2.14 -0.36 0.00 0.00 175.35 174.06 3pcb s PRO 391 N 1.06 2.19 -0.42 4.03 0.02 -1.26 -0.28 135.00 140.34 3pcb s PRO 391 Ca 0.38 1.82 0.04 0.00 0.02 0.00 0.00 61.00 63.26 3pcb s PRO 391 Cb -0.18 -1.83 0.11 0.00 0.02 0.00 0.00 34.50 32.62 3pcb s PRO 391 CO 0.18 -1.81 0.15 0.08 -0.33 0.00 0.00 177.00 175.27 3pcb s VAL 392 N -1.87 2.46 0.43 3.83 1.01 0.07 -4.80 120.40 121.53 3pcb s VAL 392 Ca 0.76 -2.75 -0.15 0.00 0.00 0.00 0.00 61.98 59.84 3pcb s VAL 392 Cb -0.31 -2.76 -0.08 0.00 0.00 0.00 0.00 36.38 33.23 3pcb s VAL 392 CO 0.44 -0.69 0.86 -2.16 0.00 0.00 0.00 175.10 173.56 3pcb s PRO 393 N 0.40 3.96 -1.43 2.72 0.04 -1.26 -4.25 135.00 135.17 3pcb s PRO 393 Ca 0.13 0.78 -0.07 0.00 0.04 0.00 0.00 61.00 61.89 3pcb s PRO 393 Cb -0.22 -2.28 0.04 0.00 0.04 0.00 0.00 34.50 32.08 3pcb s PRO 393 CO -0.05 -0.07 0.79 0.09 0.04 0.00 0.00 177.00 177.81 3pcb n ASN 394 N -1.06 -2.72 -4.76 6.66 4.13 -0.62 -4.95 115.26 111.93 3pcb n ASN 394 Ca 0.05 -0.83 -0.30 0.00 1.68 0.00 0.00 54.58 55.17 3pcb n ASN 394 Cb 0.54 -3.81 -0.07 0.00 -1.54 0.00 0.00 39.78 34.90 3pcb n ASN 394 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 3pcb s THR 395 N -3.53 4.43 -0.16 3.41 -1.32 -1.26 -4.53 115.64 112.69 3pcb s THR 395 Ca 0.32 -0.83 -0.23 0.00 -1.21 0.00 0.00 61.69 59.73 3pcb s THR 395 Cb -0.16 -3.14 -0.02 0.00 -1.51 0.00 0.00 72.50 67.67 3pcb s THR 395 CO 0.83 0.11 0.74 -0.22 -2.21 0.00 0.00 174.62 173.87 3pcb s LEU 396 N -2.43 4.20 -0.18 9.08 2.96 -1.26 -0.74 118.68 130.30 3pcb s LEU 396 Ca 0.29 1.07 0.01 0.00 -0.22 0.00 0.00 54.13 55.28 3pcb s LEU 396 Cb -0.12 -3.10 0.02 0.00 0.50 0.00 0.00 46.19 43.49 3pcb s LEU 396 CO 0.21 -0.30 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.06 3pcb s VAL 397 N 1.79 2.15 -0.00 1.68 1.01 -0.12 -1.65 120.40 125.25 3pcb s VAL 397 Ca 0.35 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.50 3pcb s VAL 397 Cb -0.17 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 3pcb s VAL 397 CO 0.13 0.53 -0.23 -1.61 0.00 0.00 0.00 175.10 173.92 3pcb s GLU 398 N 1.30 1.80 0.04 2.72 2.02 -0.04 -0.65 118.70 125.89 3pcb s GLU 398 Ca 0.05 -0.87 -0.01 0.00 0.02 0.00 0.00 54.97 54.15 3pcb s GLU 398 Cb -0.13 -1.79 -0.03 0.00 0.10 0.00 0.00 34.13 32.27 3pcb s GLU 398 CO -0.12 0.48 -0.01 0.00 0.02 0.00 0.00 175.26 175.63 3pcb s MET 399 N -0.71 0.55 -0.15 1.61 0.23 -0.39 0.10 119.30 120.53 3pcb s MET 399 Ca 0.09 -1.03 -0.19 0.00 -1.03 0.00 0.00 55.69 53.53 3pcb s MET 399 Cb -0.09 0.19 0.05 0.00 -1.53 0.00 0.00 34.83 33.45 3pcb s MET 399 CO -0.00 -0.11 0.50 1.67 -2.03 0.00 0.00 175.02 175.05 3pcb s TRP 400 N -3.23 -0.52 0.30 3.16 -2.14 -0.91 -1.78 118.94 113.82 3pcb s TRP 400 Ca 0.01 1.18 -0.16 0.00 2.66 0.00 0.00 56.10 59.78 3pcb s TRP 400 Cb 0.03 0.20 0.02 0.00 -3.10 0.00 0.00 33.47 30.62 3pcb s TRP 400 CO -0.07 -0.33 0.65 1.14 -2.66 0.00 0.00 176.95 175.68 3pcb s GLN 401 N -0.13 1.83 0.86 3.25 -2.07 -0.71 -0.79 119.66 121.90 3pcb s GLN 401 Ca -0.03 -1.22 -0.10 0.00 -1.82 0.00 0.00 55.36 52.19 3pcb s GLN 401 Cb -0.03 0.56 0.17 0.00 -1.09 0.00 0.00 33.01 32.62 3pcb s GLN 401 CO 0.02 -0.82 1.19 0.00 -1.32 0.00 0.00 175.29 174.37 3pcb s ALA 402 N -3.55 2.82 0.82 2.60 0.00 -1.26 -4.59 121.76 118.60 3pcb s ALA 402 Ca 0.17 -1.40 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 3pcb s ALA 402 Cb -0.04 -2.48 0.02 0.00 0.00 0.00 0.00 23.12 20.62 3pcb s ALA 402 CO 0.10 -2.04 0.12 0.27 0.00 0.00 0.00 175.76 174.20 3pcb n ASN 403 N -3.39 0.05 0.28 0.00 0.23 -0.24 -4.57 115.26 107.61 3pcb n ASN 403 Ca 0.15 -1.07 0.14 0.00 -0.53 0.00 0.00 54.58 53.28 3pcb n ASN 403 Cb 0.60 -0.09 0.83 0.00 -2.08 0.00 0.00 39.78 39.04 3pcb n ASN 403 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3pcb h ALA 404 N -1.52 1.37 -0.16 -2.53 0.00 -1.79 -1.39 119.26 113.23 3pcb h ALA 404 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3pcb h ALA 404 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3pcb h ALA 404 CO 0.03 0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.77 3pcb n GLY 405 N -0.96 1.24 1.18 0.00 0.00 -1.26 -3.34 105.19 102.05 3pcb n GLY 405 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3pcb n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pcb n GLY 406 N 1.39 0.65 3.71 -0.02 0.00 -0.97 -4.80 105.19 105.14 3pcb n GLY 406 Ca 0.16 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 3pcb n GLY 406 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pcb s ARG 407 N -1.03 4.17 0.14 1.61 6.06 -1.26 -4.76 118.95 123.88 3pcb s ARG 407 Ca 0.00 -0.17 -0.07 0.00 -2.50 0.00 0.00 55.73 52.98 3pcb s ARG 407 Cb 0.00 -3.46 -0.06 0.00 0.06 0.00 0.00 34.95 31.49 3pcb s ARG 407 CO 0.00 0.21 0.42 0.71 -2.50 0.00 0.00 175.30 174.15 3pcb s TYR 408 N 0.60 3.50 -1.30 5.12 1.51 -1.26 -1.08 117.35 124.44 3pcb s TYR 408 Ca 0.10 0.70 -0.10 0.00 -1.01 0.00 0.00 57.07 56.75 3pcb s TYR 408 Cb -0.12 -2.11 0.15 0.00 -0.11 0.00 0.00 41.96 39.77 3pcb s TYR 408 CO 0.01 0.42 1.89 -2.13 -1.11 0.00 0.00 175.55 174.63 3pcb n ARG 409 N 0.28 3.50 -3.78 -0.62 0.63 -1.26 -4.73 116.66 110.68 3pcb n ARG 409 Ca -0.03 -3.43 -0.13 0.00 -0.92 0.00 0.00 57.85 53.34 3pcb n ARG 409 Cb 0.52 -2.99 -0.13 0.00 0.45 0.00 0.00 32.46 30.31 3pcb n ARG 409 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 3pcb s HIS 410 N 0.88 -0.20 0.23 -0.14 2.46 -1.26 -5.06 115.29 112.19 3pcb s HIS 410 Ca 0.41 0.51 -0.16 0.00 0.47 0.00 0.00 55.06 56.29 3pcb s HIS 410 Cb 0.09 0.01 0.25 0.00 -0.13 0.00 0.00 32.58 32.81 3pcb s HIS 410 CO -0.01 -0.14 1.57 0.87 -2.47 0.00 0.00 174.74 174.56 3pcb h LYS 411 N 6.55 -0.04 0.00 2.88 1.57 -2.07 0.25 116.57 125.72 3pcb h LYS 411 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 3pcb h LYS 411 Cb 1.17 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3pcb h LYS 411 CO 0.41 -0.02 0.00 0.09 -0.57 0.00 0.00 179.45 179.35 3pcb n ASN 412 N -5.49 0.00 -4.46 0.86 5.03 -1.26 -4.59 115.26 105.35 3pcb n ASN 412 Ca 0.10 0.09 -0.43 0.00 0.87 0.00 0.00 54.58 55.21 3pcb n ASN 412 Cb 0.40 -0.20 -0.08 0.00 -1.02 0.00 0.00 39.78 38.89 3pcb n ASN 412 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3pcb s ASP 413 N -2.40 6.21 -0.04 6.41 2.15 0.87 -4.88 116.67 124.99 3pcb s ASP 413 Ca 0.06 -0.80 0.19 0.00 0.43 0.00 0.00 52.55 52.42 3pcb s ASP 413 Cb 0.04 -2.25 0.60 0.00 -0.30 0.00 0.00 42.92 41.00 3pcb s ASP 413 CO 0.08 -0.72 1.50 0.54 -0.17 0.00 0.00 175.17 176.40 3pcb n ARG 414 N 5.81 3.07 -1.77 4.34 5.12 -1.26 -4.90 116.66 127.07 3pcb n ARG 414 Ca -0.07 -2.62 -0.41 0.00 -1.93 0.00 0.00 57.85 52.82 3pcb n ARG 414 Cb 0.46 -1.62 -0.00 0.00 -1.16 0.00 0.00 32.46 30.14 3pcb n ARG 414 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 3pcb n TYR 415 N 1.17 2.95 0.30 -1.55 9.36 -1.26 -4.87 117.16 123.26 3pcb n TYR 415 Ca 0.22 0.40 0.18 0.00 3.32 0.00 0.00 57.90 62.02 3pcb n TYR 415 Cb 0.67 -2.55 0.84 0.00 -0.63 0.00 0.00 39.34 37.68 3pcb n TYR 415 CO 0.00 0.00 0.00 1.37 0.22 0.00 0.00 176.86 178.45 3pcb h LEU 416 N 3.36 0.00 -9.81 2.98 -0.00 -1.98 -3.43 115.31 106.43 3pcb h LEU 416 Ca -0.50 0.00 -0.52 0.00 -0.00 0.00 0.00 57.88 56.86 3pcb h LEU 416 Cb 1.24 0.00 0.04 0.00 -0.00 0.00 0.00 40.66 41.94 3pcb h LEU 416 CO 0.67 0.00 0.59 0.00 -0.00 0.00 0.00 178.44 179.71 3pcb s ALA 417 N -3.78 3.48 0.72 0.17 0.00 -1.26 -4.98 121.76 116.11 3pcb s ALA 417 Ca -0.01 1.12 -0.11 0.00 0.00 0.00 0.00 51.96 52.96 3pcb s ALA 417 Cb 0.10 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.81 3pcb s ALA 417 CO 0.44 -0.48 1.07 -1.25 0.00 0.00 0.00 175.76 175.54 3pcb s PRO 418 N -1.29 2.73 0.52 0.00 0.04 -1.26 -4.74 135.00 131.00 3pcb s PRO 418 Ca 0.49 0.96 -0.17 0.00 0.04 0.00 0.00 61.00 62.32 3pcb s PRO 418 Cb -0.37 -1.97 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 3pcb s PRO 418 CO 0.46 -1.25 1.00 -0.51 0.04 0.00 0.00 177.00 176.74 3pcb s LEU 419 N -5.64 3.65 -0.29 -3.56 1.43 -1.26 -4.74 118.68 108.27 3pcb s LEU 419 Ca 0.59 1.65 -0.10 0.00 -1.03 0.00 0.00 54.13 55.24 3pcb s LEU 419 Cb -0.15 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.52 3pcb s LEU 419 CO 0.55 -0.68 0.17 -0.62 0.23 0.00 0.00 176.35 175.99 3pcb s ASP 420 N -2.85 5.75 0.56 2.29 -1.08 -1.26 -4.98 116.67 115.10 3pcb s ASP 420 Ca 0.61 -0.20 0.36 0.00 -0.52 0.00 0.00 52.55 52.79 3pcb s ASP 420 Cb -0.11 -2.06 1.95 0.00 -1.46 0.00 0.00 42.92 41.23 3pcb s ASP 420 CO 0.30 -0.10 2.09 1.55 0.52 0.00 0.00 175.17 179.53 3pcb h PRO 421 N 8.36 0.00 -0.32 4.34 0.13 -1.96 -1.48 132.00 141.06 3pcb h PRO 421 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3pcb h PRO 421 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3pcb h PRO 421 CO 0.58 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.44 3pcb n ASN 422 N -2.79 3.79 -3.95 1.44 5.03 -1.26 -4.98 115.26 112.53 3pcb n ASN 422 Ca -0.02 -2.74 -0.23 0.00 0.87 0.00 0.00 54.58 52.46 3pcb n ASN 422 Cb 0.10 -0.48 -0.17 0.00 -1.02 0.00 0.00 39.78 38.22 3pcb n ASN 422 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 3pcb s PHE 423 N -2.33 1.20 -0.23 3.10 5.36 -0.56 -4.24 117.98 120.28 3pcb s PHE 423 Ca 0.39 -0.45 -0.16 0.00 -0.96 0.00 0.00 56.93 55.75 3pcb s PHE 423 Cb 0.29 -0.95 -0.10 0.00 -0.34 0.00 0.00 43.02 41.92 3pcb s PHE 423 CO 0.12 -0.29 -0.29 0.41 -1.46 0.00 0.00 175.22 173.71 3pcb n GLY 424 N 4.12 -0.56 0.46 13.12 0.00 -1.26 -4.69 105.19 116.38 3pcb n GLY 424 Ca -0.21 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3pcb n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pcb n GLY 425 N 1.37 0.87 3.23 -0.02 0.00 -1.26 -4.58 105.19 104.79 3pcb n GLY 425 Ca -0.35 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 3pcb n GLY 425 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3pcb s VAL 426 N -2.00 1.88 0.06 1.61 1.01 -1.26 -1.73 120.40 119.97 3pcb s VAL 426 Ca 0.00 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 60.95 3pcb s VAL 426 Cb 0.00 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 3pcb s VAL 426 CO 0.00 0.53 0.11 -0.83 0.00 0.00 0.00 175.10 174.91 3pcb s GLY 427 N -0.08 0.20 -0.04 4.51 0.00 -0.74 -4.76 107.32 106.42 3pcb s GLY 427 Ca -0.04 -0.71 -0.17 0.00 0.00 0.00 0.00 44.72 43.79 3pcb s GLY 427 CO 0.04 -0.87 0.38 1.09 0.00 0.00 0.00 173.10 173.74 3pcb s ARG 428 N -3.42 0.71 -0.23 2.90 1.70 -0.86 -1.27 118.95 118.49 3pcb s ARG 428 Ca 0.02 -0.03 -0.20 0.00 -0.47 0.00 0.00 55.73 55.05 3pcb s ARG 428 Cb 0.03 0.32 0.06 0.00 -0.57 0.00 0.00 34.95 34.80 3pcb s ARG 428 CO -0.08 -0.19 0.60 0.00 -1.08 0.00 0.00 175.30 174.54 3pcb s LEU 430 N 0.43 4.28 0.67 0.00 2.96 -1.26 -0.95 118.68 124.81 3pcb s LEU 430 Ca -0.01 0.58 -0.16 0.00 -0.22 0.00 0.00 54.13 54.32 3pcb s LEU 430 Cb -0.04 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.24 3pcb s LEU 430 CO -0.01 0.13 1.16 0.42 -1.32 0.00 0.00 176.35 176.73 3pcb s THR 431 N 0.25 2.77 0.36 3.68 -4.23 0.08 -4.85 115.64 113.70 3pcb s THR 431 Ca 0.18 0.39 -0.04 0.00 -1.18 0.00 0.00 61.69 61.04 3pcb s THR 431 Cb -0.13 -2.97 0.08 0.00 1.34 0.00 0.00 72.50 70.82 3pcb s THR 431 CO 0.05 -0.19 0.49 -0.90 -0.54 0.00 0.00 174.62 173.53 3pcb n ASP 432 N -2.34 0.24 0.28 3.99 5.68 -0.63 -1.59 116.55 122.18 3pcb n ASP 432 Ca 0.12 -1.30 0.17 0.00 -0.50 0.00 0.00 54.79 53.28 3pcb n ASP 432 Cb 0.51 -0.35 0.94 0.00 -1.14 0.00 0.00 41.12 41.08 3pcb n ASP 432 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3pcb h SER 433 N -0.53 0.00 -0.35 -1.12 0.02 -1.95 -0.27 113.55 109.35 3pcb h SER 433 Ca -0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 3pcb h SER 433 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 3pcb h SER 433 CO 0.13 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.29 3pcb n ASP 434 N -3.66 3.42 0.00 3.07 8.00 -1.26 -4.64 116.55 121.48 3pcb n ASP 434 Ca -0.02 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.49 3pcb n ASP 434 Cb 0.16 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 3pcb n ASP 434 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3pcb n GLY 435 N 1.48 0.60 3.80 0.44 0.00 -0.11 -4.73 105.19 106.67 3pcb n GLY 435 Ca 0.19 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3pcb n GLY 435 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3pcb s TYR 436 N -2.00 3.67 0.11 1.61 2.02 -1.26 0.12 117.35 121.61 3pcb s TYR 436 Ca 0.00 1.51 0.02 0.00 -0.37 0.00 0.00 57.07 58.24 3pcb s TYR 436 Cb 0.00 -2.72 -0.04 0.00 -0.40 0.00 0.00 41.96 38.80 3pcb s TYR 436 CO 0.00 0.30 -0.07 1.52 -1.57 0.00 0.00 175.55 175.73 3pcb s TYR 437 N -1.55 0.97 -0.10 2.71 -0.85 -0.68 -1.61 117.35 116.25 3pcb s TYR 437 Ca 0.45 -0.88 -0.25 0.00 -0.52 0.00 0.00 57.07 55.87 3pcb s TYR 437 Cb -0.17 -0.54 0.06 0.00 0.38 0.00 0.00 41.96 41.68 3pcb s TYR 437 CO 0.22 -0.10 0.59 -1.54 -1.52 0.00 0.00 175.55 173.20 3pcb s SER 438 N -3.05 -0.57 0.10 -0.18 1.04 -1.26 -2.50 113.70 107.28 3pcb s SER 438 Ca 0.13 0.77 0.03 0.00 0.48 0.00 0.00 55.95 57.36 3pcb s SER 438 Cb 0.04 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.85 3pcb s SER 438 CO -0.04 -0.46 -0.09 -0.36 0.98 0.00 0.00 173.24 173.28 3pcb s PHE 439 N -0.74 1.02 -0.08 5.02 0.08 0.69 -4.91 117.98 119.05 3pcb s PHE 439 Ca -0.08 -0.73 0.00 0.00 0.12 0.00 0.00 56.93 56.24 3pcb s PHE 439 Cb -0.02 -0.56 0.02 0.00 -0.57 0.00 0.00 43.02 41.89 3pcb s PHE 439 CO 0.06 -0.03 -0.06 0.50 -0.10 0.00 0.00 175.22 175.59 3pcb s ARG 440 N -3.14 1.24 0.00 0.44 3.52 -0.77 -1.36 118.95 118.88 3pcb s ARG 440 Ca 0.08 -0.18 0.00 0.00 -0.13 0.00 0.00 55.73 55.50 3pcb s ARG 440 Cb -0.00 -1.29 0.00 0.00 -1.56 0.00 0.00 34.95 32.10 3pcb s ARG 440 CO -0.01 -0.19 0.00 -2.37 -0.81 0.00 0.00 175.30 171.92 3pcb n THR 441 N 4.62 0.00 -4.38 4.11 5.66 -0.18 0.06 114.28 124.16 3pcb n THR 441 Ca -0.15 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.57 3pcb n THR 441 Cb 0.50 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.16 3pcb n THR 441 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3pcb s ILE 442 N -2.54 2.12 -0.02 1.09 -4.36 -1.26 -1.07 121.20 115.17 3pcb s ILE 442 Ca 0.00 -1.69 -0.30 0.00 -0.26 0.00 0.00 60.65 58.40 3pcb s ILE 442 Cb 0.00 -1.88 -0.06 0.00 1.25 0.00 0.00 42.46 41.77 3pcb s ILE 442 CO 0.00 0.06 1.53 -0.75 0.24 0.00 0.00 174.94 176.02 3pcb s LYS 443 N -1.99 4.23 0.72 0.37 2.20 0.00 -4.91 119.74 120.37 3pcb s LYS 443 Ca 0.12 2.09 -0.13 0.00 -0.36 0.00 0.00 55.97 57.70 3pcb s LYS 443 Cb -0.10 -3.73 0.03 0.00 -1.51 0.00 0.00 37.83 32.53 3pcb s LYS 443 CO 0.05 -0.71 1.11 -1.25 -0.36 0.00 0.00 175.35 174.19 3pcb s PRO 444 N 3.07 2.45 0.35 4.03 0.04 -1.26 -4.27 135.00 139.40 3pcb s PRO 444 Ca 0.68 1.32 0.02 0.00 0.04 0.00 0.00 61.00 63.06 3pcb s PRO 444 Cb -0.33 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 3pcb s PRO 444 CO 0.28 -1.51 0.53 0.20 0.04 0.00 0.00 177.00 176.54 3pcb s GLY 445 N -2.92 1.39 0.83 0.56 0.00 -0.56 -4.71 107.32 101.91 3pcb s GLY 445 Ca 0.65 -1.05 -0.11 0.00 0.00 0.00 0.00 44.72 44.20 3pcb s GLY 445 CO 0.49 -0.98 1.09 -4.14 0.00 0.00 0.00 173.10 169.56 3pcb s PRO 446 N -4.30 1.83 -0.09 2.90 0.02 -1.26 -4.17 135.00 129.92 3pcb s PRO 446 Ca 0.41 0.75 -0.20 0.00 0.02 0.00 0.00 61.00 61.98 3pcb s PRO 446 Cb -0.10 -1.88 0.05 0.00 0.02 0.00 0.00 34.50 32.59 3pcb s PRO 446 CO 0.35 -1.83 0.49 1.52 -0.33 0.00 0.00 177.00 177.20 3pcb s TYR 447 N -3.06 -0.46 0.43 6.54 -0.85 -1.01 -4.18 117.35 114.77 3pcb s TYR 447 Ca 0.62 0.94 -0.22 0.00 -0.52 0.00 0.00 57.07 57.89 3pcb s TYR 447 Cb -0.16 0.22 -0.09 0.00 0.38 0.00 0.00 41.96 42.31 3pcb s TYR 447 CO 0.55 -0.40 1.03 -1.25 -1.52 0.00 0.00 175.55 173.96 3pcb s PRO 448 N -0.66 4.04 0.03 -3.49 0.04 -1.26 0.09 135.00 133.80 3pcb s PRO 448 Ca -0.08 1.40 -0.10 0.00 0.04 0.00 0.00 61.00 62.26 3pcb s PRO 448 Cb -0.03 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 32.18 3pcb s PRO 448 CO 0.04 -0.23 0.22 1.67 0.04 0.00 0.00 177.00 178.75 3pcb s TRP 449 N -1.84 0.01 -1.30 0.56 1.48 -0.97 -4.89 118.94 111.98 3pcb s TRP 449 Ca 0.62 -0.17 -0.18 0.00 -1.06 0.00 0.00 56.10 55.30 3pcb s TRP 449 Cb -0.18 0.00 0.03 0.00 -1.16 0.00 0.00 33.47 32.17 3pcb s TRP 449 CO 0.23 -0.43 1.88 0.54 -4.06 0.00 0.00 176.95 175.11 3pcb n ARG 450 N 0.77 2.86 0.00 3.25 1.74 -1.26 -4.35 116.66 119.67 3pcb n ARG 450 Ca -0.19 -2.97 0.00 0.00 -0.77 0.00 0.00 57.85 53.92 3pcb n ARG 450 Cb 0.58 -3.45 0.00 0.00 -1.02 0.00 0.00 32.46 28.57 3pcb n ARG 450 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3pcb n ASN 451 N 8.53 0.00 -4.72 0.55 5.15 -1.26 -5.02 115.26 118.48 3pcb n ASN 451 Ca 0.49 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 54.18 3pcb n ASN 451 Cb 0.44 0.00 0.11 0.00 -0.53 0.00 0.00 39.78 39.80 3pcb n ASN 451 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3pcb s GLY 452 N 0.00 1.64 0.61 8.20 0.00 -1.26 -4.95 107.32 111.56 3pcb s GLY 452 Ca 0.00 -0.81 0.37 0.00 0.00 0.00 0.00 44.72 44.28 3pcb s GLY 452 CO 0.00 -0.26 2.25 -2.55 0.00 0.00 0.00 173.10 172.54 3pcb h PRO 453 N -1.15 0.00 -1.62 2.90 0.11 -1.98 -3.31 132.00 126.95 3pcb h PRO 453 Ca -0.45 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.22 3pcb h PRO 453 Cb 1.31 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 32.03 3pcb h PRO 453 CO 0.59 0.02 -1.15 -1.71 -0.21 0.00 0.00 178.00 175.54 3pcb n ASN 454 N -3.34 0.78 -4.84 -2.05 5.15 -1.26 -5.09 115.26 104.61 3pcb n ASN 454 Ca -0.02 -2.96 -0.37 0.00 -0.60 0.00 0.00 54.58 50.63 3pcb n ASN 454 Cb 0.13 -0.45 -0.06 0.00 -0.53 0.00 0.00 39.78 38.88 3pcb n ASN 454 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3pcb s ASP 455 N -2.53 6.51 -0.04 1.20 1.01 -1.25 -5.07 116.67 116.50 3pcb s ASP 455 Ca 0.36 0.61 0.02 0.00 0.71 0.00 0.00 52.55 54.24 3pcb s ASP 455 Cb 0.38 -2.14 0.02 0.00 1.01 0.00 0.00 42.92 42.18 3pcb s ASP 455 CO -0.05 0.33 -0.07 0.26 0.21 0.00 0.00 175.17 175.85 3pcb s TRP 456 N -0.75 0.92 0.14 4.23 0.52 -1.26 -2.29 118.94 120.44 3pcb s TRP 456 Ca 0.17 -0.27 -0.30 0.00 0.02 0.00 0.00 56.10 55.72 3pcb s TRP 456 Cb -0.13 -0.73 -0.07 0.00 -1.15 0.00 0.00 33.47 31.39 3pcb s TRP 456 CO 0.06 -0.18 1.08 1.03 0.02 0.00 0.00 176.95 178.96 3pcb s ARG 457 N 0.66 4.59 0.82 4.98 1.81 0.11 -4.80 118.95 127.13 3pcb s ARG 457 Ca -0.10 1.65 -0.10 0.00 -1.72 0.00 0.00 55.73 55.46 3pcb s ARG 457 Cb -0.13 -3.32 0.09 0.00 -0.45 0.00 0.00 34.95 31.14 3pcb s ARG 457 CO 0.01 0.05 1.11 -2.14 -0.68 0.00 0.00 175.30 173.65 3pcb s PRO 458 N -0.02 1.81 0.26 3.54 0.02 -1.26 -2.39 135.00 136.95 3pcb s PRO 458 Ca 0.50 1.29 -0.31 0.00 0.02 0.00 0.00 61.00 62.50 3pcb s PRO 458 Cb -0.28 -1.84 -0.12 0.00 0.02 0.00 0.00 34.50 32.29 3pcb s PRO 458 CO 0.33 -1.99 1.60 0.00 -0.33 0.00 0.00 177.00 176.60 3pcb n ALA 459 N -3.77 2.33 -3.38 -1.55 0.00 -1.26 -4.72 120.51 108.15 3pcb n ALA 459 Ca 0.10 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.78 3pcb n ALA 459 Cb 0.53 -2.44 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 3pcb n ALA 459 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3pcb s HIS 460 N 0.33 -0.50 -0.12 0.00 -3.43 -1.26 -3.98 115.29 106.33 3pcb s HIS 460 Ca 0.68 0.64 0.02 0.00 -0.80 0.00 0.00 55.06 55.60 3pcb s HIS 460 Cb -0.53 0.39 -0.00 0.00 -1.43 0.00 0.00 32.58 31.00 3pcb s HIS 460 CO 0.44 -0.66 -0.19 0.42 -2.00 0.00 0.00 174.74 172.75 3pcb s ILE 461 N -2.23 2.48 0.04 -5.38 1.01 -0.76 -4.61 121.20 111.75 3pcb s ILE 461 Ca -0.06 -0.86 -0.28 0.00 0.00 0.00 0.00 60.65 59.45 3pcb s ILE 461 Cb -0.01 -2.00 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 3pcb s ILE 461 CO 0.00 0.54 0.87 -1.00 0.00 0.00 0.00 174.94 175.35 3pcb s HIS 462 N 0.42 3.72 0.01 3.97 3.76 0.03 -0.76 115.29 126.44 3pcb s HIS 462 Ca -0.14 1.60 0.09 0.00 -0.15 0.00 0.00 55.06 56.46 3pcb s HIS 462 Cb -0.17 -2.96 -0.02 0.00 1.11 0.00 0.00 32.58 30.53 3pcb s HIS 462 CO 0.06 0.16 -0.26 -0.06 -0.85 0.00 0.00 174.74 173.79 3pcb s PHE 463 N 0.32 2.33 -0.08 1.40 0.40 0.15 -2.13 117.98 120.36 3pcb s PHE 463 Ca 0.44 -0.43 0.02 0.00 -0.60 0.00 0.00 56.93 56.37 3pcb s PHE 463 Cb -0.21 -1.44 0.01 0.00 0.51 0.00 0.00 43.02 41.89 3pcb s PHE 463 CO 0.26 0.05 -0.13 0.20 0.70 0.00 0.00 175.22 176.30 3pcb s GLY 464 N -0.95 0.89 -0.06 4.36 0.00 0.11 -0.22 107.32 111.45 3pcb s GLY 464 Ca 0.11 -0.54 0.02 0.00 0.00 0.00 0.00 44.72 44.31 3pcb s GLY 464 CO 0.01 0.21 -0.10 -0.42 0.00 0.00 0.00 173.10 172.80 3pcb s ILE 465 N 0.86 0.93 -0.07 0.90 1.09 0.21 -0.86 121.20 124.27 3pcb s ILE 465 Ca -0.10 -0.36 -0.11 0.00 -1.10 0.00 0.00 60.65 58.98 3pcb s ILE 465 Cb -0.15 -0.88 -0.07 0.00 -1.06 0.00 0.00 42.46 40.30 3pcb s ILE 465 CO 0.01 0.31 0.43 0.77 -0.10 0.00 0.00 174.94 176.36 3pcb h SER 466 N 7.03 -0.24 -3.45 3.58 4.64 -1.60 -0.81 113.55 122.70 3pcb h SER 466 Ca -0.33 -0.07 0.01 0.00 -0.47 0.00 0.00 61.79 60.92 3pcb h SER 466 Cb 1.18 0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3pcb h SER 466 CO 0.47 0.26 -0.01 0.61 -0.87 0.00 0.00 176.83 177.29 3pcb n GLY 467 N 0.98 -1.91 0.19 -0.77 0.00 -1.26 -2.71 105.19 99.71 3pcb n GLY 467 Ca -0.05 -1.35 0.05 0.00 0.00 0.00 0.00 46.02 44.67 3pcb n GLY 467 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3pcb h PRO 468 N 0.00 0.00 -4.30 1.61 0.13 -1.93 -3.47 132.00 124.04 3pcb h PRO 468 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.82 3pcb h PRO 468 Cb 0.03 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.06 3pcb h PRO 468 CO 0.00 0.37 -0.28 -1.54 -0.23 0.00 0.00 178.00 176.32 3pcb s SER 469 N -6.64 1.01 0.45 1.44 1.04 -1.26 -3.69 113.70 106.05 3pcb s SER 469 Ca -0.02 -1.52 0.31 0.00 0.48 0.00 0.00 55.95 55.20 3pcb s SER 469 Cb 0.13 0.62 1.33 0.00 0.10 0.00 0.00 66.02 68.20 3pcb s SER 469 CO 0.70 -1.21 1.91 0.16 0.98 0.00 0.00 173.24 175.77 3pcb h ILE 470 N 2.15 0.00 0.00 -1.02 3.07 -1.18 -2.20 117.51 118.33 3pcb h ILE 470 Ca -0.28 -0.34 -0.06 0.00 1.55 0.00 0.00 64.86 65.73 3pcb h ILE 470 Cb 1.24 1.23 -0.01 0.00 -0.27 0.00 0.00 36.82 39.01 3pcb h ILE 470 CO 0.39 0.00 -0.28 0.00 -1.05 0.00 0.00 178.15 177.21 3pcb h ALA 471 N 2.09 1.07 0.00 0.16 0.00 -1.78 -3.18 119.26 117.63 3pcb h ALA 471 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3pcb h ALA 471 Cb 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3pcb h ALA 471 CO 0.00 0.35 -1.49 0.25 0.00 0.00 0.00 179.25 178.37 3pcb n THR 472 N -3.54 0.16 -1.60 0.00 -2.24 -0.84 -4.94 114.28 101.29 3pcb n THR 472 Ca -0.00 -0.40 -0.48 0.00 -2.27 0.00 0.00 64.05 60.89 3pcb n THR 472 Cb 0.43 0.08 -0.04 0.00 -2.10 0.00 0.00 70.33 68.70 3pcb n THR 472 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3pcb n LYS 473 N -2.20 1.33 -3.83 -0.78 3.00 -1.10 -4.76 118.16 109.83 3pcb n LYS 473 Ca -0.01 0.47 -0.12 0.00 -0.00 0.00 0.00 58.31 58.65 3pcb n LYS 473 Cb 0.51 -2.01 -0.11 0.00 0.00 0.00 0.00 35.03 33.43 3pcb n LYS 473 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3pcb s LEU 474 N 0.55 1.31 -0.08 3.14 2.96 -0.31 -5.03 118.68 121.23 3pcb s LEU 474 Ca 0.73 0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.78 3pcb s LEU 474 Cb -0.82 0.78 -0.00 0.00 0.50 0.00 0.00 46.19 46.65 3pcb s LEU 474 CO 0.51 -0.26 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.43 3pcb s ILE 475 N -0.75 1.92 0.13 6.68 1.01 -1.26 -0.62 121.20 128.31 3pcb s ILE 475 Ca -0.08 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 3pcb s ILE 475 Cb -0.05 -1.65 0.01 0.00 0.01 0.00 0.00 42.46 40.78 3pcb s ILE 475 CO 0.01 0.53 0.20 1.07 0.00 0.00 0.00 174.94 176.75 3pcb n THR 476 N 3.30 0.00 -3.92 2.92 5.66 0.69 -5.01 114.28 117.93 3pcb n THR 476 Ca -0.19 -0.55 -0.14 0.00 -3.05 0.00 0.00 64.05 60.13 3pcb n THR 476 Cb 0.53 0.37 -0.15 0.00 -1.55 0.00 0.00 70.33 69.53 3pcb n THR 476 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3pcb s GLN 477 N -2.22 0.11 -0.11 1.09 -0.21 -1.26 0.33 119.66 117.38 3pcb s GLN 477 Ca 0.09 -0.01 -0.10 0.00 0.02 0.00 0.00 55.36 55.36 3pcb s GLN 477 Cb -0.01 -0.15 -0.05 0.00 1.00 0.00 0.00 33.01 33.80 3pcb s GLN 477 CO 0.06 -0.01 0.22 -1.17 -2.12 0.00 0.00 175.29 172.27 3pcb s LEU 478 N 0.21 4.35 0.28 2.90 0.20 0.06 -4.83 118.68 121.85 3pcb s LEU 478 Ca -0.02 0.54 0.11 0.00 0.69 0.00 0.00 54.13 55.46 3pcb s LEU 478 Cb -0.03 -2.23 -0.05 0.00 -0.43 0.00 0.00 46.19 43.45 3pcb s LEU 478 CO -0.01 0.30 -0.16 -0.31 -0.29 0.00 0.00 176.35 175.89 3pcb s TYR 479 N -0.57 2.37 -0.18 5.38 2.02 0.29 -1.82 117.35 124.85 3pcb s TYR 479 Ca 0.16 -0.31 -0.09 0.00 -0.37 0.00 0.00 57.07 56.47 3pcb s TYR 479 Cb -0.13 -1.03 -0.05 0.00 -0.40 0.00 0.00 41.96 40.35 3pcb s TYR 479 CO 0.05 0.70 0.10 -0.06 -1.57 0.00 0.00 175.55 174.77 3pcb s PHE 480 N -2.47 3.37 0.05 2.71 0.40 -1.26 -0.17 117.98 120.62 3pcb s PHE 480 Ca 0.30 0.26 -0.37 0.00 -0.60 0.00 0.00 56.93 56.52 3pcb s PHE 480 Cb -0.05 -2.10 -0.17 0.00 0.51 0.00 0.00 43.02 41.21 3pcb s PHE 480 CO 0.16 0.30 1.32 -1.91 0.70 0.00 0.00 175.22 175.79 3pcb n GLU 481 N 3.33 0.97 0.00 0.44 2.13 -0.97 -2.18 120.64 124.35 3pcb n GLU 481 Ca -0.17 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.00 3pcb n GLU 481 Cb 0.52 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.26 3pcb n GLU 481 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3pcb n GLY 482 N 2.47 2.56 3.58 8.31 0.00 -1.26 -4.99 105.19 115.85 3pcb n GLY 482 Ca 0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 3pcb n GLY 482 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3pcb n ASP 483 N 0.00 2.98 0.24 1.61 -0.08 -0.93 -4.86 116.55 115.51 3pcb n ASP 483 Ca 0.00 0.52 0.16 0.00 -1.51 0.00 0.00 54.79 53.97 3pcb n ASP 483 Cb 0.00 -1.40 0.79 0.00 2.34 0.00 0.00 41.12 42.84 3pcb n ASP 483 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3pcb h PRO 484 N 12.30 0.00 0.00 -0.67 0.13 -1.94 -2.43 132.00 139.38 3pcb h PRO 484 Ca -0.39 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.65 3pcb h PRO 484 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3pcb h PRO 484 CO 0.98 0.00 -0.41 -0.07 -0.23 0.00 0.00 178.00 178.27 3pcb h LEU 485 N 0.00 0.00 -0.45 1.56 3.38 -1.96 -3.38 115.31 114.47 3pcb h LEU 485 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3pcb h LEU 485 Cb 0.19 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.86 3pcb h LEU 485 CO 0.00 0.41 -0.56 0.40 0.09 0.00 0.00 178.44 178.78 3pcb h ILE 486 N 0.00 0.00 0.00 1.22 2.04 -1.82 -2.25 117.51 116.70 3pcb h ILE 486 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pcb h ILE 486 Cb 1.04 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 3pcb h ILE 486 CO 0.05 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.39 3pcb n PRO 487 N -5.34 0.11 0.01 2.37 -0.04 -1.26 -2.31 135.00 128.54 3pcb n PRO 487 Ca -0.03 0.47 0.11 0.00 -0.04 0.00 0.00 63.50 64.01 3pcb n PRO 487 Cb 0.33 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.03 3pcb n PRO 487 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3pcb n MET 488 N -1.98 0.17 -2.60 0.54 2.81 -0.86 -4.96 117.12 110.23 3pcb n MET 488 Ca 0.01 -0.02 -0.43 0.00 -1.81 0.00 0.00 57.70 55.45 3pcb n MET 488 Cb 0.12 -1.54 -0.02 0.00 -0.71 0.00 0.00 33.22 31.07 3pcb n MET 488 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3pcb h PRO 490 N 7.54 0.74 -0.19 0.00 0.11 -1.90 0.44 132.00 138.73 3pcb h PRO 490 Ca -0.24 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 3pcb h PRO 490 Cb 1.09 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 3pcb h PRO 490 CO 0.95 0.50 -0.01 0.82 -0.21 0.00 0.00 178.00 180.05 3pcb h ILE 491 N 0.76 1.26 -0.70 4.15 2.04 -1.92 -1.97 117.51 121.13 3pcb h ILE 491 Ca 0.20 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.19 3pcb h ILE 491 Cb -0.07 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 3pcb h ILE 491 CO -0.04 0.27 0.46 0.58 0.00 0.00 0.00 178.15 179.41 3pcb h VAL 492 N 0.09 1.17 0.00 1.67 2.07 -1.76 -1.97 116.25 117.51 3pcb h VAL 492 Ca 0.05 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.25 3pcb h VAL 492 Cb 0.40 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3pcb h VAL 492 CO 0.01 0.17 0.00 0.29 0.02 0.00 0.00 177.57 178.06 3pcb n LYS 493 N -4.61 0.04 0.28 1.57 5.02 0.15 -1.66 118.16 118.95 3pcb n LYS 493 Ca 0.06 0.37 0.12 0.00 -2.02 0.00 0.00 58.31 56.84 3pcb n LYS 493 Cb 0.03 -1.60 0.78 0.00 -0.02 0.00 0.00 35.03 34.22 3pcb n LYS 493 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3pcb h SER 494 N 0.00 0.00 -3.61 4.39 4.64 -0.57 -3.36 113.55 115.04 3pcb h SER 494 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3pcb h SER 494 Cb 0.19 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.20 3pcb h SER 494 CO 0.00 0.02 0.77 -0.63 -0.87 0.00 0.00 176.83 176.11 3pcb s ILE 495 N -4.78 4.38 0.25 0.95 1.01 -0.66 -3.83 121.20 118.52 3pcb s ILE 495 Ca -0.05 1.16 0.05 0.00 0.00 0.00 0.00 60.65 61.81 3pcb s ILE 495 Cb 0.16 -4.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.11 3pcb s ILE 495 CO 0.60 -0.81 1.58 0.00 0.00 0.00 0.00 174.94 176.32 3pcb h ALA 496 N 8.91 0.90 -2.66 9.38 0.00 -1.86 -3.43 119.26 130.49 3pcb h ALA 496 Ca -0.23 -0.53 -0.61 0.00 0.00 0.00 0.00 54.91 53.54 3pcb h ALA 496 Cb 1.07 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.65 3pcb h ALA 496 CO 1.06 0.72 -0.05 1.21 0.00 0.00 0.00 179.25 182.19 3pcb s ASN 497 N -6.89 6.47 0.53 0.00 3.04 -1.26 -4.92 114.94 111.90 3pcb s ASN 497 Ca -0.04 0.56 0.18 0.00 0.04 0.00 0.00 52.86 53.60 3pcb s ASN 497 Cb 0.12 -2.28 1.31 0.00 -1.54 0.00 0.00 41.25 38.87 3pcb s ASN 497 CO 0.79 -0.23 2.14 -0.65 -3.04 0.00 0.00 177.10 176.12 3pcb h PRO 498 N 7.78 0.00 -0.09 0.43 0.11 -2.00 0.78 132.00 139.01 3pcb h PRO 498 Ca -0.31 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 3pcb h PRO 498 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3pcb h PRO 498 CO 0.72 0.00 -0.31 0.93 -0.21 0.00 0.00 178.00 179.13 3pcb h GLU 499 N 0.00 0.16 -0.14 1.05 5.08 -1.98 -2.47 114.58 116.28 3pcb h GLU 499 Ca 0.02 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.18 3pcb h GLU 499 Cb 0.09 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3pcb h GLU 499 CO -0.00 0.46 -0.52 0.00 -1.00 0.00 0.00 179.01 177.95 3pcb h ALA 500 N 1.54 0.84 -0.56 3.43 0.00 -1.20 -3.14 119.26 120.17 3pcb h ALA 500 Ca 0.02 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 3pcb h ALA 500 Cb 0.63 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3pcb h ALA 500 CO 0.05 0.68 0.28 0.28 0.00 0.00 0.00 179.25 180.53 3pcb h VAL 501 N 0.31 1.20 -0.26 0.00 2.07 -1.18 -2.49 116.25 115.90 3pcb h VAL 501 Ca 0.01 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.04 3pcb h VAL 501 Cb 1.02 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 3pcb h VAL 501 CO 0.09 0.23 0.18 1.56 0.02 0.00 0.00 177.57 179.65 3pcb h GLN 502 N 0.76 0.05 0.00 1.57 1.08 -1.42 -1.48 115.11 115.67 3pcb h GLN 502 Ca 0.19 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.38 3pcb h GLN 502 Cb 0.11 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.52 3pcb h GLN 502 CO -0.03 0.03 -0.04 1.96 -0.95 0.00 0.00 178.83 179.81 3pcb h GLN 503 N 0.05 0.00 -0.00 1.46 4.20 -1.50 -2.55 115.11 116.77 3pcb h GLN 503 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3pcb h GLN 503 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 3pcb h GLN 503 CO -0.01 0.04 -0.36 1.28 -0.67 0.00 0.00 178.83 179.11 3pcb n LEU 504 N -3.27 0.65 -4.53 1.46 4.77 -0.56 -4.86 117.00 110.66 3pcb n LEU 504 Ca -0.01 -0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.48 3pcb n LEU 504 Cb 0.20 -0.22 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 3pcb n LEU 504 CO 0.26 0.14 0.20 -0.63 -1.33 0.00 0.00 177.39 176.02 3pcb s ILE 505 N -2.79 5.02 0.30 -0.08 1.01 -0.96 -0.54 121.20 123.14 3pcb s ILE 505 Ca 0.17 0.06 -0.29 0.00 0.00 0.00 0.00 60.65 60.58 3pcb s ILE 505 Cb 0.18 -4.02 -0.10 0.00 0.01 0.00 0.00 42.46 38.53 3pcb s ILE 505 CO 0.61 -0.34 1.40 0.00 0.00 0.00 0.00 174.94 176.62 3pcb s ALA 506 N 2.36 3.58 -0.09 9.38 0.00 0.76 -4.81 121.76 132.93 3pcb s ALA 506 Ca 0.17 1.34 -0.05 0.00 0.00 0.00 0.00 51.96 53.42 3pcb s ALA 506 Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 3pcb s ALA 506 CO 0.14 -0.75 0.11 0.15 0.00 0.00 0.00 175.76 175.41 3pcb s LYS 507 N -1.10 3.30 0.17 0.00 -0.14 -0.60 -2.29 119.74 119.07 3pcb s LYS 507 Ca 0.55 -0.24 -0.33 0.00 -1.36 0.00 0.00 55.97 54.58 3pcb s LYS 507 Cb -0.42 -3.06 -0.13 0.00 -1.68 0.00 0.00 37.83 32.55 3pcb s LYS 507 CO 0.49 0.74 1.67 -0.11 -0.76 0.00 0.00 175.35 177.38 3pcb n LEU 508 N 1.85 3.55 -3.80 3.17 7.94 -1.26 -0.36 117.00 128.09 3pcb n LEU 508 Ca -0.18 1.06 -0.29 0.00 -1.11 0.00 0.00 56.01 55.49 3pcb n LEU 508 Cb 0.54 -1.50 -0.13 0.00 0.53 0.00 0.00 43.42 42.87 3pcb n LEU 508 CO 0.32 -0.05 -0.18 -0.62 -1.11 0.00 0.00 177.39 175.75 3pcb s ASP 509 N 1.26 3.94 0.53 1.96 2.15 0.16 -4.85 116.67 121.82 3pcb s ASP 509 Ca 0.78 -3.07 0.18 0.00 0.43 0.00 0.00 52.55 50.87 3pcb s ASP 509 Cb -0.59 -1.31 1.35 0.00 -0.30 0.00 0.00 42.92 42.07 3pcb s ASP 509 CO 0.36 -0.20 2.16 0.24 -0.17 0.00 0.00 175.17 177.56 3pcb h MET 510 N 6.25 0.00 0.00 4.34 2.86 -1.93 -1.86 114.93 124.59 3pcb h MET 510 Ca 0.03 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 3pcb h MET 510 Cb 0.87 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 3pcb h MET 510 CO 0.59 0.00 -0.27 -0.91 1.06 0.00 0.00 176.91 177.38 3pcb h ASN 511 N 0.00 0.00 0.03 1.22 2.35 -1.95 -3.08 115.58 114.16 3pcb h ASN 511 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3pcb h ASN 511 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 3pcb h ASN 511 CO 0.00 0.27 -0.44 -3.20 -1.65 0.00 0.00 177.43 172.42 3pcb n ASN 512 N -3.58 1.85 -4.78 5.81 5.15 -0.70 -4.97 115.26 114.03 3pcb n ASN 512 Ca -0.01 -1.40 -0.33 0.00 -0.60 0.00 0.00 54.58 52.24 3pcb n ASN 512 Cb 0.41 0.41 0.03 0.00 -0.53 0.00 0.00 39.78 40.11 3pcb n ASN 512 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3pcb s ALA 513 N -2.48 2.58 -0.44 5.20 0.00 -1.17 -4.75 121.76 120.70 3pcb s ALA 513 Ca 0.20 0.47 -0.12 0.00 0.00 0.00 0.00 51.96 52.50 3pcb s ALA 513 Cb 0.18 -3.28 0.08 0.00 0.00 0.00 0.00 23.12 20.10 3pcb s ALA 513 CO 0.56 -1.10 0.32 -0.80 0.00 0.00 0.00 175.76 174.75 3pcb s ASN 514 N -2.72 5.88 0.29 0.00 0.01 0.11 -4.99 114.94 113.51 3pcb s ASN 514 Ca 0.65 -1.43 -0.27 0.00 -0.71 0.00 0.00 52.86 51.10 3pcb s ASN 514 Cb -0.18 -2.08 -0.15 0.00 0.41 0.00 0.00 41.25 39.25 3pcb s ASN 514 CO 0.40 -0.59 0.80 -2.65 -1.51 0.00 0.00 177.10 173.55 3pcb n PRO 515 N 5.05 0.86 -1.43 -0.60 -0.02 -1.26 -0.55 135.00 137.04 3pcb n PRO 515 Ca -0.11 0.30 -0.13 0.00 -2.02 0.00 0.00 63.50 61.54 3pcb n PRO 515 Cb 0.43 -1.56 -0.06 0.00 -0.02 0.00 0.00 33.50 32.30 3pcb n PRO 515 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3pcb n MET 516 N 0.77 -1.33 0.00 -0.52 2.81 -1.26 -4.66 117.12 112.93 3pcb n MET 516 Ca 0.12 0.78 0.00 0.00 -1.81 0.00 0.00 57.70 56.80 3pcb n MET 516 Cb 0.31 -5.05 0.00 0.00 -0.71 0.00 0.00 33.22 27.78 3pcb n MET 516 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3pcb n ASP 517 N -0.58 0.00 -3.80 7.83 2.03 0.28 -5.15 116.55 117.16 3pcb n ASP 517 Ca -0.13 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.07 3pcb n ASP 517 Cb 0.45 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.77 3pcb n ASP 517 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3pcb s LEU 519 N -2.21 2.89 -0.01 0.00 1.43 -1.04 0.06 118.68 119.80 3pcb s LEU 519 Ca -0.03 0.12 -0.08 0.00 -1.03 0.00 0.00 54.13 53.11 3pcb s LEU 519 Cb -0.00 -2.57 0.01 0.00 0.03 0.00 0.00 46.19 43.65 3pcb s LEU 519 CO -0.05 -1.86 0.16 0.00 0.23 0.00 0.00 176.35 174.82 3pcb s ALA 520 N -3.30 -0.38 -0.00 4.21 0.00 -1.26 -0.88 121.76 120.15 3pcb s ALA 520 Ca 0.65 -0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.66 3pcb s ALA 520 Cb -0.08 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 3pcb s ALA 520 CO 0.46 -0.20 -0.19 0.71 0.00 0.00 0.00 175.76 176.53 3pcb s TYR 521 N -1.18 1.74 -0.18 0.00 1.51 0.13 0.37 117.35 119.74 3pcb s TYR 521 Ca -0.13 -0.34 -0.06 0.00 -1.01 0.00 0.00 57.07 55.54 3pcb s TYR 521 Cb -0.07 -1.10 -0.03 0.00 -0.11 0.00 0.00 41.96 40.66 3pcb s TYR 521 CO 0.02 -0.00 0.02 0.50 -1.11 0.00 0.00 175.55 174.97 3pcb s ARG 522 N -0.63 3.79 -0.24 -0.62 6.06 0.52 -1.72 118.95 126.11 3pcb s ARG 522 Ca 0.07 -0.44 -0.04 0.00 -2.50 0.00 0.00 55.73 52.82 3pcb s ARG 522 Cb -0.08 -3.10 0.08 0.00 0.06 0.00 0.00 34.95 31.92 3pcb s ARG 522 CO -0.00 0.19 0.10 0.12 -2.50 0.00 0.00 175.30 173.21 3pcb s PHE 523 N 0.55 0.50 -0.04 5.12 5.36 0.42 -1.57 117.98 128.31 3pcb s PHE 523 Ca 0.00 -0.78 -0.10 0.00 -0.96 0.00 0.00 56.93 55.10 3pcb s PHE 523 Cb -0.14 -0.93 -0.05 0.00 -0.34 0.00 0.00 43.02 41.57 3pcb s PHE 523 CO 0.02 -0.71 0.27 -0.51 -1.46 0.00 0.00 175.22 172.83 3pcb s ASP 524 N 2.04 6.57 -0.04 6.13 1.01 -1.26 -3.85 116.67 127.26 3pcb s ASP 524 Ca 0.06 0.68 0.06 0.00 0.71 0.00 0.00 52.55 54.06 3pcb s ASP 524 Cb -0.16 -2.14 -0.02 0.00 1.01 0.00 0.00 42.92 41.61 3pcb s ASP 524 CO -0.24 0.34 -0.24 -0.63 0.21 0.00 0.00 175.17 174.61 3pcb s ILE 525 N -1.11 2.15 -0.18 0.77 1.01 -0.70 -4.95 121.20 118.19 3pcb s ILE 525 Ca 0.21 -1.05 -0.01 0.00 0.00 0.00 0.00 60.65 59.80 3pcb s ILE 525 Cb -0.14 -1.77 -0.00 0.00 0.01 0.00 0.00 42.46 40.56 3pcb s ILE 525 CO 0.10 0.57 -0.12 -0.69 0.00 0.00 0.00 174.94 174.81 3pcb s VAL 526 N -0.36 2.84 0.28 2.92 1.01 -1.26 -1.56 120.40 124.28 3pcb s VAL 526 Ca 0.02 -0.69 0.06 0.00 0.00 0.00 0.00 61.98 61.38 3pcb s VAL 526 Cb -0.12 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 3pcb s VAL 526 CO 0.02 0.49 0.32 -0.76 0.00 0.00 0.00 175.10 175.17 3pcb s LEU 527 N 1.14 3.99 0.23 3.92 1.43 0.66 -4.92 118.68 125.13 3pcb s LEU 527 Ca 0.01 -0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 3pcb s LEU 527 Cb -0.14 -2.59 -0.15 0.00 0.03 0.00 0.00 46.19 43.34 3pcb s LEU 527 CO -0.04 -0.18 1.06 0.54 0.23 0.00 0.00 176.35 177.96 3pcb n ARG 528 N -1.39 1.22 -1.95 1.70 1.74 -1.26 -0.60 116.66 116.12 3pcb n ARG 528 Ca -0.06 0.43 -0.41 0.00 -0.77 0.00 0.00 57.85 57.04 3pcb n ARG 528 Cb 0.58 -1.85 -0.01 0.00 -1.02 0.00 0.00 32.46 30.16 3pcb n ARG 528 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3pcb s GLY 529 N -0.31 2.73 -0.19 -0.13 0.00 -1.26 -4.33 107.32 103.84 3pcb s GLY 529 Ca 0.66 1.42 -0.06 0.00 0.00 0.00 0.00 44.72 46.74 3pcb s GLY 529 CO 0.56 2.18 0.02 1.62 0.00 0.00 0.00 173.10 177.48 3pcb s GLN 530 N -1.44 3.74 0.07 2.90 0.74 -1.26 -1.31 119.66 123.10 3pcb s GLN 530 Ca 0.54 -0.46 0.01 0.00 0.05 0.00 0.00 55.36 55.50 3pcb s GLN 530 Cb -0.43 -3.11 -0.04 0.00 1.10 0.00 0.00 33.01 30.52 3pcb s GLN 530 CO 0.54 0.12 -0.05 -0.98 -0.55 0.00 0.00 175.29 174.36 3pcb s ARG 531 N 0.75 0.72 0.38 1.67 1.70 -0.61 -4.97 118.95 118.59 3pcb s ARG 531 Ca 0.01 -1.24 -0.20 0.00 -0.47 0.00 0.00 55.73 53.83 3pcb s ARG 531 Cb -0.14 -0.04 -0.10 0.00 -0.57 0.00 0.00 34.95 34.10 3pcb s ARG 531 CO 0.02 -0.05 0.88 -1.59 -1.08 0.00 0.00 175.30 173.48 3pcb s LYS 532 N -3.70 4.19 0.66 3.89 -2.85 -1.26 -1.13 119.74 119.54 3pcb s LYS 532 Ca 0.08 0.99 -0.14 0.00 -1.00 0.00 0.00 55.97 55.90 3pcb s LYS 532 Cb 0.05 -2.32 -0.00 0.00 -2.06 0.00 0.00 37.83 33.50 3pcb s LYS 532 CO -0.06 0.06 1.09 0.95 0.10 0.00 0.00 175.35 177.48 3pcb s THR 533 N -2.06 3.48 -0.09 3.79 -4.23 -1.23 -4.80 115.64 110.50 3pcb s THR 533 Ca 0.58 0.65 -0.17 0.00 -1.18 0.00 0.00 61.69 61.57 3pcb s THR 533 Cb -0.10 -3.18 0.04 0.00 1.34 0.00 0.00 72.50 70.59 3pcb s THR 533 CO 0.15 -0.47 0.41 -1.38 -0.54 0.00 0.00 174.62 172.80 3pcb s HIS 534 N -2.50 -0.38 -1.18 3.99 -3.43 -1.26 -4.92 115.29 105.62 3pcb s HIS 534 Ca 0.65 0.80 -0.15 0.00 -0.80 0.00 0.00 55.06 55.56 3pcb s HIS 534 Cb -0.18 0.16 0.15 0.00 -1.43 0.00 0.00 32.58 31.28 3pcb s HIS 534 CO 0.43 -0.33 0.38 1.19 -2.00 0.00 0.00 174.74 174.40 3pcb n PHE 535 N 2.03 -1.45 1.86 0.38 3.72 -1.26 -5.25 117.46 117.49 3pcb n PHE 535 Ca -0.17 0.43 0.15 0.00 -0.05 0.00 0.00 57.45 57.81 3pcb n PHE 535 Cb 0.57 -1.52 0.88 0.00 -0.94 0.00 0.00 39.48 38.46 3pcb n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10