#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 3.03 0.11 0.55 0.00 -1.26 -5.08 121.76 119.11 3pcg s ALA 302 Ca 0.00 0.46 0.11 0.00 0.00 0.00 0.00 51.96 52.53 3pcg s ALA 302 Cb 0.00 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 3pcg s ALA 302 CO 0.00 0.04 -0.27 -0.65 0.00 0.00 0.00 175.76 174.89 3pcg s GLN 303 N -3.04 1.51 -1.32 0.00 -0.21 -1.26 -5.07 119.66 110.27 3pcg s GLN 303 Ca 0.61 -1.29 -0.13 0.00 0.02 0.00 0.00 55.36 54.58 3pcg s GLN 303 Cb -0.12 -1.92 0.12 0.00 1.00 0.00 0.00 33.01 32.08 3pcg s GLN 303 CO 0.16 0.47 1.84 -3.47 -2.12 0.00 0.00 175.29 172.17 3pcg n ASP 304 N 1.13 4.78 -0.00 5.90 2.03 -1.26 -4.64 116.55 124.48 3pcg n ASP 304 Ca -0.18 -2.97 0.06 0.00 0.52 0.00 0.00 54.79 52.22 3pcg n ASP 304 Cb 0.53 -1.60 -0.08 0.00 -0.72 0.00 0.00 41.12 39.24 3pcg n ASP 304 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3pcg n ASN 305 N 5.75 1.28 -4.60 1.67 0.23 -1.26 -5.01 115.26 113.32 3pcg n ASN 305 Ca 0.44 -0.43 -0.25 0.00 -0.53 0.00 0.00 54.58 53.82 3pcg n ASN 305 Cb 0.40 1.27 -0.09 0.00 -2.08 0.00 0.00 39.78 39.28 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 -2.76 4.07 0.09 0.53 0.01 -1.26 -3.14 113.70 111.25 3pcg s SER 306 Ca 0.00 -1.01 0.05 0.00 1.31 0.00 0.00 55.95 56.30 3pcg s SER 306 Cb 0.09 -0.50 -0.03 0.00 0.21 0.00 0.00 66.02 65.78 3pcg s SER 306 CO 0.51 -0.19 -0.12 -0.13 0.41 0.00 0.00 173.24 173.72 3pcg s ARG 307 N -3.68 0.87 -0.06 12.44 1.81 0.49 -4.83 118.95 126.00 3pcg s ARG 307 Ca 0.34 -1.10 0.06 0.00 -1.72 0.00 0.00 55.73 53.30 3pcg s ARG 307 Cb -0.00 -0.71 -0.01 0.00 -0.45 0.00 0.00 34.95 33.78 3pcg s ARG 307 CO 0.18 0.13 -0.23 -0.06 -0.68 0.00 0.00 175.30 174.65 3pcg s PHE 308 N -1.96 2.27 0.31 -0.53 0.08 -1.26 -1.49 117.98 115.39 3pcg s PHE 308 Ca 0.03 -0.68 -0.29 0.00 0.12 0.00 0.00 56.93 56.12 3pcg s PHE 308 Cb -0.06 -1.50 -0.13 0.00 -0.57 0.00 0.00 43.02 40.77 3pcg s PHE 308 CO 0.02 -0.21 1.26 0.28 -0.10 0.00 0.00 175.22 176.47 3pcg n VAL 309 N 3.01 1.80 -1.89 -0.44 0.31 -0.62 -4.88 118.33 115.63 3pcg n VAL 309 Ca -0.18 -0.45 -0.41 0.00 -0.01 0.00 0.00 64.34 63.29 3pcg n VAL 309 Cb 0.52 -1.45 -0.01 0.00 -0.91 0.00 0.00 33.84 31.99 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 -0.89 2.30 0.45 2.52 -1.09 -1.26 -4.70 121.20 118.53 3pcg s ILE 310 Ca 0.58 0.27 -0.24 0.00 -2.23 0.00 0.00 60.65 59.03 3pcg s ILE 310 Cb -0.61 -3.17 -0.07 0.00 -1.58 0.00 0.00 42.46 37.02 3pcg s ILE 310 CO 0.60 0.05 1.28 -0.13 -1.23 0.00 0.00 174.94 175.51 3pcg s ARG 311 N -1.13 3.72 -0.60 2.79 0.52 -1.26 -4.96 118.95 118.02 3pcg s ARG 311 Ca 0.57 2.08 -0.18 0.00 -0.52 0.00 0.00 55.73 57.68 3pcg s ARG 311 Cb -0.45 -2.55 0.12 0.00 0.52 0.00 0.00 34.95 32.59 3pcg s ARG 311 CO 0.52 -0.67 0.67 0.34 0.02 0.00 0.00 175.30 176.18 3pcg s ASP 312 N -0.95 6.22 0.00 0.23 -1.08 -1.26 -4.91 116.67 114.93 3pcg s ASP 312 Ca 0.62 -1.59 0.22 0.00 -0.52 0.00 0.00 52.55 51.28 3pcg s ASP 312 Cb -0.36 -2.28 1.11 0.00 -1.46 0.00 0.00 42.92 39.93 3pcg s ASP 312 CO 0.45 -1.04 1.71 0.54 0.52 0.00 0.00 175.17 177.35 3pcg n ARG 313 N 6.00 0.32 0.00 4.34 1.74 -1.26 -2.24 116.66 125.56 3pcg n ARG 313 Ca -0.09 0.08 0.11 0.00 -0.77 0.00 0.00 57.85 57.18 3pcg n ARG 313 Cb 0.42 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.43 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 -1.28 0.73 -0.09 0.55 3.02 -1.26 -4.21 115.26 112.72 3pcg n ASN 314 Ca 0.11 -0.58 -0.17 0.00 -0.03 0.00 0.00 54.58 53.90 3pcg n ASN 314 Cb 0.17 0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 39.88 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 -4.19 3.10 2.91 -1.87 -3.44 115.95 112.46 3pcg h TRP 315 Ca 0.00 0.00 -0.51 0.00 1.13 0.00 0.00 58.89 59.51 3pcg h TRP 315 Cb 0.52 0.00 0.16 0.00 -0.51 0.00 0.00 29.16 29.33 3pcg h TRP 315 CO 0.00 1.15 0.25 -1.01 -1.03 0.00 0.00 178.44 177.81 3pcg s HIS 316 N -2.28 2.12 0.55 2.65 3.76 -1.09 -4.67 115.29 116.33 3pcg s HIS 316 Ca -0.24 1.57 -0.20 0.00 -0.15 0.00 0.00 55.06 56.04 3pcg s HIS 316 Cb 0.03 -3.17 -0.05 0.00 1.11 0.00 0.00 32.58 30.50 3pcg s HIS 316 CO 0.55 -2.39 1.20 -1.25 -0.85 0.00 0.00 174.74 172.01 3pcg s PRO 317 N -4.79 3.24 0.83 8.40 0.04 -1.26 -4.77 135.00 136.68 3pcg s PRO 317 Ca 0.64 1.83 -0.12 0.00 0.04 0.00 0.00 61.00 63.39 3pcg s PRO 317 Cb -0.20 -2.09 0.09 0.00 0.04 0.00 0.00 34.50 32.34 3pcg s PRO 317 CO 0.57 -0.99 1.13 0.15 0.04 0.00 0.00 177.00 177.90 3pcg s LYS 318 N -3.12 1.81 -0.01 4.56 -0.14 -1.23 -5.00 119.74 116.61 3pcg s LYS 318 Ca 0.73 0.38 -0.25 0.00 -1.36 0.00 0.00 55.97 55.47 3pcg s LYS 318 Cb -0.30 -1.91 -0.19 0.00 -1.68 0.00 0.00 37.83 33.75 3pcg s LYS 318 CO 0.34 -1.75 1.31 0.00 -0.76 0.00 0.00 175.35 174.49 3pcg h ALA 319 N -1.18 0.02 -2.20 5.17 0.00 -1.95 -3.41 119.26 115.72 3pcg h ALA 319 Ca -0.48 -0.23 -0.66 0.00 0.00 0.00 0.00 54.91 53.54 3pcg h ALA 319 Cb 1.30 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.93 3pcg h ALA 319 CO 0.62 -0.24 0.08 -1.17 0.00 0.00 0.00 179.25 178.54 3pcg s LEU 320 N -9.29 4.58 -0.39 0.00 2.96 -1.26 -4.76 118.68 110.52 3pcg s LEU 320 Ca -0.16 -0.43 0.03 0.00 -0.22 0.00 0.00 54.13 53.35 3pcg s LEU 320 Cb 0.02 -2.66 0.16 0.00 0.50 0.00 0.00 46.19 44.21 3pcg s LEU 320 CO 0.68 -0.77 0.30 0.42 -1.32 0.00 0.00 176.35 175.66 3pcg s THR 321 N 2.73 0.25 0.57 3.68 -4.23 -1.26 -5.03 115.64 112.34 3pcg s THR 321 Ca 0.21 -2.30 0.34 0.00 -1.18 0.00 0.00 61.69 58.76 3pcg s THR 321 Cb -0.15 -1.19 0.49 0.00 1.34 0.00 0.00 72.50 73.00 3pcg s THR 321 CO 0.18 -1.14 1.68 -0.65 -0.54 0.00 0.00 174.62 174.14 3pcg h PRO 322 N 6.11 0.00 0.00 3.99 0.11 -1.94 0.13 132.00 140.40 3pcg h PRO 322 Ca 0.20 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 3pcg h PRO 322 Cb 0.93 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3pcg h PRO 322 CO 0.33 0.00 -0.24 -0.44 -0.21 0.00 0.00 178.00 177.44 3pcg h ASP 323 N 0.00 0.00 -3.38 -2.05 3.32 -1.96 -3.23 116.42 109.12 3pcg h ASP 323 Ca 0.50 0.00 -0.76 0.00 0.02 0.00 0.00 57.03 56.80 3pcg h ASP 323 Cb 2.34 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 41.66 3pcg h ASP 323 CO -0.01 0.24 0.31 -0.47 -1.72 0.00 0.00 179.24 177.59 3pcg s TYR 324 N -4.04 3.55 0.28 4.55 5.04 0.46 -4.84 117.35 122.36 3pcg s TYR 324 Ca -0.02 -1.78 -0.00 0.00 -2.44 0.00 0.00 57.07 52.83 3pcg s TYR 324 Cb 0.13 -3.96 0.66 0.00 0.35 0.00 0.00 41.96 39.14 3pcg s TYR 324 CO 0.65 -1.14 1.62 0.87 -1.34 0.00 0.00 175.55 176.20 3pcg h LYS 325 N 8.14 0.11 0.00 4.97 1.57 -1.76 -0.56 116.57 129.04 3pcg h LYS 325 Ca 0.11 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 3pcg h LYS 325 Cb 1.04 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 3pcg h LYS 325 CO 0.87 0.08 -0.12 1.15 -0.57 0.00 0.00 179.45 180.85 3pcg h THR 326 N 0.12 0.52 0.00 -0.16 2.02 -1.91 -1.96 112.91 111.54 3pcg h THR 326 Ca 0.53 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 3pcg h THR 326 Cb 1.06 1.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.85 3pcg h THR 326 CO -0.74 0.12 -0.14 0.77 0.37 0.00 0.00 175.52 175.90 3pcg h SER 327 N 0.00 0.00 0.28 4.18 4.64 -1.38 -3.07 113.55 118.20 3pcg h SER 327 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3pcg h SER 327 Cb 0.37 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.42 3pcg h SER 327 CO 0.02 0.14 -0.51 0.40 -0.87 0.00 0.00 176.83 176.00 3pcg h ILE 328 N 0.00 0.00 0.00 0.95 2.04 -1.49 -2.31 117.51 116.69 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 0.39 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 3pcg h ILE 328 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.17 3pcg n ALA 329 N -2.87 2.27 -1.36 1.87 0.00 -1.24 -3.93 120.51 115.25 3pcg n ALA 329 Ca -0.10 -0.06 -0.08 0.00 0.00 0.00 0.00 53.44 53.21 3pcg n ALA 329 Cb 0.43 -1.46 0.20 0.00 0.00 0.00 0.00 19.45 18.62 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 -1.90 2.08 -5.00 0.00 1.74 -0.96 -4.95 116.66 107.67 3pcg n ARG 330 Ca 0.06 -3.12 -0.29 0.00 -0.77 0.00 0.00 57.85 53.73 3pcg n ARG 330 Cb 0.38 -1.92 -0.17 0.00 -1.02 0.00 0.00 32.46 29.74 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 -2.16 2.58 0.54 0.55 1.04 -0.91 -4.96 113.70 110.38 3pcg s SER 331 Ca 0.48 -0.45 -0.21 0.00 0.48 0.00 0.00 55.95 56.25 3pcg s SER 331 Cb 0.42 -1.00 -0.05 0.00 0.10 0.00 0.00 66.02 65.49 3pcg s SER 331 CO 0.03 0.14 1.28 -2.16 0.98 0.00 0.00 173.24 173.52 3pcg s PRO 332 N 0.26 3.21 -0.00 4.02 0.04 -1.26 -4.94 135.00 136.32 3pcg s PRO 332 Ca -0.12 2.04 0.22 0.00 0.04 0.00 0.00 61.00 63.18 3pcg s PRO 332 Cb -0.15 -2.20 -0.29 0.00 0.04 0.00 0.00 34.50 31.90 3pcg s PRO 332 CO 0.05 -1.08 0.57 0.54 0.04 0.00 0.00 177.00 177.13 3pcg n ARG 333 N -1.07 0.62 -3.45 4.56 5.12 -1.26 -4.93 116.66 116.26 3pcg n ARG 333 Ca 0.11 -0.15 -0.32 0.00 -1.93 0.00 0.00 57.85 55.55 3pcg n ARG 333 Cb 0.47 -1.56 -0.05 0.00 -1.16 0.00 0.00 32.46 30.16 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 -3.48 3.79 0.69 5.56 -1.52 -1.26 -5.05 119.66 118.39 3pcg s GLN 334 Ca -0.06 0.24 -0.16 0.00 -1.95 0.00 0.00 55.36 53.42 3pcg s GLN 334 Cb 0.14 -2.69 0.02 0.00 -0.22 0.00 0.00 33.01 30.25 3pcg s GLN 334 CO 0.89 0.35 1.20 0.00 -0.25 0.00 0.00 175.29 177.48 3pcg s ALA 335 N -1.77 2.25 0.43 6.09 0.00 -1.26 -4.98 121.76 122.52 3pcg s ALA 335 Ca 0.46 0.88 -0.24 0.00 0.00 0.00 0.00 51.96 53.06 3pcg s ALA 335 Cb -0.12 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.47 3pcg s ALA 335 CO 0.21 -1.66 1.11 -0.51 0.00 0.00 0.00 175.76 174.92 3pcg s LEU 336 N -4.88 4.09 -0.25 0.00 1.43 -1.26 -5.02 118.68 112.79 3pcg s LEU 336 Ca 0.74 2.19 -0.18 0.00 -1.03 0.00 0.00 54.13 55.85 3pcg s LEU 336 Cb -0.29 -4.20 -0.03 0.00 0.03 0.00 0.00 46.19 41.71 3pcg s LEU 336 CO 0.42 -0.70 0.53 -0.69 0.23 0.00 0.00 176.35 176.13 3pcg s VAL 337 N -1.58 5.07 0.23 -1.59 1.01 -1.26 -5.06 120.40 117.22 3pcg s VAL 337 Ca 0.60 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 63.21 3pcg s VAL 337 Cb -0.26 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.19 3pcg s VAL 337 CO 0.32 0.10 0.92 -0.44 0.00 0.00 0.00 175.10 176.00 3pcg s SER 338 N 1.45 7.60 0.01 3.32 0.01 -1.26 -5.06 113.70 119.77 3pcg s SER 338 Ca 0.22 1.90 0.03 0.00 1.31 0.00 0.00 55.95 59.42 3pcg s SER 338 Cb -0.16 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.47 3pcg s SER 338 CO 0.09 0.16 -0.10 0.27 0.41 0.00 0.00 173.24 174.07 3pcg s ILE 339 N -1.19 0.77 0.76 1.44 -4.36 -1.26 -5.14 121.20 112.22 3pcg s ILE 339 Ca 0.41 -0.60 -0.15 0.00 -0.26 0.00 0.00 60.65 60.04 3pcg s ILE 339 Cb -0.25 -0.68 0.05 0.00 1.25 0.00 0.00 42.46 42.83 3pcg s ILE 339 CO 0.31 0.08 1.24 -2.65 0.24 0.00 0.00 174.94 174.16 3pcg n PRO 340 N 2.47 0.47 -2.62 0.37 -0.02 -1.26 -4.96 135.00 129.45 3pcg n PRO 340 Ca -0.16 0.23 -0.41 0.00 -2.02 0.00 0.00 63.50 61.15 3pcg n PRO 340 Cb 0.56 -2.47 -0.05 0.00 -0.02 0.00 0.00 33.50 31.52 3pcg n PRO 340 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3pcg s GLN 341 N -3.89 4.68 0.40 -0.52 -0.21 -1.26 -5.01 119.66 113.85 3pcg s GLN 341 Ca 0.76 1.60 0.05 0.00 0.02 0.00 0.00 55.36 57.80 3pcg s GLN 341 Cb -0.32 -3.30 -0.02 0.00 1.00 0.00 0.00 33.01 30.37 3pcg s GLN 341 CO 0.47 0.22 0.18 -1.54 -2.12 0.00 0.00 175.29 172.50 3pcg s SER 342 N -0.38 2.59 0.56 5.90 1.04 -1.26 -5.01 113.70 117.14 3pcg s SER 342 Ca 0.46 -1.73 0.25 0.00 0.48 0.00 0.00 55.95 55.41 3pcg s SER 342 Cb -0.27 0.58 1.60 0.00 0.10 0.00 0.00 66.02 68.03 3pcg s SER 342 CO 0.33 -1.00 2.20 -0.29 0.98 0.00 0.00 173.24 175.46 3pcg h ILE 343 N 1.83 0.70 -0.81 -1.02 2.10 -1.96 -0.80 117.51 117.56 3pcg h ILE 343 Ca -0.32 -0.07 -0.02 0.00 1.08 0.00 0.00 64.86 65.54 3pcg h ILE 343 Cb 1.27 1.04 -0.04 0.00 -1.09 0.00 0.00 36.82 38.00 3pcg h ILE 343 CO 0.50 0.02 0.43 0.28 -1.08 0.00 0.00 178.15 178.29 3pcg h SER 344 N 0.00 1.02 0.55 2.19 0.02 -1.96 -3.04 113.55 112.34 3pcg h SER 344 Ca -0.00 -0.11 -0.09 0.00 -0.84 0.00 0.00 61.79 60.75 3pcg h SER 344 Cb 0.04 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 3pcg h SER 344 CO 0.00 0.84 -1.53 -0.62 -1.14 0.00 0.00 176.83 174.38 3pcg n GLU 345 N -4.39 0.63 -0.02 3.45 4.71 -0.58 -4.34 120.64 120.09 3pcg n GLU 345 Ca 0.08 0.07 0.13 0.00 -0.01 0.00 0.00 57.16 57.42 3pcg n GLU 345 Cb 0.11 -1.72 0.37 0.00 -1.01 0.00 0.00 31.44 29.19 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 -2.65 0.05 -4.37 2.62 -2.24 -0.41 -2.94 114.28 104.34 3pcg n THR 346 Ca -0.08 -0.36 -0.28 0.00 -2.27 0.00 0.00 64.05 61.06 3pcg n THR 346 Cb 0.71 0.81 -0.07 0.00 -2.10 0.00 0.00 70.33 69.68 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 -1.95 1.81 -0.09 4.28 -4.23 -1.15 -4.69 115.64 109.62 3pcg s THR 347 Ca 0.34 -1.81 -0.32 0.00 -1.18 0.00 0.00 61.69 58.73 3pcg s THR 347 Cb 0.20 -2.61 0.13 0.00 1.34 0.00 0.00 72.50 71.56 3pcg s THR 347 CO 0.32 0.00 1.41 -0.83 -0.54 0.00 0.00 174.62 174.98 3pcg s GLY 348 N -3.92 -0.39 0.43 3.99 0.00 -1.23 -1.41 107.32 104.78 3pcg s GLY 348 Ca 0.29 0.66 -0.24 0.00 0.00 0.00 0.00 44.72 45.43 3pcg s GLY 348 CO 0.16 2.62 1.16 2.56 0.00 0.00 0.00 173.10 179.60 3pcg s PRO 349 N -2.03 3.89 -0.21 2.90 0.04 -1.26 -4.84 135.00 133.50 3pcg s PRO 349 Ca 0.21 1.78 -0.02 0.00 0.04 0.00 0.00 61.00 63.01 3pcg s PRO 349 Cb 0.05 -2.51 0.00 0.00 0.04 0.00 0.00 34.50 32.08 3pcg s PRO 349 CO -0.05 -0.44 -0.10 1.21 0.04 0.00 0.00 177.00 177.65 3pcg s ASN 350 N -1.29 3.87 -0.17 6.66 3.84 -1.26 -4.87 114.94 121.71 3pcg s ASN 350 Ca 0.61 -0.50 0.14 0.00 0.21 0.00 0.00 52.86 53.31 3pcg s ASN 350 Cb -0.29 -1.64 0.70 0.00 -0.55 0.00 0.00 41.25 39.47 3pcg s ASN 350 CO 0.36 -0.02 1.58 0.49 -2.79 0.00 0.00 177.10 176.72 3pcg n PHE 351 N 4.73 1.68 -0.16 0.43 3.72 -1.26 -4.58 117.46 122.02 3pcg n PHE 351 Ca -0.19 -0.61 0.17 0.00 -0.05 0.00 0.00 57.45 56.78 3pcg n PHE 351 Cb 0.50 -0.39 0.54 0.00 -0.94 0.00 0.00 39.48 39.20 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 3.59 0.32 -0.60 4.37 0.02 -1.96 -1.52 113.55 117.77 3pcg h SER 352 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3pcg h SER 352 Cb 1.65 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 64.15 3pcg h SER 352 CO 0.36 0.16 0.00 1.41 -1.14 0.00 0.00 176.83 177.62 3pcg n HIS 353 N -4.46 0.99 -2.50 3.45 8.25 -1.26 -4.92 115.22 114.77 3pcg n HIS 353 Ca 0.15 -0.45 -0.38 0.00 -0.26 0.00 0.00 57.72 56.78 3pcg n HIS 353 Cb 0.60 -0.08 -0.04 0.00 1.12 0.00 0.00 29.99 31.59 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 -1.22 4.31 -0.66 2.41 2.96 -0.58 -4.96 118.68 120.94 3pcg s LEU 354 Ca 0.42 2.15 -0.20 0.00 -0.22 0.00 0.00 54.13 56.28 3pcg s LEU 354 Cb 0.24 -3.95 0.10 0.00 0.50 0.00 0.00 46.19 43.07 3pcg s LEU 354 CO 0.26 -0.37 0.85 -0.83 -1.32 0.00 0.00 176.35 174.94 3pcg s GLY 355 N -1.27 1.66 0.13 7.98 0.00 -1.26 -5.02 107.32 109.55 3pcg s GLY 355 Ca 0.52 -2.18 -0.25 0.00 0.00 0.00 0.00 44.72 42.82 3pcg s GLY 355 CO 0.34 1.80 0.76 -1.36 0.00 0.00 0.00 173.10 174.64 3pcg s PHE 356 N 3.13 3.86 0.76 1.90 0.08 -1.26 -5.06 117.98 121.39 3pcg s PHE 356 Ca 0.18 1.57 -0.11 0.00 0.12 0.00 0.00 56.93 58.69 3pcg s PHE 356 Cb -0.19 -2.76 0.05 0.00 -0.57 0.00 0.00 43.02 39.55 3pcg s PHE 356 CO 0.05 0.46 1.08 0.20 -0.10 0.00 0.00 175.22 176.91 3pcg s GLY 357 N -0.87 1.65 0.52 4.36 0.00 -1.26 -4.96 107.32 106.76 3pcg s GLY 357 Ca 0.36 0.02 0.18 0.00 0.00 0.00 0.00 44.72 45.28 3pcg s GLY 357 CO 0.25 0.39 2.13 0.00 0.00 0.00 0.00 173.10 175.87 3pcg h ALA 358 N -0.98 1.83 -0.12 3.20 0.00 -2.03 -2.86 119.26 118.30 3pcg h ALA 358 Ca -0.45 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 3pcg h ALA 358 Cb 1.24 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 3pcg h ALA 358 CO 0.56 0.05 -0.16 0.72 0.00 0.00 0.00 179.25 180.43 3pcg n HIS 359 N -4.35 0.39 -0.30 0.00 8.25 -1.26 -4.75 115.22 113.20 3pcg n HIS 359 Ca -0.03 -1.24 0.17 0.00 -0.26 0.00 0.00 57.72 56.36 3pcg n HIS 359 Cb 0.13 -0.28 0.43 0.00 1.12 0.00 0.00 29.99 31.39 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 0.79 0.57 -0.49 0.41 5.19 -1.79 -0.26 116.42 120.84 3pcg h ASP 360 Ca 0.05 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.52 3pcg h ASP 360 Cb 1.21 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.69 3pcg h ASP 360 CO 0.12 0.20 0.00 0.00 -3.12 0.00 0.00 179.24 176.44 3pcg n HIS 361 N -4.62 0.64 -3.91 4.55 1.44 -1.17 -2.30 115.22 109.85 3pcg n HIS 361 Ca 0.22 -0.33 -0.33 0.00 -2.01 0.00 0.00 57.72 55.27 3pcg n HIS 361 Cb 0.67 -0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.64 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 -1.33 4.94 0.12 4.39 -1.08 -0.11 -2.21 116.67 121.39 3pcg s ASP 362 Ca 0.42 -2.19 0.17 0.00 -0.52 0.00 0.00 52.55 50.42 3pcg s ASP 362 Cb 0.23 -1.71 0.73 0.00 -1.46 0.00 0.00 42.92 40.71 3pcg s ASP 362 CO 0.32 -0.43 1.53 0.18 0.52 0.00 0.00 175.17 177.28 3pcg n LEU 363 N 4.28 0.28 0.12 -1.34 4.32 0.15 -1.07 117.00 123.73 3pcg n LEU 363 Ca 0.02 0.58 -0.01 0.00 -0.02 0.00 0.00 56.01 56.58 3pcg n LEU 363 Cb 0.41 -0.55 0.01 0.00 -1.62 0.00 0.00 43.42 41.67 3pcg n LEU 363 CO 0.27 -0.43 0.38 -0.07 -1.22 0.00 0.00 177.39 176.32 3pcg h LEU 364 N 0.00 0.00 0.00 2.23 4.07 -1.91 -3.38 115.31 116.32 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 0.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.99 3pcg h LEU 364 CO 0.00 0.67 -0.64 0.18 -1.08 0.00 0.00 178.44 177.57 3pcg n LEU 365 N -3.33 0.03 -0.04 1.67 4.77 -1.00 -4.56 117.00 114.54 3pcg n LEU 365 Ca 0.01 -0.22 0.13 0.00 -0.03 0.00 0.00 56.01 55.90 3pcg n LEU 365 Cb 0.78 0.00 0.73 0.00 -2.33 0.00 0.00 43.42 42.60 3pcg n LEU 365 CO 0.42 0.01 0.97 -0.46 -1.33 0.00 0.00 177.39 177.00 3pcg n ASN 366 N -1.33 0.14 0.00 -1.43 0.23 -0.23 -5.03 115.26 107.60 3pcg n ASN 366 Ca -0.00 -1.24 -0.01 0.00 -0.53 0.00 0.00 54.58 52.80 3pcg n ASN 366 Cb 0.03 -0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.72 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 -0.80 0.00 0.00 -2.53 7.35 -1.26 -4.96 117.46 115.26 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 0.11 -0.08 0.00 0.00 0.35 0.00 0.00 39.48 39.86 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 2.88 0.00 3.87 7.13 0.00 -1.26 -4.67 105.19 113.14 3pcg n GLY 371 Ca -0.02 0.00 -0.32 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 4.13 0.72 0.99 1.02 -1.26 -4.78 118.68 119.49 3pcg s LEU 372 Ca 0.00 0.99 -0.11 0.00 0.02 0.00 0.00 54.13 55.03 3pcg s LEU 372 Cb 0.00 -3.77 0.02 0.00 0.02 0.00 0.00 46.19 42.47 3pcg s LEU 372 CO 0.00 -0.12 1.07 -2.84 0.02 0.00 0.00 176.35 174.48 3pcg s PRO 373 N -2.93 2.73 -0.08 1.29 0.02 -1.26 -4.78 135.00 129.99 3pcg s PRO 373 Ca 0.49 0.81 -0.11 0.00 0.02 0.00 0.00 61.00 62.21 3pcg s PRO 373 Cb -0.11 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.39 3pcg s PRO 373 CO 0.21 -1.21 0.27 0.42 -0.33 0.00 0.00 177.00 176.36 3pcg s ILE 374 N -3.11 5.28 0.00 2.83 1.01 -1.26 -5.01 121.20 120.94 3pcg s ILE 374 Ca 0.59 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.75 3pcg s ILE 374 Cb -0.14 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.77 3pcg s ILE 374 CO 0.54 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.65 3pcg n GLY 375 N 2.22 3.35 3.63 6.18 0.00 -1.26 -4.44 105.19 114.87 3pcg n GLY 375 Ca -0.16 -1.65 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 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 3.77 0.06 1.61 2.02 -1.26 -4.89 118.70 117.85 3pcg s GLU 376 Ca 0.00 1.70 -0.31 0.00 0.02 0.00 0.00 54.97 56.39 3pcg s GLU 376 Cb 0.00 -4.06 -0.06 0.00 0.10 0.00 0.00 34.13 30.11 3pcg s GLU 376 CO 0.00 -1.33 1.27 1.03 0.02 0.00 0.00 175.26 176.25 3pcg s ARG 377 N 4.75 4.38 0.06 1.61 0.52 -1.26 -1.16 118.95 127.84 3pcg s ARG 377 Ca 0.73 1.86 -0.07 0.00 -0.52 0.00 0.00 55.73 57.73 3pcg s ARG 377 Cb -0.26 -3.36 -0.01 0.00 0.52 0.00 0.00 34.95 31.84 3pcg s ARG 377 CO 0.30 -0.35 0.13 0.96 0.02 0.00 0.00 175.30 176.36 3pcg s ILE 378 N 1.32 0.14 -0.13 1.52 -4.36 -0.05 -2.28 121.20 117.36 3pcg s ILE 378 Ca 0.61 -1.16 -0.03 0.00 -0.26 0.00 0.00 60.65 59.80 3pcg s ILE 378 Cb -0.31 -1.11 -0.03 0.00 1.25 0.00 0.00 42.46 42.25 3pcg s ILE 378 CO 0.29 -0.64 -0.02 -0.63 0.24 0.00 0.00 174.94 174.18 3pcg s ILE 379 N -3.15 4.11 -0.20 8.37 1.01 -0.13 -0.12 121.20 131.08 3pcg s ILE 379 Ca -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 60.65 60.33 3pcg s ILE 379 Cb 0.02 -2.77 0.00 0.00 0.01 0.00 0.00 42.46 39.72 3pcg s ILE 379 CO -0.07 0.53 -0.10 -0.69 0.00 0.00 0.00 174.94 174.61 3pcg s VAL 380 N -0.14 2.92 0.11 2.92 1.01 0.38 -1.30 120.40 126.31 3pcg s VAL 380 Ca 0.04 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 3pcg s VAL 380 Cb -0.13 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 3pcg s VAL 380 CO 0.02 0.47 0.07 0.00 0.00 0.00 0.00 175.10 175.66 3pcg s ALA 381 N 1.34 0.60 0.00 5.51 0.00 -0.60 -0.67 121.76 127.94 3pcg s ALA 381 Ca 0.04 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.72 3pcg s ALA 381 Cb -0.14 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.67 3pcg s ALA 381 CO -0.06 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.63 3pcg n GLY 382 N -0.05 -1.28 3.27 0.00 0.00 -0.86 -0.23 105.19 106.03 3pcg n GLY 382 Ca -0.09 -0.95 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.73 1.19 -0.28 1.61 3.52 -1.26 -1.32 118.95 121.69 3pcg s ARG 383 Ca 0.00 -1.07 -0.06 0.00 -0.13 0.00 0.00 55.73 54.47 3pcg s ARG 383 Cb 0.00 -1.39 0.01 0.00 -1.56 0.00 0.00 34.95 32.01 3pcg s ARG 383 CO 0.00 0.33 0.05 0.08 -0.81 0.00 0.00 175.30 174.95 3pcg s VAL 384 N -1.04 3.78 0.37 7.11 1.01 -0.19 -0.47 120.40 130.97 3pcg s VAL 384 Ca 0.06 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.41 3pcg s VAL 384 Cb -0.10 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 3pcg s VAL 384 CO 0.03 0.16 0.11 0.68 0.00 0.00 0.00 175.10 176.08 3pcg s VAL 385 N 1.48 0.72 0.50 2.92 -7.23 -0.48 -0.81 120.40 117.50 3pcg s VAL 385 Ca 0.03 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.27 3pcg s VAL 385 Cb -0.17 -2.50 0.02 0.00 0.56 0.00 0.00 36.38 34.30 3pcg s VAL 385 CO 0.01 0.00 0.44 1.51 -0.31 0.00 0.00 175.10 176.75 3pcg s ASP 386 N -3.53 4.82 0.52 4.85 1.47 0.00 -0.83 116.67 123.97 3pcg s ASP 386 Ca 0.29 -1.03 0.27 0.00 1.18 0.00 0.00 52.55 53.26 3pcg s ASP 386 Cb 0.05 0.04 1.40 0.00 -0.34 0.00 0.00 42.92 44.07 3pcg s ASP 386 CO 0.15 -0.97 1.95 1.56 0.68 0.00 0.00 175.17 178.54 3pcg h GLN 387 N 0.80 0.03 0.00 2.11 4.20 -1.44 0.31 115.11 121.11 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 1.29 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.06 3pcg h GLN 387 CO 0.56 0.02 0.00 0.66 -0.67 0.00 0.00 178.83 179.40 3pcg n TYR 388 N -4.35 0.40 -0.30 2.96 4.01 -1.26 -4.90 117.16 113.72 3pcg n TYR 388 Ca 0.14 0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.99 3pcg n TYR 388 Cb 0.74 -0.69 0.00 0.00 -0.31 0.00 0.00 39.34 39.08 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 1.33 0.84 3.74 2.72 0.00 0.11 -5.06 105.19 108.86 3pcg n GLY 389 Ca 0.06 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.66 4.43 0.60 1.61 2.20 -1.25 -4.76 119.74 121.91 3pcg s LYS 390 Ca 0.00 0.92 -0.19 0.00 -0.36 0.00 0.00 55.97 56.34 3pcg s LYS 390 Cb 0.00 -3.39 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 3pcg s LYS 390 CO 0.00 0.22 1.21 -1.25 -0.36 0.00 0.00 175.35 175.17 3pcg s PRO 391 N 0.24 2.93 -0.58 4.03 0.04 -1.26 -0.82 135.00 139.57 3pcg s PRO 391 Ca 0.36 1.83 -0.02 0.00 0.04 0.00 0.00 61.00 63.21 3pcg s PRO 391 Cb -0.19 -1.92 0.15 0.00 0.04 0.00 0.00 34.50 32.58 3pcg s PRO 391 CO 0.20 -1.24 0.39 0.08 0.04 0.00 0.00 177.00 176.47 3pcg s VAL 392 N -1.60 3.59 0.60 -0.36 1.01 0.01 -4.82 120.40 118.82 3pcg s VAL 392 Ca 0.78 -2.83 -0.13 0.00 0.00 0.00 0.00 61.98 59.80 3pcg s VAL 392 Cb -0.31 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 3pcg s VAL 392 CO 0.34 -0.84 1.02 -2.16 0.00 0.00 0.00 175.10 173.45 3pcg s PRO 393 N 0.13 3.65 -1.66 2.72 0.04 -1.26 -4.22 135.00 134.40 3pcg s PRO 393 Ca 0.15 0.83 -0.15 0.00 0.04 0.00 0.00 61.00 61.87 3pcg s PRO 393 Cb -0.21 -2.09 0.13 0.00 0.04 0.00 0.00 34.50 32.37 3pcg s PRO 393 CO -0.03 -0.53 0.70 0.09 0.04 0.00 0.00 177.00 177.27 3pcg n ASN 394 N -2.44 -2.66 -4.74 6.66 5.03 -0.80 -4.93 115.26 111.39 3pcg n ASN 394 Ca 0.06 -1.03 -0.31 0.00 0.87 0.00 0.00 54.58 54.18 3pcg n ASN 394 Cb 0.54 -2.73 -0.07 0.00 -1.02 0.00 0.00 39.78 36.50 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 -3.43 4.32 -0.21 3.41 -1.32 -1.26 -4.54 115.64 112.61 3pcg s THR 395 Ca 0.60 -0.83 -0.24 0.00 -1.21 0.00 0.00 61.69 60.01 3pcg s THR 395 Cb -0.33 -3.06 -0.01 0.00 -1.51 0.00 0.00 72.50 67.59 3pcg s THR 395 CO 0.93 0.14 0.80 -0.22 -2.21 0.00 0.00 174.62 174.07 3pcg s LEU 396 N -2.29 4.12 -0.22 9.08 2.96 -1.26 -0.73 118.68 130.34 3pcg s LEU 396 Ca 0.27 1.05 -0.00 0.00 -0.22 0.00 0.00 54.13 55.23 3pcg s LEU 396 Cb -0.12 -3.17 0.02 0.00 0.50 0.00 0.00 46.19 43.43 3pcg s LEU 396 CO 0.20 -0.45 -0.12 -0.69 -1.32 0.00 0.00 176.35 173.97 3pcg s VAL 397 N 2.50 2.52 0.06 1.68 1.01 -0.36 -1.06 120.40 126.76 3pcg s VAL 397 Ca 0.35 -1.01 0.09 0.00 0.00 0.00 0.00 61.98 61.41 3pcg s VAL 397 Cb -0.16 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 3pcg s VAL 397 CO 0.09 0.33 -0.23 -1.61 0.00 0.00 0.00 175.10 173.68 3pcg s GLU 398 N 1.30 1.83 0.03 2.72 2.02 0.12 -0.73 118.70 125.99 3pcg s GLU 398 Ca 0.02 -1.11 -0.08 0.00 0.02 0.00 0.00 54.97 53.82 3pcg s GLU 398 Cb -0.15 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.03 3pcg s GLU 398 CO -0.08 0.51 0.17 0.00 0.02 0.00 0.00 175.26 175.88 3pcg s MET 399 N -1.49 0.63 -0.03 1.61 0.23 -0.38 -0.28 119.30 119.60 3pcg s MET 399 Ca 0.13 -0.60 -0.20 0.00 -1.03 0.00 0.00 55.69 53.99 3pcg s MET 399 Cb -0.10 0.26 0.04 0.00 -1.53 0.00 0.00 34.83 33.50 3pcg s MET 399 CO 0.04 -0.17 0.43 1.67 -2.03 0.00 0.00 175.02 174.97 3pcg s TRP 400 N -2.32 -0.34 0.20 3.16 -2.14 -0.75 -1.74 118.94 115.01 3pcg s TRP 400 Ca -0.07 0.57 -0.23 0.00 2.66 0.00 0.00 56.10 59.02 3pcg s TRP 400 Cb -0.02 0.20 0.05 0.00 -3.10 0.00 0.00 33.47 30.60 3pcg s TRP 400 CO -0.03 -0.46 0.88 1.14 -2.66 0.00 0.00 176.95 175.82 3pcg s GLN 401 N -1.26 1.41 0.84 3.25 -2.07 -0.81 -0.01 119.66 121.01 3pcg s GLN 401 Ca -0.13 -0.78 -0.10 0.00 -1.82 0.00 0.00 55.36 52.53 3pcg s GLN 401 Cb -0.03 0.48 0.14 0.00 -1.09 0.00 0.00 33.01 32.51 3pcg s GLN 401 CO 0.06 -0.65 1.17 0.00 -1.32 0.00 0.00 175.29 174.56 3pcg s ALA 402 N -3.47 2.79 0.63 2.60 0.00 -1.26 -4.63 121.76 118.42 3pcg s ALA 402 Ca 0.12 -1.21 -0.01 0.00 0.00 0.00 0.00 51.96 50.86 3pcg s ALA 402 Cb -0.03 -2.59 0.04 0.00 0.00 0.00 0.00 23.12 20.55 3pcg s ALA 402 CO 0.04 -1.92 0.28 0.27 0.00 0.00 0.00 175.76 174.43 3pcg n ASN 403 N -3.34 0.25 0.16 0.00 0.23 0.50 -4.53 115.26 108.53 3pcg n ASN 403 Ca 0.13 -1.24 0.18 0.00 -0.53 0.00 0.00 54.58 53.12 3pcg n ASN 403 Cb 0.60 -0.19 0.79 0.00 -2.08 0.00 0.00 39.78 38.90 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 -0.92 1.95 -0.43 -2.53 0.00 -1.78 -0.85 119.26 114.69 3pcg h ALA 404 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3pcg h ALA 404 Cb 0.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3pcg h ALA 404 CO 0.09 -0.38 0.00 0.41 0.00 0.00 0.00 179.25 179.36 3pcg n GLY 405 N -1.45 1.84 1.37 0.00 0.00 -1.26 -3.45 105.19 102.23 3pcg n GLY 405 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 1.48 0.59 3.74 -0.02 0.00 -0.40 -4.81 105.19 105.78 3pcg n GLY 406 Ca 0.20 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.11 4.19 0.09 1.61 6.06 -1.26 -4.75 118.95 123.77 3pcg s ARG 407 Ca 0.00 0.05 -0.02 0.00 -2.50 0.00 0.00 55.73 53.25 3pcg s ARG 407 Cb 0.00 -3.40 -0.05 0.00 0.06 0.00 0.00 34.95 31.56 3pcg s ARG 407 CO 0.00 0.30 0.28 0.71 -2.50 0.00 0.00 175.30 174.08 3pcg s TYR 408 N 0.31 3.51 -1.17 5.12 2.02 -1.26 -0.37 117.35 125.51 3pcg s TYR 408 Ca 0.15 0.40 -0.09 0.00 -0.37 0.00 0.00 57.07 57.16 3pcg s TYR 408 Cb -0.13 -1.87 0.24 0.00 -0.40 0.00 0.00 41.96 39.79 3pcg s TYR 408 CO 0.03 0.53 1.46 -2.13 -1.57 0.00 0.00 175.55 173.87 3pcg n ARG 409 N 0.28 3.77 -3.73 -0.62 0.63 -1.26 -4.76 116.66 110.96 3pcg n ARG 409 Ca -0.04 -4.13 -0.12 0.00 -0.92 0.00 0.00 57.85 52.63 3pcg n ARG 409 Cb 0.51 -2.74 -0.12 0.00 0.45 0.00 0.00 32.46 30.57 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 -0.62 -0.43 0.29 -0.14 2.46 -1.26 -5.06 115.29 110.53 3pcg s HIS 410 Ca 0.36 0.98 -0.00 0.00 0.47 0.00 0.00 55.06 56.86 3pcg s HIS 410 Cb -0.00 0.14 0.68 0.00 -0.13 0.00 0.00 32.58 33.27 3pcg s HIS 410 CO 0.01 -0.25 1.59 0.87 -2.47 0.00 0.00 174.74 174.49 3pcg h LYS 411 N 6.67 0.05 0.00 2.88 1.57 -2.07 -0.10 116.57 125.58 3pcg h LYS 411 Ca -0.35 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 3pcg h LYS 411 Cb 1.18 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3pcg h LYS 411 CO 0.33 0.03 0.00 0.09 -0.57 0.00 0.00 179.45 179.33 3pcg n ASN 412 N -5.43 0.00 -4.48 0.86 5.03 -1.26 -4.66 115.26 105.32 3pcg n ASN 412 Ca 0.21 0.04 -0.43 0.00 0.87 0.00 0.00 54.58 55.27 3pcg n ASN 412 Cb 0.69 -0.28 -0.08 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 -2.56 6.23 0.00 6.41 2.15 -0.05 -4.87 116.67 123.97 3pcg s ASP 413 Ca 0.16 -0.67 0.17 0.00 0.43 0.00 0.00 52.55 52.64 3pcg s ASP 413 Cb 0.11 -2.26 0.43 0.00 -0.30 0.00 0.00 42.92 40.90 3pcg s ASP 413 CO 0.25 -0.70 1.35 0.54 -0.17 0.00 0.00 175.17 176.43 3pcg n ARG 414 N 5.88 2.58 -1.65 4.34 5.12 -1.26 -4.91 116.66 126.76 3pcg n ARG 414 Ca -0.06 -2.24 -0.43 0.00 -1.93 0.00 0.00 57.85 53.19 3pcg n ARG 414 Cb 0.47 -1.41 -0.01 0.00 -1.16 0.00 0.00 32.46 30.35 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 1.09 1.88 0.54 -1.55 9.36 -1.26 -4.83 117.16 122.38 3pcg n TYR 415 Ca 0.17 0.61 0.07 0.00 3.32 0.00 0.00 57.90 62.06 3pcg n TYR 415 Cb 0.51 -2.35 0.31 0.00 -0.63 0.00 0.00 39.34 37.18 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 1.03 0.00 -4.75 2.98 -0.00 -1.26 -4.70 117.00 110.31 3pcg n LEU 416 Ca 0.07 0.43 -0.41 0.00 -0.00 0.00 0.00 56.01 56.10 3pcg n LEU 416 Cb 0.34 -0.43 -0.03 0.00 -0.00 0.00 0.00 43.42 43.30 3pcg n LEU 416 CO 0.61 -0.23 0.89 0.00 -0.00 0.00 0.00 177.39 178.67 3pcg s ALA 417 N -2.85 3.45 0.77 1.47 0.00 -1.26 -4.98 121.76 118.36 3pcg s ALA 417 Ca 0.09 1.01 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 3pcg s ALA 417 Cb 0.09 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 19.85 3pcg s ALA 417 CO 0.24 -0.39 1.08 -1.25 0.00 0.00 0.00 175.76 175.44 3pcg s PRO 418 N -0.65 2.27 0.68 0.00 0.04 -1.26 -4.73 135.00 131.34 3pcg s PRO 418 Ca 0.51 0.99 -0.11 0.00 0.04 0.00 0.00 61.00 62.43 3pcg s PRO 418 Cb -0.34 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.29 3pcg s PRO 418 CO 0.40 -1.58 1.05 -0.51 0.04 0.00 0.00 177.00 176.40 3pcg s LEU 419 N -5.85 3.14 -0.27 -3.56 1.43 -1.26 -4.73 118.68 107.59 3pcg s LEU 419 Ca 0.61 1.56 -0.06 0.00 -1.03 0.00 0.00 54.13 55.21 3pcg s LEU 419 Cb -0.16 -4.47 0.00 0.00 0.03 0.00 0.00 46.19 41.59 3pcg s LEU 419 CO 0.56 -1.32 0.03 -0.62 0.23 0.00 0.00 176.35 175.24 3pcg s ASP 420 N -3.89 4.85 0.53 2.29 -1.08 -1.26 -4.99 116.67 113.11 3pcg s ASP 420 Ca 0.57 -0.60 0.28 0.00 -0.52 0.00 0.00 52.55 52.28 3pcg s ASP 420 Cb -0.13 -1.83 1.44 0.00 -1.46 0.00 0.00 42.92 40.94 3pcg s ASP 420 CO 0.55 -0.13 1.94 1.55 0.52 0.00 0.00 175.17 179.60 3pcg h PRO 421 N 8.18 0.01 -0.54 4.34 0.13 -1.97 -0.63 132.00 141.53 3pcg h PRO 421 Ca -0.34 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3pcg h PRO 421 Cb 1.14 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3pcg h PRO 421 CO 0.60 0.01 0.00 0.09 -0.23 0.00 0.00 178.00 178.46 3pcg n ASN 422 N -4.32 5.24 -3.87 1.44 4.13 -1.26 -4.94 115.26 111.67 3pcg n ASN 422 Ca 0.14 -2.85 -0.22 0.00 1.68 0.00 0.00 54.58 53.34 3pcg n ASN 422 Cb 0.79 -0.64 -0.17 0.00 -1.54 0.00 0.00 39.78 38.23 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 -2.59 0.89 -0.21 3.10 5.36 -0.24 -4.25 117.98 120.04 3pcg s PHE 423 Ca 0.52 -0.30 -0.16 0.00 -0.96 0.00 0.00 56.93 56.03 3pcg s PHE 423 Cb 0.39 -0.82 -0.09 0.00 -0.34 0.00 0.00 43.02 42.16 3pcg s PHE 423 CO 0.16 -0.28 -0.24 0.41 -1.46 0.00 0.00 175.22 173.81 3pcg n GLY 424 N 4.45 -0.64 0.68 13.12 0.00 -1.26 -4.67 105.19 116.87 3pcg n GLY 424 Ca -0.18 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 1.42 1.43 3.09 -0.02 0.00 -1.26 -4.60 105.19 105.26 3pcg n GLY 425 Ca -0.27 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 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 1.21 0.12 1.61 1.01 -1.26 -1.93 120.40 119.15 3pcg s VAL 426 Ca 0.00 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 3pcg s VAL 426 Cb 0.00 -1.05 -0.00 0.00 0.00 0.00 0.00 36.38 35.33 3pcg s VAL 426 CO 0.00 0.36 0.24 -0.83 0.00 0.00 0.00 175.10 174.87 3pcg s GLY 427 N 0.11 0.17 -0.07 4.51 0.00 -0.71 -4.77 107.32 106.56 3pcg s GLY 427 Ca -0.04 -0.64 -0.24 0.00 0.00 0.00 0.00 44.72 43.80 3pcg s GLY 427 CO 0.02 -0.76 0.55 1.09 0.00 0.00 0.00 173.10 173.99 3pcg s ARG 428 N -3.89 0.87 -0.16 2.90 1.70 -0.97 -1.25 118.95 118.15 3pcg s ARG 428 Ca 0.09 0.22 -0.20 0.00 -0.47 0.00 0.00 55.73 55.36 3pcg s ARG 428 Cb 0.04 0.41 0.05 0.00 -0.57 0.00 0.00 34.95 34.88 3pcg s ARG 428 CO -0.08 -0.24 0.53 0.00 -1.08 0.00 0.00 175.30 174.43 3pcg s LEU 430 N -0.11 4.17 0.77 0.00 2.96 -1.26 -1.22 118.68 123.99 3pcg s LEU 430 Ca -0.03 0.29 -0.13 0.00 -0.22 0.00 0.00 54.13 54.03 3pcg s LEU 430 Cb -0.03 -2.22 0.06 0.00 0.50 0.00 0.00 46.19 44.50 3pcg s LEU 430 CO 0.02 0.08 1.16 0.42 -1.32 0.00 0.00 176.35 176.71 3pcg s THR 431 N 0.79 2.57 0.48 3.68 -4.23 0.09 -4.87 115.64 114.15 3pcg s THR 431 Ca 0.11 0.24 -0.05 0.00 -1.18 0.00 0.00 61.69 60.81 3pcg s THR 431 Cb -0.13 -2.65 0.10 0.00 1.34 0.00 0.00 72.50 71.16 3pcg s THR 431 CO 0.03 -0.19 0.65 -0.90 -0.54 0.00 0.00 174.62 173.67 3pcg n ASP 432 N -3.17 0.42 0.07 3.99 5.68 -0.54 -1.90 116.55 121.09 3pcg n ASP 432 Ca 0.12 -1.46 0.21 0.00 -0.50 0.00 0.00 54.79 53.15 3pcg n ASP 432 Cb 0.51 -0.46 0.74 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 -0.65 0.00 -0.28 -1.12 0.02 -1.95 -0.73 113.55 108.85 3pcg h SER 433 Ca -0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 3pcg h SER 433 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 3pcg h SER 433 CO 0.18 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.34 3pcg n ASP 434 N -3.88 3.24 0.00 3.07 8.00 -1.26 -4.62 116.55 121.10 3pcg n ASP 434 Ca 0.08 -1.96 0.00 0.00 0.71 0.00 0.00 54.79 53.62 3pcg n ASP 434 Cb 0.61 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 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 1.36 0.69 3.77 0.44 0.00 -0.28 -4.73 105.19 106.44 3pcg n GLY 435 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.43 3.86 0.12 1.61 2.02 -1.26 -1.02 117.35 120.26 3pcg s TYR 436 Ca 0.00 1.75 0.03 0.00 -0.37 0.00 0.00 57.07 58.48 3pcg s TYR 436 Cb 0.00 -2.86 -0.04 0.00 -0.40 0.00 0.00 41.96 38.66 3pcg s TYR 436 CO 0.00 0.41 -0.09 1.52 -1.57 0.00 0.00 175.55 175.82 3pcg s TYR 437 N -1.30 1.11 -0.13 2.71 -0.85 -0.43 -1.47 117.35 116.98 3pcg s TYR 437 Ca 0.42 -0.78 -0.23 0.00 -0.52 0.00 0.00 57.07 55.96 3pcg s TYR 437 Cb -0.22 -0.59 0.05 0.00 0.38 0.00 0.00 41.96 41.58 3pcg s TYR 437 CO 0.27 -0.00 0.56 -1.54 -1.52 0.00 0.00 175.55 173.32 3pcg s SER 438 N -2.96 -0.55 0.06 -0.18 1.04 -1.26 -2.03 113.70 107.82 3pcg s SER 438 Ca 0.13 0.83 0.02 0.00 0.48 0.00 0.00 55.95 57.41 3pcg s SER 438 Cb 0.02 0.83 -0.03 0.00 0.10 0.00 0.00 66.02 66.94 3pcg s SER 438 CO -0.01 -0.37 -0.07 -0.36 0.98 0.00 0.00 173.24 173.41 3pcg s PHE 439 N -0.45 0.71 -0.13 5.02 0.08 0.16 -4.90 117.98 118.47 3pcg s PHE 439 Ca -0.06 -0.67 0.01 0.00 0.12 0.00 0.00 56.93 56.33 3pcg s PHE 439 Cb -0.03 -0.43 0.02 0.00 -0.57 0.00 0.00 43.02 42.01 3pcg s PHE 439 CO 0.04 -0.13 -0.14 0.50 -0.10 0.00 0.00 175.22 175.40 3pcg s ARG 440 N -2.47 2.19 0.00 0.44 3.52 -0.94 -0.47 118.95 121.22 3pcg s ARG 440 Ca -0.02 -0.53 0.00 0.00 -0.13 0.00 0.00 55.73 55.05 3pcg s ARG 440 Cb -0.04 -1.97 0.00 0.00 -1.56 0.00 0.00 34.95 31.39 3pcg s ARG 440 CO -0.02 -0.17 0.00 -2.37 -0.81 0.00 0.00 175.30 171.93 3pcg n THR 441 N 4.56 0.00 -4.39 4.11 5.66 0.82 0.30 114.28 125.34 3pcg n THR 441 Ca -0.17 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.55 3pcg n THR 441 Cb 0.50 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.17 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 -2.32 2.48 -0.03 1.09 -5.25 -1.26 -0.87 121.20 115.04 3pcg s ILE 442 Ca 0.00 -1.86 -0.30 0.00 -0.99 0.00 0.00 60.65 57.50 3pcg s ILE 442 Cb 0.00 -2.16 -0.05 0.00 2.95 0.00 0.00 42.46 43.20 3pcg s ILE 442 CO 0.00 -0.04 1.34 -0.75 -1.79 0.00 0.00 174.94 173.70 3pcg s LYS 443 N -2.48 4.30 0.69 0.37 2.20 -0.31 -4.89 119.74 119.62 3pcg s LYS 443 Ca 0.19 1.86 -0.14 0.00 -0.36 0.00 0.00 55.97 57.53 3pcg s LYS 443 Cb -0.09 -3.59 0.01 0.00 -1.51 0.00 0.00 37.83 32.66 3pcg s LYS 443 CO 0.09 -0.55 1.10 -1.25 -0.36 0.00 0.00 175.35 174.39 3pcg s PRO 444 N 2.42 2.67 0.18 4.03 0.04 -1.26 -4.32 135.00 138.77 3pcg s PRO 444 Ca 0.61 1.33 0.04 0.00 0.04 0.00 0.00 61.00 63.02 3pcg s PRO 444 Cb -0.29 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 3pcg s PRO 444 CO 0.25 -1.34 0.27 0.20 0.04 0.00 0.00 177.00 176.41 3pcg s GLY 445 N -2.79 1.56 1.14 0.56 0.00 -0.78 -4.70 107.32 102.32 3pcg s GLY 445 Ca 0.65 -1.15 -0.15 0.00 0.00 0.00 0.00 44.72 44.08 3pcg s GLY 445 CO 0.45 -1.16 1.05 2.56 0.00 0.00 0.00 173.10 176.00 3pcg s PRO 446 N -3.45 -0.74 -0.12 2.90 0.04 -1.26 -4.02 135.00 128.36 3pcg s PRO 446 Ca 0.34 0.46 -0.29 0.00 0.04 0.00 0.00 61.00 61.55 3pcg s PRO 446 Cb -0.10 -1.61 0.07 0.00 0.04 0.00 0.00 34.50 32.91 3pcg s PRO 446 CO 0.27 -3.51 0.70 1.52 0.04 0.00 0.00 177.00 176.03 3pcg s TYR 447 N -2.73 -0.69 0.50 0.56 -0.85 -0.99 -4.16 117.35 108.99 3pcg s TYR 447 Ca 0.68 1.35 -0.18 0.00 -0.52 0.00 0.00 57.07 58.40 3pcg s TYR 447 Cb -0.19 0.37 -0.08 0.00 0.38 0.00 0.00 41.96 42.44 3pcg s TYR 447 CO 0.60 -0.53 0.99 -1.25 -1.52 0.00 0.00 175.55 173.83 3pcg s PRO 448 N -0.72 3.93 0.04 -3.49 0.04 -1.26 -0.05 135.00 133.49 3pcg s PRO 448 Ca -0.08 1.05 -0.14 0.00 0.04 0.00 0.00 61.00 61.88 3pcg s PRO 448 Cb -0.01 -2.13 0.02 0.00 0.04 0.00 0.00 34.50 32.41 3pcg s PRO 448 CO 0.07 -0.29 0.31 1.67 0.04 0.00 0.00 177.00 178.80 3pcg s TRP 449 N -2.45 -0.12 -0.95 0.56 1.48 -0.79 -4.88 118.94 111.79 3pcg s TRP 449 Ca 0.61 0.01 -0.20 0.00 -1.06 0.00 0.00 56.10 55.46 3pcg s TRP 449 Cb -0.11 0.10 0.11 0.00 -1.16 0.00 0.00 33.47 32.41 3pcg s TRP 449 CO 0.27 -0.49 1.23 1.03 -4.06 0.00 0.00 176.95 174.92 3pcg s ARG 450 N -2.40 3.59 0.00 3.25 0.52 -1.26 -4.27 118.95 118.37 3pcg s ARG 450 Ca -0.06 -1.55 0.00 0.00 -0.52 0.00 0.00 55.73 53.60 3pcg s ARG 450 Cb -0.01 -5.05 0.00 0.00 0.52 0.00 0.00 34.95 30.41 3pcg s ARG 450 CO -0.02 -1.91 0.00 -1.71 0.02 0.00 0.00 175.30 171.68 3pcg n ASN 451 N 7.29 0.00 -4.50 0.23 5.15 -1.26 -5.03 115.26 117.13 3pcg n ASN 451 Ca 0.26 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.96 3pcg n ASN 451 Cb 0.50 0.00 0.14 0.00 -0.53 0.00 0.00 39.78 39.88 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 -0.13 1.70 0.58 8.20 0.00 -1.26 -4.96 107.32 111.45 3pcg s GLY 452 Ca 0.00 -1.00 0.34 0.00 0.00 0.00 0.00 44.72 44.07 3pcg s GLY 452 CO 0.00 -0.37 2.16 -2.55 0.00 0.00 0.00 173.10 172.34 3pcg h PRO 453 N -1.30 0.00 -1.51 2.90 0.11 -1.98 -3.29 132.00 126.92 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 1.28 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 32.01 3pcg h PRO 453 CO 0.50 0.05 -1.13 -1.71 -0.21 0.00 0.00 178.00 175.50 3pcg n ASN 454 N -3.35 0.73 -4.78 -2.05 5.15 -1.26 -5.08 115.26 104.62 3pcg n ASN 454 Ca -0.02 -2.95 -0.38 0.00 -0.60 0.00 0.00 54.58 50.64 3pcg n ASN 454 Cb 0.19 -0.38 -0.06 0.00 -0.53 0.00 0.00 39.78 39.00 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 -2.53 6.82 -0.06 1.20 1.01 -1.24 -5.06 116.67 116.80 3pcg s ASP 455 Ca 0.34 0.97 0.01 0.00 0.71 0.00 0.00 52.55 54.59 3pcg s ASP 455 Cb 0.38 -2.29 0.02 0.00 1.01 0.00 0.00 42.92 42.04 3pcg s ASP 455 CO -0.04 0.17 -0.08 0.26 0.21 0.00 0.00 175.17 175.68 3pcg s TRP 456 N -0.32 1.11 0.21 4.23 0.52 -1.26 -1.89 118.94 121.55 3pcg s TRP 456 Ca 0.26 -0.39 -0.30 0.00 0.02 0.00 0.00 56.10 55.69 3pcg s TRP 456 Cb -0.17 -0.89 -0.08 0.00 -1.15 0.00 0.00 33.47 31.19 3pcg s TRP 456 CO 0.13 -0.25 1.05 1.03 0.02 0.00 0.00 176.95 178.93 3pcg s ARG 457 N 0.87 4.68 0.85 4.98 1.81 0.93 -4.75 118.95 128.33 3pcg s ARG 457 Ca -0.11 1.66 -0.10 0.00 -1.72 0.00 0.00 55.73 55.46 3pcg s ARG 457 Cb -0.15 -3.26 0.11 0.00 -0.45 0.00 0.00 34.95 31.19 3pcg s ARG 457 CO 0.01 0.22 1.13 -2.14 -0.68 0.00 0.00 175.30 173.84 3pcg s PRO 458 N -0.80 1.55 0.31 3.54 0.02 -1.26 -2.35 135.00 136.01 3pcg s PRO 458 Ca 0.46 1.41 -0.29 0.00 0.02 0.00 0.00 61.00 62.59 3pcg s PRO 458 Cb -0.29 -1.80 -0.11 0.00 0.02 0.00 0.00 34.50 32.32 3pcg s PRO 458 CO 0.35 -2.21 1.52 0.00 -0.33 0.00 0.00 177.00 176.33 3pcg s ALA 459 N -2.73 3.67 0.10 -1.55 0.00 -1.26 -4.72 121.76 115.26 3pcg s ALA 459 Ca 0.65 1.51 -0.22 0.00 0.00 0.00 0.00 51.96 53.89 3pcg s ALA 459 Cb -0.21 -3.61 0.06 0.00 0.00 0.00 0.00 23.12 19.36 3pcg s ALA 459 CO 0.57 -0.93 0.55 -3.38 0.00 0.00 0.00 175.76 172.56 3pcg s HIS 460 N -0.33 -0.46 -0.11 0.00 -3.43 -1.26 -4.05 115.29 105.66 3pcg s HIS 460 Ca 0.59 0.38 0.02 0.00 -0.80 0.00 0.00 55.06 55.25 3pcg s HIS 460 Cb -0.46 0.42 -0.01 0.00 -1.43 0.00 0.00 32.58 31.10 3pcg s HIS 460 CO 0.51 -0.73 -0.17 0.42 -2.00 0.00 0.00 174.74 172.77 3pcg s ILE 461 N -3.09 2.73 0.19 -5.38 1.01 -0.67 -4.65 121.20 111.35 3pcg s ILE 461 Ca -0.02 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.54 3pcg s ILE 461 Cb -0.00 -2.11 -0.08 0.00 0.01 0.00 0.00 42.46 40.28 3pcg s ILE 461 CO -0.07 0.54 0.96 -1.00 0.00 0.00 0.00 174.94 175.37 3pcg s HIS 462 N 0.17 3.90 0.04 3.97 3.76 0.98 -0.86 115.29 127.26 3pcg s HIS 462 Ca -0.10 1.86 0.05 0.00 -0.15 0.00 0.00 55.06 56.73 3pcg s HIS 462 Cb -0.16 -3.03 -0.02 0.00 1.11 0.00 0.00 32.58 30.48 3pcg s HIS 462 CO 0.06 0.30 -0.15 -0.06 -0.85 0.00 0.00 174.74 174.04 3pcg s PHE 463 N -0.70 1.33 -0.06 1.40 0.40 -0.22 -1.81 117.98 118.32 3pcg s PHE 463 Ca 0.44 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 56.41 3pcg s PHE 463 Cb -0.25 -0.78 0.02 0.00 0.51 0.00 0.00 43.02 42.51 3pcg s PHE 463 CO 0.32 0.05 -0.08 0.20 0.70 0.00 0.00 175.22 176.41 3pcg s GLY 464 N -1.22 0.61 -0.04 4.36 0.00 0.62 -1.26 107.32 110.39 3pcg s GLY 464 Ca 0.02 -0.23 0.03 0.00 0.00 0.00 0.00 44.72 44.54 3pcg s GLY 464 CO 0.01 0.37 -0.11 -0.42 0.00 0.00 0.00 173.10 172.95 3pcg s ILE 465 N 0.92 1.00 -0.15 0.90 1.09 -0.14 -0.70 121.20 124.10 3pcg s ILE 465 Ca -0.11 -0.45 -0.23 0.00 -1.10 0.00 0.00 60.65 58.76 3pcg s ILE 465 Cb -0.15 -0.89 -0.24 0.00 -1.06 0.00 0.00 42.46 40.13 3pcg s ILE 465 CO 0.01 0.31 0.51 0.77 -0.10 0.00 0.00 174.94 176.44 3pcg h SER 466 N 6.53 0.10 -3.61 3.58 4.64 -1.39 -1.34 113.55 122.06 3pcg h SER 466 Ca -0.33 -0.78 0.02 0.00 -0.47 0.00 0.00 61.79 60.23 3pcg h SER 466 Cb 1.17 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3pcg h SER 466 CO 0.48 1.34 -0.02 0.61 -0.87 0.00 0.00 176.83 178.37 3pcg n GLY 467 N 1.57 -1.99 0.25 -0.77 0.00 -1.26 -2.90 105.19 100.08 3pcg n GLY 467 Ca -0.22 -1.39 0.14 0.00 0.00 0.00 0.00 46.02 44.55 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 -3.65 1.61 0.14 -1.94 -3.47 132.00 124.69 3pcg h PRO 468 Ca 0.00 0.00 -0.08 0.00 0.14 0.00 0.00 66.00 66.06 3pcg h PRO 468 Cb 0.05 0.00 -0.08 0.00 0.14 0.00 0.00 31.00 31.11 3pcg h PRO 468 CO 0.00 0.07 -0.09 -1.54 0.14 0.00 0.00 178.00 176.58 3pcg s SER 469 N -5.93 0.05 0.45 1.44 1.04 -1.26 -3.55 113.70 105.95 3pcg s SER 469 Ca 0.02 -1.01 0.31 0.00 0.48 0.00 0.00 55.95 55.74 3pcg s SER 469 Cb 0.09 0.62 1.37 0.00 0.10 0.00 0.00 66.02 68.20 3pcg s SER 469 CO 0.59 -1.21 1.92 0.16 0.98 0.00 0.00 173.24 175.69 3pcg h ILE 470 N 2.21 0.00 0.00 -1.02 3.07 -1.38 -2.03 117.51 118.36 3pcg h ILE 470 Ca -0.27 -0.31 -0.09 0.00 1.55 0.00 0.00 64.86 65.74 3pcg h ILE 470 Cb 1.25 1.18 -0.01 0.00 -0.27 0.00 0.00 36.82 38.97 3pcg h ILE 470 CO 0.36 0.00 -0.44 0.00 -1.05 0.00 0.00 178.15 177.02 3pcg h ALA 471 N 2.08 0.96 0.00 0.16 0.00 -1.78 -3.27 119.26 117.42 3pcg h ALA 471 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3pcg h ALA 471 Cb 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3pcg h ALA 471 CO 0.00 0.55 -1.22 0.25 0.00 0.00 0.00 179.25 178.83 3pcg n THR 472 N -3.56 0.19 -1.59 0.00 -2.24 -0.78 -4.93 114.28 101.38 3pcg n THR 472 Ca -0.00 -0.33 -0.47 0.00 -2.27 0.00 0.00 64.05 60.99 3pcg n THR 472 Cb 0.55 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 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 -2.10 1.32 -3.72 -0.78 3.00 -1.13 -4.71 118.16 110.03 3pcg n LYS 473 Ca 0.01 0.47 -0.14 0.00 -0.00 0.00 0.00 58.31 58.65 3pcg n LYS 473 Cb 0.47 -1.92 -0.09 0.00 0.00 0.00 0.00 35.03 33.49 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 0.54 0.46 -0.05 3.14 2.96 -0.51 -5.02 118.68 120.20 3pcg s LEU 474 Ca 0.67 0.54 0.06 0.00 -0.22 0.00 0.00 54.13 55.17 3pcg s LEU 474 Cb -0.77 1.49 -0.01 0.00 0.50 0.00 0.00 46.19 47.40 3pcg s LEU 474 CO 0.55 -0.31 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.40 3pcg s ILE 475 N -0.53 2.21 0.03 6.68 1.01 -1.26 -0.97 121.20 128.37 3pcg s ILE 475 Ca -0.06 -1.02 -0.00 0.00 0.00 0.00 0.00 60.65 59.56 3pcg s ILE 475 Cb -0.04 -1.81 0.00 0.00 0.01 0.00 0.00 42.46 40.63 3pcg s ILE 475 CO 0.03 0.57 0.04 1.07 0.00 0.00 0.00 174.94 176.66 3pcg n THR 476 N 2.80 0.00 -3.90 2.92 5.66 -0.39 -5.02 114.28 116.35 3pcg n THR 476 Ca -0.17 -0.11 -0.15 0.00 -3.05 0.00 0.00 64.05 60.57 3pcg n THR 476 Cb 0.52 0.08 -0.15 0.00 -1.55 0.00 0.00 70.33 69.22 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 -2.04 0.14 -0.10 1.09 -0.21 -1.26 -1.05 119.66 116.22 3pcg s GLN 477 Ca 0.02 0.04 -0.14 0.00 0.02 0.00 0.00 55.36 55.30 3pcg s GLN 477 Cb -0.00 -0.26 -0.05 0.00 1.00 0.00 0.00 33.01 33.70 3pcg s GLN 477 CO 0.01 -0.07 0.35 -1.17 -2.12 0.00 0.00 175.29 172.29 3pcg s LEU 478 N 0.55 4.33 0.29 2.90 0.20 -0.04 -4.83 118.68 122.08 3pcg s LEU 478 Ca -0.05 0.69 0.09 0.00 0.69 0.00 0.00 54.13 55.56 3pcg s LEU 478 Cb -0.08 -2.46 -0.04 0.00 -0.43 0.00 0.00 46.19 43.18 3pcg s LEU 478 CO -0.01 0.18 0.01 -0.31 -0.29 0.00 0.00 176.35 175.93 3pcg s TYR 479 N -0.10 2.66 -0.12 5.38 2.02 0.12 -1.66 117.35 125.65 3pcg s TYR 479 Ca 0.20 -0.28 -0.05 0.00 -0.37 0.00 0.00 57.07 56.57 3pcg s TYR 479 Cb -0.14 -1.29 -0.04 0.00 -0.40 0.00 0.00 41.96 40.09 3pcg s TYR 479 CO 0.08 0.56 0.06 -0.06 -1.57 0.00 0.00 175.55 174.62 3pcg s PHE 480 N -2.38 3.32 -0.01 2.71 0.40 -1.26 -0.25 117.98 120.53 3pcg s PHE 480 Ca 0.33 0.27 -0.39 0.00 -0.60 0.00 0.00 56.93 56.54 3pcg s PHE 480 Cb -0.05 -1.90 -0.18 0.00 0.51 0.00 0.00 43.02 41.40 3pcg s PHE 480 CO 0.20 0.49 1.30 -1.91 0.70 0.00 0.00 175.22 176.00 3pcg n GLU 481 N 2.39 0.70 -0.62 0.44 2.13 -0.56 -2.07 120.64 123.05 3pcg n GLU 481 Ca -0.19 0.25 0.00 0.00 0.66 0.00 0.00 57.16 57.89 3pcg n GLU 481 Cb 0.54 -1.84 0.00 0.00 0.27 0.00 0.00 31.44 30.40 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 2.40 1.52 3.62 8.31 0.00 -1.26 -5.00 105.19 114.79 3pcg n GLY 482 Ca 0.20 0.00 -0.43 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 5.90 0.41 1.61 -1.08 -0.88 -4.88 116.67 114.54 3pcg s ASP 483 Ca 0.00 2.07 0.29 0.00 -0.52 0.00 0.00 52.55 54.40 3pcg s ASP 483 Cb 0.00 -2.52 1.32 0.00 -1.46 0.00 0.00 42.92 40.26 3pcg s ASP 483 CO 0.00 -1.58 1.88 1.55 0.52 0.00 0.00 175.17 177.54 3pcg h PRO 484 N 13.03 0.00 0.00 4.34 0.13 -1.94 -2.47 132.00 145.09 3pcg h PRO 484 Ca -0.42 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.69 3pcg h PRO 484 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 3pcg h PRO 484 CO 0.96 0.00 -0.10 -0.07 -0.23 0.00 0.00 178.00 178.57 3pcg h LEU 485 N 0.00 0.00 -0.34 1.56 3.38 -1.96 -3.36 115.31 114.59 3pcg h LEU 485 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 3pcg h LEU 485 Cb 0.31 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.98 3pcg h LEU 485 CO 0.00 0.10 -0.55 0.40 0.09 0.00 0.00 178.44 178.48 3pcg h ILE 486 N 0.00 0.00 0.00 1.22 2.04 -1.82 -1.57 117.51 117.37 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 0.73 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3pcg h ILE 486 CO 0.01 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.35 3pcg n PRO 487 N -5.34 0.03 0.00 2.37 -0.04 -1.26 -2.45 135.00 128.32 3pcg n PRO 487 Ca -0.04 0.31 0.10 0.00 -0.04 0.00 0.00 63.50 63.83 3pcg n PRO 487 Cb 0.34 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.21 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 -1.45 0.50 -2.53 0.54 2.81 -0.61 -4.95 117.12 111.43 3pcg n MET 488 Ca 0.03 -0.20 -0.43 0.00 -1.81 0.00 0.00 57.70 55.29 3pcg n MET 488 Cb 0.10 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.13 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 7.78 0.10 -0.18 0.00 0.11 -1.90 0.12 132.00 138.03 3pcg h PRO 490 Ca -0.25 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.65 3pcg h PRO 490 Cb 1.10 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.19 3pcg h PRO 490 CO 0.96 0.07 -0.68 0.82 -0.21 0.00 0.00 178.00 178.95 3pcg h ILE 491 N 0.10 1.28 -0.25 4.15 2.04 -1.92 -2.39 117.51 120.52 3pcg h ILE 491 Ca 0.03 -1.88 -0.02 0.00 1.00 0.00 0.00 64.86 63.99 3pcg h ILE 491 Cb -0.00 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 3pcg h ILE 491 CO -0.01 0.60 0.10 0.58 0.00 0.00 0.00 178.15 179.42 3pcg h VAL 492 N 0.52 1.18 0.00 1.67 2.07 -1.60 -1.81 116.25 118.28 3pcg h VAL 492 Ca -0.03 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.94 3pcg h VAL 492 Cb 1.31 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 3pcg h VAL 492 CO 0.14 0.18 0.00 0.29 0.02 0.00 0.00 177.57 178.20 3pcg n LYS 493 N -4.77 0.45 0.23 1.57 5.02 0.33 -1.89 118.16 119.09 3pcg n LYS 493 Ca -0.03 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.35 3pcg n LYS 493 Cb 0.14 -1.46 0.55 0.00 -0.02 0.00 0.00 35.03 34.24 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 -3.29 4.39 4.64 -0.79 -3.39 113.55 115.11 3pcg h SER 494 Ca 0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 3pcg h SER 494 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 3pcg h SER 494 CO 0.00 0.22 0.64 -0.63 -0.87 0.00 0.00 176.83 176.19 3pcg s ILE 495 N -4.04 4.69 0.09 0.95 1.01 -0.79 -3.57 121.20 119.53 3pcg s ILE 495 Ca -0.02 1.61 -0.14 0.00 0.00 0.00 0.00 60.65 62.10 3pcg s ILE 495 Cb 0.13 -4.26 -0.16 0.00 0.01 0.00 0.00 42.46 38.18 3pcg s ILE 495 CO 0.64 -0.27 1.29 0.00 0.00 0.00 0.00 174.94 176.60 3pcg h ALA 496 N 7.89 0.29 -2.30 9.38 0.00 -1.83 -3.44 119.26 129.24 3pcg h ALA 496 Ca -0.22 -0.56 -0.60 0.00 0.00 0.00 0.00 54.91 53.53 3pcg h ALA 496 Cb 1.08 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.75 3pcg h ALA 496 CO 0.95 0.59 0.40 1.21 0.00 0.00 0.00 179.25 182.40 3pcg s ASN 497 N -6.96 6.74 0.47 0.00 3.04 -1.26 -4.95 114.94 112.02 3pcg s ASN 497 Ca -0.11 0.86 0.15 0.00 0.04 0.00 0.00 52.86 53.80 3pcg s ASN 497 Cb 0.08 -2.41 1.13 0.00 -1.54 0.00 0.00 41.25 38.51 3pcg s ASN 497 CO 0.88 -0.53 2.05 1.55 -3.04 0.00 0.00 177.10 178.02 3pcg h PRO 498 N 7.86 0.24 -0.15 0.43 0.13 -2.00 0.29 132.00 138.79 3pcg h PRO 498 Ca -0.24 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 3pcg h PRO 498 Cb 1.10 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 3pcg h PRO 498 CO 0.86 0.16 -0.14 0.93 -0.23 0.00 0.00 178.00 179.58 3pcg h GLU 499 N 0.24 0.25 -0.33 0.86 5.08 -1.98 -1.94 114.58 116.76 3pcg h GLU 499 Ca 0.16 -0.06 -0.17 0.00 -1.00 0.00 0.00 59.36 58.29 3pcg h GLU 499 Cb 0.31 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 3pcg h GLU 499 CO -0.03 0.39 -0.46 0.00 -1.00 0.00 0.00 179.01 177.91 3pcg h ALA 500 N 1.63 0.55 -0.95 3.43 0.00 -0.80 -3.10 119.26 120.02 3pcg h ALA 500 Ca 0.05 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.52 3pcg h ALA 500 Cb 0.39 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 3pcg h ALA 500 CO 0.02 0.68 0.61 0.28 0.00 0.00 0.00 179.25 180.84 3pcg h VAL 501 N 0.70 1.13 -0.37 0.00 2.07 -1.01 -2.38 116.25 116.39 3pcg h VAL 501 Ca 0.04 -0.40 0.06 0.00 0.82 0.00 0.00 66.70 67.22 3pcg h VAL 501 Cb 1.06 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3pcg h VAL 501 CO 0.11 0.21 0.25 1.56 0.02 0.00 0.00 177.57 179.72 3pcg h GLN 502 N 1.16 0.23 0.00 1.57 1.08 -1.37 -1.26 115.11 116.52 3pcg h GLN 502 Ca 0.39 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.57 3pcg h GLN 502 Cb 0.06 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3pcg h GLN 502 CO -0.14 0.15 -0.02 1.96 -0.95 0.00 0.00 178.83 179.83 3pcg h GLN 503 N 0.24 0.00 -0.02 1.46 4.20 -1.48 -2.79 115.11 116.72 3pcg h GLN 503 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 3pcg h GLN 503 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 3pcg h GLN 503 CO -0.03 0.02 -0.09 1.28 -0.67 0.00 0.00 178.83 179.34 3pcg n LEU 504 N -3.16 2.13 -4.58 1.46 4.77 -0.48 -4.87 117.00 112.26 3pcg n LEU 504 Ca -0.01 -0.71 -0.41 0.00 -0.03 0.00 0.00 56.01 54.85 3pcg n LEU 504 Cb 0.22 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3pcg n LEU 504 CO 0.25 0.36 0.26 -0.63 -1.33 0.00 0.00 177.39 176.30 3pcg s ILE 505 N -2.12 5.02 0.29 -0.08 1.01 -1.05 0.15 121.20 124.42 3pcg s ILE 505 Ca 0.30 0.58 -0.29 0.00 0.00 0.00 0.00 60.65 61.24 3pcg s ILE 505 Cb 0.20 -3.93 -0.10 0.00 0.01 0.00 0.00 42.46 38.65 3pcg s ILE 505 CO 0.37 -0.11 1.13 0.00 0.00 0.00 0.00 174.94 176.34 3pcg s ALA 506 N 2.41 3.41 -0.13 9.38 0.00 0.66 -4.84 121.76 132.65 3pcg s ALA 506 Ca 0.20 0.96 -0.06 0.00 0.00 0.00 0.00 51.96 53.06 3pcg s ALA 506 Cb -0.15 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 3pcg s ALA 506 CO 0.12 -0.25 0.10 0.15 0.00 0.00 0.00 175.76 175.88 3pcg s LYS 507 N -1.55 3.48 0.22 0.00 -0.14 -0.68 -1.50 119.74 119.57 3pcg s LYS 507 Ca 0.46 -0.21 -0.32 0.00 -1.36 0.00 0.00 55.97 54.53 3pcg s LYS 507 Cb -0.33 -3.14 -0.13 0.00 -1.68 0.00 0.00 37.83 32.55 3pcg s LYS 507 CO 0.43 0.67 1.58 -0.11 -0.76 0.00 0.00 175.35 177.15 3pcg n LEU 508 N 2.32 3.58 -3.84 3.17 7.94 -1.26 -0.53 117.00 128.38 3pcg n LEU 508 Ca -0.19 1.10 -0.29 0.00 -1.11 0.00 0.00 56.01 55.52 3pcg n LEU 508 Cb 0.54 -1.50 -0.13 0.00 0.53 0.00 0.00 43.42 42.86 3pcg n LEU 508 CO 0.32 -0.12 -0.16 -0.62 -1.11 0.00 0.00 177.39 175.69 3pcg s ASP 509 N 0.75 4.12 0.47 1.96 -1.08 0.28 -4.82 116.67 118.35 3pcg s ASP 509 Ca 0.72 -3.16 0.15 0.00 -0.52 0.00 0.00 52.55 49.74 3pcg s ASP 509 Cb -0.59 -1.41 1.10 0.00 -1.46 0.00 0.00 42.92 40.55 3pcg s ASP 509 CO 0.41 -0.19 2.05 0.24 0.52 0.00 0.00 175.17 178.20 3pcg h MET 510 N 6.18 0.02 -0.07 4.34 2.86 -1.92 -2.29 114.93 124.06 3pcg h MET 510 Ca 0.02 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 3pcg h MET 510 Cb 0.86 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.51 3pcg h MET 510 CO 0.63 0.12 -0.16 -0.91 1.06 0.00 0.00 176.91 177.64 3pcg h ASN 511 N 0.02 0.10 0.11 1.22 2.35 -1.94 -2.92 115.58 114.52 3pcg h ASN 511 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3pcg h ASN 511 Cb 0.19 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3pcg h ASN 511 CO 0.01 0.27 -0.39 -3.20 -1.65 0.00 0.00 177.43 172.48 3pcg n ASN 512 N -4.29 1.50 -4.78 5.81 5.15 -0.87 -4.96 115.26 112.81 3pcg n ASN 512 Ca -0.02 -1.18 -0.32 0.00 -0.60 0.00 0.00 54.58 52.47 3pcg n ASN 512 Cb 0.26 0.33 0.07 0.00 -0.53 0.00 0.00 39.78 39.90 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 -2.51 2.42 -0.35 5.20 0.00 -1.10 -4.79 121.76 120.62 3pcg s ALA 513 Ca 0.21 0.30 -0.07 0.00 0.00 0.00 0.00 51.96 52.40 3pcg s ALA 513 Cb 0.19 -3.26 0.05 0.00 0.00 0.00 0.00 23.12 20.09 3pcg s ALA 513 CO 0.56 -1.48 0.13 -0.80 0.00 0.00 0.00 175.76 174.17 3pcg s ASN 514 N -3.26 5.37 0.34 0.00 0.01 -0.33 -5.00 114.94 112.07 3pcg s ASN 514 Ca 0.62 -1.22 -0.27 0.00 -0.71 0.00 0.00 52.86 51.29 3pcg s ASN 514 Cb -0.17 -1.89 -0.13 0.00 0.41 0.00 0.00 41.25 39.48 3pcg s ASN 514 CO 0.51 -0.36 1.02 -2.65 -1.51 0.00 0.00 177.10 174.11 3pcg n PRO 515 N 4.82 1.41 -1.69 -0.60 -0.02 -1.26 -0.68 135.00 136.97 3pcg n PRO 515 Ca -0.12 0.50 -0.18 0.00 -2.02 0.00 0.00 63.50 61.68 3pcg n PRO 515 Cb 0.44 -1.95 -0.07 0.00 -0.02 0.00 0.00 33.50 31.91 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 0.51 -1.48 0.00 -0.52 2.81 -1.26 -4.69 117.12 112.48 3pcg n MET 516 Ca 0.09 1.04 0.00 0.00 -1.81 0.00 0.00 57.70 57.02 3pcg n MET 516 Cb 0.35 -5.44 0.00 0.00 -0.71 0.00 0.00 33.22 27.43 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 -1.24 0.00 -3.56 7.83 2.03 0.14 -5.16 116.55 116.59 3pcg n ASP 517 Ca -0.19 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.01 3pcg n ASP 517 Cb 0.61 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.97 3pcg n ASP 517 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3pcg n LEU 519 N -0.26 0.00 -3.72 0.00 4.77 -0.97 -1.19 117.00 115.64 3pcg n LEU 519 Ca -0.16 -1.72 -0.14 0.00 -0.03 0.00 0.00 56.01 53.96 3pcg n LEU 519 Cb 0.64 -0.63 -0.09 0.00 -2.33 0.00 0.00 43.42 41.01 3pcg n LEU 519 CO 0.15 -1.01 0.10 0.00 -1.33 0.00 0.00 177.39 175.31 3pcg s ALA 520 N -3.30 -1.00 -0.02 -1.18 0.00 -1.26 -0.96 121.76 114.04 3pcg s ALA 520 Ca 0.59 0.70 0.06 0.00 0.00 0.00 0.00 51.96 53.31 3pcg s ALA 520 Cb -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.94 3pcg s ALA 520 CO 0.40 -0.26 -0.19 0.71 0.00 0.00 0.00 175.76 176.42 3pcg s TYR 521 N -0.90 1.74 -0.14 0.00 1.51 -0.42 0.99 117.35 120.13 3pcg s TYR 521 Ca -0.10 -0.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 3pcg s TYR 521 Cb -0.04 -1.12 -0.03 0.00 -0.11 0.00 0.00 41.96 40.66 3pcg s TYR 521 CO 0.04 -0.04 -0.05 0.50 -1.11 0.00 0.00 175.55 174.89 3pcg s ARG 522 N -0.42 3.56 -0.22 -0.62 6.06 0.31 -1.56 118.95 126.06 3pcg s ARG 522 Ca 0.07 -0.54 -0.04 0.00 -2.50 0.00 0.00 55.73 52.71 3pcg s ARG 522 Cb -0.08 -2.85 0.08 0.00 0.06 0.00 0.00 34.95 32.17 3pcg s ARG 522 CO -0.01 0.28 0.13 0.12 -2.50 0.00 0.00 175.30 173.32 3pcg s PHE 523 N 0.25 0.16 -0.00 5.12 5.36 0.68 -1.68 117.98 127.87 3pcg s PHE 523 Ca -0.04 -0.46 -0.07 0.00 -0.96 0.00 0.00 56.93 55.40 3pcg s PHE 523 Cb -0.14 -0.72 -0.05 0.00 -0.34 0.00 0.00 43.02 41.77 3pcg s PHE 523 CO 0.03 -0.66 0.28 -0.51 -1.46 0.00 0.00 175.22 172.90 3pcg s ASP 524 N 2.15 6.52 -0.04 6.13 1.01 -1.26 -4.09 116.67 127.09 3pcg s ASP 524 Ca 0.05 0.60 0.06 0.00 0.71 0.00 0.00 52.55 53.97 3pcg s ASP 524 Cb -0.16 -2.11 -0.02 0.00 1.01 0.00 0.00 42.92 41.64 3pcg s ASP 524 CO -0.21 0.27 -0.21 -0.63 0.21 0.00 0.00 175.17 174.61 3pcg s ILE 525 N -1.26 2.51 -0.20 0.77 1.01 0.38 -4.94 121.20 119.48 3pcg s ILE 525 Ca 0.26 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3pcg s ILE 525 Cb -0.13 -1.93 0.02 0.00 0.01 0.00 0.00 42.46 40.42 3pcg s ILE 525 CO 0.15 0.58 -0.16 -0.69 0.00 0.00 0.00 174.94 174.82 3pcg s VAL 526 N -0.57 2.31 0.27 2.92 1.01 -1.25 -1.39 120.40 123.70 3pcg s VAL 526 Ca 0.08 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.19 3pcg s VAL 526 Cb -0.11 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 3pcg s VAL 526 CO 0.00 0.47 0.40 -0.76 0.00 0.00 0.00 175.10 175.21 3pcg s LEU 527 N 1.31 4.20 0.32 3.92 1.43 -0.01 -4.91 118.68 124.93 3pcg s LEU 527 Ca 0.04 -0.01 -0.27 0.00 -1.03 0.00 0.00 54.13 52.86 3pcg s LEU 527 Cb -0.14 -2.83 -0.13 0.00 0.03 0.00 0.00 46.19 43.11 3pcg s LEU 527 CO -0.11 -0.20 0.97 0.54 0.23 0.00 0.00 176.35 177.79 3pcg n ARG 528 N -1.50 1.29 -1.87 1.70 1.74 -1.26 -1.43 116.66 115.33 3pcg n ARG 528 Ca -0.06 0.45 -0.41 0.00 -0.77 0.00 0.00 57.85 57.07 3pcg n ARG 528 Cb 0.57 -1.84 -0.00 0.00 -1.02 0.00 0.00 32.46 30.17 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 -0.61 2.95 -0.17 -0.13 0.00 -1.26 -4.37 107.32 103.73 3pcg s GLY 529 Ca 0.59 1.50 -0.05 0.00 0.00 0.00 0.00 44.72 46.77 3pcg s GLY 529 CO 0.59 2.17 -0.01 1.62 0.00 0.00 0.00 173.10 177.48 3pcg s GLN 530 N -2.05 3.75 0.12 2.90 0.74 -1.26 -1.58 119.66 122.27 3pcg s GLN 530 Ca 0.52 -0.47 0.01 0.00 0.05 0.00 0.00 55.36 55.47 3pcg s GLN 530 Cb -0.45 -3.00 -0.04 0.00 1.10 0.00 0.00 33.01 30.61 3pcg s GLN 530 CO 0.60 0.23 -0.02 -0.98 -0.55 0.00 0.00 175.29 174.58 3pcg s ARG 531 N 0.41 0.91 0.50 1.67 1.70 -0.56 -4.96 118.95 118.62 3pcg s ARG 531 Ca -0.02 -1.40 -0.17 0.00 -0.47 0.00 0.00 55.73 53.68 3pcg s ARG 531 Cb -0.14 -0.11 -0.08 0.00 -0.57 0.00 0.00 34.95 34.05 3pcg s ARG 531 CO 0.02 -0.10 0.97 -1.59 -1.08 0.00 0.00 175.30 173.53 3pcg s LYS 532 N -3.90 3.97 0.50 3.89 -2.85 -1.26 -0.38 119.74 119.71 3pcg s LYS 532 Ca 0.17 0.95 -0.20 0.00 -1.00 0.00 0.00 55.97 55.88 3pcg s LYS 532 Cb 0.06 -2.15 -0.08 0.00 -2.06 0.00 0.00 37.83 33.60 3pcg s LYS 532 CO -0.02 -0.24 1.06 0.95 0.10 0.00 0.00 175.35 177.21 3pcg s THR 533 N -2.58 3.61 -0.08 3.79 -4.23 -1.19 -4.70 115.64 110.26 3pcg s THR 533 Ca 0.59 1.01 -0.11 0.00 -1.18 0.00 0.00 61.69 61.99 3pcg s THR 533 Cb -0.10 -3.41 0.03 0.00 1.34 0.00 0.00 72.50 70.36 3pcg s THR 533 CO 0.30 -0.21 0.30 -1.38 -0.54 0.00 0.00 174.62 173.08 3pcg s HIS 534 N -1.91 -0.27 -0.94 3.99 -3.43 -1.26 -4.91 115.29 106.56 3pcg s HIS 534 Ca 0.69 0.61 -0.08 0.00 -0.80 0.00 0.00 55.06 55.48 3pcg s HIS 534 Cb -0.19 0.10 0.07 0.00 -1.43 0.00 0.00 32.58 31.13 3pcg s HIS 534 CO 0.22 -0.23 0.28 1.19 -2.00 0.00 0.00 174.74 174.20 3pcg n PHE 535 N 2.39 -1.69 1.83 0.38 3.72 -1.26 -5.24 117.46 117.58 3pcg n PHE 535 Ca -0.16 0.29 0.15 0.00 -0.05 0.00 0.00 57.45 57.68 3pcg n PHE 535 Cb 0.57 -2.10 0.80 0.00 -0.94 0.00 0.00 39.48 37.82 3pcg n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10