#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 2.53 0.04 0.55 0.00 -1.26 -5.07 121.76 118.55 3pcg s ALA 302 Ca 0.00 0.50 0.07 0.00 0.00 0.00 0.00 51.96 52.52 3pcg s ALA 302 Cb 0.00 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 3pcg s ALA 302 CO 0.00 -1.19 -0.19 -0.65 0.00 0.00 0.00 175.76 173.73 3pcg s GLN 303 N -4.13 1.32 -1.08 0.00 -0.21 -1.26 -5.08 119.66 109.22 3pcg s GLN 303 Ca 0.66 -0.88 -0.19 0.00 0.02 0.00 0.00 55.36 54.96 3pcg s GLN 303 Cb -0.19 -1.40 0.10 0.00 1.00 0.00 0.00 33.01 32.51 3pcg s GLN 303 CO 0.41 0.36 1.41 0.34 -2.12 0.00 0.00 175.29 175.69 3pcg s ASP 304 N -1.10 6.69 0.00 5.90 2.15 -1.26 -4.64 116.67 124.40 3pcg s ASP 304 Ca 0.06 -2.05 0.00 0.00 0.43 0.00 0.00 52.55 51.00 3pcg s ASP 304 Cb -0.08 -2.50 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 3pcg s ASP 304 CO 0.01 -1.20 0.49 -0.46 -0.17 0.00 0.00 175.17 173.84 3pcg n ASN 305 N 7.63 0.95 -4.36 -0.34 0.23 -1.26 -4.99 115.26 113.12 3pcg n ASN 305 Ca 0.34 -1.11 -0.22 0.00 -0.53 0.00 0.00 54.58 53.06 3pcg n ASN 305 Cb 0.48 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.07 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 -0.11 2.81 0.05 0.53 0.01 -1.26 -3.61 113.70 112.11 3pcg s SER 306 Ca 0.00 -0.91 0.06 0.00 1.31 0.00 0.00 55.95 56.41 3pcg s SER 306 Cb 0.00 -0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.03 3pcg s SER 306 CO 0.00 -0.04 -0.17 -0.13 0.41 0.00 0.00 173.24 173.30 3pcg s ARG 307 N -3.03 1.11 -0.07 12.44 1.81 0.28 -4.86 118.95 126.63 3pcg s ARG 307 Ca 0.19 -0.89 0.05 0.00 -1.72 0.00 0.00 55.73 53.35 3pcg s ARG 307 Cb -0.05 -1.19 -0.01 0.00 -0.45 0.00 0.00 34.95 33.25 3pcg s ARG 307 CO 0.08 0.29 -0.21 -0.06 -0.68 0.00 0.00 175.30 174.72 3pcg s PHE 308 N -0.91 2.54 0.26 -0.53 0.08 -1.26 -1.24 117.98 116.93 3pcg s PHE 308 Ca 0.04 -0.59 -0.31 0.00 0.12 0.00 0.00 56.93 56.20 3pcg s PHE 308 Cb -0.09 -1.64 -0.13 0.00 -0.57 0.00 0.00 43.02 40.60 3pcg s PHE 308 CO 0.02 -0.13 1.43 0.28 -0.10 0.00 0.00 175.22 176.72 3pcg n VAL 309 N 2.88 1.08 -1.70 -0.44 0.31 -0.12 -4.91 118.33 115.43 3pcg n VAL 309 Ca -0.17 -0.27 -0.43 0.00 -0.01 0.00 0.00 64.34 63.46 3pcg n VAL 309 Cb 0.52 -1.58 -0.01 0.00 -0.91 0.00 0.00 33.84 31.86 3pcg n VAL 309 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3pcg n ILE 310 N 1.78 1.55 -2.24 2.52 2.08 -1.26 -4.69 119.36 119.10 3pcg n ILE 310 Ca 0.10 -0.39 -0.36 0.00 0.56 0.00 0.00 62.75 62.66 3pcg n ILE 310 Cb 0.33 -1.64 -0.00 0.00 -0.75 0.00 0.00 39.64 37.58 3pcg n ILE 310 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 3pcg s ARG 311 N -1.27 3.60 -0.55 0.38 0.52 -1.26 -4.96 118.95 115.40 3pcg s ARG 311 Ca 0.60 1.74 -0.17 0.00 -0.52 0.00 0.00 55.73 57.37 3pcg s ARG 311 Cb -0.57 -2.27 0.11 0.00 0.52 0.00 0.00 34.95 32.74 3pcg s ARG 311 CO 0.57 -0.68 0.59 0.34 0.02 0.00 0.00 175.30 176.14 3pcg s ASP 312 N -1.48 6.19 0.00 0.23 -1.08 -1.26 -4.91 116.67 114.35 3pcg s ASP 312 Ca 0.67 -1.51 0.20 0.00 -0.52 0.00 0.00 52.55 51.39 3pcg s ASP 312 Cb -0.27 -2.26 1.11 0.00 -1.46 0.00 0.00 42.92 40.04 3pcg s ASP 312 CO 0.32 -0.96 1.63 0.54 0.52 0.00 0.00 175.17 177.22 3pcg n ARG 313 N 5.81 0.44 -0.00 4.34 1.74 -1.26 -2.02 116.66 125.71 3pcg n ARG 313 Ca -0.11 0.06 0.11 0.00 -0.77 0.00 0.00 57.85 57.13 3pcg n ARG 313 Cb 0.42 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.22 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 -1.16 0.42 -0.07 0.55 3.02 -1.26 -4.35 115.26 112.41 3pcg n ASN 314 Ca 0.12 -0.38 -0.10 0.00 -0.03 0.00 0.00 54.58 54.19 3pcg n ASN 314 Cb 0.12 1.52 -0.07 0.00 -0.61 0.00 0.00 39.78 40.75 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 0.00 -4.26 3.10 2.91 -1.83 -3.44 115.95 112.43 3pcg h TRP 315 Ca 0.00 0.00 -0.52 0.00 1.13 0.00 0.00 58.89 59.50 3pcg h TRP 315 Cb 0.80 0.00 0.17 0.00 -0.51 0.00 0.00 29.16 29.61 3pcg h TRP 315 CO 0.00 0.63 0.29 -1.01 -1.03 0.00 0.00 178.44 177.32 3pcg s HIS 316 N -2.08 2.03 0.56 2.65 3.76 -1.07 -4.67 115.29 116.47 3pcg s HIS 316 Ca -0.15 1.68 -0.19 0.00 -0.15 0.00 0.00 55.06 56.25 3pcg s HIS 316 Cb 0.01 -3.27 -0.05 0.00 1.11 0.00 0.00 32.58 30.38 3pcg s HIS 316 CO 0.38 -2.42 1.16 -1.25 -0.85 0.00 0.00 174.74 171.75 3pcg s PRO 317 N -4.57 3.22 0.89 8.40 0.04 -1.26 -4.81 135.00 136.91 3pcg s PRO 317 Ca 0.66 1.68 -0.14 0.00 0.04 0.00 0.00 61.00 63.25 3pcg s PRO 317 Cb -0.22 -1.98 0.15 0.00 0.04 0.00 0.00 34.50 32.49 3pcg s PRO 317 CO 0.54 -0.97 1.25 0.15 0.04 0.00 0.00 177.00 178.02 3pcg s LYS 318 N -3.31 1.18 -0.01 4.56 -0.14 -1.25 -5.00 119.74 115.77 3pcg s LYS 318 Ca 0.74 -0.25 -0.24 0.00 -1.36 0.00 0.00 55.97 54.86 3pcg s LYS 318 Cb -0.26 -1.91 -0.19 0.00 -1.68 0.00 0.00 37.83 33.79 3pcg s LYS 318 CO 0.29 -2.07 1.27 0.00 -0.76 0.00 0.00 175.35 174.09 3pcg h ALA 319 N -1.37 0.06 -2.51 5.17 0.00 -1.95 -3.42 119.26 115.24 3pcg h ALA 319 Ca -0.45 -0.28 -0.65 0.00 0.00 0.00 0.00 54.91 53.53 3pcg h ALA 319 Cb 1.27 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.89 3pcg h ALA 319 CO 0.48 -0.15 -0.16 -1.17 0.00 0.00 0.00 179.25 178.26 3pcg s LEU 320 N -9.15 4.41 -0.41 0.00 2.96 -1.26 -4.76 118.68 110.46 3pcg s LEU 320 Ca -0.16 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 53.65 3pcg s LEU 320 Cb 0.02 -2.47 0.17 0.00 0.50 0.00 0.00 46.19 44.41 3pcg s LEU 320 CO 0.70 -0.42 0.34 0.42 -1.32 0.00 0.00 176.35 176.06 3pcg s THR 321 N 2.22 0.35 0.56 3.68 -4.23 -1.26 -5.03 115.64 111.92 3pcg s THR 321 Ca 0.15 -2.66 0.42 0.00 -1.18 0.00 0.00 61.69 58.43 3pcg s THR 321 Cb -0.16 -1.26 0.62 0.00 1.34 0.00 0.00 72.50 73.04 3pcg s THR 321 CO 0.13 -1.24 1.63 -0.65 -0.54 0.00 0.00 174.62 173.95 3pcg h PRO 322 N 5.64 0.00 0.00 3.99 0.11 -1.94 0.26 132.00 140.06 3pcg h PRO 322 Ca 0.27 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.36 3pcg h PRO 322 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 3pcg h PRO 322 CO 0.37 0.00 -0.08 -0.44 -0.21 0.00 0.00 178.00 177.64 3pcg h ASP 323 N 0.00 0.00 -3.57 -2.05 3.32 -1.96 -3.23 116.42 108.94 3pcg h ASP 323 Ca 0.72 0.00 -0.79 0.00 0.02 0.00 0.00 57.03 56.99 3pcg h ASP 323 Cb 3.05 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 42.34 3pcg h ASP 323 CO -0.01 0.08 0.34 -0.47 -1.72 0.00 0.00 179.24 177.46 3pcg s TYR 324 N -4.07 3.92 0.26 4.55 5.04 0.08 -4.83 117.35 122.30 3pcg s TYR 324 Ca -0.02 -2.24 -0.04 0.00 -2.44 0.00 0.00 57.07 52.32 3pcg s TYR 324 Cb 0.12 -3.88 0.53 0.00 0.35 0.00 0.00 41.96 39.08 3pcg s TYR 324 CO 0.55 -1.02 1.62 0.87 -1.34 0.00 0.00 175.55 176.23 3pcg h LYS 325 N 7.38 0.10 0.00 4.97 1.57 -1.78 -1.25 116.57 127.56 3pcg h LYS 325 Ca 0.15 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3pcg h LYS 325 Cb 0.97 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 3pcg h LYS 325 CO 0.90 0.07 -0.02 1.15 -0.57 0.00 0.00 179.45 180.97 3pcg h THR 326 N 0.10 0.45 0.00 -0.16 2.02 -1.92 -1.50 112.91 111.91 3pcg h THR 326 Ca 0.47 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.55 3pcg h THR 326 Cb 0.86 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 3pcg h THR 326 CO -0.72 0.02 0.00 -1.54 0.37 0.00 0.00 175.52 173.65 3pcg n SER 327 N -3.70 0.49 0.13 4.18 3.41 -0.47 -3.10 113.62 114.57 3pcg n SER 327 Ca -0.03 0.61 -0.14 0.00 -0.26 0.00 0.00 58.87 59.06 3pcg n SER 327 Cb 0.11 -0.72 -0.08 0.00 -0.26 0.00 0.00 64.21 63.26 3pcg n SER 327 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3pcg h ILE 328 N 0.00 0.81 -0.00 -1.33 2.04 -1.41 -2.92 117.51 114.70 3pcg h ILE 328 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.82 3pcg h ILE 328 Cb 0.37 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 3pcg h ILE 328 CO 0.00 0.01 -0.21 0.00 0.00 0.00 0.00 178.15 177.95 3pcg n ALA 329 N -2.21 2.92 -1.14 1.87 0.00 -1.21 -4.03 120.51 116.69 3pcg n ALA 329 Ca -0.09 -0.26 0.02 0.00 0.00 0.00 0.00 53.44 53.11 3pcg n ALA 329 Cb 0.13 -1.29 0.25 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.23 2.68 -5.25 0.00 1.74 -1.14 -4.95 116.66 108.51 3pcg n ARG 330 Ca 0.10 -2.98 -0.31 0.00 -0.77 0.00 0.00 57.85 53.88 3pcg n ARG 330 Cb 0.32 -1.89 -0.16 0.00 -1.02 0.00 0.00 32.46 29.70 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 -1.99 3.03 0.60 0.55 1.04 -1.11 -4.98 113.70 110.83 3pcg s SER 331 Ca 0.45 -0.51 -0.18 0.00 0.48 0.00 0.00 55.95 56.19 3pcg s SER 331 Cb 0.38 -0.84 -0.03 0.00 0.10 0.00 0.00 66.02 65.63 3pcg s SER 331 CO 0.07 0.24 1.16 -2.84 0.98 0.00 0.00 173.24 172.85 3pcg s PRO 332 N -0.15 3.03 -0.02 4.02 0.02 -1.26 -4.96 135.00 135.68 3pcg s PRO 332 Ca -0.04 1.67 0.21 0.00 0.02 0.00 0.00 61.00 62.86 3pcg s PRO 332 Cb -0.14 -1.95 -0.31 0.00 0.02 0.00 0.00 34.50 32.12 3pcg s PRO 332 CO 0.04 -1.12 0.58 0.54 -0.33 0.00 0.00 177.00 176.70 3pcg n ARG 333 N -1.70 0.51 -3.32 5.54 5.12 -1.26 -4.94 116.66 116.62 3pcg n ARG 333 Ca 0.12 -0.15 -0.31 0.00 -1.93 0.00 0.00 57.85 55.58 3pcg n ARG 333 Cb 0.51 -1.50 -0.05 0.00 -1.16 0.00 0.00 32.46 30.25 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 -3.36 3.79 0.55 5.56 -1.52 -1.26 -5.05 119.66 118.38 3pcg s GLN 334 Ca -0.04 0.29 -0.18 0.00 -1.95 0.00 0.00 55.36 53.49 3pcg s GLN 334 Cb 0.14 -2.60 -0.05 0.00 -0.22 0.00 0.00 33.01 30.28 3pcg s GLN 334 CO 0.88 0.25 1.08 0.00 -0.25 0.00 0.00 175.29 177.25 3pcg s ALA 335 N -1.93 2.74 0.57 6.09 0.00 -1.26 -4.99 121.76 122.96 3pcg s ALA 335 Ca 0.48 0.60 -0.19 0.00 0.00 0.00 0.00 51.96 52.85 3pcg s ALA 335 Cb -0.11 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 3pcg s ALA 335 CO 0.23 -0.70 1.17 -0.51 0.00 0.00 0.00 175.76 175.96 3pcg s LEU 336 N -4.02 3.71 -0.28 0.00 1.43 -1.26 -4.99 118.68 113.27 3pcg s LEU 336 Ca 0.68 2.30 -0.13 0.00 -1.03 0.00 0.00 54.13 55.94 3pcg s LEU 336 Cb -0.19 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.40 3pcg s LEU 336 CO 0.29 -1.42 0.29 -0.69 0.23 0.00 0.00 176.35 175.05 3pcg s VAL 337 N -1.67 5.24 0.23 -1.59 1.01 -1.26 -5.07 120.40 117.29 3pcg s VAL 337 Ca 0.75 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 62.82 3pcg s VAL 337 Cb -0.28 -3.62 -0.09 0.00 0.00 0.00 0.00 36.38 32.39 3pcg s VAL 337 CO 0.30 0.20 0.92 -0.44 0.00 0.00 0.00 175.10 176.08 3pcg s SER 338 N 1.70 7.61 0.07 3.32 0.01 -1.26 -5.06 113.70 120.09 3pcg s SER 338 Ca 0.11 1.91 0.03 0.00 1.31 0.00 0.00 55.95 59.32 3pcg s SER 338 Cb -0.16 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.44 3pcg s SER 338 CO 0.10 0.16 -0.10 0.27 0.41 0.00 0.00 173.24 174.08 3pcg s ILE 339 N -1.19 0.82 0.57 1.44 -4.36 -1.26 -5.13 121.20 112.08 3pcg s ILE 339 Ca 0.41 -1.39 -0.19 0.00 -0.26 0.00 0.00 60.65 59.22 3pcg s ILE 339 Cb -0.25 -1.05 -0.05 0.00 1.25 0.00 0.00 42.46 42.36 3pcg s ILE 339 CO 0.31 -0.45 1.12 -2.16 0.24 0.00 0.00 174.94 174.00 3pcg s PRO 340 N -2.21 3.26 0.13 0.37 0.04 -1.26 -4.98 135.00 130.35 3pcg s PRO 340 Ca -0.01 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.27 3pcg s PRO 340 Cb -0.06 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 3pcg s PRO 340 CO 0.00 -0.91 1.18 -0.65 0.04 0.00 0.00 177.00 176.66 3pcg s GLN 341 N -3.46 4.48 0.37 4.56 -0.21 -1.26 -5.01 119.66 119.13 3pcg s GLN 341 Ca 0.71 1.80 0.05 0.00 0.02 0.00 0.00 55.36 57.94 3pcg s GLN 341 Cb -0.23 -3.30 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 3pcg s GLN 341 CO 0.30 -0.14 0.20 -1.54 -2.12 0.00 0.00 175.29 171.99 3pcg s SER 342 N 0.52 2.25 0.49 5.90 1.04 -1.26 -5.01 113.70 117.63 3pcg s SER 342 Ca 0.55 -1.72 0.28 0.00 0.48 0.00 0.00 55.95 55.53 3pcg s SER 342 Cb -0.31 0.55 1.35 0.00 0.10 0.00 0.00 66.02 67.72 3pcg s SER 342 CO 0.33 -1.01 1.83 -0.29 0.98 0.00 0.00 173.24 175.08 3pcg h ILE 343 N 1.95 0.51 -0.99 -1.02 2.10 -1.95 0.97 117.51 119.08 3pcg h ILE 343 Ca -0.30 -0.05 0.01 0.00 1.08 0.00 0.00 64.86 65.59 3pcg h ILE 343 Cb 1.25 0.35 -0.05 0.00 -1.09 0.00 0.00 36.82 37.28 3pcg h ILE 343 CO 0.46 0.03 0.64 0.28 -1.08 0.00 0.00 178.15 178.48 3pcg h SER 344 N 0.16 1.15 0.45 2.19 0.02 -1.95 -3.18 113.55 112.38 3pcg h SER 344 Ca 0.52 -0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 61.30 3pcg h SER 344 Cb 1.76 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.99 3pcg h SER 344 CO -0.11 0.84 -1.67 -0.62 -1.14 0.00 0.00 176.83 174.14 3pcg n GLU 345 N -4.38 0.64 -0.43 3.45 4.71 0.25 -4.43 120.64 120.46 3pcg n GLU 345 Ca 0.12 0.06 0.09 0.00 -0.01 0.00 0.00 57.16 57.41 3pcg n GLU 345 Cb 0.02 -1.69 0.29 0.00 -1.01 0.00 0.00 31.44 29.06 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 -2.67 1.21 -4.42 2.62 -2.24 -0.70 -2.75 114.28 105.33 3pcg n THR 346 Ca -0.11 -0.92 -0.21 0.00 -2.27 0.00 0.00 64.05 60.54 3pcg n THR 346 Cb 0.78 0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.50 1.36 0.11 4.28 -4.23 -1.20 -4.77 115.64 109.68 3pcg s THR 347 Ca 0.43 -2.05 -0.25 0.00 -1.18 0.00 0.00 61.69 58.63 3pcg s THR 347 Cb 0.25 -2.58 0.08 0.00 1.34 0.00 0.00 72.50 71.59 3pcg s THR 347 CO 0.25 -0.18 1.10 -0.83 -0.54 0.00 0.00 174.62 174.42 3pcg s GLY 348 N -3.44 -0.13 0.39 3.99 0.00 -1.20 -1.68 107.32 105.24 3pcg s GLY 348 Ca 0.32 0.07 -0.26 0.00 0.00 0.00 0.00 44.72 44.85 3pcg s GLY 348 CO 0.13 1.59 1.18 2.56 0.00 0.00 0.00 173.10 178.57 3pcg s PRO 349 N -2.54 4.11 -0.20 2.90 0.04 -1.26 -4.84 135.00 133.21 3pcg s PRO 349 Ca 0.18 1.89 -0.04 0.00 0.04 0.00 0.00 61.00 63.07 3pcg s PRO 349 Cb -0.00 -2.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.77 3pcg s PRO 349 CO 0.02 -0.28 -0.03 1.21 0.04 0.00 0.00 177.00 177.96 3pcg s ASN 350 N -1.04 4.56 -0.26 6.66 3.84 -1.26 -4.89 114.94 122.55 3pcg s ASN 350 Ca 0.55 -0.29 0.12 0.00 0.21 0.00 0.00 52.86 53.46 3pcg s ASN 350 Cb -0.32 -1.77 0.78 0.00 -0.55 0.00 0.00 41.25 39.38 3pcg s ASN 350 CO 0.41 0.04 1.75 0.49 -2.79 0.00 0.00 177.10 176.99 3pcg n PHE 351 N 4.40 2.19 0.27 0.43 3.72 -1.26 -4.59 117.46 122.62 3pcg n PHE 351 Ca -0.18 -0.88 0.13 0.00 -0.05 0.00 0.00 57.45 56.48 3pcg n PHE 351 Cb 0.51 -0.57 0.82 0.00 -0.94 0.00 0.00 39.48 39.30 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 3.43 0.00 -0.59 4.37 0.02 -1.96 -2.36 113.55 116.46 3pcg h SER 352 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3pcg h SER 352 Cb 2.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.63 3pcg h SER 352 CO 0.58 0.00 0.00 1.41 -1.14 0.00 0.00 176.83 177.68 3pcg n HIS 353 N -4.06 0.87 -2.36 3.45 8.25 -1.26 -4.96 115.22 115.14 3pcg n HIS 353 Ca -0.02 -0.52 -0.41 0.00 -0.26 0.00 0.00 57.72 56.51 3pcg n HIS 353 Cb 0.12 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.13 4.47 -0.83 2.41 2.96 -0.89 -4.96 118.68 120.71 3pcg s LEU 354 Ca 0.41 2.29 -0.22 0.00 -0.22 0.00 0.00 54.13 56.39 3pcg s LEU 354 Cb 0.22 -3.61 0.08 0.00 0.50 0.00 0.00 46.19 43.38 3pcg s LEU 354 CO 0.26 -0.35 1.16 -0.83 -1.32 0.00 0.00 176.35 175.27 3pcg s GLY 355 N -0.10 1.47 0.23 7.98 0.00 -1.26 -5.01 107.32 110.62 3pcg s GLY 355 Ca 0.51 -2.17 -0.30 0.00 0.00 0.00 0.00 44.72 42.77 3pcg s GLY 355 CO 0.39 2.25 0.99 -1.36 0.00 0.00 0.00 173.10 175.37 3pcg s PHE 356 N 4.02 3.85 0.86 1.90 0.40 -1.26 -5.05 117.98 122.69 3pcg s PHE 356 Ca 0.32 1.83 -0.11 0.00 -0.60 0.00 0.00 56.93 58.37 3pcg s PHE 356 Cb -0.08 -3.08 0.11 0.00 0.51 0.00 0.00 43.02 40.47 3pcg s PHE 356 CO 0.00 0.12 1.09 0.20 0.70 0.00 0.00 175.22 177.33 3pcg s GLY 357 N -0.89 1.63 0.42 4.36 0.00 -1.26 -4.94 107.32 106.64 3pcg s GLY 357 Ca 0.43 -0.02 0.11 0.00 0.00 0.00 0.00 44.72 45.24 3pcg s GLY 357 CO 0.34 0.44 1.98 0.00 0.00 0.00 0.00 173.10 175.86 3pcg h ALA 358 N -1.42 1.64 -0.33 3.20 0.00 -2.02 -2.95 119.26 117.38 3pcg h ALA 358 Ca -0.48 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.17 3pcg h ALA 358 Cb 1.27 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 3pcg h ALA 358 CO 0.54 0.27 -0.02 0.72 0.00 0.00 0.00 179.25 180.77 3pcg n HIS 359 N -4.35 1.07 -0.15 0.00 8.25 -1.26 -4.75 115.22 114.03 3pcg n HIS 359 Ca -0.01 -1.30 0.09 0.00 -0.26 0.00 0.00 57.72 56.23 3pcg n HIS 359 Cb 0.21 -0.43 0.41 0.00 1.12 0.00 0.00 29.99 31.30 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 1.28 0.56 -0.30 0.41 5.19 -1.79 -1.94 116.42 119.83 3pcg h ASP 360 Ca 0.14 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 3pcg h ASP 360 Cb 1.60 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 41.00 3pcg h ASP 360 CO 0.34 0.35 0.00 0.00 -3.12 0.00 0.00 179.24 176.81 3pcg n HIS 361 N -4.48 0.38 -3.88 4.55 1.44 -1.11 -1.71 115.22 110.41 3pcg n HIS 361 Ca 0.11 -0.19 -0.33 0.00 -2.01 0.00 0.00 57.72 55.30 3pcg n HIS 361 Cb 0.29 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.27 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 -1.55 4.82 0.00 4.39 -1.08 -0.73 -1.92 116.67 120.59 3pcg s ASP 362 Ca 0.36 -2.60 0.14 0.00 -0.52 0.00 0.00 52.55 49.92 3pcg s ASP 362 Cb 0.21 -1.72 0.66 0.00 -1.46 0.00 0.00 42.92 40.61 3pcg s ASP 362 CO 0.30 -0.36 1.38 0.18 0.52 0.00 0.00 175.17 177.19 3pcg n LEU 363 N 3.73 0.00 0.08 -1.34 4.32 0.55 -1.01 117.00 123.33 3pcg n LEU 363 Ca 0.04 0.34 -0.04 0.00 -0.02 0.00 0.00 56.01 56.34 3pcg n LEU 363 Cb 0.37 -0.34 -0.07 0.00 -1.62 0.00 0.00 43.42 41.76 3pcg n LEU 363 CO 0.31 -0.19 0.22 -0.07 -1.22 0.00 0.00 177.39 176.44 3pcg h LEU 364 N 0.00 0.00 -0.08 2.23 4.07 -1.92 -3.38 115.31 116.22 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 0.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 3pcg h LEU 364 CO 0.00 0.81 0.00 0.18 -1.08 0.00 0.00 178.44 178.35 3pcg n LEU 365 N -3.28 0.08 -0.11 1.67 4.77 -0.76 -4.59 117.00 114.78 3pcg n LEU 365 Ca -0.00 -0.52 0.15 0.00 -0.03 0.00 0.00 56.01 55.61 3pcg n LEU 365 Cb 0.87 0.00 0.77 0.00 -2.33 0.00 0.00 43.42 42.73 3pcg n LEU 365 CO 0.45 0.02 1.00 -0.46 -1.33 0.00 0.00 177.39 177.06 3pcg n ASN 366 N -0.88 0.37 0.00 -1.43 0.23 -0.18 -5.03 115.26 108.33 3pcg n ASN 366 Ca 0.00 -0.86 -0.02 0.00 -0.53 0.00 0.00 54.58 53.18 3pcg n ASN 366 Cb 0.00 -0.06 -0.01 0.00 -2.08 0.00 0.00 39.78 37.64 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 -0.84 0.00 0.00 -2.53 7.35 -1.26 -4.95 117.46 115.23 3pcg n PHE 367 Ca 0.19 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.88 3pcg n PHE 367 Cb 0.21 -0.10 0.00 0.00 0.35 0.00 0.00 39.48 39.94 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 2.83 0.00 3.89 7.13 0.00 -1.26 -4.52 105.19 113.25 3pcg n GLY 371 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 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 4.38 0.69 0.99 1.02 -1.26 -4.81 118.68 119.69 3pcg s LEU 372 Ca 0.00 0.42 -0.16 0.00 0.02 0.00 0.00 54.13 54.41 3pcg s LEU 372 Cb 0.00 -2.29 0.02 0.00 0.02 0.00 0.00 46.19 43.94 3pcg s LEU 372 CO 0.00 0.35 1.19 -2.16 0.02 0.00 0.00 176.35 175.75 3pcg s PRO 373 N -1.40 2.40 -0.04 1.29 0.04 -1.26 -4.81 135.00 131.22 3pcg s PRO 373 Ca 0.20 1.70 -0.19 0.00 0.04 0.00 0.00 61.00 62.75 3pcg s PRO 373 Cb -0.12 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 3pcg s PRO 373 CO 0.10 -1.62 0.53 0.42 0.04 0.00 0.00 177.00 176.46 3pcg s ILE 374 N -1.99 5.01 0.00 0.56 1.01 -1.26 -4.99 121.20 119.54 3pcg s ILE 374 Ca 0.73 1.08 0.00 0.00 0.00 0.00 0.00 60.65 62.47 3pcg s ILE 374 Cb -0.28 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.34 3pcg s ILE 374 CO 0.43 0.42 0.00 0.61 0.00 0.00 0.00 174.94 176.40 3pcg n GLY 375 N 2.58 1.57 3.62 6.18 0.00 -1.26 -4.45 105.19 113.42 3pcg n GLY 375 Ca -0.08 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.74 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 -1.47 3.82 -0.01 1.61 2.02 -1.26 -4.91 118.70 118.51 3pcg s GLU 376 Ca 0.00 1.18 -0.30 0.00 0.02 0.00 0.00 54.97 55.87 3pcg s GLU 376 Cb 0.00 -3.92 -0.04 0.00 0.10 0.00 0.00 34.13 30.27 3pcg s GLU 376 CO 0.00 -1.24 1.18 1.03 0.02 0.00 0.00 175.26 176.25 3pcg s ARG 377 N 4.38 4.40 0.06 1.61 0.52 -1.26 -0.84 118.95 127.81 3pcg s ARG 377 Ca 0.58 1.69 -0.09 0.00 -0.52 0.00 0.00 55.73 57.39 3pcg s ARG 377 Cb -0.16 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 31.84 3pcg s ARG 377 CO 0.26 -0.34 0.19 0.96 0.02 0.00 0.00 175.30 176.39 3pcg s ILE 378 N 1.67 0.12 -0.08 1.52 -4.36 0.28 -1.57 121.20 118.78 3pcg s ILE 378 Ca 0.57 -0.99 -0.00 0.00 -0.26 0.00 0.00 60.65 59.96 3pcg s ILE 378 Cb -0.26 -1.06 -0.03 0.00 1.25 0.00 0.00 42.46 42.35 3pcg s ILE 378 CO 0.25 -0.55 -0.05 -0.63 0.24 0.00 0.00 174.94 174.21 3pcg s ILE 379 N -3.02 3.90 -0.18 8.37 1.01 -0.18 0.40 121.20 131.49 3pcg s ILE 379 Ca -0.02 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.24 3pcg s ILE 379 Cb 0.01 -2.62 0.03 0.00 0.01 0.00 0.00 42.46 39.90 3pcg s ILE 379 CO -0.06 0.59 -0.14 -0.69 0.00 0.00 0.00 174.94 174.64 3pcg s VAL 380 N -0.72 1.77 0.19 2.92 1.01 -0.01 -0.97 120.40 124.59 3pcg s VAL 380 Ca 0.11 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3pcg s VAL 380 Cb -0.11 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 3pcg s VAL 380 CO 0.02 0.33 0.07 0.00 0.00 0.00 0.00 175.10 175.52 3pcg s ALA 381 N 1.37 1.25 0.00 5.51 0.00 -0.75 -0.88 121.76 128.26 3pcg s ALA 381 Ca 0.01 -1.65 0.00 0.00 0.00 0.00 0.00 51.96 50.32 3pcg s ALA 381 Cb -0.15 0.99 0.00 0.00 0.00 0.00 0.00 23.12 23.96 3pcg s ALA 381 CO -0.10 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.60 3pcg n GLY 382 N -0.26 -1.52 3.28 0.00 0.00 -0.98 -0.78 105.19 104.93 3pcg n GLY 382 Ca -0.02 -1.06 -0.25 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.29 1.28 -0.25 1.61 3.52 -1.26 -1.72 118.95 120.86 3pcg s ARG 383 Ca 0.00 -1.07 -0.07 0.00 -0.13 0.00 0.00 55.73 54.45 3pcg s ARG 383 Cb 0.00 -1.49 -0.03 0.00 -1.56 0.00 0.00 34.95 31.87 3pcg s ARG 383 CO 0.00 0.36 0.07 0.08 -0.81 0.00 0.00 175.30 175.01 3pcg s VAL 384 N -0.98 4.39 0.36 7.11 1.01 0.17 -1.02 120.40 131.45 3pcg s VAL 384 Ca 0.08 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 61.95 3pcg s VAL 384 Cb -0.09 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 3pcg s VAL 384 CO 0.03 0.34 0.06 0.68 0.00 0.00 0.00 175.10 176.22 3pcg s VAL 385 N 1.53 1.18 0.47 2.92 -7.23 0.07 -0.73 120.40 118.62 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 -0.15 -2.70 0.02 0.00 0.56 0.00 0.00 36.38 34.11 3pcg s VAL 385 CO 0.04 0.00 0.51 1.51 -0.31 0.00 0.00 175.10 176.85 3pcg s ASP 386 N -3.57 5.10 0.57 4.85 -4.77 0.78 -0.85 116.67 118.79 3pcg s ASP 386 Ca 0.32 -0.80 0.27 0.00 -3.30 0.00 0.00 52.55 49.03 3pcg s ASP 386 Cb 0.07 -0.22 1.66 0.00 -1.09 0.00 0.00 42.92 43.35 3pcg s ASP 386 CO 0.15 -0.91 2.19 1.56 0.70 0.00 0.00 175.17 178.87 3pcg h GLN 387 N 0.72 0.00 -0.00 2.11 4.20 -1.33 0.82 115.11 121.63 3pcg h GLN 387 Ca -0.38 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.33 3pcg h GLN 387 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 3pcg h GLN 387 CO 0.51 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 179.33 3pcg n TYR 388 N -4.00 0.00 -0.94 2.96 4.01 -1.26 -4.89 117.16 113.04 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 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 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 1.02 0.52 3.80 2.72 0.00 0.28 -5.05 105.19 108.48 3pcg n GLY 389 Ca 0.23 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.23 4.39 0.46 1.61 2.20 -1.25 -4.72 119.74 122.20 3pcg s LYS 390 Ca 0.00 0.98 -0.22 0.00 -0.36 0.00 0.00 55.97 56.37 3pcg s LYS 390 Cb 0.00 -3.11 -0.08 0.00 -1.51 0.00 0.00 37.83 33.14 3pcg s LYS 390 CO 0.00 0.51 1.13 -2.14 -0.36 0.00 0.00 175.35 174.49 3pcg s PRO 391 N -1.47 3.77 -0.67 4.03 0.02 -1.26 -0.15 135.00 139.27 3pcg s PRO 391 Ca 0.37 1.66 -0.05 0.00 0.02 0.00 0.00 61.00 63.01 3pcg s PRO 391 Cb -0.20 -2.33 0.17 0.00 0.02 0.00 0.00 34.50 32.16 3pcg s PRO 391 CO 0.23 -0.51 0.51 0.08 -0.33 0.00 0.00 177.00 176.98 3pcg s VAL 392 N -1.64 4.09 0.55 3.83 1.01 0.10 -4.84 120.40 123.49 3pcg s VAL 392 Ca 0.64 -2.90 -0.16 0.00 0.00 0.00 0.00 61.98 59.56 3pcg s VAL 392 Cb -0.25 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.44 3pcg s VAL 392 CO 0.31 -0.91 1.02 -2.16 0.00 0.00 0.00 175.10 173.35 3pcg s PRO 393 N -0.06 3.65 -1.42 2.72 0.04 -1.26 -4.24 135.00 134.42 3pcg s PRO 393 Ca 0.17 1.09 -0.02 0.00 0.04 0.00 0.00 61.00 62.28 3pcg s PRO 393 Cb -0.18 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.29 3pcg s PRO 393 CO -0.04 -0.53 0.53 0.09 0.04 0.00 0.00 177.00 177.09 3pcg n ASN 394 N -1.77 -0.95 -4.60 6.66 5.03 -0.33 -4.93 115.26 114.38 3pcg n ASN 394 Ca 0.08 -0.96 -0.29 0.00 0.87 0.00 0.00 54.58 54.27 3pcg n ASN 394 Cb 0.53 -3.25 -0.09 0.00 -1.02 0.00 0.00 39.78 35.95 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 -3.82 3.47 -0.16 3.41 -1.32 -1.26 -4.56 115.64 111.41 3pcg s THR 395 Ca 0.10 -1.29 -0.23 0.00 -1.21 0.00 0.00 61.69 59.06 3pcg s THR 395 Cb -0.05 -2.65 -0.02 0.00 -1.51 0.00 0.00 72.50 68.26 3pcg s THR 395 CO 0.88 0.07 0.72 -0.22 -2.21 0.00 0.00 174.62 173.85 3pcg s LEU 396 N -2.36 4.19 -0.18 9.08 2.96 -1.26 -0.55 118.68 130.56 3pcg s LEU 396 Ca 0.23 1.03 -0.00 0.00 -0.22 0.00 0.00 54.13 55.16 3pcg s LEU 396 Cb -0.11 -3.05 0.01 0.00 0.50 0.00 0.00 46.19 43.54 3pcg s LEU 396 CO 0.15 -0.28 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.05 3pcg s VAL 397 N 1.76 2.54 0.05 1.68 1.01 -0.27 -1.48 120.40 125.69 3pcg s VAL 397 Ca 0.34 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.61 3pcg s VAL 397 Cb -0.16 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 3pcg s VAL 397 CO 0.13 0.51 -0.24 -1.61 0.00 0.00 0.00 175.10 173.89 3pcg s GLU 398 N 1.17 1.59 0.05 2.72 2.02 0.62 -0.75 118.70 126.12 3pcg s GLU 398 Ca 0.01 -1.03 -0.05 0.00 0.02 0.00 0.00 54.97 53.93 3pcg s GLU 398 Cb -0.14 -1.74 -0.02 0.00 0.10 0.00 0.00 34.13 32.33 3pcg s GLU 398 CO -0.06 0.45 0.07 0.00 0.02 0.00 0.00 175.26 175.74 3pcg s MET 399 N -1.22 0.64 0.01 1.61 0.23 -0.34 0.08 119.30 120.31 3pcg s MET 399 Ca 0.10 -0.93 -0.15 0.00 -1.03 0.00 0.00 55.69 53.67 3pcg s MET 399 Cb -0.09 0.24 0.03 0.00 -1.53 0.00 0.00 34.83 33.47 3pcg s MET 399 CO 0.02 -0.16 0.33 1.67 -2.03 0.00 0.00 175.02 174.85 3pcg s TRP 400 N -3.22 -0.19 0.27 3.16 -2.14 -0.71 -1.54 118.94 114.58 3pcg s TRP 400 Ca 0.00 0.21 -0.20 0.00 2.66 0.00 0.00 56.10 58.78 3pcg s TRP 400 Cb 0.02 0.12 0.05 0.00 -3.10 0.00 0.00 33.47 30.56 3pcg s TRP 400 CO -0.07 -0.45 0.85 1.14 -2.66 0.00 0.00 176.95 175.76 3pcg s GLN 401 N -1.76 1.74 0.61 3.25 -2.07 -0.61 -0.78 119.66 120.04 3pcg s GLN 401 Ca -0.10 -1.05 0.00 0.00 -1.82 0.00 0.00 55.36 52.39 3pcg s GLN 401 Cb -0.03 0.53 0.12 0.00 -1.09 0.00 0.00 33.01 32.54 3pcg s GLN 401 CO 0.02 -0.81 0.84 0.00 -1.32 0.00 0.00 175.29 174.02 3pcg n ALA 402 N -0.53 0.23 -1.96 2.60 0.00 -1.26 -4.66 120.51 114.93 3pcg n ALA 402 Ca -0.06 -1.68 -0.27 0.00 0.00 0.00 0.00 53.44 51.43 3pcg n ALA 402 Cb 0.60 0.29 0.16 0.00 0.00 0.00 0.00 19.45 20.49 3pcg n ALA 402 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3pcg s ASN 403 N -4.44 3.56 0.65 0.00 2.20 -0.43 -4.54 114.94 111.95 3pcg s ASN 403 Ca 0.56 -0.00 0.35 0.00 -0.94 0.00 0.00 52.86 52.83 3pcg s ASN 403 Cb -0.03 -0.15 1.93 0.00 -2.00 0.00 0.00 41.25 40.99 3pcg s ASN 403 CO 0.37 -2.42 2.11 0.00 -2.94 0.00 0.00 177.10 174.23 3pcg h ALA 404 N -1.22 1.31 -0.03 3.54 0.00 -1.78 -1.24 119.26 119.83 3pcg h ALA 404 Ca -0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3pcg h ALA 404 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3pcg h ALA 404 CO 0.38 -0.22 -0.04 0.41 0.00 0.00 0.00 179.25 179.79 3pcg n GLY 405 N -1.20 0.82 1.00 0.00 0.00 -1.26 -3.26 105.19 101.29 3pcg n GLY 405 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 1.30 0.75 3.73 -0.02 0.00 -0.52 -4.79 105.19 105.65 3pcg n GLY 406 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.50 4.20 0.07 1.61 6.06 -1.26 -4.69 118.95 124.44 3pcg s ARG 407 Ca 0.00 -0.10 -0.07 0.00 -2.50 0.00 0.00 55.73 53.07 3pcg s ARG 407 Cb 0.00 -3.42 -0.05 0.00 0.06 0.00 0.00 34.95 31.54 3pcg s ARG 407 CO 0.00 0.29 0.34 0.71 -2.50 0.00 0.00 175.30 174.14 3pcg s TYR 408 N 0.36 3.55 -1.27 5.12 1.51 -1.26 -1.31 117.35 124.05 3pcg s TYR 408 Ca 0.11 0.62 -0.13 0.00 -1.01 0.00 0.00 57.07 56.66 3pcg s TYR 408 Cb -0.12 -2.04 0.14 0.00 -0.11 0.00 0.00 41.96 39.83 3pcg s TYR 408 CO 0.00 0.53 1.67 -2.13 -1.11 0.00 0.00 175.55 174.51 3pcg n ARG 409 N 0.70 3.36 -3.74 -0.62 0.63 -1.26 -4.77 116.66 110.96 3pcg n ARG 409 Ca -0.07 -3.56 -0.12 0.00 -0.92 0.00 0.00 57.85 53.18 3pcg n ARG 409 Cb 0.52 -3.11 -0.12 0.00 0.45 0.00 0.00 32.46 30.20 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 1.87 -0.40 0.22 -0.14 2.46 -1.26 -5.07 115.29 112.97 3pcg s HIS 410 Ca 0.44 0.92 -0.12 0.00 0.47 0.00 0.00 55.06 56.77 3pcg s HIS 410 Cb 0.03 0.13 0.27 0.00 -0.13 0.00 0.00 32.58 32.88 3pcg s HIS 410 CO 0.01 -0.23 1.63 0.87 -2.47 0.00 0.00 174.74 174.55 3pcg h LYS 411 N 6.52 0.01 0.00 2.88 1.57 -2.07 0.84 116.57 126.34 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 1.18 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3pcg h LYS 411 CO 0.33 0.01 0.00 0.09 -0.57 0.00 0.00 179.45 179.31 3pcg n ASN 412 N -5.43 0.17 -4.47 0.86 5.03 -1.26 -4.61 115.26 105.56 3pcg n ASN 412 Ca 0.09 0.56 -0.43 0.00 0.87 0.00 0.00 54.58 55.66 3pcg n ASN 412 Cb 0.35 -0.59 -0.06 0.00 -1.02 0.00 0.00 39.78 38.46 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 -3.32 6.25 -0.27 6.41 2.15 0.29 -4.89 116.67 123.29 3pcg s ASP 413 Ca 0.03 -0.71 0.11 0.00 0.43 0.00 0.00 52.55 52.41 3pcg s ASP 413 Cb 0.06 -2.30 0.55 0.00 -0.30 0.00 0.00 42.92 40.93 3pcg s ASP 413 CO 0.20 -0.86 1.51 0.54 -0.17 0.00 0.00 175.17 176.39 3pcg n ARG 414 N 6.23 2.37 -1.92 4.34 5.12 -1.26 -4.86 116.66 126.68 3pcg n ARG 414 Ca -0.05 -3.05 -0.38 0.00 -1.93 0.00 0.00 57.85 52.45 3pcg n ARG 414 Cb 0.46 -1.89 0.03 0.00 -1.16 0.00 0.00 32.46 29.91 3pcg n ARG 414 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3pcg s TYR 415 N -3.09 2.42 -0.50 -1.55 5.04 -1.26 -4.90 117.35 113.51 3pcg s TYR 415 Ca 0.46 1.43 0.24 0.00 -2.44 0.00 0.00 57.07 56.76 3pcg s TYR 415 Cb 0.39 -3.66 0.96 0.00 0.35 0.00 0.00 41.96 40.01 3pcg s TYR 415 CO 0.05 -2.50 1.73 1.47 -1.34 0.00 0.00 175.55 174.96 3pcg n LEU 416 N -1.01 0.73 -4.73 6.97 -0.00 -1.26 -4.71 117.00 112.99 3pcg n LEU 416 Ca 0.10 0.66 -0.42 0.00 -0.00 0.00 0.00 56.01 56.35 3pcg n LEU 416 Cb 0.46 -0.53 -0.03 0.00 -0.00 0.00 0.00 43.42 43.32 3pcg n LEU 416 CO 0.50 -0.51 1.02 0.00 -0.00 0.00 0.00 177.39 178.41 3pcg s ALA 417 N -3.29 3.56 0.70 1.47 0.00 -1.26 -4.97 121.76 117.97 3pcg s ALA 417 Ca 0.05 1.14 -0.13 0.00 0.00 0.00 0.00 51.96 53.02 3pcg s ALA 417 Cb 0.10 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.73 3pcg s ALA 417 CO 0.44 -0.58 1.10 -1.25 0.00 0.00 0.00 175.76 175.47 3pcg s PRO 418 N 0.22 2.61 0.63 0.00 0.04 -1.26 -4.75 135.00 132.49 3pcg s PRO 418 Ca 0.59 1.32 -0.16 0.00 0.04 0.00 0.00 61.00 62.80 3pcg s PRO 418 Cb -0.37 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 3pcg s PRO 418 CO 0.36 -1.39 1.09 -0.51 0.04 0.00 0.00 177.00 176.60 3pcg s LEU 419 N -5.22 3.46 -0.36 -3.56 1.43 -1.26 -4.81 118.68 108.36 3pcg s LEU 419 Ca 0.65 1.94 -0.09 0.00 -1.03 0.00 0.00 54.13 55.60 3pcg s LEU 419 Cb -0.19 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 41.51 3pcg s LEU 419 CO 0.46 -1.42 0.16 -0.62 0.23 0.00 0.00 176.35 175.16 3pcg s ASP 420 N -2.61 5.53 0.55 2.29 -1.08 -1.26 -4.99 116.67 115.10 3pcg s ASP 420 Ca 0.66 -1.05 0.34 0.00 -0.52 0.00 0.00 52.55 51.98 3pcg s ASP 420 Cb -0.19 -1.95 1.51 0.00 -1.46 0.00 0.00 42.92 40.83 3pcg s ASP 420 CO 0.39 -0.35 1.82 1.55 0.52 0.00 0.00 175.17 179.10 3pcg h PRO 421 N 8.33 0.00 -0.45 4.34 0.13 -1.97 -0.77 132.00 141.61 3pcg h PRO 421 Ca -0.25 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3pcg h PRO 421 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 3pcg h PRO 421 CO 0.64 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.50 3pcg n ASN 422 N -4.13 4.98 -3.82 1.44 4.13 -1.26 -4.95 115.26 111.65 3pcg n ASN 422 Ca 0.22 -2.98 -0.18 0.00 1.68 0.00 0.00 54.58 53.32 3pcg n ASN 422 Cb 1.12 -0.63 -0.16 0.00 -1.54 0.00 0.00 39.78 38.56 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 -2.81 0.35 -0.20 3.10 5.36 -0.30 -4.21 117.98 119.28 3pcg s PHE 423 Ca 0.50 -0.01 -0.16 0.00 -0.96 0.00 0.00 56.93 56.30 3pcg s PHE 423 Cb 0.39 -0.45 -0.09 0.00 -0.34 0.00 0.00 43.02 42.53 3pcg s PHE 423 CO 0.13 -0.15 -0.23 0.41 -1.46 0.00 0.00 175.22 173.93 3pcg n GLY 424 N 4.22 -0.66 0.34 13.12 0.00 -1.26 -4.69 105.19 116.26 3pcg n GLY 424 Ca -0.25 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 1.44 0.95 3.31 -0.02 0.00 -1.26 -4.52 105.19 105.09 3pcg n GLY 425 Ca -0.26 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.00 1.98 0.13 1.61 1.01 -1.26 -1.57 120.40 120.29 3pcg s VAL 426 Ca 0.00 -1.26 -0.15 0.00 0.00 0.00 0.00 61.98 60.57 3pcg s VAL 426 Cb 0.00 -1.68 0.03 0.00 0.00 0.00 0.00 36.38 34.72 3pcg s VAL 426 CO 0.00 0.37 0.37 -0.83 0.00 0.00 0.00 175.10 175.01 3pcg s GLY 427 N -1.07 -0.16 -0.04 4.51 0.00 -0.59 -4.75 107.32 105.22 3pcg s GLY 427 Ca 0.10 -0.21 -0.22 0.00 0.00 0.00 0.00 44.72 44.39 3pcg s GLY 427 CO 0.01 -0.42 0.48 1.09 0.00 0.00 0.00 173.10 174.27 3pcg s ARG 428 N -3.83 0.84 -0.24 2.90 1.70 -0.69 -1.19 118.95 118.44 3pcg s ARG 428 Ca 0.05 0.04 -0.23 0.00 -0.47 0.00 0.00 55.73 55.12 3pcg s ARG 428 Cb 0.02 0.39 0.06 0.00 -0.57 0.00 0.00 34.95 34.85 3pcg s ARG 428 CO -0.10 -0.25 0.65 0.00 -1.08 0.00 0.00 175.30 174.52 3pcg s LEU 430 N 0.31 4.04 0.74 0.00 2.96 -1.26 -1.12 118.68 124.35 3pcg s LEU 430 Ca -0.00 0.10 -0.15 0.00 -0.22 0.00 0.00 54.13 53.85 3pcg s LEU 430 Cb -0.04 -2.07 0.04 0.00 0.50 0.00 0.00 46.19 44.61 3pcg s LEU 430 CO 0.01 0.09 1.25 0.42 -1.32 0.00 0.00 176.35 176.80 3pcg s THR 431 N 0.92 2.02 0.11 3.68 -4.23 0.29 -4.82 115.64 113.60 3pcg s THR 431 Ca 0.07 0.01 -0.01 0.00 -1.18 0.00 0.00 61.69 60.58 3pcg s THR 431 Cb -0.13 -2.68 0.02 0.00 1.34 0.00 0.00 72.50 71.05 3pcg s THR 431 CO 0.03 -0.00 0.15 -0.90 -0.54 0.00 0.00 174.62 173.36 3pcg n ASP 432 N -2.67 0.10 -0.24 3.99 5.68 -0.46 -1.18 116.55 121.77 3pcg n ASP 432 Ca 0.15 -1.11 0.12 0.00 -0.50 0.00 0.00 54.79 53.45 3pcg n ASP 432 Cb 0.49 -0.11 0.41 0.00 -1.14 0.00 0.00 41.12 40.77 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 -0.15 0.59 -0.22 -1.12 0.02 -1.95 -0.44 113.55 110.29 3pcg h SER 433 Ca -0.05 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 3pcg h SER 433 Cb 0.16 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.61 3pcg h SER 433 CO 0.04 0.31 0.00 0.47 -1.14 0.00 0.00 176.83 176.51 3pcg n ASP 434 N -4.53 1.94 -0.09 3.07 8.00 -1.26 -4.56 116.55 119.12 3pcg n ASP 434 Ca 0.16 -1.78 -0.01 0.00 0.71 0.00 0.00 54.79 53.87 3pcg n ASP 434 Cb 0.46 -0.14 -0.01 0.00 -0.02 0.00 0.00 41.12 41.42 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 1.18 0.50 3.85 0.44 0.00 -0.18 -4.76 105.19 106.22 3pcg n GLY 435 Ca 0.16 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.02 3.59 0.08 1.61 2.02 -1.26 0.45 117.35 121.82 3pcg s TYR 436 Ca 0.00 1.02 0.00 0.00 -0.37 0.00 0.00 57.07 57.72 3pcg s TYR 436 Cb 0.00 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 39.18 3pcg s TYR 436 CO 0.00 0.43 -0.03 1.52 -1.57 0.00 0.00 175.55 175.90 3pcg s TYR 437 N -1.48 0.72 -0.21 2.71 1.13 -0.70 -1.35 117.35 118.17 3pcg s TYR 437 Ca 0.38 -1.04 -0.27 0.00 -1.41 0.00 0.00 57.07 54.73 3pcg s TYR 437 Cb -0.15 -0.46 0.10 0.00 -1.10 0.00 0.00 41.96 40.35 3pcg s TYR 437 CO 0.19 -0.32 0.85 -1.54 -2.51 0.00 0.00 175.55 172.23 3pcg s SER 438 N -2.99 -0.58 0.05 -0.18 1.04 -1.26 -2.32 113.70 107.47 3pcg s SER 438 Ca 0.12 0.95 0.04 0.00 0.48 0.00 0.00 55.95 57.53 3pcg s SER 438 Cb 0.07 0.91 -0.03 0.00 0.10 0.00 0.00 66.02 67.07 3pcg s SER 438 CO -0.06 -0.31 -0.11 -0.36 0.98 0.00 0.00 173.24 173.38 3pcg s PHE 439 N -0.23 0.95 -0.09 5.02 0.08 -0.05 -4.88 117.98 118.77 3pcg s PHE 439 Ca -0.02 -0.46 0.04 0.00 0.12 0.00 0.00 56.93 56.61 3pcg s PHE 439 Cb -0.03 -0.55 0.00 0.00 -0.57 0.00 0.00 43.02 41.87 3pcg s PHE 439 CO 0.01 -0.01 -0.21 0.50 -0.10 0.00 0.00 175.22 175.41 3pcg s ARG 440 N -1.58 2.72 0.00 0.44 3.52 -0.81 -0.83 118.95 122.41 3pcg s ARG 440 Ca -0.05 -0.77 0.00 0.00 -0.13 0.00 0.00 55.73 54.78 3pcg s ARG 440 Cb -0.10 -2.08 0.00 0.00 -1.56 0.00 0.00 34.95 31.21 3pcg s ARG 440 CO 0.01 0.15 0.00 -2.37 -0.81 0.00 0.00 175.30 172.28 3pcg n THR 441 N 3.58 0.00 -4.41 4.11 5.66 0.16 -0.33 114.28 123.05 3pcg n THR 441 Ca -0.20 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.51 3pcg n THR 441 Cb 0.53 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.18 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 -2.92 2.53 -0.04 1.09 -4.36 -1.26 -0.55 121.20 115.69 3pcg s ILE 442 Ca 0.00 -1.58 -0.30 0.00 -0.26 0.00 0.00 60.65 58.51 3pcg s ILE 442 Cb 0.00 -2.12 -0.04 0.00 1.25 0.00 0.00 42.46 41.54 3pcg s ILE 442 CO 0.00 0.13 1.35 -0.75 0.24 0.00 0.00 174.94 175.91 3pcg s LYS 443 N -1.98 4.29 0.77 0.37 2.20 -0.02 -4.92 119.74 120.45 3pcg s LYS 443 Ca 0.15 1.87 -0.12 0.00 -0.36 0.00 0.00 55.97 57.51 3pcg s LYS 443 Cb -0.10 -3.62 0.06 0.00 -1.51 0.00 0.00 37.83 32.66 3pcg s LYS 443 CO 0.07 -0.57 1.13 -1.25 -0.36 0.00 0.00 175.35 174.37 3pcg s PRO 444 N 2.58 2.05 0.24 4.03 0.04 -1.26 -4.33 135.00 138.35 3pcg s PRO 444 Ca 0.61 1.44 0.06 0.00 0.04 0.00 0.00 61.00 63.15 3pcg s PRO 444 Cb -0.29 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 3pcg s PRO 444 CO 0.24 -1.83 0.23 0.20 0.04 0.00 0.00 177.00 175.87 3pcg s GLY 445 N -2.75 1.41 0.94 0.56 0.00 -0.90 -4.74 107.32 101.83 3pcg s GLY 445 Ca 0.67 -1.34 -0.12 0.00 0.00 0.00 0.00 44.72 43.93 3pcg s GLY 445 CO 0.51 -1.37 1.09 2.56 0.00 0.00 0.00 173.10 175.89 3pcg s PRO 446 N -3.76 0.92 -0.04 2.90 0.04 -1.26 -3.83 135.00 129.97 3pcg s PRO 446 Ca 0.33 0.79 -0.20 0.00 0.04 0.00 0.00 61.00 61.96 3pcg s PRO 446 Cb -0.08 -1.77 0.04 0.00 0.04 0.00 0.00 34.50 32.72 3pcg s PRO 446 CO 0.26 -2.46 0.43 1.52 0.04 0.00 0.00 177.00 176.79 3pcg s TYR 447 N -2.90 -0.35 0.67 0.56 -0.85 -1.14 -4.06 117.35 109.28 3pcg s TYR 447 Ca 0.64 0.61 -0.11 0.00 -0.52 0.00 0.00 57.07 57.69 3pcg s TYR 447 Cb -0.19 0.20 -0.01 0.00 0.38 0.00 0.00 41.96 42.34 3pcg s TYR 447 CO 0.58 -0.44 1.05 -1.25 -1.52 0.00 0.00 175.55 173.96 3pcg s PRO 448 N -1.13 3.19 0.04 -3.49 0.04 -1.26 -1.02 135.00 131.36 3pcg s PRO 448 Ca -0.12 0.88 -0.24 0.00 0.04 0.00 0.00 61.00 61.57 3pcg s PRO 448 Cb -0.04 -2.02 0.06 0.00 0.04 0.00 0.00 34.50 32.54 3pcg s PRO 448 CO 0.06 -0.90 0.55 1.67 0.04 0.00 0.00 177.00 178.42 3pcg s TRP 449 N -3.09 -0.47 -1.08 0.56 1.48 -0.98 -4.86 118.94 110.49 3pcg s TRP 449 Ca 0.57 0.57 -0.19 0.00 -1.06 0.00 0.00 56.10 55.99 3pcg s TRP 449 Cb -0.13 0.37 0.09 0.00 -1.16 0.00 0.00 33.47 32.64 3pcg s TRP 449 CO 0.54 -0.65 1.42 1.03 -4.06 0.00 0.00 176.95 175.23 3pcg s ARG 450 N -2.32 3.75 0.00 3.25 0.52 -1.26 -4.29 118.95 118.60 3pcg s ARG 450 Ca -0.06 -1.68 0.00 0.00 -0.52 0.00 0.00 55.73 53.47 3pcg s ARG 450 Cb -0.01 -5.24 0.00 0.00 0.52 0.00 0.00 34.95 30.23 3pcg s ARG 450 CO -0.01 -2.04 0.00 -1.71 0.02 0.00 0.00 175.30 171.56 3pcg n ASN 451 N 7.70 0.00 -4.32 0.23 5.15 -1.26 -5.02 115.26 117.74 3pcg n ASN 451 Ca 0.34 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 54.04 3pcg n ASN 451 Cb 0.48 0.00 0.16 0.00 -0.53 0.00 0.00 39.78 39.89 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 -0.20 1.76 0.34 8.20 0.00 -1.26 -4.94 107.32 111.21 3pcg s GLY 452 Ca 0.00 -1.28 0.24 0.00 0.00 0.00 0.00 44.72 43.68 3pcg s GLY 452 CO 0.00 -0.58 1.73 -2.55 0.00 0.00 0.00 173.10 171.70 3pcg h PRO 453 N -1.34 0.00 -0.77 2.90 0.11 -1.98 -3.31 132.00 127.61 3pcg h PRO 453 Ca -0.43 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.36 3pcg h PRO 453 Cb 1.25 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 32.07 3pcg h PRO 453 CO 0.41 0.00 -0.84 -1.71 -0.21 0.00 0.00 178.00 175.65 3pcg n ASN 454 N -2.33 -0.23 -4.83 -2.05 5.15 -1.26 -5.10 115.26 104.61 3pcg n ASN 454 Ca -0.01 -2.86 -0.38 0.00 -0.60 0.00 0.00 54.58 50.73 3pcg n ASN 454 Cb 0.10 0.28 -0.06 0.00 -0.53 0.00 0.00 39.78 39.57 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 -2.15 6.80 -0.07 1.20 1.01 -1.25 -5.07 116.67 117.15 3pcg s ASP 455 Ca 0.28 0.95 0.00 0.00 0.71 0.00 0.00 52.55 54.49 3pcg s ASP 455 Cb 0.39 -2.25 0.02 0.00 1.01 0.00 0.00 42.92 42.09 3pcg s ASP 455 CO -0.04 0.30 -0.05 0.26 0.21 0.00 0.00 175.17 175.85 3pcg s TRP 456 N -0.93 0.95 0.24 4.23 0.52 -1.26 -2.33 118.94 120.35 3pcg s TRP 456 Ca 0.24 -0.33 -0.30 0.00 0.02 0.00 0.00 56.10 55.73 3pcg s TRP 456 Cb -0.17 -0.85 -0.09 0.00 -1.15 0.00 0.00 33.47 31.22 3pcg s TRP 456 CO 0.13 -0.29 1.10 1.03 0.02 0.00 0.00 176.95 178.94 3pcg s ARG 457 N 1.29 4.63 0.70 4.98 1.81 -0.19 -4.73 118.95 127.44 3pcg s ARG 457 Ca -0.05 1.77 -0.13 0.00 -1.72 0.00 0.00 55.73 55.60 3pcg s ARG 457 Cb -0.14 -3.23 0.02 0.00 -0.45 0.00 0.00 34.95 31.16 3pcg s ARG 457 CO -0.02 0.16 1.10 -2.14 -0.68 0.00 0.00 175.30 173.72 3pcg s PRO 458 N -0.99 2.61 0.25 3.54 0.02 -1.26 -2.89 135.00 136.29 3pcg s PRO 458 Ca 0.46 1.29 -0.31 0.00 0.02 0.00 0.00 61.00 62.46 3pcg s PRO 458 Cb -0.31 -1.93 -0.13 0.00 0.02 0.00 0.00 34.50 32.15 3pcg s PRO 458 CO 0.38 -1.39 1.54 0.00 -0.33 0.00 0.00 177.00 177.21 3pcg n ALA 459 N -2.85 1.96 -3.17 -1.55 0.00 -1.26 -4.78 120.51 108.86 3pcg n ALA 459 Ca 0.10 0.40 -0.10 0.00 0.00 0.00 0.00 53.44 53.84 3pcg n ALA 459 Cb 0.52 -2.39 -0.04 0.00 0.00 0.00 0.00 19.45 17.54 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 0.21 -0.11 -0.10 0.00 -3.43 -1.26 -3.97 115.29 106.63 3pcg s HIS 460 Ca 0.68 -0.23 0.03 0.00 -0.80 0.00 0.00 55.06 54.75 3pcg s HIS 460 Cb -0.57 0.32 0.01 0.00 -1.43 0.00 0.00 32.58 30.91 3pcg s HIS 460 CO 0.46 -0.84 -0.20 0.42 -2.00 0.00 0.00 174.74 172.58 3pcg s ILE 461 N -3.86 1.80 0.13 -5.38 1.01 -0.77 -4.64 121.20 109.49 3pcg s ILE 461 Ca 0.08 -0.85 -0.27 0.00 0.00 0.00 0.00 60.65 59.60 3pcg s ILE 461 Cb 0.00 -1.58 -0.07 0.00 0.01 0.00 0.00 42.46 40.82 3pcg s ILE 461 CO -0.05 0.50 0.85 -1.00 0.00 0.00 0.00 174.94 175.24 3pcg s HIS 462 N 0.57 3.85 0.01 3.97 3.76 0.04 -0.54 115.29 126.94 3pcg s HIS 462 Ca -0.15 1.69 0.05 0.00 -0.15 0.00 0.00 55.06 56.50 3pcg s HIS 462 Cb -0.17 -2.90 -0.02 0.00 1.11 0.00 0.00 32.58 30.61 3pcg s HIS 462 CO 0.05 0.35 -0.16 -0.06 -0.85 0.00 0.00 174.74 174.07 3pcg s PHE 463 N -0.54 1.41 -0.10 1.40 0.40 -0.54 -1.74 117.98 118.28 3pcg s PHE 463 Ca 0.40 -0.30 -0.00 0.00 -0.60 0.00 0.00 56.93 56.43 3pcg s PHE 463 Cb -0.23 -0.88 0.02 0.00 0.51 0.00 0.00 43.02 42.44 3pcg s PHE 463 CO 0.27 0.01 -0.07 0.20 0.70 0.00 0.00 175.22 176.33 3pcg s GLY 464 N -0.69 0.77 -0.07 4.36 0.00 0.11 -0.60 107.32 111.20 3pcg s GLY 464 Ca 0.05 -0.46 0.04 0.00 0.00 0.00 0.00 44.72 44.35 3pcg s GLY 464 CO 0.00 0.73 -0.18 -0.42 0.00 0.00 0.00 173.10 173.23 3pcg s ILE 465 N 1.56 1.59 -0.10 0.90 1.09 0.08 -0.28 121.20 126.04 3pcg s ILE 465 Ca 0.02 -0.76 -0.09 0.00 -1.10 0.00 0.00 60.65 58.71 3pcg s ILE 465 Cb -0.13 -1.39 -0.07 0.00 -1.06 0.00 0.00 42.46 39.81 3pcg s ILE 465 CO -0.06 0.45 0.28 0.77 -0.10 0.00 0.00 174.94 176.29 3pcg h SER 466 N 6.62 -0.06 -3.40 3.58 4.64 -1.55 -0.58 113.55 122.79 3pcg h SER 466 Ca -0.28 -0.22 0.04 0.00 -0.47 0.00 0.00 61.79 60.87 3pcg h SER 466 Cb 1.20 0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 3pcg h SER 466 CO 0.47 0.53 -0.06 0.61 -0.87 0.00 0.00 176.83 177.52 3pcg n GLY 467 N 1.51 -1.93 0.15 -0.77 0.00 -1.26 -2.65 105.19 100.24 3pcg n GLY 467 Ca -0.03 -1.35 0.13 0.00 0.00 0.00 0.00 46.02 44.76 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 -3.28 1.61 0.13 -1.93 -3.46 132.00 125.06 3pcg h PRO 468 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.12 3pcg h PRO 468 Cb 0.15 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.23 3pcg h PRO 468 CO 0.00 0.00 0.11 -1.54 -0.23 0.00 0.00 178.00 176.34 3pcg s SER 469 N -4.40 -0.04 0.59 1.44 1.04 -1.26 -3.22 113.70 107.85 3pcg s SER 469 Ca 0.04 -0.91 0.37 0.00 0.48 0.00 0.00 55.95 55.93 3pcg s SER 469 Cb 0.09 0.72 1.78 0.00 0.10 0.00 0.00 66.02 68.71 3pcg s SER 469 CO 0.40 -1.37 2.14 0.16 0.98 0.00 0.00 173.24 175.55 3pcg h ILE 470 N 2.08 0.08 -0.15 -1.02 3.07 -1.44 -1.67 117.51 118.47 3pcg h ILE 470 Ca -0.25 -0.33 -0.13 0.00 1.55 0.00 0.00 64.86 65.70 3pcg h ILE 470 Cb 1.25 1.30 -0.01 0.00 -0.27 0.00 0.00 36.82 39.09 3pcg h ILE 470 CO 0.32 0.02 -0.47 0.00 -1.05 0.00 0.00 178.15 176.96 3pcg h ALA 471 N 1.98 0.91 0.00 0.16 0.00 -1.77 -3.18 119.26 117.36 3pcg h ALA 471 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3pcg h ALA 471 Cb 0.30 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3pcg h ALA 471 CO 0.00 0.65 -0.59 1.79 0.00 0.00 0.00 179.25 181.11 3pcg h THR 472 N 0.30 0.00 -3.20 0.00 1.35 -1.55 -3.48 112.91 106.33 3pcg h THR 472 Ca 0.02 -0.53 -0.56 0.00 -0.55 0.00 0.00 66.41 64.79 3pcg h THR 472 Cb 0.95 1.14 0.10 0.00 -1.73 0.00 0.00 68.15 68.61 3pcg h THR 472 CO 0.08 0.00 0.64 1.17 -0.25 0.00 0.00 175.52 177.16 3pcg n LYS 473 N -2.17 2.28 -3.78 4.72 3.00 -1.08 -4.72 118.16 116.40 3pcg n LYS 473 Ca 0.03 0.80 -0.13 0.00 -0.00 0.00 0.00 58.31 59.02 3pcg n LYS 473 Cb 0.45 -2.46 -0.10 0.00 0.00 0.00 0.00 35.03 32.91 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 -0.73 0.93 -0.12 3.14 2.96 -0.23 -5.02 118.68 119.61 3pcg s LEU 474 Ca 0.60 0.37 0.02 0.00 -0.22 0.00 0.00 54.13 54.90 3pcg s LEU 474 Cb -0.57 1.06 -0.01 0.00 0.50 0.00 0.00 46.19 47.18 3pcg s LEU 474 CO 0.56 -0.23 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.55 3pcg s ILE 475 N -0.44 2.53 0.14 6.68 1.01 -1.26 -0.74 121.20 129.12 3pcg s ILE 475 Ca -0.05 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.77 3pcg s ILE 475 Cb -0.04 -2.02 -0.01 0.00 0.01 0.00 0.00 42.46 40.41 3pcg s ILE 475 CO 0.02 0.54 0.15 1.07 0.00 0.00 0.00 174.94 176.71 3pcg n THR 476 N 3.60 0.00 -4.33 2.92 5.66 0.23 -5.02 114.28 117.34 3pcg n THR 476 Ca -0.19 -0.88 -0.19 0.00 -3.05 0.00 0.00 64.05 59.74 3pcg n THR 476 Cb 0.53 0.47 -0.15 0.00 -1.55 0.00 0.00 70.33 69.62 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 -2.46 0.84 -0.05 1.09 -0.21 -1.26 -1.46 119.66 116.14 3pcg s GLN 477 Ca 0.14 -0.27 -0.04 0.00 0.02 0.00 0.00 55.36 55.21 3pcg s GLN 477 Cb 0.00 -0.80 -0.04 0.00 1.00 0.00 0.00 33.01 33.18 3pcg s GLN 477 CO 0.10 0.11 0.17 -1.17 -2.12 0.00 0.00 175.29 172.38 3pcg s LEU 478 N 0.16 4.38 0.25 2.90 0.20 0.30 -4.85 118.68 122.02 3pcg s LEU 478 Ca -0.02 0.40 0.07 0.00 0.69 0.00 0.00 54.13 55.26 3pcg s LEU 478 Cb -0.08 -2.40 -0.05 0.00 -0.43 0.00 0.00 46.19 43.23 3pcg s LEU 478 CO 0.00 0.32 -0.09 -0.31 -0.29 0.00 0.00 176.35 175.99 3pcg s TYR 479 N -1.21 1.82 -0.14 5.38 2.02 0.47 -1.85 117.35 123.84 3pcg s TYR 479 Ca 0.22 -0.67 -0.05 0.00 -0.37 0.00 0.00 57.07 56.21 3pcg s TYR 479 Cb -0.12 -0.97 -0.04 0.00 -0.40 0.00 0.00 41.96 40.43 3pcg s TYR 479 CO 0.13 0.28 0.03 -0.06 -1.57 0.00 0.00 175.55 174.36 3pcg s PHE 480 N -3.03 3.20 -0.15 2.71 0.40 -1.25 0.27 117.98 120.13 3pcg s PHE 480 Ca 0.27 0.07 -0.42 0.00 -0.60 0.00 0.00 56.93 56.25 3pcg s PHE 480 Cb 0.02 -1.95 -0.19 0.00 0.51 0.00 0.00 43.02 41.40 3pcg s PHE 480 CO 0.10 0.26 1.28 -1.91 0.70 0.00 0.00 175.22 175.64 3pcg n GLU 481 N 2.98 0.16 -0.91 0.44 2.13 -0.92 -1.57 120.64 122.95 3pcg n GLU 481 Ca -0.18 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.70 3pcg n GLU 481 Cb 0.53 -1.58 0.00 0.00 0.27 0.00 0.00 31.44 30.66 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 2.43 0.58 3.68 8.31 0.00 -1.26 -4.99 105.19 113.93 3pcg n GLY 482 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.45 6.60 0.59 1.61 -1.08 -0.61 -4.88 116.67 116.44 3pcg s ASP 483 Ca 0.00 2.43 0.36 0.00 -0.52 0.00 0.00 52.55 54.83 3pcg s ASP 483 Cb 0.00 -2.55 1.76 0.00 -1.46 0.00 0.00 42.92 40.67 3pcg s ASP 483 CO 0.00 -0.92 2.14 1.55 0.52 0.00 0.00 175.17 178.46 3pcg h PRO 484 N 9.05 0.00 0.00 4.34 0.13 -1.94 -2.67 132.00 140.90 3pcg h PRO 484 Ca -0.43 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.65 3pcg h PRO 484 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3pcg h PRO 484 CO 0.94 0.03 -0.27 -0.07 -0.23 0.00 0.00 178.00 178.39 3pcg h LEU 485 N 0.00 0.00 -0.50 1.56 3.38 -1.95 -3.35 115.31 114.45 3pcg h LEU 485 Ca -0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3pcg h LEU 485 Cb 0.30 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.95 3pcg h LEU 485 CO 0.00 0.27 -0.17 0.40 0.09 0.00 0.00 178.44 179.04 3pcg h ILE 486 N 0.00 0.43 0.00 1.22 2.04 -1.85 -2.48 117.51 116.87 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 0.79 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 3pcg h ILE 486 CO 0.04 0.00 0.00 -0.65 0.00 0.00 0.00 178.15 177.54 3pcg h PRO 487 N -0.05 0.00 0.00 2.37 0.11 -1.81 -3.07 132.00 129.55 3pcg h PRO 487 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 3pcg h PRO 487 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 3pcg h PRO 487 CO -0.54 0.00 -0.67 -1.33 -0.21 0.00 0.00 178.00 175.25 3pcg n MET 488 N -2.87 0.02 -2.78 1.05 2.81 -0.95 -4.94 117.12 109.45 3pcg n MET 488 Ca 0.00 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.48 3pcg n MET 488 Cb 0.24 -1.51 -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 6.94 0.53 -0.15 0.00 0.11 -1.91 -0.53 132.00 137.00 3pcg h PRO 490 Ca -0.37 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.50 3pcg h PRO 490 Cb 1.18 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 32.18 3pcg h PRO 490 CO 0.79 0.35 -0.73 0.82 -0.21 0.00 0.00 178.00 179.02 3pcg h ILE 491 N 0.55 1.29 -0.41 4.15 2.04 -1.92 -2.80 117.51 120.40 3pcg h ILE 491 Ca 0.15 -1.94 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 3pcg h ILE 491 Cb -0.04 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3pcg h ILE 491 CO -0.03 0.61 0.18 0.58 0.00 0.00 0.00 178.15 179.49 3pcg h VAL 492 N 0.47 1.19 0.00 1.67 2.07 -1.78 -2.38 116.25 117.49 3pcg h VAL 492 Ca -0.05 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3pcg h VAL 492 Cb 1.37 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3pcg h VAL 492 CO 0.15 0.21 0.00 0.29 0.02 0.00 0.00 177.57 178.24 3pcg n LYS 493 N -4.66 0.01 0.28 1.57 5.02 -0.24 -1.22 118.16 118.93 3pcg n LYS 493 Ca 0.00 0.36 0.14 0.00 -2.02 0.00 0.00 58.31 56.79 3pcg n LYS 493 Cb 0.13 -1.50 0.84 0.00 -0.02 0.00 0.00 35.03 34.48 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 -3.51 4.39 4.64 -1.15 -3.36 113.55 114.56 3pcg h SER 494 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 3pcg h SER 494 Cb 0.11 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.10 3pcg h SER 494 CO 0.00 0.05 0.49 -0.63 -0.87 0.00 0.00 176.83 175.87 3pcg s ILE 495 N -4.45 4.66 0.23 0.95 1.01 -0.35 -3.75 121.20 119.50 3pcg s ILE 495 Ca -0.04 1.03 -0.01 0.00 0.00 0.00 0.00 60.65 61.63 3pcg s ILE 495 Cb 0.14 -4.27 0.01 0.00 0.01 0.00 0.00 42.46 38.35 3pcg s ILE 495 CO 0.56 -0.49 1.62 0.00 0.00 0.00 0.00 174.94 176.63 3pcg h ALA 496 N 8.49 0.90 -2.60 9.38 0.00 -1.83 -3.43 119.26 130.16 3pcg h ALA 496 Ca -0.24 -0.42 -0.63 0.00 0.00 0.00 0.00 54.91 53.61 3pcg h ALA 496 Cb 1.09 -0.11 -0.15 0.00 0.00 0.00 0.00 17.79 18.62 3pcg h ALA 496 CO 0.95 0.63 -0.14 1.21 0.00 0.00 0.00 179.25 181.90 3pcg s ASN 497 N -6.84 6.30 0.54 0.00 3.04 -1.26 -4.96 114.94 111.77 3pcg s ASN 497 Ca -0.07 0.19 0.24 0.00 0.04 0.00 0.00 52.86 53.26 3pcg s ASN 497 Cb 0.13 -2.24 1.43 0.00 -1.54 0.00 0.00 41.25 39.02 3pcg s ASN 497 CO 0.82 -0.31 2.05 1.55 -3.04 0.00 0.00 177.10 178.17 3pcg h PRO 498 N 8.25 0.00 -0.07 0.43 0.13 -2.00 0.31 132.00 139.06 3pcg h PRO 498 Ca -0.30 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.72 3pcg h PRO 498 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 3pcg h PRO 498 CO 0.70 0.00 -0.47 0.93 -0.23 0.00 0.00 178.00 178.93 3pcg h GLU 499 N 0.00 0.16 -0.39 0.86 5.08 -1.98 -2.78 114.58 115.53 3pcg h GLU 499 Ca 0.15 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 3pcg h GLU 499 Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 3pcg h GLU 499 CO -0.00 0.60 -0.29 0.00 -1.00 0.00 0.00 179.01 178.32 3pcg h ALA 500 N 1.39 0.75 -0.57 3.43 0.00 -0.76 -3.06 119.26 120.43 3pcg h ALA 500 Ca 0.01 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.53 3pcg h ALA 500 Cb 0.88 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 3pcg h ALA 500 CO 0.07 0.66 0.36 0.28 0.00 0.00 0.00 179.25 180.62 3pcg h VAL 501 N 0.71 1.09 -0.55 0.00 2.07 -1.27 -2.20 116.25 116.10 3pcg h VAL 501 Ca 0.08 -0.25 0.10 0.00 0.82 0.00 0.00 66.70 67.46 3pcg h VAL 501 Cb 0.84 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3pcg h VAL 501 CO 0.07 0.13 0.37 1.56 0.02 0.00 0.00 177.57 179.73 3pcg h GLN 502 N 0.72 0.29 0.00 1.57 1.08 -1.39 -0.36 115.11 117.01 3pcg h GLN 502 Ca 0.22 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.41 3pcg h GLN 502 Cb -0.01 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.35 3pcg h GLN 502 CO -0.08 0.19 -0.01 1.96 -0.95 0.00 0.00 178.83 179.94 3pcg h GLN 503 N 0.30 0.00 -0.02 1.46 4.20 -1.43 -2.39 115.11 117.22 3pcg h GLN 503 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 3pcg h GLN 503 Cb 0.62 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.40 3pcg h GLN 503 CO -0.06 0.01 -0.07 1.28 -0.67 0.00 0.00 178.83 179.32 3pcg n LEU 504 N -3.15 2.17 -4.58 1.46 4.77 -0.15 -4.88 117.00 112.65 3pcg n LEU 504 Ca -0.02 -0.72 -0.40 0.00 -0.03 0.00 0.00 56.01 54.84 3pcg n LEU 504 Cb 0.17 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.16 3pcg n LEU 504 CO 0.24 0.37 0.06 -0.63 -1.33 0.00 0.00 177.39 176.09 3pcg s ILE 505 N -2.09 5.17 0.22 -0.08 1.01 -0.90 -0.39 121.20 124.13 3pcg s ILE 505 Ca 0.30 0.38 -0.30 0.00 0.00 0.00 0.00 60.65 61.03 3pcg s ILE 505 Cb 0.20 -3.75 -0.08 0.00 0.01 0.00 0.00 42.46 38.84 3pcg s ILE 505 CO 0.36 0.06 1.00 0.00 0.00 0.00 0.00 174.94 176.36 3pcg s ALA 506 N 2.07 3.35 0.11 9.38 0.00 0.14 -4.85 121.76 131.96 3pcg s ALA 506 Ca 0.14 0.71 -0.09 0.00 0.00 0.00 0.00 51.96 52.72 3pcg s ALA 506 Cb -0.16 -3.27 -0.06 0.00 0.00 0.00 0.00 23.12 19.63 3pcg s ALA 506 CO 0.11 0.03 0.41 0.15 0.00 0.00 0.00 175.76 176.46 3pcg s LYS 507 N -0.96 3.73 0.29 0.00 -0.14 -0.64 -2.17 119.74 119.86 3pcg s LYS 507 Ca 0.44 0.13 -0.30 0.00 -1.36 0.00 0.00 55.97 54.88 3pcg s LYS 507 Cb -0.27 -2.92 -0.11 0.00 -1.68 0.00 0.00 37.83 32.85 3pcg s LYS 507 CO 0.34 0.51 1.53 -1.17 -0.76 0.00 0.00 175.35 175.80 3pcg s LEU 508 N -2.20 4.36 -0.52 3.17 2.96 -1.26 -0.73 118.68 124.46 3pcg s LEU 508 Ca 0.37 2.88 0.04 0.00 -0.22 0.00 0.00 54.13 57.19 3pcg s LEU 508 Cb -0.13 -3.64 0.15 0.00 0.50 0.00 0.00 46.19 43.08 3pcg s LEU 508 CO 0.20 -0.84 0.34 -0.62 -1.32 0.00 0.00 176.35 174.11 3pcg s ASP 509 N 0.36 3.58 0.58 3.68 2.15 0.26 -4.82 116.67 122.46 3pcg s ASP 509 Ca 0.61 -3.13 0.27 0.00 0.43 0.00 0.00 52.55 50.73 3pcg s ASP 509 Cb -0.46 -1.13 1.65 0.00 -0.30 0.00 0.00 42.92 42.68 3pcg s ASP 509 CO 0.48 -0.19 2.15 0.24 -0.17 0.00 0.00 175.17 177.68 3pcg h MET 510 N 6.07 0.00 -0.17 4.34 2.86 -1.94 -2.26 114.93 123.83 3pcg h MET 510 Ca 0.09 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 3pcg h MET 510 Cb 0.87 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.51 3pcg h MET 510 CO 0.55 0.00 -0.33 -0.91 1.06 0.00 0.00 176.91 177.27 3pcg h ASN 511 N 0.00 0.36 -0.01 1.22 2.35 -1.94 -3.13 115.58 114.43 3pcg h ASN 511 Ca 0.06 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 3pcg h ASN 511 Cb 0.33 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.60 3pcg h ASN 511 CO -0.00 0.67 -0.10 -3.20 -1.65 0.00 0.00 177.43 173.15 3pcg n ASN 512 N -4.08 2.44 -4.84 5.81 5.15 -0.86 -4.98 115.26 113.90 3pcg n ASN 512 Ca -0.01 -1.76 -0.32 0.00 -0.60 0.00 0.00 54.58 51.89 3pcg n ASN 512 Cb 0.44 0.09 -0.02 0.00 -0.53 0.00 0.00 39.78 39.77 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 -2.11 3.01 -0.46 5.20 0.00 -1.18 -4.76 121.76 121.46 3pcg s ALA 513 Ca 0.28 0.15 -0.15 0.00 0.00 0.00 0.00 51.96 52.24 3pcg s ALA 513 Cb 0.20 -3.13 0.06 0.00 0.00 0.00 0.00 23.12 20.25 3pcg s ALA 513 CO 0.37 -0.45 0.37 -0.80 0.00 0.00 0.00 175.76 175.25 3pcg s ASN 514 N -3.29 6.11 0.23 0.00 0.01 -0.57 -5.01 114.94 112.41 3pcg s ASN 514 Ca 0.59 -1.27 -0.29 0.00 -0.71 0.00 0.00 52.86 51.18 3pcg s ASN 514 Cb -0.11 -2.17 -0.16 0.00 0.41 0.00 0.00 41.25 39.23 3pcg s ASN 514 CO 0.38 -0.61 0.87 -2.65 -1.51 0.00 0.00 177.10 173.58 3pcg n PRO 515 N 5.18 0.82 -1.89 -0.60 -0.02 -1.26 -0.79 135.00 136.43 3pcg n PRO 515 Ca -0.12 0.29 -0.20 0.00 -2.02 0.00 0.00 63.50 61.45 3pcg n PRO 515 Cb 0.44 -1.56 -0.06 0.00 -0.02 0.00 0.00 33.50 32.31 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 1.01 -1.56 0.00 -0.52 2.81 -1.26 -4.75 117.12 112.85 3pcg n MET 516 Ca 0.14 1.08 0.00 0.00 -1.81 0.00 0.00 57.70 57.11 3pcg n MET 516 Cb 0.28 -5.56 0.00 0.00 -0.71 0.00 0.00 33.22 27.23 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 -1.53 0.00 -3.78 7.83 -0.08 0.03 -5.16 116.55 113.86 3pcg n ASP 517 Ca -0.21 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 52.96 3pcg n ASP 517 Cb 0.66 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 44.05 3pcg n ASP 517 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3pcg n LEU 519 N 0.44 0.00 -3.79 0.00 4.77 -0.61 -1.51 117.00 116.30 3pcg n LEU 519 Ca -0.18 -1.74 -0.13 0.00 -0.03 0.00 0.00 56.01 53.93 3pcg n LEU 519 Cb 0.60 -0.72 -0.09 0.00 -2.33 0.00 0.00 43.42 40.88 3pcg n LEU 519 CO 0.21 -1.10 -0.04 0.00 -1.33 0.00 0.00 177.39 175.13 3pcg s ALA 520 N -3.44 -0.66 0.06 -1.18 0.00 -1.26 -1.01 121.76 114.27 3pcg s ALA 520 Ca 0.64 0.28 0.05 0.00 0.00 0.00 0.00 51.96 52.94 3pcg s ALA 520 Cb -0.03 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 3pcg s ALA 520 CO 0.44 -0.23 -0.15 0.71 0.00 0.00 0.00 175.76 176.53 3pcg s TYR 521 N -1.14 1.28 -0.14 0.00 1.51 -0.14 0.89 117.35 119.62 3pcg s TYR 521 Ca -0.12 -0.41 -0.01 0.00 -1.01 0.00 0.00 57.07 55.52 3pcg s TYR 521 Cb -0.05 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 41.04 3pcg s TYR 521 CO 0.03 0.06 -0.11 0.50 -1.11 0.00 0.00 175.55 174.92 3pcg s ARG 522 N -1.48 3.44 -0.24 -0.62 6.06 0.09 -1.82 118.95 124.39 3pcg s ARG 522 Ca 0.00 -0.65 -0.04 0.00 -2.50 0.00 0.00 55.73 52.54 3pcg s ARG 522 Cb -0.09 -2.70 0.09 0.00 0.06 0.00 0.00 34.95 32.30 3pcg s ARG 522 CO 0.02 0.21 0.12 0.12 -2.50 0.00 0.00 175.30 173.27 3pcg s PHE 523 N 0.39 0.23 0.12 5.12 5.36 0.04 -1.61 117.98 127.62 3pcg s PHE 523 Ca -0.09 -0.62 -0.11 0.00 -0.96 0.00 0.00 56.93 55.15 3pcg s PHE 523 Cb -0.15 -0.80 -0.06 0.00 -0.34 0.00 0.00 43.02 41.67 3pcg s PHE 523 CO 0.05 -0.71 0.47 -0.51 -1.46 0.00 0.00 175.22 173.05 3pcg s ASP 524 N 2.13 6.70 -0.06 6.13 1.01 -1.26 -4.01 116.67 127.30 3pcg s ASP 524 Ca 0.06 0.89 0.04 0.00 0.71 0.00 0.00 52.55 54.26 3pcg s ASP 524 Cb -0.16 -2.22 -0.00 0.00 1.01 0.00 0.00 42.92 41.55 3pcg s ASP 524 CO -0.26 0.12 -0.20 -0.63 0.21 0.00 0.00 175.17 174.41 3pcg s ILE 525 N -1.48 1.66 -0.19 0.77 1.01 -0.19 -4.94 121.20 117.85 3pcg s ILE 525 Ca 0.36 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 3pcg s ILE 525 Cb -0.14 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 40.90 3pcg s ILE 525 CO 0.19 0.47 -0.13 -0.69 0.00 0.00 0.00 174.94 174.78 3pcg s VAL 526 N 0.17 2.64 0.33 2.92 1.01 -1.26 -0.75 120.40 125.45 3pcg s VAL 526 Ca -0.09 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.19 3pcg s VAL 526 Cb -0.14 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.07 3pcg s VAL 526 CO 0.04 0.49 0.48 -0.76 0.00 0.00 0.00 175.10 175.35 3pcg s LEU 527 N 1.28 4.01 0.33 3.92 1.43 -0.03 -4.90 118.68 124.72 3pcg s LEU 527 Ca 0.04 -0.03 -0.28 0.00 -1.03 0.00 0.00 54.13 52.83 3pcg s LEU 527 Cb -0.14 -2.86 -0.13 0.00 0.03 0.00 0.00 46.19 43.09 3pcg s LEU 527 CO -0.07 -0.38 1.15 0.54 0.23 0.00 0.00 176.35 177.81 3pcg n ARG 528 N -1.66 1.73 -2.02 1.70 1.74 -1.26 -1.14 116.66 115.76 3pcg n ARG 528 Ca -0.02 0.61 -0.42 0.00 -0.77 0.00 0.00 57.85 57.25 3pcg n ARG 528 Cb 0.58 -2.10 -0.03 0.00 -1.02 0.00 0.00 32.46 29.89 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 -0.45 2.15 -0.15 -0.13 0.00 -1.26 -4.35 107.32 103.13 3pcg s GLY 529 Ca 0.57 1.31 -0.04 0.00 0.00 0.00 0.00 44.72 46.57 3pcg s GLY 529 CO 0.61 2.35 -0.01 1.62 0.00 0.00 0.00 173.10 177.66 3pcg s GLN 530 N 0.04 3.65 0.08 2.90 0.74 -1.26 -0.95 119.66 124.85 3pcg s GLN 530 Ca 0.62 -0.47 -0.02 0.00 0.05 0.00 0.00 55.36 55.54 3pcg s GLN 530 Cb -0.42 -2.96 -0.03 0.00 1.10 0.00 0.00 33.01 30.70 3pcg s GLN 530 CO 0.40 0.31 0.03 -0.98 -0.55 0.00 0.00 175.29 174.49 3pcg s ARG 531 N 0.19 0.73 0.56 1.67 1.70 -0.37 -4.96 118.95 118.47 3pcg s ARG 531 Ca -0.00 -1.24 -0.14 0.00 -0.47 0.00 0.00 55.73 53.88 3pcg s ARG 531 Cb -0.13 0.24 -0.06 0.00 -0.57 0.00 0.00 34.95 34.42 3pcg s ARG 531 CO 0.02 -0.17 1.00 -1.59 -1.08 0.00 0.00 175.30 173.48 3pcg s LYS 532 N -3.94 3.80 0.58 3.89 -2.85 -1.26 -0.56 119.74 119.40 3pcg s LYS 532 Ca 0.11 0.86 -0.17 0.00 -1.00 0.00 0.00 55.97 55.76 3pcg s LYS 532 Cb 0.07 -2.12 -0.04 0.00 -2.06 0.00 0.00 37.83 33.69 3pcg s LYS 532 CO -0.07 -0.39 1.10 0.95 0.10 0.00 0.00 175.35 177.03 3pcg s THR 533 N -2.85 3.40 -0.10 3.79 -4.23 -1.24 -4.71 115.64 109.69 3pcg s THR 533 Ca 0.57 0.75 -0.16 0.00 -1.18 0.00 0.00 61.69 61.68 3pcg s THR 533 Cb -0.10 -3.27 0.04 0.00 1.34 0.00 0.00 72.50 70.51 3pcg s THR 533 CO 0.41 -0.30 0.39 -1.38 -0.54 0.00 0.00 174.62 173.20 3pcg s HIS 534 N -2.12 -0.37 -1.35 3.99 -3.43 -1.26 -4.94 115.29 105.82 3pcg s HIS 534 Ca 0.68 0.80 -0.17 0.00 -0.80 0.00 0.00 55.06 55.57 3pcg s HIS 534 Cb -0.20 0.15 0.17 0.00 -1.43 0.00 0.00 32.58 31.27 3pcg s HIS 534 CO 0.33 -0.31 0.43 1.19 -2.00 0.00 0.00 174.74 174.38 3pcg n PHE 535 N 2.15 -1.41 1.99 0.38 3.72 -1.26 -5.24 117.46 117.79 3pcg n PHE 535 Ca -0.17 0.49 0.16 0.00 -0.05 0.00 0.00 57.45 57.89 3pcg n PHE 535 Cb 0.57 -1.63 0.94 0.00 -0.94 0.00 0.00 39.48 38.42 3pcg n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10