#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3pcg s ALA 302 N 0.00 2.50 0.02 3.55 0.00 -1.26 -5.06 121.76 121.51 3pcg s ALA 302 Ca 0.00 0.48 0.03 0.00 0.00 0.00 0.00 51.96 52.47 3pcg s ALA 302 Cb 0.00 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.81 3pcg s ALA 302 CO 0.00 -1.25 -0.10 -0.65 0.00 0.00 0.00 175.76 173.76 3pcg s GLN 303 N -4.21 0.70 -0.99 0.00 -0.21 -1.26 -5.09 119.66 108.60 3pcg s GLN 303 Ca 0.65 -0.56 -0.23 0.00 0.02 0.00 0.00 55.36 55.24 3pcg s GLN 303 Cb -0.19 -0.63 0.01 0.00 1.00 0.00 0.00 33.01 33.19 3pcg s GLN 303 CO 0.43 0.16 1.65 0.34 -2.12 0.00 0.00 175.29 175.75 3pcg s ASP 304 N -0.86 5.98 0.00 5.90 2.15 -1.26 -4.61 116.67 123.97 3pcg s ASP 304 Ca -0.01 -1.21 0.00 0.00 0.43 0.00 0.00 52.55 51.77 3pcg s ASP 304 Cb -0.06 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 3pcg s ASP 304 CO 0.00 -1.99 0.40 -0.46 -0.17 0.00 0.00 175.17 172.95 3pcg n ASN 305 N 10.87 0.74 -4.31 -0.34 0.23 -1.26 -5.02 115.26 116.18 3pcg n ASN 305 Ca 0.36 -1.09 -0.18 0.00 -0.53 0.00 0.00 54.58 53.15 3pcg n ASN 305 Cb 0.49 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.09 3pcg n ASN 305 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 3pcg s SER 306 N -0.09 2.33 0.08 0.53 0.01 -1.26 -3.60 113.70 111.70 3pcg s SER 306 Ca 0.00 -0.96 0.07 0.00 1.31 0.00 0.00 55.95 56.37 3pcg s SER 306 Cb 0.00 -0.10 -0.03 0.00 0.21 0.00 0.00 66.02 66.10 3pcg s SER 306 CO 0.00 -0.18 -0.18 -0.13 0.41 0.00 0.00 173.24 173.16 3pcg s ARG 307 N -3.39 1.03 -0.06 12.44 1.81 0.30 -4.87 118.95 126.21 3pcg s ARG 307 Ca 0.18 -1.04 0.05 0.00 -1.72 0.00 0.00 55.73 53.20 3pcg s ARG 307 Cb -0.01 -1.18 -0.01 0.00 -0.45 0.00 0.00 34.95 33.29 3pcg s ARG 307 CO 0.05 0.28 -0.22 -0.06 -0.68 0.00 0.00 175.30 174.66 3pcg s PHE 308 N -1.14 2.51 0.28 -0.53 0.40 -1.26 -1.50 117.98 116.74 3pcg s PHE 308 Ca 0.03 -0.62 -0.29 0.00 -0.60 0.00 0.00 56.93 55.45 3pcg s PHE 308 Cb -0.10 -1.63 -0.14 0.00 0.51 0.00 0.00 43.02 41.67 3pcg s PHE 308 CO 0.03 -0.15 1.20 0.28 0.70 0.00 0.00 175.22 177.27 3pcg n VAL 309 N 2.90 1.64 -2.12 -0.44 0.31 -0.57 -4.90 118.33 115.15 3pcg n VAL 309 Ca -0.17 -0.41 -0.41 0.00 -0.01 0.00 0.00 64.34 63.34 3pcg n VAL 309 Cb 0.52 -1.25 -0.02 0.00 -0.91 0.00 0.00 33.84 32.18 3pcg n VAL 309 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3pcg s ILE 310 N -0.75 2.77 0.53 2.52 -1.09 -1.26 -4.70 121.20 119.21 3pcg s ILE 310 Ca 0.61 0.74 -0.21 0.00 -2.23 0.00 0.00 60.65 59.56 3pcg s ILE 310 Cb -0.67 -3.47 -0.05 0.00 -1.58 0.00 0.00 42.46 36.69 3pcg s ILE 310 CO 0.57 0.16 1.24 -0.13 -1.23 0.00 0.00 174.94 175.55 3pcg s ARG 311 N -1.41 3.32 -0.53 2.79 0.52 -1.26 -4.97 118.95 117.41 3pcg s ARG 311 Ca 0.51 1.93 -0.16 0.00 -0.52 0.00 0.00 55.73 57.50 3pcg s ARG 311 Cb -0.40 -2.21 0.12 0.00 0.52 0.00 0.00 34.95 32.99 3pcg s ARG 311 CO 0.50 -0.96 0.48 0.34 0.02 0.00 0.00 175.30 175.68 3pcg s ASP 312 N -1.31 6.18 0.00 0.23 -1.08 -1.26 -4.91 116.67 114.52 3pcg s ASP 312 Ca 0.70 -1.70 0.23 0.00 -0.52 0.00 0.00 52.55 51.26 3pcg s ASP 312 Cb -0.33 -2.20 1.22 0.00 -1.46 0.00 0.00 42.92 40.14 3pcg s ASP 312 CO 0.38 -0.82 1.74 0.54 0.52 0.00 0.00 175.17 177.53 3pcg n ARG 313 N 5.24 0.45 -0.00 4.34 1.74 -1.26 -1.72 116.66 125.45 3pcg n ARG 313 Ca -0.14 0.05 0.10 0.00 -0.77 0.00 0.00 57.85 57.10 3pcg n ARG 313 Cb 0.41 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 30.23 3pcg n ARG 313 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3pcg n ASN 314 N -1.19 0.64 -0.07 0.55 3.02 -1.26 -4.26 115.26 112.68 3pcg n ASN 314 Ca 0.13 -0.60 -0.21 0.00 -0.03 0.00 0.00 54.58 53.87 3pcg n ASN 314 Cb 0.15 1.29 -0.12 0.00 -0.61 0.00 0.00 39.78 40.49 3pcg n ASN 314 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3pcg h TRP 315 N 0.00 0.12 -4.30 3.10 2.91 -1.75 -3.43 115.95 112.60 3pcg h TRP 315 Ca 0.00 -0.09 -0.52 0.00 1.13 0.00 0.00 58.89 59.41 3pcg h TRP 315 Cb 0.68 -0.00 0.14 0.00 -0.51 0.00 0.00 29.16 29.47 3pcg h TRP 315 CO 0.00 1.51 0.30 -1.01 -1.03 0.00 0.00 178.44 178.21 3pcg s HIS 316 N -2.39 2.42 0.41 2.65 3.76 -1.02 -4.72 115.29 116.40 3pcg s HIS 316 Ca -0.26 1.59 -0.25 0.00 -0.15 0.00 0.00 55.06 56.00 3pcg s HIS 316 Cb 0.05 -3.10 -0.08 0.00 1.11 0.00 0.00 32.58 30.56 3pcg s HIS 316 CO 0.65 -1.96 1.17 -1.25 -0.85 0.00 0.00 174.74 172.50 3pcg s PRO 317 N -4.84 3.98 0.95 8.40 0.04 -1.26 -4.80 135.00 137.47 3pcg s PRO 317 Ca 0.62 1.83 -0.13 0.00 0.04 0.00 0.00 61.00 63.36 3pcg s PRO 317 Cb -0.18 -2.61 0.16 0.00 0.04 0.00 0.00 34.50 31.91 3pcg s PRO 317 CO 0.56 -0.38 1.13 0.15 0.04 0.00 0.00 177.00 178.50 3pcg s LYS 318 N -2.40 0.84 -0.03 4.56 -0.14 -1.24 -4.99 119.74 116.34 3pcg s LYS 318 Ca 0.59 0.31 -0.24 0.00 -1.36 0.00 0.00 55.97 55.27 3pcg s LYS 318 Cb -0.30 -1.80 -0.21 0.00 -1.68 0.00 0.00 37.83 33.84 3pcg s LYS 318 CO 0.38 -2.41 1.14 0.00 -0.76 0.00 0.00 175.35 173.69 3pcg h ALA 319 N -1.65 0.07 -2.01 5.17 0.00 -1.95 -3.41 119.26 115.47 3pcg h ALA 319 Ca -0.51 -0.39 -0.66 0.00 0.00 0.00 0.00 54.91 53.35 3pcg h ALA 319 Cb 1.33 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.96 3pcg h ALA 319 CO 0.60 0.02 0.23 -1.17 0.00 0.00 0.00 179.25 178.93 3pcg s LEU 320 N -8.77 4.63 -0.45 0.00 2.96 -1.26 -4.78 118.68 111.01 3pcg s LEU 320 Ca -0.16 -0.67 0.04 0.00 -0.22 0.00 0.00 54.13 53.12 3pcg s LEU 320 Cb 0.02 -2.60 0.16 0.00 0.50 0.00 0.00 46.19 44.27 3pcg s LEU 320 CO 0.73 -0.99 0.34 0.42 -1.32 0.00 0.00 176.35 175.53 3pcg s THR 321 N 3.09 0.80 0.40 3.68 -4.23 -1.26 -5.04 115.64 113.08 3pcg s THR 321 Ca 0.21 -2.80 0.23 0.00 -1.18 0.00 0.00 61.69 58.15 3pcg s THR 321 Cb -0.16 -1.56 0.41 0.00 1.34 0.00 0.00 72.50 72.53 3pcg s THR 321 CO 0.15 -1.15 1.65 1.55 -0.54 0.00 0.00 174.62 176.29 3pcg h PRO 322 N 5.84 0.19 -0.18 3.99 0.13 -1.94 0.23 132.00 140.25 3pcg h PRO 322 Ca 0.20 -0.01 0.05 0.00 -0.87 0.00 0.00 66.00 65.38 3pcg h PRO 322 Cb 0.89 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 3pcg h PRO 322 CO 0.42 0.12 0.19 -0.44 -0.23 0.00 0.00 178.00 178.07 3pcg h ASP 323 N 0.19 0.00 -3.42 1.44 3.32 -1.96 -3.04 116.42 112.95 3pcg h ASP 323 Ca 0.76 0.00 -0.77 0.00 0.02 0.00 0.00 57.03 57.04 3pcg h ASP 323 Cb 2.12 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 41.43 3pcg h ASP 323 CO -0.49 0.00 0.39 -0.47 -1.72 0.00 0.00 179.24 176.95 3pcg s TYR 324 N -4.68 3.76 0.24 4.55 5.04 0.07 -4.82 117.35 121.50 3pcg s TYR 324 Ca -0.05 -2.06 -0.13 0.00 -2.44 0.00 0.00 57.07 52.39 3pcg s TYR 324 Cb 0.16 -3.94 0.32 0.00 0.35 0.00 0.00 41.96 38.85 3pcg s TYR 324 CO 0.56 -1.09 1.58 0.87 -1.34 0.00 0.00 175.55 176.13 3pcg h LYS 325 N 7.66 -0.02 -0.01 4.97 1.57 -1.75 -1.85 116.57 127.14 3pcg h LYS 325 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3pcg h LYS 325 Cb 0.99 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.30 3pcg h LYS 325 CO 0.90 -0.02 0.01 1.15 -0.57 0.00 0.00 179.45 180.92 3pcg h THR 326 N -0.02 0.50 0.00 -0.16 2.02 -1.92 -2.28 112.91 111.04 3pcg h THR 326 Ca 0.38 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.51 3pcg h THR 326 Cb 0.62 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 3pcg h THR 326 CO -0.88 0.00 -0.20 0.77 0.37 0.00 0.00 175.52 175.58 3pcg h SER 327 N 0.00 0.00 0.04 4.18 4.64 -1.64 -2.97 113.55 117.81 3pcg h SER 327 Ca 0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 3pcg h SER 327 Cb 0.02 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.06 3pcg h SER 327 CO -0.00 0.20 -0.30 0.40 -0.87 0.00 0.00 176.83 176.26 3pcg h ILE 328 N 0.00 0.34 0.00 0.95 2.04 -1.55 -2.73 117.51 116.56 3pcg h ILE 328 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pcg h ILE 328 Cb 0.38 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3pcg h ILE 328 CO 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 178.15 177.93 3pcg n ALA 329 N -2.71 2.59 -1.52 1.87 0.00 -1.23 -4.16 120.51 115.35 3pcg n ALA 329 Ca -0.05 -0.13 -0.17 0.00 0.00 0.00 0.00 53.44 53.09 3pcg n ALA 329 Cb 0.31 -1.35 0.14 0.00 0.00 0.00 0.00 19.45 18.56 3pcg n ALA 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3pcg n ARG 330 N -2.08 2.40 -4.46 0.00 1.74 -1.05 -4.96 116.66 108.26 3pcg n ARG 330 Ca 0.05 -3.38 -0.24 0.00 -0.77 0.00 0.00 57.85 53.51 3pcg n ARG 330 Cb 0.42 -2.05 -0.17 0.00 -1.02 0.00 0.00 32.46 29.64 3pcg n ARG 330 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3pcg s SER 331 N -2.45 1.61 0.67 0.55 1.04 -1.13 -4.94 113.70 109.05 3pcg s SER 331 Ca 0.52 -0.26 -0.17 0.00 0.48 0.00 0.00 55.95 56.51 3pcg s SER 331 Cb 0.44 -0.74 0.00 0.00 0.10 0.00 0.00 66.02 65.82 3pcg s SER 331 CO 0.02 0.01 1.27 -2.16 0.98 0.00 0.00 173.24 173.36 3pcg s PRO 332 N 0.77 2.43 -0.11 4.02 0.04 -1.26 -4.94 135.00 135.95 3pcg s PRO 332 Ca -0.13 2.00 0.19 0.00 0.04 0.00 0.00 61.00 63.10 3pcg s PRO 332 Cb -0.15 -1.84 -0.28 0.00 0.04 0.00 0.00 34.50 32.27 3pcg s PRO 332 CO 0.02 -1.68 0.25 0.54 0.04 0.00 0.00 177.00 176.18 3pcg n ARG 333 N -2.12 0.76 -3.17 4.56 5.12 -1.26 -4.92 116.66 115.63 3pcg n ARG 333 Ca 0.15 -0.10 -0.34 0.00 -1.93 0.00 0.00 57.85 55.64 3pcg n ARG 333 Cb 0.49 -1.49 -0.06 0.00 -1.16 0.00 0.00 32.46 30.24 3pcg n ARG 333 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3pcg s GLN 334 N -2.93 4.08 0.52 5.56 -1.52 -1.26 -5.04 119.66 119.07 3pcg s GLN 334 Ca -0.08 0.69 -0.22 0.00 -1.95 0.00 0.00 55.36 53.80 3pcg s GLN 334 Cb 0.09 -2.68 -0.06 0.00 -0.22 0.00 0.00 33.01 30.15 3pcg s GLN 334 CO 0.81 0.30 1.25 0.00 -0.25 0.00 0.00 175.29 177.40 3pcg s ALA 335 N -1.74 2.82 0.53 6.09 0.00 -1.26 -4.97 121.76 123.24 3pcg s ALA 335 Ca 0.47 1.10 -0.22 0.00 0.00 0.00 0.00 51.96 53.32 3pcg s ALA 335 Cb -0.13 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.47 3pcg s ALA 335 CO 0.19 -1.03 1.31 -0.51 0.00 0.00 0.00 175.76 175.72 3pcg s LEU 336 N -3.43 3.87 -0.27 0.00 1.43 -1.26 -5.00 118.68 114.03 3pcg s LEU 336 Ca 0.70 2.65 -0.13 0.00 -1.03 0.00 0.00 54.13 56.31 3pcg s LEU 336 Cb -0.33 -4.28 -0.04 0.00 0.03 0.00 0.00 46.19 41.56 3pcg s LEU 336 CO 0.39 -1.44 0.30 -0.69 0.23 0.00 0.00 176.35 175.14 3pcg s VAL 337 N -1.37 5.24 0.19 -1.59 1.01 -1.26 -5.06 120.40 117.56 3pcg s VAL 337 Ca 0.70 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.79 3pcg s VAL 337 Cb -0.37 -3.63 -0.08 0.00 0.00 0.00 0.00 36.38 32.30 3pcg s VAL 337 CO 0.44 0.21 0.99 -0.44 0.00 0.00 0.00 175.10 176.30 3pcg s SER 338 N 1.61 7.50 0.04 3.32 0.01 -1.26 -5.06 113.70 119.86 3pcg s SER 338 Ca 0.12 1.96 0.03 0.00 1.31 0.00 0.00 55.95 59.36 3pcg s SER 338 Cb -0.16 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.45 3pcg s SER 338 CO 0.10 -0.01 -0.09 0.27 0.41 0.00 0.00 173.24 173.92 3pcg s ILE 339 N -0.64 0.62 0.52 1.44 -4.36 -1.26 -5.14 121.20 112.38 3pcg s ILE 339 Ca 0.45 -1.06 -0.21 0.00 -0.26 0.00 0.00 60.65 59.57 3pcg s ILE 339 Cb -0.26 -0.66 -0.06 0.00 1.25 0.00 0.00 42.46 42.73 3pcg s ILE 339 CO 0.33 -0.32 1.20 -2.16 0.24 0.00 0.00 174.94 174.22 3pcg s PRO 340 N -1.50 3.38 0.35 0.37 0.04 -1.26 -4.97 135.00 131.42 3pcg s PRO 340 Ca -0.08 1.82 -0.28 0.00 0.04 0.00 0.00 61.00 62.50 3pcg s PRO 340 Cb -0.09 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 32.17 3pcg s PRO 340 CO 0.01 -0.87 1.23 -0.65 0.04 0.00 0.00 177.00 176.75 3pcg s GLN 341 N -3.01 4.28 0.32 4.56 -0.21 -1.26 -5.01 119.66 119.32 3pcg s GLN 341 Ca 0.70 2.02 0.05 0.00 0.02 0.00 0.00 55.36 58.15 3pcg s GLN 341 Cb -0.30 -2.95 -0.03 0.00 1.00 0.00 0.00 33.01 30.74 3pcg s GLN 341 CO 0.34 -0.18 0.30 -1.54 -2.12 0.00 0.00 175.29 172.09 3pcg s SER 342 N -0.77 1.41 0.47 5.90 1.04 -1.26 -5.03 113.70 115.46 3pcg s SER 342 Ca 0.51 -1.68 0.22 0.00 0.48 0.00 0.00 55.95 55.49 3pcg s SER 342 Cb -0.35 0.56 1.24 0.00 0.10 0.00 0.00 66.02 67.56 3pcg s SER 342 CO 0.46 -1.08 1.89 -0.29 0.98 0.00 0.00 173.24 175.20 3pcg h ILE 343 N 2.18 0.66 -0.81 -1.02 2.10 -1.95 -0.72 117.51 117.95 3pcg h ILE 343 Ca -0.26 -0.08 -0.01 0.00 1.08 0.00 0.00 64.86 65.58 3pcg h ILE 343 Cb 1.23 0.40 -0.04 0.00 -1.09 0.00 0.00 36.82 37.33 3pcg h ILE 343 CO 0.38 0.04 0.45 0.28 -1.08 0.00 0.00 178.15 178.22 3pcg h SER 344 N 0.24 1.00 0.23 2.19 0.02 -1.96 -3.10 113.55 112.16 3pcg h SER 344 Ca 0.42 -0.08 -0.12 0.00 -0.84 0.00 0.00 61.79 61.17 3pcg h SER 344 Cb 1.27 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 3pcg h SER 344 CO -0.10 0.80 -1.89 -0.62 -1.14 0.00 0.00 176.83 173.88 3pcg n GLU 345 N -4.35 0.65 0.00 3.45 4.71 -0.50 -4.47 120.64 120.14 3pcg n GLU 345 Ca 0.08 -0.04 0.13 0.00 -0.01 0.00 0.00 57.16 57.32 3pcg n GLU 345 Cb 0.09 -1.60 0.43 0.00 -1.01 0.00 0.00 31.44 29.35 3pcg n GLU 345 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3pcg n THR 346 N -2.54 0.00 -4.19 2.62 -2.24 -0.40 -2.60 114.28 104.94 3pcg n THR 346 Ca -0.12 -0.21 -0.25 0.00 -2.27 0.00 0.00 64.05 61.21 3pcg n THR 346 Cb 0.76 0.52 -0.08 0.00 -2.10 0.00 0.00 70.33 69.43 3pcg n THR 346 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3pcg s THR 347 N -2.24 2.28 -0.07 4.28 -4.23 -1.17 -4.70 115.64 109.78 3pcg s THR 347 Ca 0.31 -1.73 -0.32 0.00 -1.18 0.00 0.00 61.69 58.77 3pcg s THR 347 Cb 0.20 -3.00 0.14 0.00 1.34 0.00 0.00 72.50 71.18 3pcg s THR 347 CO 0.42 -0.00 1.39 -0.83 -0.54 0.00 0.00 174.62 175.06 3pcg s GLY 348 N -3.88 -0.46 0.56 3.99 0.00 -1.24 -0.96 107.32 105.32 3pcg s GLY 348 Ca 0.40 0.84 -0.19 0.00 0.00 0.00 0.00 44.72 45.78 3pcg s GLY 348 CO 0.22 0.37 1.14 2.56 0.00 0.00 0.00 173.10 177.39 3pcg s PRO 349 N -2.16 3.26 -0.17 2.90 0.04 -1.26 -4.86 135.00 132.74 3pcg s PRO 349 Ca 0.15 1.64 -0.01 0.00 0.04 0.00 0.00 61.00 62.82 3pcg s PRO 349 Cb 0.07 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.61 3pcg s PRO 349 CO -0.06 -0.93 -0.11 1.21 0.04 0.00 0.00 177.00 177.15 3pcg s ASN 350 N -1.78 3.95 -0.10 6.66 3.84 -1.26 -4.90 114.94 121.36 3pcg s ASN 350 Ca 0.73 -0.41 0.18 0.00 0.21 0.00 0.00 52.86 53.58 3pcg s ASN 350 Cb -0.25 -1.63 0.70 0.00 -0.55 0.00 0.00 41.25 39.52 3pcg s ASN 350 CO 0.29 0.07 1.60 0.49 -2.79 0.00 0.00 177.10 176.75 3pcg n PHE 351 N 4.18 1.39 -0.33 0.43 3.72 -1.26 -4.61 117.46 120.98 3pcg n PHE 351 Ca -0.19 -0.57 0.16 0.00 -0.05 0.00 0.00 57.45 56.81 3pcg n PHE 351 Cb 0.52 -0.21 0.39 0.00 -0.94 0.00 0.00 39.48 39.24 3pcg n PHE 351 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3pcg h SER 352 N 4.04 0.66 -0.01 4.37 0.02 -1.96 -1.84 113.55 118.83 3pcg h SER 352 Ca 0.00 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3pcg h SER 352 Cb 1.36 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.87 3pcg h SER 352 CO 0.20 0.21 -0.02 1.41 -1.14 0.00 0.00 176.83 177.49 3pcg n HIS 353 N -4.71 0.00 -1.95 3.45 8.25 -1.26 -4.92 115.22 114.07 3pcg n HIS 353 Ca 0.23 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.30 3pcg n HIS 353 Cb 0.66 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.77 3pcg n HIS 353 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3pcg s LEU 354 N -2.03 4.17 -0.72 2.41 2.96 -0.69 -4.93 118.68 119.85 3pcg s LEU 354 Ca 0.33 2.75 -0.23 0.00 -0.22 0.00 0.00 54.13 56.77 3pcg s LEU 354 Cb 0.20 -3.92 0.07 0.00 0.50 0.00 0.00 46.19 43.04 3pcg s LEU 354 CO 0.34 -0.98 1.04 -0.83 -1.32 0.00 0.00 176.35 174.59 3pcg s GLY 355 N -0.66 1.38 0.11 7.98 0.00 -1.26 -5.02 107.32 109.85 3pcg s GLY 355 Ca 0.59 -1.92 -0.23 0.00 0.00 0.00 0.00 44.72 43.15 3pcg s GLY 355 CO 0.52 2.15 0.71 -1.36 0.00 0.00 0.00 173.10 175.12 3pcg s PHE 356 N 4.12 3.84 0.76 1.90 0.08 -1.26 -5.07 117.98 122.36 3pcg s PHE 356 Ca 0.26 1.49 -0.11 0.00 0.12 0.00 0.00 56.93 58.69 3pcg s PHE 356 Cb -0.14 -2.70 0.05 0.00 -0.57 0.00 0.00 43.02 39.66 3pcg s PHE 356 CO 0.07 0.49 1.09 0.20 -0.10 0.00 0.00 175.22 176.97 3pcg s GLY 357 N -0.90 1.63 0.47 4.36 0.00 -1.26 -4.97 107.32 106.65 3pcg s GLY 357 Ca 0.34 -0.17 0.15 0.00 0.00 0.00 0.00 44.72 45.04 3pcg s GLY 357 CO 0.23 0.22 2.03 0.00 0.00 0.00 0.00 173.10 175.59 3pcg h ALA 358 N -0.95 1.77 -0.13 3.20 0.00 -2.03 -3.02 119.26 118.10 3pcg h ALA 358 Ca -0.46 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 3pcg h ALA 358 Cb 1.25 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 3pcg h ALA 358 CO 0.60 0.17 -0.10 0.72 0.00 0.00 0.00 179.25 180.64 3pcg n HIS 359 N -4.37 0.44 -0.34 0.00 8.25 -1.26 -4.74 115.22 113.20 3pcg n HIS 359 Ca -0.03 -1.16 0.10 0.00 -0.26 0.00 0.00 57.72 56.37 3pcg n HIS 359 Cb 0.21 -0.27 0.27 0.00 1.12 0.00 0.00 29.99 31.32 3pcg n HIS 359 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3pcg h ASP 360 N 0.82 0.78 0.01 0.41 5.19 -1.82 0.02 116.42 121.84 3pcg h ASP 360 Ca 0.04 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.53 3pcg h ASP 360 Cb 1.23 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.68 3pcg h ASP 360 CO 0.13 0.34 -0.04 0.00 -3.12 0.00 0.00 179.24 176.55 3pcg n HIS 361 N -4.74 0.00 -3.89 4.55 1.44 -1.13 -2.19 115.22 109.26 3pcg n HIS 361 Ca 0.20 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.59 3pcg n HIS 361 Cb 0.46 -0.02 -0.13 0.00 0.12 0.00 0.00 29.99 30.43 3pcg n HIS 361 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3pcg s ASP 362 N -2.07 4.77 0.40 4.39 -1.08 -0.01 -2.07 116.67 121.01 3pcg s ASP 362 Ca 0.35 -2.62 0.28 0.00 -0.52 0.00 0.00 52.55 50.05 3pcg s ASP 362 Cb 0.21 -1.71 1.37 0.00 -1.46 0.00 0.00 42.92 41.32 3pcg s ASP 362 CO 0.36 -0.34 1.86 -0.07 0.52 0.00 0.00 175.17 177.49 3pcg h LEU 363 N 7.13 0.00 -0.90 -1.34 4.07 -0.56 0.50 115.31 124.21 3pcg h LEU 363 Ca -0.06 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.80 3pcg h LEU 363 Cb 0.96 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 3pcg h LEU 363 CO 0.65 0.00 -0.45 -0.07 -1.08 0.00 0.00 178.44 177.49 3pcg h LEU 364 N 0.00 0.00 0.00 1.67 4.07 -1.91 -3.37 115.31 115.77 3pcg h LEU 364 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3pcg h LEU 364 Cb 0.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.95 3pcg h LEU 364 CO 0.00 0.45 -0.42 0.18 -1.08 0.00 0.00 178.44 177.58 3pcg n LEU 365 N -3.65 0.00 0.00 1.67 4.77 -0.62 -4.58 117.00 114.59 3pcg n LEU 365 Ca -0.01 -0.24 0.12 0.00 -0.03 0.00 0.00 56.01 55.86 3pcg n LEU 365 Cb 0.54 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 42.34 3pcg n LEU 365 CO 0.39 0.00 0.92 -0.46 -1.33 0.00 0.00 177.39 176.90 3pcg n ASN 366 N -1.10 0.00 0.00 -1.43 0.23 0.07 -5.05 115.26 107.98 3pcg n ASN 366 Ca 0.00 -0.58 0.00 0.00 -0.53 0.00 0.00 54.58 53.47 3pcg n ASN 366 Cb 0.00 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 37.62 3pcg n ASN 366 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 3pcg n PHE 367 N -1.08 0.00 0.00 -2.53 7.35 -1.26 -4.96 117.46 114.97 3pcg n PHE 367 Ca 0.17 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.86 3pcg n PHE 367 Cb 0.12 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.95 3pcg n PHE 367 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3pcg n GLY 371 N 2.42 0.00 3.87 7.13 0.00 -1.26 -4.74 105.19 112.61 3pcg n GLY 371 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3pcg n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3pcg s LEU 372 N 0.00 4.29 0.66 0.99 1.02 -1.26 -4.81 118.68 119.57 3pcg s LEU 372 Ca 0.00 0.89 -0.15 0.00 0.02 0.00 0.00 54.13 54.90 3pcg s LEU 372 Cb 0.00 -3.30 -0.00 0.00 0.02 0.00 0.00 46.19 42.91 3pcg s LEU 372 CO 0.00 0.07 1.10 -2.84 0.02 0.00 0.00 176.35 174.70 3pcg s PRO 373 N -2.25 2.85 -0.01 1.29 0.02 -1.26 -4.80 135.00 130.83 3pcg s PRO 373 Ca 0.39 1.34 -0.15 0.00 0.02 0.00 0.00 61.00 62.61 3pcg s PRO 373 Cb -0.13 -1.96 -0.06 0.00 0.02 0.00 0.00 34.50 32.37 3pcg s PRO 373 CO 0.20 -1.20 0.41 0.42 -0.33 0.00 0.00 177.00 176.50 3pcg s ILE 374 N -2.40 5.04 0.00 2.83 1.01 -1.26 -4.99 121.20 121.43 3pcg s ILE 374 Ca 0.66 0.85 0.00 0.00 0.00 0.00 0.00 60.65 62.16 3pcg s ILE 374 Cb -0.20 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.55 3pcg s ILE 374 CO 0.42 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.52 3pcg n GLY 375 N 1.97 3.35 3.59 6.18 0.00 -1.26 -4.45 105.19 114.57 3pcg n GLY 375 Ca -0.13 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 3pcg n GLY 375 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3pcg s GLU 376 N -2.16 3.34 0.11 1.61 2.02 -1.26 -4.88 118.70 117.48 3pcg s GLU 376 Ca 0.00 1.17 -0.31 0.00 0.02 0.00 0.00 54.97 55.85 3pcg s GLU 376 Cb 0.00 -4.16 -0.08 0.00 0.10 0.00 0.00 34.13 29.99 3pcg s GLU 376 CO 0.00 -1.85 1.49 1.03 0.02 0.00 0.00 175.26 175.95 3pcg s ARG 377 N 5.56 4.26 0.02 1.61 0.52 -1.26 -1.06 118.95 128.61 3pcg s ARG 377 Ca 0.72 2.19 -0.11 0.00 -0.52 0.00 0.00 55.73 58.01 3pcg s ARG 377 Cb -0.18 -3.30 0.01 0.00 0.52 0.00 0.00 34.95 31.99 3pcg s ARG 377 CO 0.32 -0.55 0.23 0.96 0.02 0.00 0.00 175.30 176.28 3pcg s ILE 378 N 1.48 0.09 -0.11 1.52 -4.36 0.28 -2.37 121.20 117.74 3pcg s ILE 378 Ca 0.68 -0.74 -0.01 0.00 -0.26 0.00 0.00 60.65 60.32 3pcg s ILE 378 Cb -0.39 -0.79 -0.03 0.00 1.25 0.00 0.00 42.46 42.50 3pcg s ILE 378 CO 0.30 -0.40 -0.04 -0.63 0.24 0.00 0.00 174.94 174.41 3pcg s ILE 379 N -2.15 3.90 -0.18 8.37 1.01 -0.15 -0.79 121.20 131.21 3pcg s ILE 379 Ca -0.08 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.19 3pcg s ILE 379 Cb -0.03 -2.65 0.02 0.00 0.01 0.00 0.00 42.46 39.81 3pcg s ILE 379 CO -0.01 0.56 -0.19 -0.69 0.00 0.00 0.00 174.94 174.61 3pcg s VAL 380 N -0.37 2.20 0.15 2.92 1.01 -0.16 -1.44 120.40 124.71 3pcg s VAL 380 Ca 0.06 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 3pcg s VAL 380 Cb -0.12 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 3pcg s VAL 380 CO 0.02 0.53 0.19 0.00 0.00 0.00 0.00 175.10 175.85 3pcg s ALA 381 N 1.24 0.30 0.00 5.51 0.00 -0.84 -0.41 121.76 127.56 3pcg s ALA 381 Ca 0.03 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.91 3pcg s ALA 381 Cb -0.13 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.82 3pcg s ALA 381 CO -0.10 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.49 3pcg n GLY 382 N -0.16 -0.88 3.19 0.00 0.00 -0.91 -1.26 105.19 105.17 3pcg n GLY 382 Ca -0.07 -0.78 -0.21 0.00 0.00 0.00 0.00 46.02 44.95 3pcg n GLY 382 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pcg s ARG 383 N -0.40 1.03 -0.32 1.61 3.52 -1.26 -1.99 118.95 121.15 3pcg s ARG 383 Ca 0.00 -0.90 -0.11 0.00 -0.13 0.00 0.00 55.73 54.59 3pcg s ARG 383 Cb 0.00 -1.10 -0.02 0.00 -1.56 0.00 0.00 34.95 32.26 3pcg s ARG 383 CO 0.00 0.27 0.20 0.08 -0.81 0.00 0.00 175.30 175.04 3pcg s VAL 384 N -0.97 5.08 0.40 7.11 1.01 0.11 -0.99 120.40 132.15 3pcg s VAL 384 Ca 0.03 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.86 3pcg s VAL 384 Cb -0.09 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 3pcg s VAL 384 CO 0.02 0.08 0.05 0.68 0.00 0.00 0.00 175.10 175.92 3pcg s VAL 385 N 1.70 1.29 0.57 2.92 -7.23 -0.05 -0.90 120.40 118.70 3pcg s VAL 385 Ca 0.06 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.31 3pcg s VAL 385 Cb -0.17 -2.64 0.07 0.00 0.56 0.00 0.00 36.38 34.20 3pcg s VAL 385 CO 0.09 0.00 0.64 1.51 -0.31 0.00 0.00 175.10 177.04 3pcg s ASP 386 N -3.65 4.91 0.56 4.85 1.47 0.56 -0.54 116.67 124.83 3pcg s ASP 386 Ca 0.27 -1.01 0.25 0.00 1.18 0.00 0.00 52.55 53.24 3pcg s ASP 386 Cb 0.06 0.36 1.61 0.00 -0.34 0.00 0.00 42.92 44.61 3pcg s ASP 386 CO 0.13 -1.26 2.20 1.56 0.68 0.00 0.00 175.17 178.48 3pcg h GLN 387 N 0.39 0.00 -0.01 2.11 4.20 -1.27 0.97 115.11 121.52 3pcg h GLN 387 Ca -0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.39 3pcg h GLN 387 Cb 1.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.07 3pcg h GLN 387 CO 0.47 0.00 -0.02 0.66 -0.67 0.00 0.00 178.83 179.27 3pcg n TYR 388 N -4.10 0.00 -0.46 2.96 4.01 -1.26 -4.91 117.16 113.40 3pcg n TYR 388 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 3pcg n TYR 388 Cb 0.13 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 3pcg n TYR 388 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3pcg n GLY 389 N 1.11 0.74 3.72 2.72 0.00 0.34 -5.05 105.19 108.76 3pcg n GLY 389 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3pcg n GLY 389 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3pcg s LYS 390 N -0.54 4.56 0.72 1.61 2.20 -1.26 -4.68 119.74 122.36 3pcg s LYS 390 Ca 0.00 1.52 -0.14 0.00 -0.36 0.00 0.00 55.97 56.99 3pcg s LYS 390 Cb 0.00 -3.41 0.03 0.00 -1.51 0.00 0.00 37.83 32.95 3pcg s LYS 390 CO 0.00 -0.04 1.16 -2.14 -0.36 0.00 0.00 175.35 173.98 3pcg s PRO 391 N 0.73 2.30 -0.46 4.03 0.02 -1.26 -0.32 135.00 140.04 3pcg s PRO 391 Ca 0.52 1.59 0.03 0.00 0.02 0.00 0.00 61.00 63.16 3pcg s PRO 391 Cb -0.24 -1.87 0.12 0.00 0.02 0.00 0.00 34.50 32.53 3pcg s PRO 391 CO 0.29 -1.68 0.20 0.08 -0.33 0.00 0.00 177.00 175.57 3pcg s VAL 392 N -2.20 2.64 0.64 3.83 1.01 -0.07 -4.80 120.40 121.45 3pcg s VAL 392 Ca 0.71 -2.86 -0.12 0.00 0.00 0.00 0.00 61.98 59.71 3pcg s VAL 392 Cb -0.25 -2.86 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 3pcg s VAL 392 CO 0.45 -0.73 1.04 -2.16 0.00 0.00 0.00 175.10 173.70 3pcg s PRO 393 N 0.25 3.31 -1.35 2.72 0.04 -1.26 -4.20 135.00 134.51 3pcg s PRO 393 Ca 0.14 0.94 -0.15 0.00 0.04 0.00 0.00 61.00 61.98 3pcg s PRO 393 Cb -0.23 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.29 3pcg s PRO 393 CO -0.03 -0.81 0.43 0.09 0.04 0.00 0.00 177.00 176.72 3pcg n ASN 394 N -2.66 -1.88 -4.43 6.66 5.03 -0.24 -4.93 115.26 112.82 3pcg n ASN 394 Ca 0.07 -1.19 -0.30 0.00 0.87 0.00 0.00 54.58 54.03 3pcg n ASN 394 Cb 0.54 -2.19 -0.13 0.00 -1.02 0.00 0.00 39.78 36.98 3pcg n ASN 394 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 3pcg s THR 395 N -3.88 2.58 -0.15 3.41 -1.32 -1.26 -4.58 115.64 110.44 3pcg s THR 395 Ca 0.23 -1.34 -0.29 0.00 -1.21 0.00 0.00 61.69 59.08 3pcg s THR 395 Cb -0.11 -2.09 -0.01 0.00 -1.51 0.00 0.00 72.50 68.78 3pcg s THR 395 CO 0.95 0.28 1.00 -0.22 -2.21 0.00 0.00 174.62 174.43 3pcg s LEU 396 N -1.56 4.20 -0.20 9.08 2.96 -1.26 -0.68 118.68 131.22 3pcg s LEU 396 Ca 0.14 1.46 -0.01 0.00 -0.22 0.00 0.00 54.13 55.51 3pcg s LEU 396 Cb -0.10 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.07 3pcg s LEU 396 CO 0.05 -0.51 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.75 3pcg s VAL 397 N 2.36 2.52 0.03 1.68 1.01 0.02 -1.20 120.40 126.82 3pcg s VAL 397 Ca 0.46 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.68 3pcg s VAL 397 Cb -0.17 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 3pcg s VAL 397 CO 0.14 0.45 -0.25 -1.61 0.00 0.00 0.00 175.10 173.83 3pcg s GLU 398 N 1.34 1.80 0.04 2.72 2.02 -0.28 -0.43 118.70 125.91 3pcg s GLU 398 Ca 0.04 -1.02 -0.03 0.00 0.02 0.00 0.00 54.97 53.98 3pcg s GLU 398 Cb -0.14 -1.90 -0.02 0.00 0.10 0.00 0.00 34.13 32.16 3pcg s GLU 398 CO -0.09 0.50 0.03 0.00 0.02 0.00 0.00 175.26 175.72 3pcg s MET 399 N -1.04 0.56 0.03 1.61 0.23 0.11 -0.02 119.30 120.78 3pcg s MET 399 Ca 0.10 -0.94 -0.18 0.00 -1.03 0.00 0.00 55.69 53.65 3pcg s MET 399 Cb -0.10 0.21 0.03 0.00 -1.53 0.00 0.00 34.83 33.44 3pcg s MET 399 CO 0.01 -0.12 0.39 1.67 -2.03 0.00 0.00 175.02 174.94 3pcg s TRP 400 N -3.03 -0.25 0.17 3.16 -2.14 -0.84 -1.00 118.94 115.00 3pcg s TRP 400 Ca -0.01 0.25 -0.23 0.00 2.66 0.00 0.00 56.10 58.76 3pcg s TRP 400 Cb 0.01 0.19 0.07 0.00 -3.10 0.00 0.00 33.47 30.65 3pcg s TRP 400 CO -0.07 -0.53 1.03 1.14 -2.66 0.00 0.00 176.95 175.86 3pcg s GLN 401 N -2.21 1.23 0.85 3.25 -2.07 -0.23 -0.67 119.66 119.82 3pcg s GLN 401 Ca -0.07 -0.76 -0.08 0.00 -1.82 0.00 0.00 55.36 52.64 3pcg s GLN 401 Cb -0.02 0.37 0.18 0.00 -1.09 0.00 0.00 33.01 32.45 3pcg s GLN 401 CO -0.01 -0.57 1.17 0.00 -1.32 0.00 0.00 175.29 174.56 3pcg s ALA 402 N -2.53 3.05 0.70 2.60 0.00 -1.26 -4.60 121.76 119.72 3pcg s ALA 402 Ca 0.18 -1.62 -0.00 0.00 0.00 0.00 0.00 51.96 50.52 3pcg s ALA 402 Cb -0.02 -2.29 0.01 0.00 0.00 0.00 0.00 23.12 20.82 3pcg s ALA 402 CO 0.04 -2.02 0.04 0.27 0.00 0.00 0.00 175.76 174.09 3pcg n ASN 403 N -3.31 0.02 0.29 0.00 0.23 0.33 -4.58 115.26 108.24 3pcg n ASN 403 Ca 0.17 -1.03 0.15 0.00 -0.53 0.00 0.00 54.58 53.34 3pcg n ASN 403 Cb 0.60 -0.03 0.87 0.00 -2.08 0.00 0.00 39.78 39.14 3pcg n ASN 403 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3pcg h ALA 404 N -1.23 1.37 -0.24 -2.53 0.00 -1.78 -1.84 119.26 113.01 3pcg h ALA 404 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3pcg h ALA 404 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3pcg h ALA 404 CO 0.01 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.73 3pcg n GLY 405 N -1.03 1.23 1.38 0.00 0.00 -1.26 -3.48 105.19 102.02 3pcg n GLY 405 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3pcg n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pcg n GLY 406 N 1.39 0.58 3.75 -0.02 0.00 -0.90 -4.81 105.19 105.18 3pcg n GLY 406 Ca 0.17 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 3pcg n GLY 406 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pcg s ARG 407 N -1.31 4.12 0.14 1.61 6.06 -1.26 -4.75 118.95 123.56 3pcg s ARG 407 Ca 0.00 -0.03 -0.03 0.00 -2.50 0.00 0.00 55.73 53.16 3pcg s ARG 407 Cb 0.00 -3.39 -0.05 0.00 0.06 0.00 0.00 34.95 31.57 3pcg s ARG 407 CO 0.00 0.35 0.35 0.71 -2.50 0.00 0.00 175.30 174.21 3pcg s TYR 408 N 0.18 3.48 -1.18 5.12 2.02 -1.26 -0.51 117.35 125.19 3pcg s TYR 408 Ca 0.13 0.47 -0.10 0.00 -0.37 0.00 0.00 57.07 57.21 3pcg s TYR 408 Cb -0.12 -1.94 0.22 0.00 -0.40 0.00 0.00 41.96 39.72 3pcg s TYR 408 CO 0.02 0.45 1.48 -2.13 -1.57 0.00 0.00 175.55 173.80 3pcg n ARG 409 N -0.02 3.70 -3.75 -0.62 0.63 -1.26 -4.75 116.66 110.59 3pcg n ARG 409 Ca -0.03 -4.06 -0.12 0.00 -0.92 0.00 0.00 57.85 52.72 3pcg n ARG 409 Cb 0.52 -2.79 -0.12 0.00 0.45 0.00 0.00 32.46 30.52 3pcg n ARG 409 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 3pcg s HIS 410 N -0.30 -0.31 0.26 -0.14 2.46 -1.26 -5.06 115.29 110.94 3pcg s HIS 410 Ca 0.37 0.74 -0.11 0.00 0.47 0.00 0.00 55.06 56.52 3pcg s HIS 410 Cb 0.00 0.07 0.38 0.00 -0.13 0.00 0.00 32.58 32.91 3pcg s HIS 410 CO 0.00 -0.19 1.56 0.87 -2.47 0.00 0.00 174.74 174.51 3pcg h LYS 411 N 6.55 -0.00 0.00 2.88 1.57 -2.07 0.23 116.57 125.73 3pcg h LYS 411 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 3pcg h LYS 411 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3pcg h LYS 411 CO 0.36 -0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.33 3pcg n ASN 412 N -5.57 0.00 -4.46 0.86 5.03 -1.26 -4.67 115.26 105.19 3pcg n ASN 412 Ca 0.14 -0.47 -0.42 0.00 0.87 0.00 0.00 54.58 54.70 3pcg n ASN 412 Cb 0.46 -0.03 -0.10 0.00 -1.02 0.00 0.00 39.78 39.09 3pcg n ASN 412 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3pcg s ASP 413 N -2.06 6.06 -0.00 6.41 2.15 0.81 -4.91 116.67 125.13 3pcg s ASP 413 Ca 0.24 -0.83 0.15 0.00 0.43 0.00 0.00 52.55 52.54 3pcg s ASP 413 Cb 0.11 -2.14 0.43 0.00 -0.30 0.00 0.00 42.92 41.03 3pcg s ASP 413 CO 0.20 -0.41 1.36 0.54 -0.17 0.00 0.00 175.17 176.69 3pcg n ARG 414 N 5.13 2.84 -1.66 4.34 5.12 -1.26 -4.88 116.66 126.29 3pcg n ARG 414 Ca -0.11 -2.29 -0.42 0.00 -1.93 0.00 0.00 57.85 53.10 3pcg n ARG 414 Cb 0.47 -1.39 0.00 0.00 -1.16 0.00 0.00 32.46 30.39 3pcg n ARG 414 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 3pcg n TYR 415 N 0.91 1.79 0.61 -1.55 9.36 -1.26 -4.83 117.16 122.18 3pcg n TYR 415 Ca 0.16 0.57 0.08 0.00 3.32 0.00 0.00 57.90 62.03 3pcg n TYR 415 Cb 0.51 -2.33 0.36 0.00 -0.63 0.00 0.00 39.34 37.25 3pcg n TYR 415 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 3pcg n LEU 416 N 0.64 0.00 -4.76 2.98 -0.00 -1.26 -4.73 117.00 109.87 3pcg n LEU 416 Ca 0.07 0.45 -0.40 0.00 -0.00 0.00 0.00 56.01 56.13 3pcg n LEU 416 Cb 0.37 -0.45 -0.04 0.00 -0.00 0.00 0.00 43.42 43.30 3pcg n LEU 416 CO 0.60 -0.20 0.77 0.00 -0.00 0.00 0.00 177.39 178.55 3pcg s ALA 417 N -2.89 3.36 0.77 1.47 0.00 -1.26 -4.99 121.76 118.21 3pcg s ALA 417 Ca 0.10 0.84 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 3pcg s ALA 417 Cb 0.11 -3.31 0.06 0.00 0.00 0.00 0.00 23.12 19.98 3pcg s ALA 417 CO 0.28 -0.13 1.08 -1.25 0.00 0.00 0.00 175.76 175.75 3pcg s PRO 418 N -1.56 2.27 0.39 0.00 0.04 -1.26 -4.74 135.00 130.14 3pcg s PRO 418 Ca 0.46 0.83 -0.17 0.00 0.04 0.00 0.00 61.00 62.15 3pcg s PRO 418 Cb -0.30 -1.92 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 3pcg s PRO 418 CO 0.38 -1.54 0.85 -0.51 0.04 0.00 0.00 177.00 176.23 3pcg s LEU 419 N -5.78 3.95 -0.31 -3.56 1.43 -1.26 -4.69 118.68 108.46 3pcg s LEU 419 Ca 0.60 1.46 -0.12 0.00 -1.03 0.00 0.00 54.13 55.05 3pcg s LEU 419 Cb -0.15 -4.31 -0.03 0.00 0.03 0.00 0.00 46.19 41.73 3pcg s LEU 419 CO 0.55 -0.32 0.21 -0.62 0.23 0.00 0.00 176.35 176.40 3pcg s ASP 420 N -2.38 6.01 0.60 2.29 -1.08 -1.26 -4.98 116.67 115.86 3pcg s ASP 420 Ca 0.58 -0.24 0.29 0.00 -0.52 0.00 0.00 52.55 52.66 3pcg s ASP 420 Cb -0.10 -2.12 1.57 0.00 -1.46 0.00 0.00 42.92 40.81 3pcg s ASP 420 CO 0.18 -0.15 1.99 1.55 0.52 0.00 0.00 175.17 179.26 3pcg h PRO 421 N 8.43 0.00 -0.48 4.34 0.13 -1.96 -1.41 132.00 141.05 3pcg h PRO 421 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3pcg h PRO 421 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3pcg h PRO 421 CO 0.59 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.45 3pcg n ASN 422 N -3.68 4.38 -3.85 1.44 4.13 -1.26 -4.96 115.26 111.46 3pcg n ASN 422 Ca 0.05 -2.62 -0.21 0.00 1.68 0.00 0.00 54.58 53.48 3pcg n ASN 422 Cb 0.50 -0.53 -0.17 0.00 -1.54 0.00 0.00 39.78 38.04 3pcg n ASN 422 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3pcg s PHE 423 N -2.14 0.70 -0.25 3.10 5.36 -0.53 -4.20 117.98 120.02 3pcg s PHE 423 Ca 0.45 -0.19 -0.12 0.00 -0.96 0.00 0.00 56.93 56.11 3pcg s PHE 423 Cb 0.31 -0.69 -0.16 0.00 -0.34 0.00 0.00 43.02 42.15 3pcg s PHE 423 CO 0.17 -0.23 -0.15 0.41 -1.46 0.00 0.00 175.22 173.96 3pcg n GLY 424 N 4.38 -0.53 0.41 13.12 0.00 -1.26 -4.66 105.19 116.65 3pcg n GLY 424 Ca -0.20 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3pcg n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pcg n GLY 425 N 1.54 0.89 3.34 -0.02 0.00 -1.26 -4.55 105.19 105.12 3pcg n GLY 425 Ca -0.46 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.24 3pcg n GLY 425 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3pcg s VAL 426 N -2.01 2.26 0.08 1.61 1.01 -1.26 -1.07 120.40 121.01 3pcg s VAL 426 Ca 0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 61.98 60.85 3pcg s VAL 426 Cb 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.58 3pcg s VAL 426 CO 0.00 0.58 0.23 -0.83 0.00 0.00 0.00 175.10 175.08 3pcg s GLY 427 N -0.59 0.02 -0.09 4.51 0.00 -0.17 -4.78 107.32 106.22 3pcg s GLY 427 Ca 0.09 -0.41 -0.20 0.00 0.00 0.00 0.00 44.72 44.20 3pcg s GLY 427 CO -0.00 -0.60 0.49 1.09 0.00 0.00 0.00 173.10 174.07 3pcg s ARG 428 N -3.39 0.75 -0.19 2.90 1.70 -0.93 0.08 118.95 119.87 3pcg s ARG 428 Ca 0.01 0.26 -0.19 0.00 -0.47 0.00 0.00 55.73 55.34 3pcg s ARG 428 Cb 0.03 0.35 0.05 0.00 -0.57 0.00 0.00 34.95 34.81 3pcg s ARG 428 CO -0.09 -0.19 0.54 0.00 -1.08 0.00 0.00 175.30 174.49 3pcg s LEU 430 N 0.19 4.16 0.62 0.00 2.96 -1.26 -0.80 118.68 124.55 3pcg s LEU 430 Ca -0.01 0.44 -0.18 0.00 -0.22 0.00 0.00 54.13 54.16 3pcg s LEU 430 Cb -0.04 -2.41 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 3pcg s LEU 430 CO 0.01 -0.02 1.24 0.42 -1.32 0.00 0.00 176.35 176.68 3pcg s THR 431 N 1.13 2.38 0.13 3.68 -4.23 0.14 -4.83 115.64 114.05 3pcg s THR 431 Ca 0.16 0.24 -0.02 0.00 -1.18 0.00 0.00 61.69 60.89 3pcg s THR 431 Cb -0.14 -3.07 0.03 0.00 1.34 0.00 0.00 72.50 70.66 3pcg s THR 431 CO 0.07 -0.06 0.18 -0.90 -0.54 0.00 0.00 174.62 173.37 3pcg n ASP 432 N -1.79 0.03 0.17 3.99 5.68 -0.14 -1.07 116.55 123.43 3pcg n ASP 432 Ca 0.14 -1.08 0.14 0.00 -0.50 0.00 0.00 54.79 53.49 3pcg n ASP 432 Cb 0.49 -0.14 0.71 0.00 -1.14 0.00 0.00 41.12 41.04 3pcg n ASP 432 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3pcg h SER 433 N -0.23 0.00 -0.51 -1.12 0.02 -1.94 -1.04 113.55 108.73 3pcg h SER 433 Ca -0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 3pcg h SER 433 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3pcg h SER 433 CO 0.04 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.20 3pcg n ASP 434 N -4.33 3.40 -0.15 3.07 8.00 -1.26 -4.59 116.55 120.69 3pcg n ASP 434 Ca 0.02 -1.98 -0.02 0.00 0.71 0.00 0.00 54.79 53.52 3pcg n ASP 434 Cb 0.29 -0.34 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 3pcg n ASP 434 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3pcg n GLY 435 N 1.51 0.55 3.84 0.44 0.00 -0.40 -4.74 105.19 106.39 3pcg n GLY 435 Ca 0.21 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 45.15 3pcg n GLY 435 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3pcg s TYR 436 N -2.04 3.58 0.04 1.61 2.02 -1.26 0.09 117.35 121.39 3pcg s TYR 436 Ca 0.00 1.17 -0.01 0.00 -0.37 0.00 0.00 57.07 57.86 3pcg s TYR 436 Cb 0.00 -2.46 -0.03 0.00 -0.40 0.00 0.00 41.96 39.07 3pcg s TYR 436 CO 0.00 0.35 -0.03 1.52 -1.57 0.00 0.00 175.55 175.82 3pcg s TYR 437 N -1.56 0.46 -0.07 2.71 -0.85 -0.84 -0.96 117.35 116.23 3pcg s TYR 437 Ca 0.42 -0.92 -0.22 0.00 -0.52 0.00 0.00 57.07 55.82 3pcg s TYR 437 Cb -0.15 -0.34 0.05 0.00 0.38 0.00 0.00 41.96 41.90 3pcg s TYR 437 CO 0.20 -0.33 0.51 -1.54 -1.52 0.00 0.00 175.55 172.88 3pcg s SER 438 N -2.54 -0.47 0.05 -0.18 1.04 -1.26 -2.15 113.70 108.20 3pcg s SER 438 Ca 0.01 0.57 -0.00 0.00 0.48 0.00 0.00 55.95 57.01 3pcg s SER 438 Cb 0.03 0.58 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 3pcg s SER 438 CO -0.08 -0.46 -0.04 -0.36 0.98 0.00 0.00 173.24 173.29 3pcg s PHE 439 N -0.91 0.51 -0.07 5.02 0.08 0.45 -4.90 117.98 118.15 3pcg s PHE 439 Ca -0.10 -0.84 0.02 0.00 0.12 0.00 0.00 56.93 56.14 3pcg s PHE 439 Cb -0.03 -0.35 0.01 0.00 -0.57 0.00 0.00 43.02 42.08 3pcg s PHE 439 CO 0.06 -0.26 -0.14 0.50 -0.10 0.00 0.00 175.22 175.28 3pcg s ARG 440 N -2.98 1.88 0.00 0.44 3.52 -0.88 -0.99 118.95 119.94 3pcg s ARG 440 Ca -0.00 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 3pcg s ARG 440 Cb 0.01 -1.55 0.00 0.00 -1.56 0.00 0.00 34.95 31.85 3pcg s ARG 440 CO -0.06 0.03 0.00 -2.37 -0.81 0.00 0.00 175.30 172.09 3pcg n THR 441 N 3.86 0.00 -4.29 4.11 5.66 0.03 0.11 114.28 123.75 3pcg n THR 441 Ca -0.22 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.49 3pcg n THR 441 Cb 0.52 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.19 3pcg n THR 441 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3pcg s ILE 442 N -2.94 2.97 0.02 1.09 -5.25 -1.26 -0.56 121.20 115.27 3pcg s ILE 442 Ca 0.00 -1.53 -0.30 0.00 -0.99 0.00 0.00 60.65 57.83 3pcg s ILE 442 Cb 0.00 -2.39 -0.06 0.00 2.95 0.00 0.00 42.46 42.96 3pcg s ILE 442 CO 0.00 0.05 1.37 -0.75 -1.79 0.00 0.00 174.94 173.82 3pcg s LYS 443 N -2.33 4.30 0.64 0.37 2.20 -0.23 -4.90 119.74 119.80 3pcg s LYS 443 Ca 0.20 1.95 -0.14 0.00 -0.36 0.00 0.00 55.97 57.62 3pcg s LYS 443 Cb -0.10 -3.52 -0.01 0.00 -1.51 0.00 0.00 37.83 32.69 3pcg s LYS 443 CO 0.12 -0.53 1.07 -1.25 -0.36 0.00 0.00 175.35 174.40 3pcg s PRO 444 N 2.13 3.06 0.24 4.03 0.04 -1.26 -4.34 135.00 138.90 3pcg s PRO 444 Ca 0.63 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.85 3pcg s PRO 444 Cb -0.32 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 3pcg s PRO 444 CO 0.27 -1.02 0.42 0.20 0.04 0.00 0.00 177.00 176.91 3pcg s GLY 445 N -3.02 1.60 0.93 0.56 0.00 -0.74 -4.70 107.32 101.94 3pcg s GLY 445 Ca 0.63 -0.91 -0.12 0.00 0.00 0.00 0.00 44.72 44.32 3pcg s GLY 445 CO 0.43 -0.87 1.09 2.56 0.00 0.00 0.00 173.10 176.31 3pcg s PRO 446 N -3.66 1.00 -0.10 2.90 0.04 -1.26 -4.10 135.00 129.82 3pcg s PRO 446 Ca 0.38 0.87 -0.22 0.00 0.04 0.00 0.00 61.00 62.07 3pcg s PRO 446 Cb -0.10 -1.78 0.05 0.00 0.04 0.00 0.00 34.50 32.71 3pcg s PRO 446 CO 0.31 -2.43 0.53 1.52 0.04 0.00 0.00 177.00 176.96 3pcg s TYR 447 N -2.87 -0.50 0.50 0.56 -0.85 -1.06 -4.16 117.35 108.96 3pcg s TYR 447 Ca 0.64 1.01 -0.18 0.00 -0.52 0.00 0.00 57.07 58.02 3pcg s TYR 447 Cb -0.19 0.25 -0.09 0.00 0.38 0.00 0.00 41.96 42.31 3pcg s TYR 447 CO 0.58 -0.43 0.98 -1.25 -1.52 0.00 0.00 175.55 173.90 3pcg s PRO 448 N -0.70 4.01 0.03 -3.49 0.04 -1.26 0.35 135.00 133.98 3pcg s PRO 448 Ca -0.08 1.00 -0.12 0.00 0.04 0.00 0.00 61.00 61.83 3pcg s PRO 448 Cb -0.03 -2.15 0.02 0.00 0.04 0.00 0.00 34.50 32.38 3pcg s PRO 448 CO 0.05 -0.22 0.27 1.67 0.04 0.00 0.00 177.00 178.81 3pcg s TRP 449 N -2.52 -0.07 -0.91 0.56 1.48 -0.78 -4.87 118.94 111.82 3pcg s TRP 449 Ca 0.60 -0.06 -0.24 0.00 -1.06 0.00 0.00 56.10 55.33 3pcg s TRP 449 Cb -0.10 0.06 0.05 0.00 -1.16 0.00 0.00 33.47 32.32 3pcg s TRP 449 CO 0.27 -0.46 1.36 1.03 -4.06 0.00 0.00 176.95 175.09 3pcg s ARG 450 N -2.34 3.44 0.00 3.25 0.52 -1.26 -4.33 118.95 118.24 3pcg s ARG 450 Ca -0.07 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.29 3pcg s ARG 450 Cb -0.02 -4.92 0.00 0.00 0.52 0.00 0.00 34.95 30.54 3pcg s ARG 450 CO -0.02 -2.16 0.00 -1.71 0.02 0.00 0.00 175.30 171.43 3pcg n ASN 451 N 8.90 0.00 -4.34 0.23 5.15 -1.26 -5.03 115.26 118.91 3pcg n ASN 451 Ca 0.22 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.90 3pcg n ASN 451 Cb 0.50 0.00 0.16 0.00 -0.53 0.00 0.00 39.78 39.91 3pcg n ASN 451 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3pcg s GLY 452 N 0.00 1.72 0.61 8.20 0.00 -1.26 -4.96 107.32 111.63 3pcg s GLY 452 Ca 0.00 -1.02 0.39 0.00 0.00 0.00 0.00 44.72 44.09 3pcg s GLY 452 CO 0.00 -0.33 2.19 -2.55 0.00 0.00 0.00 173.10 172.41 3pcg h PRO 453 N -1.52 0.00 -1.48 2.90 0.11 -1.98 -3.33 132.00 126.70 3pcg h PRO 453 Ca -0.45 0.00 -0.42 0.00 0.11 0.00 0.00 66.00 65.24 3pcg h PRO 453 Cb 1.27 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 32.03 3pcg h PRO 453 CO 0.46 0.01 -1.02 -1.71 -0.21 0.00 0.00 178.00 175.52 3pcg n ASN 454 N -3.11 0.14 -4.85 -2.05 5.15 -1.26 -5.10 115.26 104.17 3pcg n ASN 454 Ca -0.01 -3.13 -0.37 0.00 -0.60 0.00 0.00 54.58 50.46 3pcg n ASN 454 Cb 0.18 -0.04 -0.06 0.00 -0.53 0.00 0.00 39.78 39.33 3pcg n ASN 454 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3pcg s ASP 455 N -2.20 6.45 -0.03 1.20 1.01 -1.25 -5.08 116.67 116.77 3pcg s ASP 455 Ca 0.35 0.53 0.00 0.00 0.71 0.00 0.00 52.55 54.15 3pcg s ASP 455 Cb 0.34 -2.11 0.03 0.00 1.01 0.00 0.00 42.92 42.19 3pcg s ASP 455 CO -0.07 0.36 -0.00 0.26 0.21 0.00 0.00 175.17 175.92 3pcg s TRP 456 N -0.82 0.36 0.22 4.23 0.52 -1.26 -1.87 118.94 120.32 3pcg s TRP 456 Ca 0.16 -0.02 -0.30 0.00 0.02 0.00 0.00 56.10 55.96 3pcg s TRP 456 Cb -0.13 -0.44 -0.08 0.00 -1.15 0.00 0.00 33.47 31.67 3pcg s TRP 456 CO 0.05 -0.14 1.01 1.03 0.02 0.00 0.00 176.95 178.92 3pcg s ARG 457 N 1.02 4.73 0.72 4.98 1.81 0.16 -4.77 118.95 127.60 3pcg s ARG 457 Ca -0.10 1.60 -0.13 0.00 -1.72 0.00 0.00 55.73 55.38 3pcg s ARG 457 Cb -0.14 -3.27 0.03 0.00 -0.45 0.00 0.00 34.95 31.12 3pcg s ARG 457 CO -0.02 0.31 1.12 -1.25 -0.68 0.00 0.00 175.30 174.79 3pcg s PRO 458 N -0.90 2.43 0.26 3.54 0.04 -1.26 -2.57 135.00 136.54 3pcg s PRO 458 Ca 0.44 1.38 -0.31 0.00 0.04 0.00 0.00 61.00 62.56 3pcg s PRO 458 Cb -0.28 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.23 3pcg s PRO 458 CO 0.34 -1.54 1.44 0.00 0.04 0.00 0.00 177.00 177.29 3pcg n ALA 459 N -2.92 1.47 -3.23 8.56 0.00 -1.26 -4.74 120.51 118.40 3pcg n ALA 459 Ca 0.10 0.40 -0.12 0.00 0.00 0.00 0.00 53.44 53.82 3pcg n ALA 459 Cb 0.52 -2.32 -0.04 0.00 0.00 0.00 0.00 19.45 17.62 3pcg n ALA 459 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3pcg s HIS 460 N -0.18 -0.38 -0.11 0.00 -3.43 -1.26 -4.09 115.29 105.84 3pcg s HIS 460 Ca 0.66 0.19 0.03 0.00 -0.80 0.00 0.00 55.06 55.13 3pcg s HIS 460 Cb -0.60 0.39 0.01 0.00 -1.43 0.00 0.00 32.58 30.94 3pcg s HIS 460 CO 0.51 -0.74 -0.21 0.42 -2.00 0.00 0.00 174.74 172.72 3pcg s ILE 461 N -3.45 1.87 0.15 -5.38 1.01 -0.61 -4.63 121.20 110.14 3pcg s ILE 461 Ca 0.00 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.47 3pcg s ILE 461 Cb 0.00 -1.65 -0.07 0.00 0.01 0.00 0.00 42.46 40.76 3pcg s ILE 461 CO -0.10 0.51 1.07 -1.00 0.00 0.00 0.00 174.94 175.42 3pcg s HIS 462 N 0.65 3.64 0.05 3.97 3.76 0.16 -0.49 115.29 127.03 3pcg s HIS 462 Ca -0.12 1.63 0.07 0.00 -0.15 0.00 0.00 55.06 56.49 3pcg s HIS 462 Cb -0.16 -3.22 -0.03 0.00 1.11 0.00 0.00 32.58 30.28 3pcg s HIS 462 CO 0.03 -0.43 -0.19 -0.06 -0.85 0.00 0.00 174.74 173.24 3pcg s PHE 463 N -0.03 1.68 -0.05 1.40 0.40 1.00 -1.98 117.98 120.39 3pcg s PHE 463 Ca 0.50 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.47 3pcg s PHE 463 Cb -0.28 -0.99 0.01 0.00 0.51 0.00 0.00 43.02 42.28 3pcg s PHE 463 CO 0.33 0.10 -0.09 0.20 0.70 0.00 0.00 175.22 176.45 3pcg s GLY 464 N -1.28 0.62 -0.06 4.36 0.00 0.96 -0.61 107.32 111.31 3pcg s GLY 464 Ca 0.06 -0.27 0.03 0.00 0.00 0.00 0.00 44.72 44.54 3pcg s GLY 464 CO 0.02 0.17 -0.14 -0.42 0.00 0.00 0.00 173.10 172.73 3pcg s ILE 465 N 0.63 1.27 -0.02 0.90 1.09 0.75 -1.13 121.20 124.69 3pcg s ILE 465 Ca -0.11 -0.58 -0.05 0.00 -1.10 0.00 0.00 60.65 58.80 3pcg s ILE 465 Cb -0.14 -1.13 -0.03 0.00 -1.06 0.00 0.00 42.46 40.11 3pcg s ILE 465 CO 0.02 0.38 0.43 0.77 -0.10 0.00 0.00 174.94 176.44 3pcg h SER 466 N 6.68 -0.16 -4.00 3.58 4.64 -1.45 -1.53 113.55 121.31 3pcg h SER 466 Ca -0.31 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3pcg h SER 466 Cb 1.19 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3pcg h SER 466 CO 0.48 0.01 -0.00 0.61 -0.87 0.00 0.00 176.83 177.06 3pcg n GLY 467 N 0.80 -2.18 0.26 -0.77 0.00 -1.26 -2.96 105.19 99.07 3pcg n GLY 467 Ca -0.02 -1.48 0.16 0.00 0.00 0.00 0.00 46.02 44.68 3pcg n GLY 467 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3pcg h PRO 468 N 0.00 0.00 -3.69 1.61 0.13 -1.94 -3.47 132.00 124.65 3pcg h PRO 468 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 3pcg h PRO 468 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 3pcg h PRO 468 CO 0.00 0.00 -0.11 -1.54 -0.23 0.00 0.00 178.00 176.12 3pcg s SER 469 N -5.57 0.08 0.58 1.44 1.04 -1.26 -3.69 113.70 106.32 3pcg s SER 469 Ca 0.02 -1.03 0.34 0.00 0.48 0.00 0.00 55.95 55.76 3pcg s SER 469 Cb 0.09 0.62 1.82 0.00 0.10 0.00 0.00 66.02 68.64 3pcg s SER 469 CO 0.54 -1.20 2.19 0.16 0.98 0.00 0.00 173.24 175.90 3pcg h ILE 470 N 2.22 0.30 0.00 -1.02 3.07 -1.15 -1.34 117.51 119.59 3pcg h ILE 470 Ca -0.27 -0.27 -0.05 0.00 1.55 0.00 0.00 64.86 65.82 3pcg h ILE 470 Cb 1.25 1.20 -0.01 0.00 -0.27 0.00 0.00 36.82 38.99 3pcg h ILE 470 CO 0.36 0.04 -0.25 0.00 -1.05 0.00 0.00 178.15 177.25 3pcg h ALA 471 N 1.96 1.28 0.00 0.16 0.00 -1.75 -3.13 119.26 117.79 3pcg h ALA 471 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3pcg h ALA 471 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3pcg h ALA 471 CO 0.01 0.31 -1.05 0.25 0.00 0.00 0.00 179.25 178.77 3pcg n THR 472 N -3.80 0.03 -1.64 0.00 -2.24 -0.52 -4.93 114.28 101.18 3pcg n THR 472 Ca -0.01 -0.10 -0.45 0.00 -2.27 0.00 0.00 64.05 61.21 3pcg n THR 472 Cb 0.35 0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 69.18 3pcg n THR 472 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3pcg n LYS 473 N -1.68 1.74 -3.78 -0.78 3.00 -1.11 -4.73 118.16 110.82 3pcg n LYS 473 Ca 0.03 0.62 -0.13 0.00 -0.00 0.00 0.00 58.31 58.83 3pcg n LYS 473 Cb 0.38 -2.17 -0.09 0.00 0.00 0.00 0.00 35.03 33.14 3pcg n LYS 473 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3pcg s LEU 474 N 0.09 0.98 -0.05 3.14 2.96 -0.58 -5.01 118.68 120.22 3pcg s LEU 474 Ca 0.65 0.16 0.05 0.00 -0.22 0.00 0.00 54.13 54.77 3pcg s LEU 474 Cb -0.69 1.10 -0.01 0.00 0.50 0.00 0.00 46.19 47.09 3pcg s LEU 474 CO 0.54 -0.35 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.39 3pcg s ILE 475 N -0.97 1.71 0.24 6.68 1.01 -1.26 -0.18 121.20 128.43 3pcg s ILE 475 Ca -0.10 -0.88 -0.06 0.00 0.00 0.00 0.00 60.65 59.61 3pcg s ILE 475 Cb -0.05 -1.46 0.02 0.00 0.01 0.00 0.00 42.46 40.99 3pcg s ILE 475 CO 0.03 0.48 0.42 1.07 0.00 0.00 0.00 174.94 176.94 3pcg n THR 476 N 3.03 0.00 -4.26 2.92 5.66 0.22 -5.01 114.28 116.84 3pcg n THR 476 Ca -0.18 -0.81 -0.18 0.00 -3.05 0.00 0.00 64.05 59.83 3pcg n THR 476 Cb 0.52 0.64 -0.15 0.00 -1.55 0.00 0.00 70.33 69.80 3pcg n THR 476 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3pcg s GLN 477 N -2.23 0.62 -0.08 1.09 -0.21 -1.26 -0.00 119.66 117.58 3pcg s GLN 477 Ca 0.13 -0.24 -0.12 0.00 0.02 0.00 0.00 55.36 55.15 3pcg s GLN 477 Cb -0.02 -0.60 -0.05 0.00 1.00 0.00 0.00 33.01 33.34 3pcg s GLN 477 CO 0.10 0.13 0.29 -1.17 -2.12 0.00 0.00 175.29 172.52 3pcg s LEU 478 N -0.04 4.38 0.32 2.90 0.20 0.36 -4.84 118.68 121.96 3pcg s LEU 478 Ca 0.01 0.68 0.10 0.00 0.69 0.00 0.00 54.13 55.60 3pcg s LEU 478 Cb -0.04 -2.37 -0.05 0.00 -0.43 0.00 0.00 46.19 43.30 3pcg s LEU 478 CO -0.00 0.28 -0.03 -0.31 -0.29 0.00 0.00 176.35 175.99 3pcg s TYR 479 N -0.59 2.52 -0.16 5.38 2.02 0.53 -1.58 117.35 125.47 3pcg s TYR 479 Ca 0.19 -0.39 -0.05 0.00 -0.37 0.00 0.00 57.07 56.45 3pcg s TYR 479 Cb -0.14 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.04 3pcg s TYR 479 CO 0.08 0.55 0.01 -0.06 -1.57 0.00 0.00 175.55 174.56 3pcg s PHE 480 N -2.49 3.14 -0.00 2.71 0.40 -1.26 0.28 117.98 120.76 3pcg s PHE 480 Ca 0.33 -0.09 -0.39 0.00 -0.60 0.00 0.00 56.93 56.18 3pcg s PHE 480 Cb -0.02 -2.00 -0.19 0.00 0.51 0.00 0.00 43.02 41.32 3pcg s PHE 480 CO 0.18 0.09 1.21 -1.91 0.70 0.00 0.00 175.22 175.50 3pcg n GLU 481 N 3.43 0.44 -0.64 0.44 2.13 -0.81 -1.78 120.64 123.85 3pcg n GLU 481 Ca -0.17 0.16 0.00 0.00 0.66 0.00 0.00 57.16 57.81 3pcg n GLU 481 Cb 0.52 -1.72 0.00 0.00 0.27 0.00 0.00 31.44 30.52 3pcg n GLU 481 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3pcg n GLY 482 N 2.06 1.51 3.65 8.31 0.00 -1.26 -5.00 105.19 114.47 3pcg n GLY 482 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3pcg n GLY 482 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3pcg s ASP 483 N -3.21 6.24 0.17 1.61 -1.08 -0.73 -4.87 116.67 114.80 3pcg s ASP 483 Ca 0.00 2.47 0.18 0.00 -0.52 0.00 0.00 52.55 54.69 3pcg s ASP 483 Cb 0.00 -2.53 0.81 0.00 -1.46 0.00 0.00 42.92 39.74 3pcg s ASP 483 CO 0.00 -1.25 1.56 -0.81 0.52 0.00 0.00 175.17 175.19 3pcg n PRO 484 N 7.79 0.11 0.20 4.34 -0.04 -1.26 -2.53 135.00 143.61 3pcg n PRO 484 Ca 0.22 0.42 0.08 0.00 -0.04 0.00 0.00 63.50 64.18 3pcg n PRO 484 Cb 0.42 -1.75 0.28 0.00 -0.04 0.00 0.00 33.50 32.42 3pcg n PRO 484 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3pcg h LEU 485 N 0.00 0.00 -0.13 1.53 3.38 -1.95 -3.38 115.31 114.76 3pcg h LEU 485 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 3pcg h LEU 485 Cb 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3pcg h LEU 485 CO 0.00 0.27 -0.17 0.40 0.09 0.00 0.00 178.44 179.03 3pcg h ILE 486 N 0.00 0.00 0.00 1.22 2.04 -1.88 -1.23 117.51 117.66 3pcg h ILE 486 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pcg h ILE 486 Cb 0.98 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 3pcg h ILE 486 CO 0.04 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.38 3pcg n PRO 487 N -3.54 0.09 0.00 2.37 -0.04 -1.26 -2.12 135.00 130.50 3pcg n PRO 487 Ca -0.01 0.15 0.08 0.00 -0.04 0.00 0.00 63.50 63.68 3pcg n PRO 487 Cb 0.11 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.98 3pcg n PRO 487 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3pcg n MET 488 N -1.17 1.46 -2.78 0.54 2.81 -0.49 -4.98 117.12 112.51 3pcg n MET 488 Ca 0.02 -0.07 -0.42 0.00 -1.81 0.00 0.00 57.70 55.43 3pcg n MET 488 Cb 0.03 -1.30 -0.03 0.00 -0.71 0.00 0.00 33.22 31.21 3pcg n MET 488 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3pcg h PRO 490 N 7.13 0.37 -0.12 0.00 0.11 -1.90 0.16 132.00 137.75 3pcg h PRO 490 Ca -0.32 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 3pcg h PRO 490 Cb 1.15 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3pcg h PRO 490 CO 0.84 0.29 -0.06 0.82 -0.21 0.00 0.00 178.00 179.68 3pcg h ILE 491 N 0.38 1.32 -0.13 4.15 2.04 -1.91 -1.79 117.51 121.56 3pcg h ILE 491 Ca 0.10 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.91 3pcg h ILE 491 Cb 0.04 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.88 3pcg h ILE 491 CO -0.01 0.31 -0.08 0.58 0.00 0.00 0.00 178.15 178.95 3pcg h VAL 492 N -0.11 0.75 0.00 1.67 2.07 -1.72 -0.55 116.25 118.36 3pcg h VAL 492 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 3pcg h VAL 492 Cb 0.52 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 3pcg h VAL 492 CO 0.02 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.90 3pcg n LYS 493 N -5.22 0.03 0.27 1.57 5.02 0.49 -1.31 118.16 119.00 3pcg n LYS 493 Ca -0.03 0.33 0.18 0.00 -2.02 0.00 0.00 58.31 56.77 3pcg n LYS 493 Cb 0.15 -1.50 0.84 0.00 -0.02 0.00 0.00 35.03 34.49 3pcg n LYS 493 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3pcg h SER 494 N 0.00 0.00 -3.56 4.39 4.64 -0.18 -3.38 113.55 115.47 3pcg h SER 494 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 3pcg h SER 494 Cb 0.04 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.00 3pcg h SER 494 CO 0.00 0.00 0.17 -0.63 -0.87 0.00 0.00 176.83 175.50 3pcg s ILE 495 N -3.78 4.88 0.16 0.95 1.01 -0.43 -3.64 121.20 120.35 3pcg s ILE 495 Ca -0.01 0.64 -0.09 0.00 0.00 0.00 0.00 60.65 61.18 3pcg s ILE 495 Cb 0.10 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.48 3pcg s ILE 495 CO 0.45 -0.31 1.53 0.00 0.00 0.00 0.00 174.94 176.61 3pcg h ALA 496 N 8.44 0.67 -2.13 9.38 0.00 -1.85 -3.43 119.26 130.34 3pcg h ALA 496 Ca -0.26 -0.42 -0.59 0.00 0.00 0.00 0.00 54.91 53.64 3pcg h ALA 496 Cb 1.11 -0.15 -0.09 0.00 0.00 0.00 0.00 17.79 18.67 3pcg h ALA 496 CO 0.84 0.67 0.58 1.21 0.00 0.00 0.00 179.25 182.55 3pcg s ASN 497 N -6.78 6.78 0.43 0.00 3.04 -1.26 -4.91 114.94 112.24 3pcg s ASN 497 Ca -0.11 0.83 0.13 0.00 0.04 0.00 0.00 52.86 53.75 3pcg s ASN 497 Cb 0.12 -2.46 1.02 0.00 -1.54 0.00 0.00 41.25 38.38 3pcg s ASN 497 CO 0.87 -0.72 1.99 1.55 -3.04 0.00 0.00 177.10 177.76 3pcg h PRO 498 N 8.08 0.40 -0.03 0.43 0.13 -2.00 0.18 132.00 139.20 3pcg h PRO 498 Ca -0.23 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.84 3pcg h PRO 498 Cb 1.08 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 3pcg h PRO 498 CO 0.94 0.26 -0.17 0.93 -0.23 0.00 0.00 178.00 179.74 3pcg h GLU 499 N 0.41 0.05 -0.12 0.86 5.08 -1.98 -2.29 114.58 116.59 3pcg h GLU 499 Ca 0.25 -0.01 -0.19 0.00 -1.00 0.00 0.00 59.36 58.42 3pcg h GLU 499 Cb 0.46 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 3pcg h GLU 499 CO -0.07 0.22 -0.70 0.00 -1.00 0.00 0.00 179.01 177.46 3pcg h ALA 500 N 1.79 0.55 -0.43 3.43 0.00 -1.01 -3.09 119.26 120.50 3pcg h ALA 500 Ca 0.01 -0.58 0.03 0.00 0.00 0.00 0.00 54.91 54.36 3pcg h ALA 500 Cb 0.33 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3pcg h ALA 500 CO 0.02 0.73 0.24 0.28 0.00 0.00 0.00 179.25 180.52 3pcg h VAL 501 N 0.37 1.01 -0.32 0.00 2.07 -0.92 -2.20 116.25 116.27 3pcg h VAL 501 Ca -0.03 -0.16 0.09 0.00 0.82 0.00 0.00 66.70 67.42 3pcg h VAL 501 Cb 1.28 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3pcg h VAL 501 CO 0.13 0.09 0.25 1.56 0.02 0.00 0.00 177.57 179.61 3pcg h GLN 502 N 0.48 0.00 0.00 1.57 1.08 -1.39 -0.56 115.11 116.28 3pcg h GLN 502 Ca 0.18 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.37 3pcg h GLN 502 Cb 0.05 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 3pcg h GLN 502 CO -0.10 0.00 -0.03 0.37 -0.95 0.00 0.00 178.83 178.12 3pcg h GLN 503 N 0.00 0.00 -0.26 1.46 4.15 -1.43 -2.80 115.11 116.22 3pcg h GLN 503 Ca 0.15 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.57 3pcg h GLN 503 Cb 0.64 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.33 3pcg h GLN 503 CO -0.00 0.03 0.00 1.28 -1.93 0.00 0.00 178.83 178.21 3pcg n LEU 504 N -3.19 2.73 -4.50 -2.39 4.77 -0.22 -4.88 117.00 109.32 3pcg n LEU 504 Ca -0.01 -1.13 -0.41 0.00 -0.03 0.00 0.00 56.01 54.43 3pcg n LEU 504 Cb 0.22 -0.17 -0.10 0.00 -2.33 0.00 0.00 43.42 41.04 3pcg n LEU 504 CO 0.25 0.56 -0.09 -0.63 -1.33 0.00 0.00 177.39 176.16 3pcg s ILE 505 N -1.67 5.27 0.20 -0.08 1.01 -1.06 -0.35 121.20 124.52 3pcg s ILE 505 Ca 0.35 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 3pcg s ILE 505 Cb 0.21 -3.81 -0.09 0.00 0.01 0.00 0.00 42.46 38.78 3pcg s ILE 505 CO 0.30 -0.14 1.29 0.00 0.00 0.00 0.00 174.94 176.38 3pcg s ALA 506 N 1.72 3.51 -0.07 9.38 0.00 0.14 -4.82 121.76 131.63 3pcg s ALA 506 Ca 0.06 1.08 -0.06 0.00 0.00 0.00 0.00 51.96 53.04 3pcg s ALA 506 Cb -0.18 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 3pcg s ALA 506 CO 0.10 -0.51 0.17 0.15 0.00 0.00 0.00 175.76 175.68 3pcg s LYS 507 N -0.14 3.47 0.27 0.00 -0.14 -0.60 -1.92 119.74 120.68 3pcg s LYS 507 Ca 0.56 -0.16 -0.31 0.00 -1.36 0.00 0.00 55.97 54.71 3pcg s LYS 507 Cb -0.36 -3.15 -0.13 0.00 -1.68 0.00 0.00 37.83 32.51 3pcg s LYS 507 CO 0.38 0.73 1.46 -0.11 -0.76 0.00 0.00 175.35 177.05 3pcg n LEU 508 N 1.60 3.56 -3.83 3.17 7.94 -1.26 -0.35 117.00 127.83 3pcg n LEU 508 Ca -0.16 1.15 -0.30 0.00 -1.11 0.00 0.00 56.01 55.59 3pcg n LEU 508 Cb 0.54 -1.49 -0.14 0.00 0.53 0.00 0.00 43.42 42.86 3pcg n LEU 508 CO 0.36 -0.28 -0.26 -0.62 -1.11 0.00 0.00 177.39 175.49 3pcg s ASP 509 N 0.31 4.07 0.37 1.96 2.15 0.22 -4.79 116.67 120.95 3pcg s ASP 509 Ca 0.66 -2.48 0.12 0.00 0.43 0.00 0.00 52.55 51.27 3pcg s ASP 509 Cb -0.59 -1.26 0.71 0.00 -0.30 0.00 0.00 42.92 41.48 3pcg s ASP 509 CO 0.50 -0.30 1.83 0.24 -0.17 0.00 0.00 175.17 177.27 3pcg h MET 510 N 7.04 0.04 -0.01 4.34 2.86 -1.93 -2.78 114.93 124.49 3pcg h MET 510 Ca -0.05 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3pcg h MET 510 Cb 0.95 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.60 3pcg h MET 510 CO 0.54 0.39 -0.04 -0.91 1.06 0.00 0.00 176.91 177.94 3pcg h ASN 511 N 0.03 0.02 -0.02 1.22 2.35 -1.95 -2.55 115.58 114.69 3pcg h ASN 511 Ca 0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3pcg h ASN 511 Cb 0.64 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.01 3pcg h ASN 511 CO 0.05 0.06 -0.41 -3.20 -1.65 0.00 0.00 177.43 172.28 3pcg n ASN 512 N -4.47 2.08 -4.78 5.81 5.15 -1.06 -4.97 115.26 113.02 3pcg n ASN 512 Ca -0.03 -1.54 -0.32 0.00 -0.60 0.00 0.00 54.58 52.09 3pcg n ASN 512 Cb 0.13 0.43 0.06 0.00 -0.53 0.00 0.00 39.78 39.87 3pcg n ASN 512 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3pcg s ALA 513 N -2.34 2.44 -0.40 5.20 0.00 -0.96 -4.76 121.76 120.94 3pcg s ALA 513 Ca 0.19 0.39 -0.11 0.00 0.00 0.00 0.00 51.96 52.43 3pcg s ALA 513 Cb 0.18 -3.28 0.05 0.00 0.00 0.00 0.00 23.12 20.07 3pcg s ALA 513 CO 0.52 -1.40 0.25 -0.80 0.00 0.00 0.00 175.76 174.33 3pcg s ASN 514 N -3.01 5.74 0.39 0.00 0.01 0.29 -5.01 114.94 113.36 3pcg s ASN 514 Ca 0.64 -1.23 -0.25 0.00 -0.71 0.00 0.00 52.86 51.31 3pcg s ASN 514 Cb -0.18 -2.03 -0.12 0.00 0.41 0.00 0.00 41.25 39.34 3pcg s ASN 514 CO 0.47 -0.48 0.94 -2.65 -1.51 0.00 0.00 177.10 173.88 3pcg n PRO 515 N 4.99 1.22 -1.88 -0.60 -0.02 -1.26 -0.73 135.00 136.71 3pcg n PRO 515 Ca -0.11 0.44 -0.14 0.00 -2.02 0.00 0.00 63.50 61.66 3pcg n PRO 515 Cb 0.44 -1.92 -0.04 0.00 -0.02 0.00 0.00 33.50 31.97 3pcg n PRO 515 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3pcg n MET 516 N 0.32 -1.67 0.00 -0.52 2.81 -1.26 -4.67 117.12 112.13 3pcg n MET 516 Ca 0.10 0.79 0.00 0.00 -1.81 0.00 0.00 57.70 56.77 3pcg n MET 516 Cb 0.38 -5.21 0.00 0.00 -0.71 0.00 0.00 33.22 27.67 3pcg n MET 516 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3pcg n ASP 517 N -1.20 0.00 -3.76 7.83 2.03 0.09 -5.16 116.55 116.38 3pcg n ASP 517 Ca -0.16 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.03 3pcg n ASP 517 Cb 0.55 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.87 3pcg n ASP 517 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3pcg s LEU 519 N -1.62 2.88 0.01 0.00 1.43 -1.00 -0.55 118.68 119.83 3pcg s LEU 519 Ca -0.10 0.23 -0.05 0.00 -1.03 0.00 0.00 54.13 53.17 3pcg s LEU 519 Cb -0.03 -2.76 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 3pcg s LEU 519 CO 0.01 -1.76 0.09 0.00 0.23 0.00 0.00 176.35 174.93 3pcg s ALA 520 N -3.27 -0.18 -0.02 4.21 0.00 -1.26 -0.98 121.76 120.27 3pcg s ALA 520 Ca 0.63 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 52.32 3pcg s ALA 520 Cb -0.09 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 3pcg s ALA 520 CO 0.45 -0.22 -0.15 0.71 0.00 0.00 0.00 175.76 176.55 3pcg s TYR 521 N -1.62 1.44 -0.17 0.00 1.51 -0.52 0.70 117.35 118.70 3pcg s TYR 521 Ca -0.13 -0.32 -0.06 0.00 -1.01 0.00 0.00 57.07 55.54 3pcg s TYR 521 Cb -0.07 -0.95 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 3pcg s TYR 521 CO -0.00 -0.07 0.03 0.50 -1.11 0.00 0.00 175.55 174.90 3pcg s ARG 522 N -0.19 3.82 -0.26 -0.62 6.06 0.52 -1.98 118.95 126.31 3pcg s ARG 522 Ca 0.02 -0.40 -0.03 0.00 -2.50 0.00 0.00 55.73 52.83 3pcg s ARG 522 Cb -0.08 -3.10 0.10 0.00 0.06 0.00 0.00 34.95 31.94 3pcg s ARG 522 CO 0.00 0.30 0.19 0.12 -2.50 0.00 0.00 175.30 173.41 3pcg s PHE 523 N 0.26 -0.02 0.16 5.12 5.36 -0.39 -1.55 117.98 126.92 3pcg s PHE 523 Ca 0.02 -0.41 -0.06 0.00 -0.96 0.00 0.00 56.93 55.51 3pcg s PHE 523 Cb -0.13 -0.65 -0.06 0.00 -0.34 0.00 0.00 43.02 41.84 3pcg s PHE 523 CO 0.01 -0.78 0.42 -0.51 -1.46 0.00 0.00 175.22 172.91 3pcg s ASP 524 N 2.22 6.54 -0.05 6.13 1.01 -1.26 -4.08 116.67 127.17 3pcg s ASP 524 Ca 0.08 0.69 0.05 0.00 0.71 0.00 0.00 52.55 54.07 3pcg s ASP 524 Cb -0.15 -2.13 -0.00 0.00 1.01 0.00 0.00 42.92 41.64 3pcg s ASP 524 CO -0.28 0.03 -0.20 -0.63 0.21 0.00 0.00 175.17 174.31 3pcg s ILE 525 N -1.67 1.63 -0.19 0.77 1.01 -0.16 -4.92 121.20 117.66 3pcg s ILE 525 Ca 0.42 -0.82 -0.02 0.00 0.00 0.00 0.00 60.65 60.22 3pcg s ILE 525 Cb -0.12 -1.40 -0.01 0.00 0.01 0.00 0.00 42.46 40.95 3pcg s ILE 525 CO 0.23 0.46 -0.08 -0.69 0.00 0.00 0.00 174.94 174.86 3pcg s VAL 526 N 0.03 3.16 0.29 2.92 1.01 -1.26 -0.87 120.40 125.68 3pcg s VAL 526 Ca -0.05 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.40 3pcg s VAL 526 Cb -0.13 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 3pcg s VAL 526 CO 0.03 0.46 0.40 -0.76 0.00 0.00 0.00 175.10 175.23 3pcg s LEU 527 N 1.16 4.11 0.27 3.92 1.43 0.30 -4.93 118.68 124.94 3pcg s LEU 527 Ca 0.02 -0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.74 3pcg s LEU 527 Cb -0.14 -2.76 -0.14 0.00 0.03 0.00 0.00 46.19 43.17 3pcg s LEU 527 CO -0.02 -0.24 1.15 0.54 0.23 0.00 0.00 176.35 178.01 3pcg n ARG 528 N -1.50 1.57 -1.96 1.70 1.74 -1.26 -1.04 116.66 115.91 3pcg n ARG 528 Ca -0.05 0.55 -0.39 0.00 -0.77 0.00 0.00 57.85 57.19 3pcg n ARG 528 Cb 0.58 -2.03 0.01 0.00 -1.02 0.00 0.00 32.46 29.99 3pcg n ARG 528 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3pcg s GLY 529 N -0.27 2.91 -0.18 -0.13 0.00 -1.26 -4.26 107.32 104.13 3pcg s GLY 529 Ca 0.62 1.30 -0.02 0.00 0.00 0.00 0.00 44.72 46.61 3pcg s GLY 529 CO 0.57 1.87 -0.08 1.62 0.00 0.00 0.00 173.10 177.08 3pcg s GLN 530 N -2.42 3.38 0.17 2.90 0.74 -1.26 -1.51 119.66 121.66 3pcg s GLN 530 Ca 0.60 -0.65 0.04 0.00 0.05 0.00 0.00 55.36 55.40 3pcg s GLN 530 Cb -0.39 -2.86 -0.05 0.00 1.10 0.00 0.00 33.01 30.81 3pcg s GLN 530 CO 0.50 -0.04 -0.06 -0.98 -0.55 0.00 0.00 175.29 174.16 3pcg s ARG 531 N 1.03 1.13 0.28 1.67 1.70 -0.56 -4.97 118.95 119.23 3pcg s ARG 531 Ca -0.00 -1.52 -0.19 0.00 -0.47 0.00 0.00 55.73 53.55 3pcg s ARG 531 Cb -0.15 -0.57 -0.09 0.00 -0.57 0.00 0.00 34.95 33.58 3pcg s ARG 531 CO -0.01 0.00 0.77 -1.59 -1.08 0.00 0.00 175.30 173.40 3pcg s LYS 532 N -3.80 4.22 0.70 3.89 -2.85 -1.26 -0.54 119.74 120.10 3pcg s LYS 532 Ca 0.20 0.89 -0.15 0.00 -1.00 0.00 0.00 55.97 55.91 3pcg s LYS 532 Cb 0.04 -2.68 0.02 0.00 -2.06 0.00 0.00 37.83 33.15 3pcg s LYS 532 CO 0.03 0.28 1.19 0.95 0.10 0.00 0.00 175.35 177.89 3pcg s THR 533 N -1.72 2.52 -0.11 3.79 -4.23 -1.24 -4.79 115.64 109.86 3pcg s THR 533 Ca 0.49 0.26 -0.21 0.00 -1.18 0.00 0.00 61.69 61.04 3pcg s THR 533 Cb -0.14 -2.84 0.05 0.00 1.34 0.00 0.00 72.50 70.90 3pcg s THR 533 CO 0.20 -0.13 0.52 -1.38 -0.54 0.00 0.00 174.62 173.29 3pcg s HIS 534 N -2.01 -0.51 -1.50 3.99 -3.43 -1.26 -4.93 115.29 105.65 3pcg s HIS 534 Ca 0.73 1.05 -0.18 0.00 -0.80 0.00 0.00 55.06 55.86 3pcg s HIS 534 Cb -0.28 0.24 0.18 0.00 -1.43 0.00 0.00 32.58 31.29 3pcg s HIS 534 CO 0.43 -0.41 0.50 1.19 -2.00 0.00 0.00 174.74 174.46 3pcg n PHE 535 N 1.86 -1.40 1.94 0.38 3.72 -1.26 -5.24 117.46 117.45 3pcg n PHE 535 Ca -0.17 0.56 0.16 0.00 -0.05 0.00 0.00 57.45 57.95 3pcg n PHE 535 Cb 0.56 -1.87 0.90 0.00 -0.94 0.00 0.00 39.48 38.13 3pcg n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10