#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 2.70 0.13 0.55 0.00 -1.26 -5.07 121.76 118.81 3pcg s ALA 302 Ca 0.00 0.09 0.06 0.00 0.00 0.00 0.00 51.96 52.11 3pcg s ALA 302 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 3pcg s ALA 302 CO 0.00 -1.19 -0.14 -0.65 0.00 0.00 0.00 175.76 173.79 3pcg s GLN 303 N -5.02 1.03 -0.94 0.00 -0.21 -1.26 -5.10 119.66 108.15 3pcg s GLN 303 Ca 0.58 -1.26 -0.16 0.00 0.02 0.00 0.00 55.36 54.54 3pcg s GLN 303 Cb -0.14 -0.87 0.18 0.00 1.00 0.00 0.00 33.01 33.17 3pcg s GLN 303 CO 0.54 0.16 1.04 0.34 -2.12 0.00 0.00 175.29 175.26 3pcg s ASP 304 N -2.54 6.78 0.00 5.90 2.15 -1.26 -4.70 116.67 123.00 3pcg s ASP 304 Ca 0.10 -2.49 0.00 0.00 0.43 0.00 0.00 52.55 50.59 3pcg s ASP 304 Cb -0.04 -2.32 0.00 0.00 -0.30 0.00 0.00 42.92 40.26 3pcg s ASP 304 CO 0.03 -0.80 0.15 -0.46 -0.17 0.00 0.00 175.17 173.92 3pcg n ASN 305 N 5.28 0.31 -4.57 -0.34 0.23 -1.26 -5.02 115.26 109.89 3pcg n ASN 305 Ca 0.22 -0.63 -0.24 0.00 -0.53 0.00 0.00 54.58 53.39 3pcg n ASN 305 Cb 0.47 0.55 -0.09 0.00 -2.08 0.00 0.00 39.78 38.63 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 -0.55 4.15 0.05 0.53 0.01 -1.26 -2.87 113.70 113.77 3pcg s SER 306 Ca 0.00 -0.75 0.04 0.00 1.31 0.00 0.00 55.95 56.55 3pcg s SER 306 Cb 0.00 -0.63 -0.02 0.00 0.21 0.00 0.00 66.02 65.57 3pcg s SER 306 CO 0.00 0.04 -0.12 -0.13 0.41 0.00 0.00 173.24 173.44 3pcg s ARG 307 N -3.39 0.77 -0.00 12.44 1.81 0.39 -4.86 118.95 126.10 3pcg s ARG 307 Ca 0.29 -0.78 0.05 0.00 -1.72 0.00 0.00 55.73 53.57 3pcg s ARG 307 Cb -0.07 -0.72 -0.03 0.00 -0.45 0.00 0.00 34.95 33.68 3pcg s ARG 307 CO 0.17 0.17 -0.14 -0.06 -0.68 0.00 0.00 175.30 174.76 3pcg s PHE 308 N -1.05 2.68 0.28 -0.53 0.40 -1.26 -1.23 117.98 117.27 3pcg s PHE 308 Ca -0.02 -0.17 -0.30 0.00 -0.60 0.00 0.00 56.93 55.83 3pcg s PHE 308 Cb -0.09 -1.56 -0.12 0.00 0.51 0.00 0.00 43.02 41.76 3pcg s PHE 308 CO 0.01 0.25 1.61 0.28 0.70 0.00 0.00 175.22 178.07 3pcg n VAL 309 N 1.86 0.85 -1.70 -0.44 0.31 -0.25 -4.90 118.33 114.07 3pcg n VAL 309 Ca -0.16 -0.21 -0.44 0.00 -0.01 0.00 0.00 64.34 63.52 3pcg n VAL 309 Cb 0.52 -1.94 -0.03 0.00 -0.91 0.00 0.00 33.84 31.48 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 2.42 0.49 -1.76 2.52 2.08 -1.26 -4.72 119.36 119.13 3pcg n ILE 310 Ca 0.10 -0.12 -0.35 0.00 0.56 0.00 0.00 62.75 62.93 3pcg n ILE 310 Cb 0.36 -1.74 0.06 0.00 -0.75 0.00 0.00 39.64 37.57 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 0.30 2.61 -0.48 0.38 0.52 -1.26 -4.96 118.95 116.05 3pcg s ARG 311 Ca 0.72 1.82 -0.12 0.00 -0.52 0.00 0.00 55.73 57.63 3pcg s ARG 311 Cb -0.58 -1.88 0.11 0.00 0.52 0.00 0.00 34.95 33.12 3pcg s ARG 311 CO 0.42 -1.49 0.38 0.34 0.02 0.00 0.00 175.30 174.98 3pcg s ASP 312 N -1.77 5.88 0.00 0.23 -1.08 -1.26 -4.94 116.67 113.73 3pcg s ASP 312 Ca 0.77 -1.77 0.27 0.00 -0.52 0.00 0.00 52.55 51.30 3pcg s ASP 312 Cb -0.31 -2.08 1.51 0.00 -1.46 0.00 0.00 42.92 40.58 3pcg s ASP 312 CO 0.39 -0.72 1.96 0.54 0.52 0.00 0.00 175.17 177.86 3pcg n ARG 313 N 5.04 0.63 0.02 4.34 1.74 -1.26 -1.52 116.66 125.65 3pcg n ARG 313 Ca -0.10 0.02 0.11 0.00 -0.77 0.00 0.00 57.85 57.10 3pcg n ARG 313 Cb 0.41 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.29 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 -1.14 0.52 -0.06 0.55 3.02 -1.26 -4.40 115.26 112.49 3pcg n ASN 314 Ca 0.17 -0.25 -0.19 0.00 -0.03 0.00 0.00 54.58 54.28 3pcg n ASN 314 Cb 0.15 1.16 -0.13 0.00 -0.61 0.00 0.00 39.78 40.35 3pcg n ASN 314 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3pcg h TRP 315 N 0.00 0.12 -4.30 3.10 2.91 -1.70 -3.44 115.95 112.64 3pcg h TRP 315 Ca 0.00 -0.09 -0.51 0.00 1.13 0.00 0.00 58.89 59.42 3pcg h TRP 315 Cb 0.79 -0.00 0.11 0.00 -0.51 0.00 0.00 29.16 29.54 3pcg h TRP 315 CO 0.00 1.35 0.35 -1.01 -1.03 0.00 0.00 178.44 178.10 3pcg s HIS 316 N -2.35 2.82 0.40 2.65 3.76 -1.08 -4.70 115.29 116.80 3pcg s HIS 316 Ca -0.23 1.50 -0.26 0.00 -0.15 0.00 0.00 55.06 55.92 3pcg s HIS 316 Cb 0.03 -2.99 -0.09 0.00 1.11 0.00 0.00 32.58 30.64 3pcg s HIS 316 CO 0.67 -1.52 1.31 -1.25 -0.85 0.00 0.00 174.74 173.10 3pcg s PRO 317 N -4.83 3.98 0.91 8.40 0.04 -1.26 -4.79 135.00 137.46 3pcg s PRO 317 Ca 0.61 2.17 -0.12 0.00 0.04 0.00 0.00 61.00 63.70 3pcg s PRO 317 Cb -0.16 -2.77 0.14 0.00 0.04 0.00 0.00 34.50 31.74 3pcg s PRO 317 CO 0.53 -0.48 1.10 0.15 0.04 0.00 0.00 177.00 178.34 3pcg s LYS 318 N -2.22 1.14 -0.02 4.56 -0.14 -1.25 -4.99 119.74 116.82 3pcg s LYS 318 Ca 0.56 0.58 -0.24 0.00 -1.36 0.00 0.00 55.97 55.51 3pcg s LYS 318 Cb -0.38 -1.81 -0.18 0.00 -1.68 0.00 0.00 37.83 33.78 3pcg s LYS 318 CO 0.49 -2.26 1.13 0.00 -0.76 0.00 0.00 175.35 173.95 3pcg h ALA 319 N -1.55 -0.19 -2.02 5.17 0.00 -1.94 -3.41 119.26 115.31 3pcg h ALA 319 Ca -0.51 -0.22 -0.67 0.00 0.00 0.00 0.00 54.91 53.51 3pcg h ALA 319 Cb 1.30 0.07 -0.17 0.00 0.00 0.00 0.00 17.79 19.00 3pcg h ALA 319 CO 0.58 -0.36 0.17 -1.17 0.00 0.00 0.00 179.25 178.47 3pcg s LEU 320 N -9.23 4.79 -0.47 0.00 2.96 -1.26 -4.81 118.68 110.66 3pcg s LEU 320 Ca -0.14 -0.81 0.03 0.00 -0.22 0.00 0.00 54.13 52.98 3pcg s LEU 320 Cb 0.01 -2.52 0.15 0.00 0.50 0.00 0.00 46.19 44.33 3pcg s LEU 320 CO 0.57 -0.98 0.31 0.42 -1.32 0.00 0.00 176.35 175.35 3pcg s THR 321 N 2.93 1.24 0.52 3.68 -4.23 -1.26 -5.03 115.64 113.50 3pcg s THR 321 Ca 0.18 -2.81 0.36 0.00 -1.18 0.00 0.00 61.69 58.25 3pcg s THR 321 Cb -0.18 -1.85 0.56 0.00 1.34 0.00 0.00 72.50 72.37 3pcg s THR 321 CO 0.13 -1.02 1.76 -0.65 -0.54 0.00 0.00 174.62 174.30 3pcg h PRO 322 N 6.21 0.05 0.00 3.99 0.11 -1.93 0.18 132.00 140.60 3pcg h PRO 322 Ca 0.10 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 3pcg h PRO 322 Cb 0.89 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 3pcg h PRO 322 CO 0.47 0.03 -0.06 -0.44 -0.21 0.00 0.00 178.00 177.80 3pcg h ASP 323 N 0.05 0.00 -3.62 -2.05 3.32 -1.95 -3.16 116.42 109.01 3pcg h ASP 323 Ca 0.64 0.00 -0.80 0.00 0.02 0.00 0.00 57.03 56.89 3pcg h ASP 323 Cb 2.42 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 41.69 3pcg h ASP 323 CO -0.07 0.06 0.37 -0.47 -1.72 0.00 0.00 179.24 177.41 3pcg s TYR 324 N -4.05 4.17 0.25 4.55 5.04 0.62 -4.83 117.35 123.10 3pcg s TYR 324 Ca -0.02 -2.56 -0.09 0.00 -2.44 0.00 0.00 57.07 51.95 3pcg s TYR 324 Cb 0.12 -3.82 0.39 0.00 0.35 0.00 0.00 41.96 39.00 3pcg s TYR 324 CO 0.53 -0.95 1.44 1.63 -1.34 0.00 0.00 175.55 176.85 3pcg n LYS 325 N 2.95 -0.11 0.20 4.97 5.02 -1.20 -1.06 118.16 128.93 3pcg n LYS 325 Ca 0.22 1.43 0.16 0.00 -2.02 0.00 0.00 58.31 58.10 3pcg n LYS 325 Cb 0.41 -2.14 0.79 0.00 -0.02 0.00 0.00 35.03 34.07 3pcg n LYS 325 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3pcg h THR 326 N 0.00 0.60 0.00 -0.18 2.02 -1.91 -0.74 112.91 112.70 3pcg h THR 326 Ca 0.42 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.58 3pcg h THR 326 Cb 0.65 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3pcg h THR 326 CO -0.94 0.00 -0.09 0.77 0.37 0.00 0.00 175.52 175.63 3pcg h SER 327 N 0.00 0.00 -0.15 4.18 4.64 -1.39 -3.16 113.55 117.67 3pcg h SER 327 Ca 0.08 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.45 3pcg h SER 327 Cb 0.42 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.44 3pcg h SER 327 CO -0.00 0.09 -0.32 0.40 -0.87 0.00 0.00 176.83 176.13 3pcg h ILE 328 N 0.00 0.29 -0.01 0.95 2.04 -1.26 -2.87 117.51 116.65 3pcg h ILE 328 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pcg h ILE 328 Cb 0.38 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3pcg h ILE 328 CO 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 178.15 178.00 3pcg n ALA 329 N -2.84 2.89 -1.45 1.87 0.00 -1.22 -4.02 120.51 115.74 3pcg n ALA 329 Ca -0.03 -0.47 -0.01 0.00 0.00 0.00 0.00 53.44 52.93 3pcg n ALA 329 Cb 0.32 -1.08 0.20 0.00 0.00 0.00 0.00 19.45 18.90 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 -0.09 1.82 -4.50 0.00 1.74 -1.11 -4.96 116.66 109.56 3pcg n ARG 330 Ca 0.14 -3.18 -0.23 0.00 -0.77 0.00 0.00 57.85 53.82 3pcg n ARG 330 Cb 0.39 -1.76 -0.16 0.00 -1.02 0.00 0.00 32.46 29.90 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 -2.68 1.56 0.70 0.55 1.04 -1.10 -4.94 113.70 108.84 3pcg s SER 331 Ca 0.43 -0.25 -0.16 0.00 0.48 0.00 0.00 55.95 56.44 3pcg s SER 331 Cb 0.39 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.88 3pcg s SER 331 CO -0.01 0.03 1.24 -2.16 0.98 0.00 0.00 173.24 173.32 3pcg s PRO 332 N 0.57 2.26 -0.07 4.02 0.04 -1.26 -4.94 135.00 135.62 3pcg s PRO 332 Ca -0.11 1.88 0.15 0.00 0.04 0.00 0.00 61.00 62.96 3pcg s PRO 332 Cb -0.14 -1.83 -0.22 0.00 0.04 0.00 0.00 34.50 32.35 3pcg s PRO 332 CO 0.02 -1.77 0.23 0.54 0.04 0.00 0.00 177.00 176.06 3pcg n ARG 333 N -2.43 0.93 -3.08 4.56 5.12 -1.26 -4.92 116.66 115.58 3pcg n ARG 333 Ca 0.14 -0.09 -0.30 0.00 -1.93 0.00 0.00 57.85 55.67 3pcg n ARG 333 Cb 0.49 -1.38 -0.04 0.00 -1.16 0.00 0.00 32.46 30.38 3pcg n ARG 333 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3pcg s GLN 334 N -2.80 3.76 0.48 5.56 -1.52 -1.26 -5.05 119.66 118.83 3pcg s GLN 334 Ca -0.06 0.34 -0.22 0.00 -1.95 0.00 0.00 55.36 53.46 3pcg s GLN 334 Cb 0.08 -2.49 -0.07 0.00 -0.22 0.00 0.00 33.01 30.31 3pcg s GLN 334 CO 0.64 0.09 1.15 0.00 -0.25 0.00 0.00 175.29 176.92 3pcg s ALA 335 N -2.19 2.90 0.66 6.09 0.00 -1.26 -4.99 121.76 122.96 3pcg s ALA 335 Ca 0.49 0.90 -0.17 0.00 0.00 0.00 0.00 51.96 53.18 3pcg s ALA 335 Cb -0.10 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.64 3pcg s ALA 335 CO 0.28 -0.68 1.21 -0.51 0.00 0.00 0.00 175.76 176.06 3pcg s LEU 336 N -3.23 3.50 -0.28 0.00 1.43 -1.26 -4.99 118.68 113.85 3pcg s LEU 336 Ca 0.66 2.36 -0.10 0.00 -1.03 0.00 0.00 54.13 56.02 3pcg s LEU 336 Cb -0.27 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.32 3pcg s LEU 336 CO 0.33 -1.89 0.16 -0.69 0.23 0.00 0.00 176.35 174.49 3pcg s VAL 337 N -1.79 4.95 0.05 -1.59 1.01 -1.26 -5.07 120.40 116.70 3pcg s VAL 337 Ca 0.76 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 62.42 3pcg s VAL 337 Cb -0.30 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.65 3pcg s VAL 337 CO 0.39 0.22 0.91 -0.44 0.00 0.00 0.00 175.10 176.19 3pcg s SER 338 N 1.70 7.37 0.09 3.32 0.01 -1.26 -5.06 113.70 119.87 3pcg s SER 338 Ca 0.06 1.65 0.07 0.00 1.31 0.00 0.00 55.95 59.04 3pcg s SER 338 Cb -0.16 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.49 3pcg s SER 338 CO 0.08 -0.12 -0.18 0.27 0.41 0.00 0.00 173.24 173.71 3pcg s ILE 339 N 0.38 1.43 0.66 1.44 -4.36 -1.26 -5.13 121.20 114.36 3pcg s ILE 339 Ca 0.46 -1.45 -0.17 0.00 -0.26 0.00 0.00 60.65 59.23 3pcg s ILE 339 Cb -0.22 -1.35 -0.00 0.00 1.25 0.00 0.00 42.46 42.15 3pcg s ILE 339 CO 0.27 -0.15 1.19 -2.16 0.24 0.00 0.00 174.94 174.33 3pcg s PRO 340 N -1.89 2.62 0.32 0.37 0.04 -1.26 -4.97 135.00 130.23 3pcg s PRO 340 Ca 0.03 1.73 -0.27 0.00 0.04 0.00 0.00 61.00 62.53 3pcg s PRO 340 Cb -0.10 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 3pcg s PRO 340 CO 0.03 -1.46 1.02 -0.65 0.04 0.00 0.00 177.00 175.98 3pcg s GLN 341 N -3.68 4.53 0.35 4.56 -0.21 -1.26 -5.03 119.66 118.92 3pcg s GLN 341 Ca 0.75 1.56 0.07 0.00 0.02 0.00 0.00 55.36 57.76 3pcg s GLN 341 Cb -0.28 -2.94 -0.03 0.00 1.00 0.00 0.00 33.01 30.76 3pcg s GLN 341 CO 0.39 0.18 0.25 -1.13 -2.12 0.00 0.00 175.29 172.86 3pcg n SER 342 N 0.75 -0.28 0.10 5.90 3.41 -1.26 -5.01 113.62 117.23 3pcg n SER 342 Ca 0.01 -3.17 0.17 0.00 -0.26 0.00 0.00 58.87 55.62 3pcg n SER 342 Cb 0.48 1.52 0.71 0.00 -0.26 0.00 0.00 64.21 66.66 3pcg n SER 342 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3pcg h ILE 343 N 1.98 0.73 -0.92 -1.33 2.10 -1.95 -0.18 117.51 117.93 3pcg h ILE 343 Ca -0.25 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.68 3pcg h ILE 343 Cb 1.19 0.81 -0.04 0.00 -1.09 0.00 0.00 36.82 37.69 3pcg h ILE 343 CO 0.37 0.00 0.55 0.28 -1.08 0.00 0.00 178.15 178.28 3pcg h SER 344 N 0.00 1.11 0.23 2.19 0.02 -1.95 -3.04 113.55 112.12 3pcg h SER 344 Ca 0.16 -0.07 -0.13 0.00 -0.84 0.00 0.00 61.79 60.91 3pcg h SER 344 Cb 0.68 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 3pcg h SER 344 CO -0.00 0.85 -1.89 -0.62 -1.14 0.00 0.00 176.83 174.04 3pcg n GLU 345 N -4.37 0.65 -0.09 3.45 4.71 -0.34 -4.46 120.64 120.20 3pcg n GLU 345 Ca 0.10 -0.04 0.12 0.00 -0.01 0.00 0.00 57.16 57.33 3pcg n GLU 345 Cb 0.06 -1.61 0.32 0.00 -1.01 0.00 0.00 31.44 29.20 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 -2.55 0.23 -4.22 2.62 -2.24 -0.23 -3.16 114.28 104.74 3pcg n THR 346 Ca -0.12 -0.46 -0.24 0.00 -2.27 0.00 0.00 64.05 60.96 3pcg n THR 346 Cb 0.77 0.70 -0.07 0.00 -2.10 0.00 0.00 70.33 69.63 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 -1.77 2.83 0.09 4.28 -4.23 -1.15 -4.71 115.64 110.98 3pcg s THR 347 Ca 0.34 -1.83 -0.27 0.00 -1.18 0.00 0.00 61.69 58.76 3pcg s THR 347 Cb 0.20 -2.89 0.08 0.00 1.34 0.00 0.00 72.50 71.23 3pcg s THR 347 CO 0.29 -0.19 1.00 -0.83 -0.54 0.00 0.00 174.62 174.35 3pcg s GLY 348 N -3.78 -0.31 0.53 3.99 0.00 -1.23 -1.54 107.32 104.98 3pcg s GLY 348 Ca 0.36 0.44 -0.20 0.00 0.00 0.00 0.00 44.72 45.32 3pcg s GLY 348 CO 0.21 0.10 1.12 2.56 0.00 0.00 0.00 173.10 177.10 3pcg s PRO 349 N -3.10 3.45 -0.14 2.90 0.04 -1.26 -4.88 135.00 132.00 3pcg s PRO 349 Ca 0.11 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.75 3pcg s PRO 349 Cb -0.00 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 3pcg s PRO 349 CO -0.01 -0.77 -0.14 1.21 0.04 0.00 0.00 177.00 177.33 3pcg s ASN 350 N -1.76 3.82 -0.11 6.66 3.84 -1.26 -4.90 114.94 121.24 3pcg s ASN 350 Ca 0.71 -0.40 0.18 0.00 0.21 0.00 0.00 52.86 53.56 3pcg s ASN 350 Cb -0.23 -1.59 0.71 0.00 -0.55 0.00 0.00 41.25 39.59 3pcg s ASN 350 CO 0.27 0.12 1.61 0.49 -2.79 0.00 0.00 177.10 176.80 3pcg n PHE 351 N 3.81 1.47 -0.35 0.43 3.72 -1.26 -4.59 117.46 120.68 3pcg n PHE 351 Ca -0.19 -0.58 0.14 0.00 -0.05 0.00 0.00 57.45 56.77 3pcg n PHE 351 Cb 0.52 -0.24 0.34 0.00 -0.94 0.00 0.00 39.48 39.16 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 3.99 0.76 -0.15 4.37 0.02 -1.96 0.29 113.55 120.87 3pcg h SER 352 Ca 0.00 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3pcg h SER 352 Cb 1.43 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.95 3pcg h SER 352 CO 0.23 0.23 0.00 1.41 -1.14 0.00 0.00 176.83 177.56 3pcg n HIS 353 N -4.80 0.19 -2.33 3.45 8.25 -1.26 -4.88 115.22 113.83 3pcg n HIS 353 Ca 0.24 -0.09 -0.41 0.00 -0.26 0.00 0.00 57.72 57.20 3pcg n HIS 353 Cb 0.62 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.70 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 -1.54 4.46 -0.63 2.41 2.96 0.09 -4.95 118.68 121.49 3pcg s LEU 354 Ca 0.31 2.34 -0.22 0.00 -0.22 0.00 0.00 54.13 56.34 3pcg s LEU 354 Cb 0.16 -3.62 0.07 0.00 0.50 0.00 0.00 46.19 43.31 3pcg s LEU 354 CO 0.25 -0.38 0.89 -0.83 -1.32 0.00 0.00 176.35 174.96 3pcg s GLY 355 N -0.14 1.48 0.07 7.98 0.00 -1.26 -5.02 107.32 110.44 3pcg s GLY 355 Ca 0.51 -1.88 -0.20 0.00 0.00 0.00 0.00 44.72 43.15 3pcg s GLY 355 CO 0.40 1.93 0.59 -1.36 0.00 0.00 0.00 173.10 174.66 3pcg s PHE 356 N 3.69 3.80 0.87 1.90 0.40 -1.26 -5.08 117.98 122.30 3pcg s PHE 356 Ca 0.20 1.30 -0.12 0.00 -0.60 0.00 0.00 56.93 57.71 3pcg s PHE 356 Cb -0.18 -2.54 0.11 0.00 0.51 0.00 0.00 43.02 40.92 3pcg s PHE 356 CO 0.10 0.55 1.10 0.20 0.70 0.00 0.00 175.22 177.87 3pcg s GLY 357 N -0.99 1.61 0.39 4.36 0.00 -1.26 -4.96 107.32 106.47 3pcg s GLY 357 Ca 0.30 -0.22 0.06 0.00 0.00 0.00 0.00 44.72 44.85 3pcg s GLY 357 CO 0.19 0.26 2.01 0.00 0.00 0.00 0.00 173.10 175.57 3pcg h ALA 358 N -1.39 1.61 -0.27 3.20 0.00 -2.03 -2.77 119.26 117.63 3pcg h ALA 358 Ca -0.49 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 3pcg h ALA 358 Cb 1.29 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3pcg h ALA 358 CO 0.58 0.33 0.00 0.72 0.00 0.00 0.00 179.25 180.88 3pcg n HIS 359 N -4.43 0.96 -0.34 0.00 8.25 -1.26 -4.72 115.22 113.68 3pcg n HIS 359 Ca 0.03 -0.90 0.11 0.00 -0.26 0.00 0.00 57.72 56.70 3pcg n HIS 359 Cb 0.09 -0.32 0.29 0.00 1.12 0.00 0.00 29.99 31.17 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 1.79 0.73 -0.26 0.41 5.19 -1.78 -0.82 116.42 121.67 3pcg h ASP 360 Ca 0.01 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 3pcg h ASP 360 Cb 1.46 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.94 3pcg h ASP 360 CO 0.23 0.27 0.00 0.00 -3.12 0.00 0.00 179.24 176.63 3pcg n HIS 361 N -4.79 0.33 -3.78 4.55 1.44 -1.16 -2.48 115.22 109.33 3pcg n HIS 361 Ca 0.21 -0.16 -0.35 0.00 -2.01 0.00 0.00 57.72 55.41 3pcg n HIS 361 Cb 0.52 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.52 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 -1.59 5.11 0.00 4.39 -1.08 -0.31 -2.04 116.67 121.14 3pcg s ASP 362 Ca 0.35 -2.53 0.14 0.00 -0.52 0.00 0.00 52.55 49.99 3pcg s ASP 362 Cb 0.21 -1.81 0.67 0.00 -1.46 0.00 0.00 42.92 40.53 3pcg s ASP 362 CO 0.30 -0.42 1.39 0.18 0.52 0.00 0.00 175.17 177.14 3pcg n LEU 363 N 3.90 0.00 0.12 -1.34 4.32 0.77 -1.32 117.00 123.45 3pcg n LEU 363 Ca 0.04 0.34 0.04 0.00 -0.02 0.00 0.00 56.01 56.41 3pcg n LEU 363 Cb 0.39 -0.34 0.02 0.00 -1.62 0.00 0.00 43.42 41.87 3pcg n LEU 363 CO 0.33 -0.18 0.31 -0.07 -1.22 0.00 0.00 177.39 176.55 3pcg h LEU 364 N 0.00 0.00 0.00 2.23 4.07 -1.91 -3.39 115.31 116.31 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 0.38 -0.05 0.18 -1.08 0.00 0.00 178.44 177.88 3pcg n LEU 365 N -3.07 0.00 -0.00 1.67 4.77 -0.89 -4.54 117.00 114.94 3pcg n LEU 365 Ca -0.00 -0.38 0.15 0.00 -0.03 0.00 0.00 56.01 55.74 3pcg n LEU 365 Cb 0.70 0.00 0.73 0.00 -2.33 0.00 0.00 43.42 42.52 3pcg n LEU 365 CO 0.40 0.00 1.01 -0.46 -1.33 0.00 0.00 177.39 177.01 3pcg n ASN 366 N -0.83 0.00 0.00 -1.43 0.23 -0.43 -5.02 115.26 107.78 3pcg n ASN 366 Ca 0.00 -0.01 0.00 0.00 -0.53 0.00 0.00 54.58 54.04 3pcg n ASN 366 Cb 0.00 -0.33 0.00 0.00 -2.08 0.00 0.00 39.78 37.37 3pcg n ASN 366 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 3pcg n PHE 367 N -1.33 0.00 0.00 -2.53 7.35 -1.26 -4.99 117.46 114.70 3pcg n PHE 367 Ca 0.13 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.82 3pcg n PHE 367 Cb 0.26 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.09 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 2.33 0.00 3.86 7.13 0.00 -1.26 -4.74 105.19 112.52 3pcg n GLY 371 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 4.42 0.69 0.99 1.02 -1.26 -4.75 118.68 119.78 3pcg s LEU 372 Ca 0.00 0.67 -0.17 0.00 0.02 0.00 0.00 54.13 54.66 3pcg s LEU 372 Cb 0.00 -2.35 0.00 0.00 0.02 0.00 0.00 46.19 43.86 3pcg s LEU 372 CO 0.00 0.36 1.17 -2.65 0.02 0.00 0.00 176.35 175.25 3pcg n PRO 373 N 1.79 0.81 -3.19 1.29 -0.02 -1.26 -4.82 135.00 129.61 3pcg n PRO 373 Ca -0.16 0.33 -0.39 0.00 -2.02 0.00 0.00 63.50 61.26 3pcg n PRO 373 Cb 0.54 -2.41 -0.06 0.00 -0.02 0.00 0.00 33.50 31.55 3pcg n PRO 373 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3pcg s ILE 374 N -1.61 4.87 0.00 4.25 1.01 -1.26 -4.99 121.20 123.47 3pcg s ILE 374 Ca 0.79 1.29 0.00 0.00 0.00 0.00 0.00 60.65 62.72 3pcg s ILE 374 Cb -0.36 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.16 3pcg s ILE 374 CO 0.45 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.42 3pcg n GLY 375 N 2.36 2.33 3.60 6.18 0.00 -1.26 -4.52 105.19 113.87 3pcg n GLY 375 Ca -0.07 -1.65 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 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 -1.79 3.56 0.13 1.61 2.02 -1.26 -4.91 118.70 118.06 3pcg s GLU 376 Ca 0.00 0.97 -0.31 0.00 0.02 0.00 0.00 54.97 55.65 3pcg s GLU 376 Cb 0.00 -4.04 -0.08 0.00 0.10 0.00 0.00 34.13 30.11 3pcg s GLU 376 CO 0.00 -1.58 1.41 1.03 0.02 0.00 0.00 175.26 176.14 3pcg s ARG 377 N 4.98 4.31 0.07 1.61 0.52 -1.26 -0.99 118.95 128.19 3pcg s ARG 377 Ca 0.62 2.13 -0.13 0.00 -0.52 0.00 0.00 55.73 57.83 3pcg s ARG 377 Cb -0.14 -3.22 0.02 0.00 0.52 0.00 0.00 34.95 32.12 3pcg s ARG 377 CO 0.33 -0.45 0.30 0.96 0.02 0.00 0.00 175.30 176.46 3pcg s ILE 378 N 1.00 0.09 -0.12 1.52 -4.36 -0.08 -1.93 121.20 117.31 3pcg s ILE 378 Ca 0.65 -0.76 -0.02 0.00 -0.26 0.00 0.00 60.65 60.26 3pcg s ILE 378 Cb -0.38 -1.08 -0.03 0.00 1.25 0.00 0.00 42.46 42.23 3pcg s ILE 378 CO 0.31 -0.42 -0.05 -0.63 0.24 0.00 0.00 174.94 174.39 3pcg s ILE 379 N -3.11 3.81 -0.22 8.37 1.01 -0.18 -0.41 121.20 130.48 3pcg s ILE 379 Ca -0.01 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.25 3pcg s ILE 379 Cb 0.01 -2.63 0.04 0.00 0.01 0.00 0.00 42.46 39.89 3pcg s ILE 379 CO -0.07 0.53 -0.15 -0.69 0.00 0.00 0.00 174.94 174.57 3pcg s VAL 380 N -0.07 2.07 0.10 2.92 1.01 0.32 -0.50 120.40 126.25 3pcg s VAL 380 Ca 0.01 -1.28 -0.02 0.00 0.00 0.00 0.00 61.98 60.69 3pcg s VAL 380 Cb -0.13 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 3pcg s VAL 380 CO 0.03 0.23 0.04 0.00 0.00 0.00 0.00 175.10 175.40 3pcg s ALA 381 N 1.21 0.63 0.00 5.51 0.00 -0.76 -0.23 121.76 128.13 3pcg s ALA 381 Ca -0.02 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.63 3pcg s ALA 381 Cb -0.17 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.59 3pcg s ALA 381 CO -0.09 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 175.63 3pcg n GLY 382 N -0.03 -1.08 3.28 0.00 0.00 -0.90 -0.60 105.19 105.86 3pcg n GLY 382 Ca -0.09 -0.89 -0.19 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.65 1.12 -0.23 1.61 3.52 -1.25 -1.16 118.95 121.92 3pcg s ARG 383 Ca 0.00 -1.32 -0.04 0.00 -0.13 0.00 0.00 55.73 54.24 3pcg s ARG 383 Cb 0.00 -1.03 -0.01 0.00 -1.56 0.00 0.00 34.95 32.35 3pcg s ARG 383 CO 0.00 0.20 -0.03 0.08 -0.81 0.00 0.00 175.30 174.74 3pcg s VAL 384 N -2.22 3.43 0.30 7.11 1.01 0.61 -0.75 120.40 129.88 3pcg s VAL 384 Ca 0.12 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.63 3pcg s VAL 384 Cb -0.04 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.69 3pcg s VAL 384 CO 0.04 0.38 0.00 0.68 0.00 0.00 0.00 175.10 176.21 3pcg s VAL 385 N 1.48 1.39 0.56 2.92 -7.23 -0.01 -1.24 120.40 118.27 3pcg s VAL 385 Ca 0.05 -2.05 0.07 0.00 -1.81 0.00 0.00 61.98 58.24 3pcg s VAL 385 Cb -0.15 -2.61 0.07 0.00 0.56 0.00 0.00 36.38 34.25 3pcg s VAL 385 CO -0.03 -0.16 0.77 1.51 -0.31 0.00 0.00 175.10 176.88 3pcg s ASP 386 N -3.46 5.13 0.50 4.85 -4.77 -0.20 0.76 116.67 119.48 3pcg s ASP 386 Ca 0.33 -0.61 0.34 0.00 -3.30 0.00 0.00 52.55 49.30 3pcg s ASP 386 Cb 0.07 -0.06 1.63 0.00 -1.09 0.00 0.00 42.92 43.46 3pcg s ASP 386 CO 0.13 -1.27 2.01 1.56 0.70 0.00 0.00 175.17 178.30 3pcg h GLN 387 N 0.17 0.00 -0.01 2.11 4.20 -1.34 -0.44 115.11 119.80 3pcg h GLN 387 Ca -0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.37 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 0.42 0.00 -0.09 0.66 -0.67 0.00 0.00 178.83 179.16 3pcg n TYR 388 N -2.79 0.00 -0.67 2.96 4.01 -1.26 -4.92 117.16 114.49 3pcg n TYR 388 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3pcg n TYR 388 Cb 0.17 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 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 1.23 0.71 3.74 2.72 0.00 -0.17 -5.05 105.19 108.36 3pcg n GLY 389 Ca 0.16 0.00 -0.40 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 -0.33 4.78 0.60 1.61 2.20 -1.26 -4.75 119.74 122.59 3pcg s LYS 390 Ca 0.00 1.44 -0.18 0.00 -0.36 0.00 0.00 55.97 56.87 3pcg s LYS 390 Cb 0.00 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.98 3pcg s LYS 390 CO 0.00 0.42 1.14 -2.14 -0.36 0.00 0.00 175.35 174.41 3pcg s PRO 391 N -0.78 3.05 -0.60 4.03 0.02 -1.26 -1.03 135.00 138.43 3pcg s PRO 391 Ca 0.42 1.60 0.00 0.00 0.02 0.00 0.00 61.00 63.04 3pcg s PRO 391 Cb -0.25 -1.96 0.15 0.00 0.02 0.00 0.00 34.50 32.46 3pcg s PRO 391 CO 0.31 -1.09 0.38 0.08 -0.33 0.00 0.00 177.00 176.35 3pcg s VAL 392 N -1.92 3.26 0.61 3.83 1.01 -0.37 -4.83 120.40 121.99 3pcg s VAL 392 Ca 0.72 -3.19 -0.12 0.00 0.00 0.00 0.00 61.98 59.38 3pcg s VAL 392 Cb -0.24 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 3pcg s VAL 392 CO 0.33 -0.86 1.03 -2.16 0.00 0.00 0.00 175.10 173.44 3pcg s PRO 393 N -0.26 3.55 -1.47 2.72 0.04 -1.26 -4.21 135.00 134.11 3pcg s PRO 393 Ca 0.18 0.84 -0.07 0.00 0.04 0.00 0.00 61.00 61.99 3pcg s PRO 393 Cb -0.22 -2.07 0.05 0.00 0.04 0.00 0.00 34.50 32.30 3pcg s PRO 393 CO -0.03 -0.61 0.70 0.09 0.04 0.00 0.00 177.00 177.19 3pcg n ASN 394 N -2.56 -2.23 -4.66 6.66 4.13 -0.36 -4.91 115.26 111.33 3pcg n ASN 394 Ca 0.06 -0.91 -0.30 0.00 1.68 0.00 0.00 54.58 55.11 3pcg n ASN 394 Cb 0.54 -3.44 -0.09 0.00 -1.54 0.00 0.00 39.78 35.25 3pcg n ASN 394 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 3pcg s THR 395 N -3.60 3.88 -0.08 3.41 -1.32 -1.26 -4.55 115.64 112.12 3pcg s THR 395 Ca 0.31 -1.00 -0.25 0.00 -1.21 0.00 0.00 61.69 59.55 3pcg s THR 395 Cb -0.16 -2.82 -0.03 0.00 -1.51 0.00 0.00 72.50 67.98 3pcg s THR 395 CO 0.86 0.16 0.76 -0.22 -2.21 0.00 0.00 174.62 173.98 3pcg s LEU 396 N -2.16 4.29 -0.21 9.08 2.96 -1.26 -0.74 118.68 130.63 3pcg s LEU 396 Ca 0.24 1.24 0.02 0.00 -0.22 0.00 0.00 54.13 55.41 3pcg s LEU 396 Cb -0.12 -3.18 0.04 0.00 0.50 0.00 0.00 46.19 43.43 3pcg s LEU 396 CO 0.16 -0.20 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.14 3pcg s VAL 397 N 1.14 2.05 0.08 1.68 1.01 -0.46 -1.04 120.40 124.85 3pcg s VAL 397 Ca 0.39 -1.19 0.08 0.00 0.00 0.00 0.00 61.98 61.27 3pcg s VAL 397 Cb -0.18 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3pcg s VAL 397 CO 0.18 0.30 -0.20 -1.61 0.00 0.00 0.00 175.10 173.77 3pcg s GLU 398 N 1.24 1.86 0.03 2.72 2.02 0.41 -0.97 118.70 126.02 3pcg s GLU 398 Ca -0.01 -1.10 -0.03 0.00 0.02 0.00 0.00 54.97 53.85 3pcg s GLU 398 Cb -0.16 -2.10 -0.02 0.00 0.10 0.00 0.00 34.13 31.95 3pcg s GLU 398 CO -0.10 0.51 0.04 0.00 0.02 0.00 0.00 175.26 175.73 3pcg s MET 399 N -1.70 0.50 -0.04 1.61 0.23 -0.14 -0.94 119.30 118.82 3pcg s MET 399 Ca 0.15 -0.77 -0.19 0.00 -1.03 0.00 0.00 55.69 53.85 3pcg s MET 399 Cb -0.10 0.19 0.04 0.00 -1.53 0.00 0.00 34.83 33.42 3pcg s MET 399 CO 0.06 -0.11 0.42 1.67 -2.03 0.00 0.00 175.02 175.03 3pcg s TRP 400 N -2.42 -0.33 0.26 3.16 -2.14 -0.90 -1.60 118.94 114.98 3pcg s TRP 400 Ca -0.07 0.57 -0.20 0.00 2.66 0.00 0.00 56.10 59.06 3pcg s TRP 400 Cb -0.03 0.18 0.06 0.00 -3.10 0.00 0.00 33.47 30.59 3pcg s TRP 400 CO -0.04 -0.43 0.91 1.14 -2.66 0.00 0.00 176.95 175.86 3pcg s GLN 401 N -1.16 1.69 0.78 3.25 -2.07 -0.32 -0.67 119.66 121.16 3pcg s GLN 401 Ca -0.12 -1.05 -0.05 0.00 -1.82 0.00 0.00 55.36 52.32 3pcg s GLN 401 Cb -0.04 0.49 0.16 0.00 -1.09 0.00 0.00 33.01 32.54 3pcg s GLN 401 CO 0.05 -0.79 1.06 0.00 -1.32 0.00 0.00 175.29 174.30 3pcg n ALA 402 N -0.58 -0.35 -1.64 2.60 0.00 -1.26 -4.62 120.51 114.65 3pcg n ALA 402 Ca -0.06 -1.80 -0.02 0.00 0.00 0.00 0.00 53.44 51.56 3pcg n ALA 402 Cb 0.60 0.18 0.02 0.00 0.00 0.00 0.00 19.45 20.24 3pcg n ALA 402 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3pcg n ASN 403 N -3.21 0.07 0.26 0.00 0.23 -0.03 -4.55 115.26 108.02 3pcg n ASN 403 Ca 0.16 -1.07 0.18 0.00 -0.53 0.00 0.00 54.58 53.31 3pcg n ASN 403 Cb 0.56 -0.08 0.91 0.00 -2.08 0.00 0.00 39.78 39.09 3pcg n ASN 403 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3pcg h ALA 404 N -1.27 1.58 -0.06 -2.53 0.00 -1.80 -1.42 119.26 113.76 3pcg h ALA 404 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3pcg h ALA 404 Cb 0.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3pcg h ALA 404 CO 0.03 -0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.48 3pcg n GLY 405 N -1.32 0.97 1.56 0.00 0.00 -1.26 -3.48 105.19 101.66 3pcg n GLY 405 Ca -0.00 -0.67 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 1.31 0.52 3.72 -0.02 0.00 -0.58 -4.81 105.19 105.33 3pcg n GLY 406 Ca 0.14 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.51 4.23 0.09 1.61 6.06 -1.26 -4.71 118.95 123.47 3pcg s ARG 407 Ca 0.00 0.01 -0.07 0.00 -2.50 0.00 0.00 55.73 53.17 3pcg s ARG 407 Cb 0.00 -3.43 -0.05 0.00 0.06 0.00 0.00 34.95 31.52 3pcg s ARG 407 CO 0.00 0.23 0.36 0.71 -2.50 0.00 0.00 175.30 174.11 3pcg s TYR 408 N 0.51 3.53 -1.20 5.12 2.02 -1.26 -0.86 117.35 125.22 3pcg s TYR 408 Ca 0.14 0.64 -0.10 0.00 -0.37 0.00 0.00 57.07 57.39 3pcg s TYR 408 Cb -0.13 -2.06 0.21 0.00 -0.40 0.00 0.00 41.96 39.59 3pcg s TYR 408 CO 0.02 0.50 1.53 -2.13 -1.57 0.00 0.00 175.55 173.91 3pcg n ARG 409 N 0.59 3.66 -3.73 -0.62 0.63 -1.26 -4.77 116.66 111.16 3pcg n ARG 409 Ca -0.06 -3.97 -0.12 0.00 -0.92 0.00 0.00 57.85 52.78 3pcg n ARG 409 Cb 0.52 -2.84 -0.11 0.00 0.45 0.00 0.00 32.46 30.49 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 -0.00 -0.44 0.24 -0.14 2.46 -1.26 -5.07 115.29 111.07 3pcg s HIS 410 Ca 0.38 1.03 -0.16 0.00 0.47 0.00 0.00 55.06 56.78 3pcg s HIS 410 Cb 0.01 0.16 0.29 0.00 -0.13 0.00 0.00 32.58 32.91 3pcg s HIS 410 CO 0.01 -0.24 1.55 0.87 -2.47 0.00 0.00 174.74 174.46 3pcg h LYS 411 N 6.32 -0.00 0.00 2.88 1.57 -2.07 -0.47 116.57 124.80 3pcg h LYS 411 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3pcg h LYS 411 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3pcg h LYS 411 CO 0.30 -0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.27 3pcg n ASN 412 N -5.50 0.00 -4.47 0.86 5.03 -1.26 -4.66 115.26 105.26 3pcg n ASN 412 Ca 0.11 0.10 -0.43 0.00 0.87 0.00 0.00 54.58 55.23 3pcg n ASN 412 Cb 0.42 -0.29 -0.07 0.00 -1.02 0.00 0.00 39.78 38.82 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 -2.59 6.23 -0.26 6.41 2.15 -0.19 -4.90 116.67 123.53 3pcg s ASP 413 Ca 0.13 -0.75 0.12 0.00 0.43 0.00 0.00 52.55 52.48 3pcg s ASP 413 Cb 0.10 -2.27 0.52 0.00 -0.30 0.00 0.00 42.92 40.97 3pcg s ASP 413 CO 0.22 -0.76 1.47 0.54 -0.17 0.00 0.00 175.17 176.47 3pcg n ARG 414 N 5.96 2.26 -2.03 4.34 5.12 -1.26 -4.89 116.66 126.17 3pcg n ARG 414 Ca -0.06 -3.04 -0.38 0.00 -1.93 0.00 0.00 57.85 52.43 3pcg n ARG 414 Cb 0.46 -1.85 0.01 0.00 -1.16 0.00 0.00 32.46 29.92 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 2.68 -0.66 -1.55 5.04 -1.26 -4.89 117.35 113.61 3pcg s TYR 415 Ca 0.44 1.43 0.20 0.00 -2.44 0.00 0.00 57.07 56.70 3pcg s TYR 415 Cb 0.39 -3.63 0.85 0.00 0.35 0.00 0.00 41.96 39.91 3pcg s TYR 415 CO 0.04 -2.17 1.61 1.47 -1.34 0.00 0.00 175.55 175.16 3pcg n LEU 416 N -0.37 0.43 -4.75 6.97 -0.00 -1.26 -4.75 117.00 113.27 3pcg n LEU 416 Ca 0.07 0.61 -0.41 0.00 -0.00 0.00 0.00 56.01 56.27 3pcg n LEU 416 Cb 0.45 -0.56 -0.03 0.00 -0.00 0.00 0.00 43.42 43.28 3pcg n LEU 416 CO 0.53 -0.47 0.89 0.00 -0.00 0.00 0.00 177.39 178.34 3pcg s ALA 417 N -3.21 3.45 0.75 1.47 0.00 -1.26 -4.98 121.76 117.98 3pcg s ALA 417 Ca 0.05 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 52.89 3pcg s ALA 417 Cb 0.09 -3.42 0.05 0.00 0.00 0.00 0.00 23.12 19.84 3pcg s ALA 417 CO 0.34 -0.39 1.11 -1.25 0.00 0.00 0.00 175.76 175.57 3pcg s PRO 418 N -0.63 2.27 0.56 0.00 0.04 -1.26 -4.75 135.00 131.23 3pcg s PRO 418 Ca 0.51 1.33 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 3pcg s PRO 418 Cb -0.34 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 3pcg s PRO 418 CO 0.40 -1.65 1.02 -0.51 0.04 0.00 0.00 177.00 176.29 3pcg s LEU 419 N -5.60 3.52 -0.25 -3.56 1.43 -1.26 -4.76 118.68 108.19 3pcg s LEU 419 Ca 0.65 1.66 -0.07 0.00 -1.03 0.00 0.00 54.13 55.34 3pcg s LEU 419 Cb -0.20 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.49 3pcg s LEU 419 CO 0.51 -0.89 0.06 -0.62 0.23 0.00 0.00 176.35 175.64 3pcg s ASP 420 N -3.07 5.02 0.55 2.29 -1.08 -1.26 -5.00 116.67 114.12 3pcg s ASP 420 Ca 0.60 -0.32 0.25 0.00 -0.52 0.00 0.00 52.55 52.56 3pcg s ASP 420 Cb -0.13 -1.89 1.46 0.00 -1.46 0.00 0.00 42.92 40.90 3pcg s ASP 420 CO 0.36 -0.06 2.06 1.55 0.52 0.00 0.00 175.17 179.60 3pcg h PRO 421 N 8.22 0.00 -0.64 4.34 0.13 -1.97 -0.88 132.00 141.21 3pcg h PRO 421 Ca -0.38 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.63 3pcg h PRO 421 Cb 1.16 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.22 3pcg h PRO 421 CO 0.59 0.00 0.15 0.09 -0.23 0.00 0.00 178.00 178.60 3pcg n ASN 422 N -4.21 5.00 -3.80 1.44 4.13 -1.26 -4.94 115.26 111.62 3pcg n ASN 422 Ca 0.04 -3.13 -0.17 0.00 1.68 0.00 0.00 54.58 53.01 3pcg n ASN 422 Cb 0.41 -0.71 -0.16 0.00 -1.54 0.00 0.00 39.78 37.78 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 -2.92 0.24 -0.10 3.10 5.36 -0.34 -4.05 117.98 119.26 3pcg s PHE 423 Ca 0.54 0.04 -0.10 0.00 -0.96 0.00 0.00 56.93 56.44 3pcg s PHE 423 Cb 0.43 -0.37 -0.03 0.00 -0.34 0.00 0.00 43.02 42.70 3pcg s PHE 423 CO 0.14 -0.12 -0.20 0.41 -1.46 0.00 0.00 175.22 173.99 3pcg n GLY 424 N 4.17 -0.55 0.00 13.12 0.00 -1.26 -4.67 105.19 116.00 3pcg n GLY 424 Ca -0.26 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 1.50 1.44 3.14 -0.02 0.00 -1.26 -4.49 105.19 105.50 3pcg n GLY 425 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 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 1.18 0.10 1.61 1.01 -1.26 -1.17 120.40 119.87 3pcg s VAL 426 Ca 0.00 -0.81 -0.15 0.00 0.00 0.00 0.00 61.98 61.02 3pcg s VAL 426 Cb 0.00 -1.02 0.03 0.00 0.00 0.00 0.00 36.38 35.39 3pcg s VAL 426 CO 0.00 0.20 0.36 -0.83 0.00 0.00 0.00 175.10 174.83 3pcg s GLY 427 N -0.70 -0.21 -0.01 4.51 0.00 -0.63 -4.76 107.32 105.53 3pcg s GLY 427 Ca 0.04 -0.07 -0.14 0.00 0.00 0.00 0.00 44.72 44.55 3pcg s GLY 427 CO 0.00 -0.32 0.29 1.09 0.00 0.00 0.00 173.10 174.16 3pcg s ARG 428 N -3.52 0.66 -0.21 2.90 1.70 -1.03 -0.97 118.95 118.47 3pcg s ARG 428 Ca 0.01 -0.24 -0.19 0.00 -0.47 0.00 0.00 55.73 54.84 3pcg s ARG 428 Cb 0.02 0.29 0.05 0.00 -0.57 0.00 0.00 34.95 34.74 3pcg s ARG 428 CO -0.10 -0.18 0.56 0.00 -1.08 0.00 0.00 175.30 174.50 3pcg s LEU 430 N 0.31 4.27 0.63 0.00 2.96 -1.26 -1.36 118.68 124.24 3pcg s LEU 430 Ca -0.00 0.46 -0.17 0.00 -0.22 0.00 0.00 54.13 54.20 3pcg s LEU 430 Cb -0.04 -2.27 -0.01 0.00 0.50 0.00 0.00 46.19 44.37 3pcg s LEU 430 CO 0.01 0.18 1.15 0.42 -1.32 0.00 0.00 176.35 176.79 3pcg s THR 431 N 0.12 2.92 0.39 3.68 -4.23 0.08 -4.82 115.64 113.78 3pcg s THR 431 Ca 0.14 0.49 -0.05 0.00 -1.18 0.00 0.00 61.69 61.10 3pcg s THR 431 Cb -0.13 -3.08 0.09 0.00 1.34 0.00 0.00 72.50 70.72 3pcg s THR 431 CO 0.03 -0.20 0.53 -0.90 -0.54 0.00 0.00 174.62 173.54 3pcg n ASP 432 N -2.05 0.25 0.17 3.99 5.68 -0.78 -1.23 116.55 122.58 3pcg n ASP 432 Ca 0.12 -1.32 0.14 0.00 -0.50 0.00 0.00 54.79 53.23 3pcg n ASP 432 Cb 0.51 -0.39 0.71 0.00 -1.14 0.00 0.00 41.12 40.81 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 -0.58 0.00 -0.03 -1.12 0.02 -1.94 -0.44 113.55 109.45 3pcg h SER 433 Ca -0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3pcg h SER 433 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 3pcg h SER 433 CO 0.14 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.30 3pcg n ASP 434 N -4.32 1.88 0.00 3.07 8.00 -1.26 -4.52 116.55 119.41 3pcg n ASP 434 Ca 0.02 -1.63 0.00 0.00 0.71 0.00 0.00 54.79 53.89 3pcg n ASP 434 Cb 0.29 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 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 1.22 0.62 3.81 0.44 0.00 -0.18 -4.74 105.19 106.37 3pcg n GLY 435 Ca 0.18 -0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.00 3.74 0.12 1.61 2.02 -1.26 -0.29 117.35 121.29 3pcg s TYR 436 Ca 0.00 1.30 0.02 0.00 -0.37 0.00 0.00 57.07 58.02 3pcg s TYR 436 Cb 0.00 -2.53 -0.04 0.00 -0.40 0.00 0.00 41.96 38.98 3pcg s TYR 436 CO 0.00 0.48 -0.05 1.52 -1.57 0.00 0.00 175.55 175.93 3pcg s TYR 437 N -1.29 0.96 0.01 2.71 -0.85 -0.31 -1.87 117.35 116.71 3pcg s TYR 437 Ca 0.35 -0.94 -0.19 0.00 -0.52 0.00 0.00 57.07 55.77 3pcg s TYR 437 Cb -0.18 -0.55 0.04 0.00 0.38 0.00 0.00 41.96 41.64 3pcg s TYR 437 CO 0.20 -0.17 0.42 -1.54 -1.52 0.00 0.00 175.55 172.94 3pcg s SER 438 N -3.07 -0.31 0.03 -0.18 1.04 -1.26 -2.11 113.70 107.84 3pcg s SER 438 Ca 0.15 0.14 -0.04 0.00 0.48 0.00 0.00 55.95 56.68 3pcg s SER 438 Cb 0.05 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.56 3pcg s SER 438 CO -0.03 -0.58 0.05 -0.36 0.98 0.00 0.00 173.24 173.30 3pcg s PHE 439 N -1.89 0.25 -0.09 5.02 0.08 0.68 -4.88 117.98 117.15 3pcg s PHE 439 Ca -0.09 -0.58 0.02 0.00 0.12 0.00 0.00 56.93 56.40 3pcg s PHE 439 Cb -0.02 -0.19 0.01 0.00 -0.57 0.00 0.00 43.02 42.26 3pcg s PHE 439 CO 0.02 -0.33 -0.14 0.50 -0.10 0.00 0.00 175.22 175.17 3pcg s ARG 440 N -2.53 2.00 0.00 0.44 3.52 -0.87 -0.52 118.95 121.00 3pcg s ARG 440 Ca -0.06 -0.49 0.00 0.00 -0.13 0.00 0.00 55.73 55.05 3pcg s ARG 440 Cb -0.02 -1.69 0.00 0.00 -1.56 0.00 0.00 34.95 31.68 3pcg s ARG 440 CO -0.04 -0.03 0.00 -2.37 -0.81 0.00 0.00 175.30 172.04 3pcg n THR 441 N 4.08 0.00 -4.43 4.11 5.66 0.45 -0.17 114.28 123.99 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 0.51 0.00 -0.13 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 -2.59 2.50 0.10 1.09 -4.36 -1.26 -0.91 121.20 115.77 3pcg s ILE 442 Ca 0.00 -1.59 -0.31 0.00 -0.26 0.00 0.00 60.65 58.49 3pcg s ILE 442 Cb 0.00 -2.11 -0.07 0.00 1.25 0.00 0.00 42.46 41.53 3pcg s ILE 442 CO 0.00 0.14 1.36 -0.75 0.24 0.00 0.00 174.94 175.93 3pcg s LYS 443 N -1.97 4.33 0.80 0.37 2.20 -0.16 -4.91 119.74 120.41 3pcg s LYS 443 Ca 0.15 2.02 -0.11 0.00 -0.36 0.00 0.00 55.97 57.67 3pcg s LYS 443 Cb -0.10 -3.29 0.07 0.00 -1.51 0.00 0.00 37.83 33.00 3pcg s LYS 443 CO 0.07 -0.42 1.09 -1.25 -0.36 0.00 0.00 175.35 174.48 3pcg s PRO 444 N 1.20 2.06 0.14 4.03 0.04 -1.26 -4.26 135.00 136.96 3pcg s PRO 444 Ca 0.64 0.84 0.04 0.00 0.04 0.00 0.00 61.00 62.56 3pcg s PRO 444 Cb -0.35 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 3pcg s PRO 444 CO 0.30 -1.69 0.15 0.20 0.04 0.00 0.00 177.00 176.01 3pcg s GLY 445 N -3.67 1.78 1.04 0.56 0.00 -0.93 -4.72 107.32 101.38 3pcg s GLY 445 Ca 0.61 -1.14 -0.12 0.00 0.00 0.00 0.00 44.72 44.07 3pcg s GLY 445 CO 0.55 -1.14 1.07 2.56 0.00 0.00 0.00 173.10 176.15 3pcg s PRO 446 N -2.98 0.05 -0.02 2.90 0.04 -1.26 -3.99 135.00 129.73 3pcg s PRO 446 Ca 0.31 0.75 -0.21 0.00 0.04 0.00 0.00 61.00 61.89 3pcg s PRO 446 Cb -0.11 -1.67 0.04 0.00 0.04 0.00 0.00 34.50 32.80 3pcg s PRO 446 CO 0.24 -3.05 0.46 1.52 0.04 0.00 0.00 177.00 176.22 3pcg s TYR 447 N -2.75 -0.37 0.63 0.56 -0.85 -1.14 -4.19 117.35 109.24 3pcg s TYR 447 Ca 0.66 0.60 -0.13 0.00 -0.52 0.00 0.00 57.07 57.68 3pcg s TYR 447 Cb -0.21 0.23 -0.02 0.00 0.38 0.00 0.00 41.96 42.33 3pcg s TYR 447 CO 0.60 -0.49 1.05 -1.25 -1.52 0.00 0.00 175.55 173.94 3pcg s PRO 448 N -1.35 3.24 -0.04 -3.49 0.04 -1.26 -0.77 135.00 131.37 3pcg s PRO 448 Ca -0.12 1.03 -0.18 0.00 0.04 0.00 0.00 61.00 61.76 3pcg s PRO 448 Cb -0.03 -2.03 0.04 0.00 0.04 0.00 0.00 34.50 32.52 3pcg s PRO 448 CO 0.06 -0.86 0.40 1.67 0.04 0.00 0.00 177.00 178.32 3pcg s TRP 449 N -2.80 -0.32 -1.05 0.56 1.48 -1.02 -4.87 118.94 110.92 3pcg s TRP 449 Ca 0.60 0.57 -0.22 0.00 -1.06 0.00 0.00 56.10 55.98 3pcg s TRP 449 Cb -0.14 0.17 0.06 0.00 -1.16 0.00 0.00 33.47 32.40 3pcg s TRP 449 CO 0.46 -0.42 1.48 1.03 -4.06 0.00 0.00 176.95 175.44 3pcg s ARG 450 N -1.10 3.64 0.00 3.25 0.52 -1.26 -4.32 118.95 119.68 3pcg s ARG 450 Ca -0.11 -1.26 0.00 0.00 -0.52 0.00 0.00 55.73 53.84 3pcg s ARG 450 Cb -0.04 -5.37 0.00 0.00 0.52 0.00 0.00 34.95 30.06 3pcg s ARG 450 CO 0.05 -2.20 0.00 -1.71 0.02 0.00 0.00 175.30 171.46 3pcg n ASN 451 N 8.74 0.00 -4.13 0.23 5.15 -1.26 -5.04 115.26 118.95 3pcg n ASN 451 Ca 0.35 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 54.03 3pcg n ASN 451 Cb 0.50 0.00 0.19 0.00 -0.53 0.00 0.00 39.78 39.94 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 -0.38 1.78 0.29 8.20 0.00 -1.26 -4.95 107.32 111.01 3pcg s GLY 452 Ca 0.00 -1.22 0.25 0.00 0.00 0.00 0.00 44.72 43.74 3pcg s GLY 452 CO 0.00 -0.45 1.74 -2.55 0.00 0.00 0.00 173.10 171.84 3pcg h PRO 453 N -1.63 0.00 -0.99 2.90 0.11 -1.98 -3.31 132.00 127.11 3pcg h PRO 453 Ca -0.44 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.31 3pcg h PRO 453 Cb 1.23 0.00 -0.30 0.00 0.11 0.00 0.00 31.00 32.04 3pcg h PRO 453 CO 0.38 0.00 -0.89 -1.71 -0.21 0.00 0.00 178.00 175.57 3pcg n ASN 454 N -2.33 -0.20 -4.84 -2.05 5.15 -1.26 -5.10 115.26 104.63 3pcg n ASN 454 Ca 0.02 -3.02 -0.38 0.00 -0.60 0.00 0.00 54.58 50.60 3pcg n ASN 454 Cb 0.24 0.26 -0.06 0.00 -0.53 0.00 0.00 39.78 39.69 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 -2.13 6.68 -0.06 1.20 1.01 -1.25 -5.07 116.67 117.05 3pcg s ASP 455 Ca 0.30 0.81 -0.01 0.00 0.71 0.00 0.00 52.55 54.36 3pcg s ASP 455 Cb 0.37 -2.20 0.03 0.00 1.01 0.00 0.00 42.92 42.13 3pcg s ASP 455 CO -0.05 0.33 -0.00 0.26 0.21 0.00 0.00 175.17 175.92 3pcg s TRP 456 N -0.97 0.58 0.31 4.23 0.52 -1.26 -2.43 118.94 119.92 3pcg s TRP 456 Ca 0.21 -0.12 -0.28 0.00 0.02 0.00 0.00 56.10 55.93 3pcg s TRP 456 Cb -0.15 -0.68 -0.09 0.00 -1.15 0.00 0.00 33.47 31.39 3pcg s TRP 456 CO 0.10 -0.25 1.11 1.03 0.02 0.00 0.00 176.95 178.96 3pcg s ARG 457 N 1.58 4.51 0.80 4.98 1.81 0.05 -4.75 118.95 127.93 3pcg s ARG 457 Ca -0.01 1.79 -0.11 0.00 -1.72 0.00 0.00 55.73 55.68 3pcg s ARG 457 Cb -0.13 -3.05 0.07 0.00 -0.45 0.00 0.00 34.95 31.40 3pcg s ARG 457 CO -0.03 0.10 1.09 -2.14 -0.68 0.00 0.00 175.30 173.64 3pcg s PRO 458 N -1.68 2.02 0.33 3.54 0.02 -1.26 -2.86 135.00 135.10 3pcg s PRO 458 Ca 0.48 1.14 -0.29 0.00 0.02 0.00 0.00 61.00 62.35 3pcg s PRO 458 Cb -0.31 -1.87 -0.12 0.00 0.02 0.00 0.00 34.50 32.22 3pcg s PRO 458 CO 0.40 -1.81 1.44 0.00 -0.33 0.00 0.00 177.00 176.69 3pcg n ALA 459 N -3.63 1.91 -3.66 -1.55 0.00 -1.26 -4.72 120.51 107.59 3pcg n ALA 459 Ca 0.09 0.36 -0.09 0.00 0.00 0.00 0.00 53.44 53.80 3pcg n ALA 459 Cb 0.53 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.61 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 -0.76 -0.33 -0.07 0.00 -3.43 -1.26 -4.07 115.29 105.38 3pcg s HIS 460 Ca 0.58 -0.00 0.02 0.00 -0.80 0.00 0.00 55.06 54.86 3pcg s HIS 460 Cb -0.53 0.64 0.01 0.00 -1.43 0.00 0.00 32.58 31.27 3pcg s HIS 460 CO 0.59 -1.01 -0.12 0.42 -2.00 0.00 0.00 174.74 172.62 3pcg s ILE 461 N -3.75 1.11 0.17 -5.38 1.01 -0.69 -4.65 121.20 109.02 3pcg s ILE 461 Ca 0.07 -0.46 -0.25 0.00 0.00 0.00 0.00 60.65 60.01 3pcg s ILE 461 Cb -0.03 -1.02 -0.08 0.00 0.01 0.00 0.00 42.46 41.33 3pcg s ILE 461 CO -0.02 0.35 0.77 -1.00 0.00 0.00 0.00 174.94 175.04 3pcg s HIS 462 N 0.69 3.90 0.06 3.97 3.76 0.16 -0.61 115.29 127.21 3pcg s HIS 462 Ca -0.14 1.62 0.06 0.00 -0.15 0.00 0.00 55.06 56.45 3pcg s HIS 462 Cb -0.16 -2.76 -0.03 0.00 1.11 0.00 0.00 32.58 30.75 3pcg s HIS 462 CO 0.03 0.51 -0.17 -0.06 -0.85 0.00 0.00 174.74 174.21 3pcg s PHE 463 N -1.16 1.44 -0.08 1.40 0.40 0.01 -2.13 117.98 117.87 3pcg s PHE 463 Ca 0.36 -0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 56.29 3pcg s PHE 463 Cb -0.23 -0.83 0.02 0.00 0.51 0.00 0.00 43.02 42.50 3pcg s PHE 463 CO 0.26 0.09 -0.04 0.20 0.70 0.00 0.00 175.22 176.43 3pcg s GLY 464 N -1.47 0.58 -0.07 4.36 0.00 -0.12 -1.03 107.32 109.58 3pcg s GLY 464 Ca 0.03 -0.23 0.03 0.00 0.00 0.00 0.00 44.72 44.54 3pcg s GLY 464 CO 0.02 0.82 -0.16 -0.42 0.00 0.00 0.00 173.10 173.36 3pcg s ILE 465 N 1.56 1.44 -0.06 0.90 1.09 0.16 -0.44 121.20 125.84 3pcg s ILE 465 Ca -0.00 -0.67 -0.21 0.00 -1.10 0.00 0.00 60.65 58.67 3pcg s ILE 465 Cb -0.13 -1.28 -0.16 0.00 -1.06 0.00 0.00 42.46 39.83 3pcg s ILE 465 CO -0.04 0.42 0.82 0.77 -0.10 0.00 0.00 174.94 176.81 3pcg h SER 466 N 6.76 -0.14 -3.78 3.58 4.64 -1.39 -1.94 113.55 121.29 3pcg h SER 466 Ca -0.28 -0.41 0.05 0.00 -0.47 0.00 0.00 61.79 60.68 3pcg h SER 466 Cb 1.20 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 3pcg h SER 466 CO 0.47 0.45 -0.06 0.61 -0.87 0.00 0.00 176.83 177.44 3pcg n GLY 467 N 0.77 -2.13 0.13 -0.77 0.00 -1.26 -2.41 105.19 99.52 3pcg n GLY 467 Ca -0.07 -1.44 0.12 0.00 0.00 0.00 0.00 46.02 44.62 3pcg n GLY 467 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3pcg n PRO 468 N -1.21 0.20 -3.97 1.61 -0.04 -1.26 -4.87 135.00 125.45 3pcg n PRO 468 Ca 0.00 0.42 -0.11 0.00 -0.04 0.00 0.00 63.50 63.77 3pcg n PRO 468 Cb 0.08 -1.87 -0.03 0.00 -0.04 0.00 0.00 33.50 31.64 3pcg n PRO 468 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3pcg s SER 469 N -4.26 0.25 0.39 3.54 1.04 -1.26 -3.48 113.70 109.92 3pcg s SER 469 Ca 0.04 -1.14 0.28 0.00 0.48 0.00 0.00 55.95 55.62 3pcg s SER 469 Cb 0.09 0.69 1.12 0.00 0.10 0.00 0.00 66.02 68.03 3pcg s SER 469 CO 0.40 -1.34 1.83 0.16 0.98 0.00 0.00 173.24 175.27 3pcg h ILE 470 N 2.12 0.00 0.00 -1.02 3.07 -1.42 -2.39 117.51 117.88 3pcg h ILE 470 Ca -0.28 -0.39 -0.04 0.00 1.55 0.00 0.00 64.86 65.71 3pcg h ILE 470 Cb 1.25 1.26 -0.01 0.00 -0.27 0.00 0.00 36.82 39.05 3pcg h ILE 470 CO 0.37 0.00 -0.18 0.00 -1.05 0.00 0.00 178.15 177.29 3pcg h ALA 471 N 2.16 0.99 0.00 0.16 0.00 -1.81 -3.21 119.26 117.54 3pcg h ALA 471 Ca 0.00 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 3pcg h ALA 471 Cb 0.47 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3pcg h ALA 471 CO 0.00 0.22 -1.72 0.25 0.00 0.00 0.00 179.25 178.00 3pcg n THR 472 N -3.28 1.07 -1.55 0.00 -2.24 -0.93 -4.92 114.28 102.44 3pcg n THR 472 Ca 0.01 -0.70 -0.48 0.00 -2.27 0.00 0.00 64.05 60.61 3pcg n THR 472 Cb 0.44 -0.58 -0.03 0.00 -2.10 0.00 0.00 70.33 68.06 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 -2.77 0.96 -3.76 -0.78 3.00 -1.01 -4.75 118.16 109.05 3pcg n LYS 473 Ca -0.14 0.34 -0.12 0.00 -0.00 0.00 0.00 58.31 58.39 3pcg n LYS 473 Cb 0.87 -1.72 -0.08 0.00 0.00 0.00 0.00 35.03 34.11 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 0.95 0.87 -0.02 3.14 2.96 -0.73 -5.02 118.68 120.83 3pcg s LEU 474 Ca 0.68 -0.04 0.04 0.00 -0.22 0.00 0.00 54.13 54.59 3pcg s LEU 474 Cb -0.84 1.31 -0.01 0.00 0.50 0.00 0.00 46.19 47.15 3pcg s LEU 474 CO 0.55 -0.52 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.28 3pcg s ILE 475 N -1.89 1.21 0.17 6.68 1.01 -1.26 -0.67 121.20 126.45 3pcg s ILE 475 Ca -0.10 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 59.89 3pcg s ILE 475 Cb -0.03 -1.02 0.01 0.00 0.01 0.00 0.00 42.46 41.43 3pcg s ILE 475 CO 0.01 0.35 0.28 1.07 0.00 0.00 0.00 174.94 176.65 3pcg n THR 476 N 2.86 0.00 -4.55 2.92 5.66 -0.19 -5.01 114.28 115.97 3pcg n THR 476 Ca -0.16 -0.67 -0.21 0.00 -3.05 0.00 0.00 64.05 59.96 3pcg n THR 476 Cb 0.54 0.48 -0.15 0.00 -1.55 0.00 0.00 70.33 69.66 3pcg n THR 476 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3pcg s GLN 477 N -2.23 1.06 -0.14 1.09 -0.21 -1.26 -0.81 119.66 117.16 3pcg s GLN 477 Ca 0.11 -0.57 -0.06 0.00 0.02 0.00 0.00 55.36 54.86 3pcg s GLN 477 Cb -0.01 -1.04 -0.04 0.00 1.00 0.00 0.00 33.01 32.92 3pcg s GLN 477 CO 0.08 0.28 0.07 -1.17 -2.12 0.00 0.00 175.29 172.43 3pcg s LEU 478 N -0.56 3.92 0.34 2.90 0.20 0.21 -4.84 118.68 120.86 3pcg s LEU 478 Ca 0.04 0.20 0.09 0.00 0.69 0.00 0.00 54.13 55.15 3pcg s LEU 478 Cb -0.06 -1.96 -0.06 0.00 -0.43 0.00 0.00 46.19 43.68 3pcg s LEU 478 CO 0.00 0.28 -0.01 -0.31 -0.29 0.00 0.00 176.35 176.02 3pcg s TYR 479 N -0.29 2.52 -0.12 5.38 2.02 0.78 -1.71 117.35 125.92 3pcg s TYR 479 Ca 0.09 -0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 56.33 3pcg s TYR 479 Cb -0.12 -1.46 -0.02 0.00 -0.40 0.00 0.00 41.96 39.96 3pcg s TYR 479 CO 0.01 0.50 -0.08 -0.06 -1.57 0.00 0.00 175.55 174.36 3pcg s PHE 480 N -2.54 2.93 -0.35 2.71 0.40 -1.26 0.04 117.98 119.92 3pcg s PHE 480 Ca 0.34 -0.32 -0.43 0.00 -0.60 0.00 0.00 56.93 55.92 3pcg s PHE 480 Cb 0.00 -1.86 -0.19 0.00 0.51 0.00 0.00 43.02 41.49 3pcg s PHE 480 CO 0.19 0.01 1.39 -1.91 0.70 0.00 0.00 175.22 175.59 3pcg n GLU 481 N 3.19 0.00 -0.81 0.44 2.13 -0.66 -1.73 120.64 123.20 3pcg n GLU 481 Ca -0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.64 3pcg n GLU 481 Cb 0.53 -1.43 0.00 0.00 0.27 0.00 0.00 31.44 30.81 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 3.18 1.11 3.67 8.31 0.00 -1.26 -5.00 105.19 115.19 3pcg n GLY 482 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.07 6.60 0.07 1.61 -1.08 -0.71 -4.87 116.67 115.22 3pcg s ASP 483 Ca 0.00 2.39 0.14 0.00 -0.52 0.00 0.00 52.55 54.56 3pcg s ASP 483 Cb 0.00 -2.54 0.59 0.00 -1.46 0.00 0.00 42.92 39.51 3pcg s ASP 483 CO 0.00 -0.95 1.43 -0.81 0.52 0.00 0.00 175.17 175.36 3pcg n PRO 484 N 6.89 0.04 0.16 4.34 -0.04 -1.26 -2.10 135.00 143.04 3pcg n PRO 484 Ca 0.18 0.36 0.05 0.00 -0.04 0.00 0.00 63.50 64.05 3pcg n PRO 484 Cb 0.42 -1.60 0.09 0.00 -0.04 0.00 0.00 33.50 32.37 3pcg n PRO 484 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3pcg h LEU 485 N 0.00 0.00 -0.62 1.53 3.38 -1.95 -3.38 115.31 114.27 3pcg h LEU 485 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3pcg h LEU 485 Cb 0.20 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.86 3pcg h LEU 485 CO 0.00 0.36 -0.55 0.40 0.09 0.00 0.00 178.44 178.74 3pcg h ILE 486 N 0.00 0.00 0.00 1.22 2.04 -1.80 -1.58 117.51 117.39 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 1.25 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3pcg h ILE 486 CO 0.05 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.39 3pcg n PRO 487 N -5.21 0.03 0.00 2.37 -0.04 -1.26 -2.96 135.00 127.94 3pcg n PRO 487 Ca -0.01 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 63.87 3pcg n PRO 487 Cb 0.29 -1.57 0.16 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.63 0.63 -2.94 0.54 2.81 -0.61 -4.92 117.12 111.00 3pcg n MET 488 Ca 0.03 -0.45 -0.41 0.00 -1.81 0.00 0.00 57.70 55.06 3pcg n MET 488 Cb 0.16 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.14 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 7.33 0.43 -0.33 0.00 0.11 -1.91 0.61 132.00 138.25 3pcg h PRO 490 Ca -0.30 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.69 3pcg h PRO 490 Cb 1.14 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3pcg h PRO 490 CO 0.82 0.42 0.00 0.82 -0.21 0.00 0.00 178.00 179.85 3pcg h ILE 491 N 0.42 1.26 0.42 4.15 2.04 -1.92 -1.85 117.51 122.03 3pcg h ILE 491 Ca 0.10 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 3pcg h ILE 491 Cb 0.20 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 3pcg h ILE 491 CO -0.00 0.31 -0.20 0.58 0.00 0.00 0.00 178.15 178.84 3pcg h VAL 492 N 0.38 0.59 0.00 1.67 2.07 -1.71 -2.03 116.25 117.21 3pcg h VAL 492 Ca 0.09 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3pcg h VAL 492 Cb 0.44 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 3pcg h VAL 492 CO 0.02 0.02 0.19 0.29 0.02 0.00 0.00 177.57 178.10 3pcg n LYS 493 N -5.31 0.05 0.30 1.57 5.02 0.15 -0.51 118.16 119.43 3pcg n LYS 493 Ca -0.11 0.46 0.17 0.00 -2.02 0.00 0.00 58.31 56.81 3pcg n LYS 493 Cb 0.25 -1.85 0.92 0.00 -0.02 0.00 0.00 35.03 34.34 3pcg n LYS 493 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3pcg h SER 494 N 0.00 0.00 -3.56 4.39 4.64 -0.56 -3.38 113.55 115.09 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 0.38 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.36 3pcg h SER 494 CO 0.00 0.04 0.49 -0.63 -0.87 0.00 0.00 176.83 175.86 3pcg s ILE 495 N -4.15 4.62 0.15 0.95 1.01 0.33 -3.79 121.20 120.33 3pcg s ILE 495 Ca -0.03 0.90 -0.15 0.00 0.00 0.00 0.00 60.65 61.37 3pcg s ILE 495 Cb 0.13 -4.31 0.02 0.00 0.01 0.00 0.00 42.46 38.31 3pcg s ILE 495 CO 0.51 -0.58 1.71 0.00 0.00 0.00 0.00 174.94 176.58 3pcg h ALA 496 N 8.66 0.58 -2.24 9.38 0.00 -1.84 -3.43 119.26 130.37 3pcg h ALA 496 Ca -0.24 -0.13 -0.62 0.00 0.00 0.00 0.00 54.91 53.93 3pcg h ALA 496 Cb 1.08 -0.18 -0.12 0.00 0.00 0.00 0.00 17.79 18.58 3pcg h ALA 496 CO 0.96 0.16 0.29 1.21 0.00 0.00 0.00 179.25 181.88 3pcg s ASN 497 N -5.86 6.52 0.55 0.00 3.04 -1.26 -4.95 114.94 112.98 3pcg s ASN 497 Ca -0.13 0.33 0.29 0.00 0.04 0.00 0.00 52.86 53.39 3pcg s ASN 497 Cb 0.11 -2.37 1.46 0.00 -1.54 0.00 0.00 41.25 38.91 3pcg s ASN 497 CO 0.76 -0.66 1.92 1.55 -3.04 0.00 0.00 177.10 177.63 3pcg h PRO 498 N 8.42 0.00 0.00 0.43 0.13 -2.00 0.99 132.00 139.97 3pcg h PRO 498 Ca -0.25 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.81 3pcg h PRO 498 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 3pcg h PRO 498 CO 0.88 0.00 -0.31 0.93 -0.23 0.00 0.00 178.00 179.27 3pcg h GLU 499 N 0.00 0.00 -0.08 0.86 3.07 -1.97 -2.75 114.58 113.71 3pcg h GLU 499 Ca 0.31 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.98 3pcg h GLU 499 Cb 1.35 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.26 3pcg h GLU 499 CO -0.00 0.31 -0.76 0.00 -1.40 0.00 0.00 179.01 177.16 3pcg h ALA 500 N 1.69 0.53 -0.46 3.43 0.00 0.67 -3.17 119.26 121.94 3pcg h ALA 500 Ca -0.00 -0.62 0.01 0.00 0.00 0.00 0.00 54.91 54.30 3pcg h ALA 500 Cb 0.85 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3pcg h ALA 500 CO 0.04 0.76 0.29 0.28 0.00 0.00 0.00 179.25 180.62 3pcg h VAL 501 N 0.31 1.09 -0.75 0.00 2.07 -1.27 -2.43 116.25 115.27 3pcg h VAL 501 Ca -0.04 -0.21 0.15 0.00 0.82 0.00 0.00 66.70 67.43 3pcg h VAL 501 Cb 1.35 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.52 3pcg h VAL 501 CO 0.13 0.11 0.50 1.56 0.02 0.00 0.00 177.57 179.90 3pcg h GLN 502 N 0.60 0.37 0.00 1.57 1.08 -1.47 0.71 115.11 117.97 3pcg h GLN 502 Ca 0.17 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 3pcg h GLN 502 Cb -0.04 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 3pcg h GLN 502 CO -0.05 0.25 0.00 1.96 -0.95 0.00 0.00 178.83 180.03 3pcg h GLN 503 N 0.38 0.00 -0.04 1.46 4.20 -1.47 -2.47 115.11 117.18 3pcg h GLN 503 Ca 0.37 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.08 3pcg h GLN 503 Cb 0.89 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.67 3pcg h GLN 503 CO -0.11 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.33 3pcg n LEU 504 N -2.90 2.41 -4.57 1.46 4.77 0.24 -4.91 117.00 113.50 3pcg n LEU 504 Ca -0.01 -0.82 -0.38 0.00 -0.03 0.00 0.00 56.01 54.76 3pcg n LEU 504 Cb 0.17 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 3pcg n LEU 504 CO 0.21 0.41 -0.17 -0.63 -1.33 0.00 0.00 177.39 175.89 3pcg s ILE 505 N -1.97 5.26 0.18 -0.08 1.01 -0.93 -0.16 121.20 124.52 3pcg s ILE 505 Ca 0.32 0.10 -0.30 0.00 0.00 0.00 0.00 60.65 60.77 3pcg s ILE 505 Cb 0.20 -3.53 -0.08 0.00 0.01 0.00 0.00 42.46 39.06 3pcg s ILE 505 CO 0.31 0.22 1.01 0.00 0.00 0.00 0.00 174.94 176.48 3pcg s ALA 506 N 1.75 3.32 -0.04 9.38 0.00 0.11 -4.86 121.76 131.42 3pcg s ALA 506 Ca 0.07 0.69 -0.09 0.00 0.00 0.00 0.00 51.96 52.62 3pcg s ALA 506 Cb -0.16 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 3pcg s ALA 506 CO 0.11 -0.02 0.26 0.15 0.00 0.00 0.00 175.76 176.26 3pcg s LYS 507 N -0.59 3.63 0.25 0.00 -0.14 -0.74 -1.65 119.74 120.50 3pcg s LYS 507 Ca 0.46 0.05 -0.31 0.00 -1.36 0.00 0.00 55.97 54.81 3pcg s LYS 507 Cb -0.27 -3.16 -0.11 0.00 -1.68 0.00 0.00 37.83 32.61 3pcg s LYS 507 CO 0.33 0.71 1.60 -1.17 -0.76 0.00 0.00 175.35 176.06 3pcg s LEU 508 N -1.27 4.36 -0.48 3.17 2.96 -1.26 0.35 118.68 126.50 3pcg s LEU 508 Ca 0.22 2.86 0.03 0.00 -0.22 0.00 0.00 54.13 57.01 3pcg s LEU 508 Cb -0.14 -3.62 0.15 0.00 0.50 0.00 0.00 46.19 43.08 3pcg s LEU 508 CO 0.11 -0.89 0.31 -0.62 -1.32 0.00 0.00 176.35 173.93 3pcg s ASP 509 N 0.72 3.45 0.54 3.68 -1.08 0.15 -4.80 116.67 119.33 3pcg s ASP 509 Ca 0.66 -2.94 0.25 0.00 -0.52 0.00 0.00 52.55 50.00 3pcg s ASP 509 Cb -0.47 -1.03 1.51 0.00 -1.46 0.00 0.00 42.92 41.47 3pcg s ASP 509 CO 0.42 -0.21 2.15 0.24 0.52 0.00 0.00 175.17 178.28 3pcg h MET 510 N 6.27 0.00 -0.39 4.34 2.86 -1.93 -2.48 114.93 123.60 3pcg h MET 510 Ca 0.07 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3pcg h MET 510 Cb 0.89 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 3pcg h MET 510 CO 0.50 0.06 0.16 -0.91 1.06 0.00 0.00 176.91 177.78 3pcg h ASN 511 N 0.00 0.49 0.18 1.22 2.35 -1.94 -2.93 115.58 114.96 3pcg h ASN 511 Ca -0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3pcg h ASN 511 Cb 0.14 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.39 3pcg h ASN 511 CO 0.01 0.45 -0.59 -3.20 -1.65 0.00 0.00 177.43 172.45 3pcg n ASN 512 N -4.38 1.10 -4.74 5.81 5.15 -0.94 -4.96 115.26 112.29 3pcg n ASN 512 Ca 0.03 -0.89 -0.37 0.00 -0.60 0.00 0.00 54.58 52.75 3pcg n ASN 512 Cb 0.14 0.49 0.05 0.00 -0.53 0.00 0.00 39.78 39.93 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 -2.77 2.52 -0.37 5.20 0.00 -1.11 -4.80 121.76 120.43 3pcg s ALA 513 Ca 0.15 1.13 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 3pcg s ALA 513 Cb 0.18 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.80 3pcg s ALA 513 CO 0.68 -1.34 0.25 -0.80 0.00 0.00 0.00 175.76 174.55 3pcg s ASN 514 N -1.43 5.98 0.38 0.00 0.01 -0.44 -5.01 114.94 114.42 3pcg s ASN 514 Ca 0.78 -0.74 -0.26 0.00 -0.71 0.00 0.00 52.86 51.93 3pcg s ASN 514 Cb -0.34 -2.12 -0.11 0.00 0.41 0.00 0.00 41.25 39.09 3pcg s ASN 514 CO 0.37 -0.35 1.16 -2.65 -1.51 0.00 0.00 177.10 174.12 3pcg n PRO 515 N 5.10 1.73 -1.73 -0.60 -0.02 -1.26 -1.38 135.00 136.84 3pcg n PRO 515 Ca -0.12 0.61 -0.20 0.00 -2.02 0.00 0.00 63.50 61.77 3pcg n PRO 515 Cb 0.48 -2.19 -0.07 0.00 -0.02 0.00 0.00 33.50 31.70 3pcg n PRO 515 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3pcg n MET 516 N 0.32 -1.49 0.01 -0.52 2.81 -1.26 -4.74 117.12 112.24 3pcg n MET 516 Ca 0.07 1.17 0.00 0.00 -1.81 0.00 0.00 57.70 57.13 3pcg n MET 516 Cb 0.37 -5.59 0.00 0.00 -0.71 0.00 0.00 33.22 27.29 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 -1.43 -0.03 -3.80 7.83 -0.08 -0.48 -5.15 116.55 113.41 3pcg n ASP 517 Ca -0.21 0.04 -0.12 0.00 -1.51 0.00 0.00 54.79 52.99 3pcg n ASP 517 Cb 0.67 0.06 -0.09 0.00 2.34 0.00 0.00 41.12 44.11 3pcg n ASP 517 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3pcg s LEU 519 N -1.57 2.81 -0.02 0.00 1.43 -0.81 -1.33 118.68 119.19 3pcg s LEU 519 Ca -0.11 0.03 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 3pcg s LEU 519 Cb -0.04 -2.19 0.01 0.00 0.03 0.00 0.00 46.19 44.00 3pcg s LEU 519 CO 0.01 -2.41 0.20 0.00 0.23 0.00 0.00 176.35 174.39 3pcg s ALA 520 N -3.61 -0.50 0.05 4.21 0.00 -1.26 -1.01 121.76 119.64 3pcg s ALA 520 Ca 0.71 0.13 0.06 0.00 0.00 0.00 0.00 51.96 52.85 3pcg s ALA 520 Cb -0.04 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.07 3pcg s ALA 520 CO 0.50 -0.21 -0.16 0.71 0.00 0.00 0.00 175.76 176.60 3pcg s TYR 521 N -1.12 1.42 -0.12 0.00 1.51 0.34 0.32 117.35 119.71 3pcg s TYR 521 Ca -0.12 -0.38 -0.00 0.00 -1.01 0.00 0.00 57.07 55.56 3pcg s TYR 521 Cb -0.06 -0.83 -0.02 0.00 -0.11 0.00 0.00 41.96 40.94 3pcg s TYR 521 CO 0.02 0.07 -0.12 0.50 -1.11 0.00 0.00 175.55 174.91 3pcg s ARG 522 N -1.29 3.32 -0.19 -0.62 6.06 0.16 -1.82 118.95 124.56 3pcg s ARG 522 Ca 0.03 -0.66 -0.04 0.00 -2.50 0.00 0.00 55.73 52.55 3pcg s ARG 522 Cb -0.09 -2.64 0.08 0.00 0.06 0.00 0.00 34.95 32.36 3pcg s ARG 522 CO 0.02 0.27 0.15 0.12 -2.50 0.00 0.00 175.30 173.36 3pcg s PHE 523 N 0.22 -0.03 0.01 5.12 5.36 0.23 -1.78 117.98 127.10 3pcg s PHE 523 Ca -0.08 -0.07 -0.01 0.00 -0.96 0.00 0.00 56.93 55.81 3pcg s PHE 523 Cb -0.15 -0.54 -0.04 0.00 -0.34 0.00 0.00 43.02 41.95 3pcg s PHE 523 CO 0.05 -0.57 0.15 -0.51 -1.46 0.00 0.00 175.22 172.89 3pcg s ASP 524 N 2.23 6.12 0.01 6.13 1.01 -1.26 -3.83 116.67 127.08 3pcg s ASP 524 Ca 0.05 0.25 0.08 0.00 0.71 0.00 0.00 52.55 53.63 3pcg s ASP 524 Cb -0.16 -1.86 -0.02 0.00 1.01 0.00 0.00 42.92 41.89 3pcg s ASP 524 CO -0.11 0.24 -0.23 -0.63 0.21 0.00 0.00 175.17 174.65 3pcg s ILE 525 N -1.33 1.82 -0.24 0.77 1.01 0.07 -4.93 121.20 118.37 3pcg s ILE 525 Ca 0.28 -1.12 0.02 0.00 0.00 0.00 0.00 60.65 59.82 3pcg s ILE 525 Cb -0.12 -1.54 0.05 0.00 0.01 0.00 0.00 42.46 40.85 3pcg s ILE 525 CO 0.19 0.38 -0.13 -0.69 0.00 0.00 0.00 174.94 174.70 3pcg s VAL 526 N -0.67 2.22 0.50 2.92 1.01 -1.25 -0.83 120.40 124.31 3pcg s VAL 526 Ca 0.09 -1.38 -0.01 0.00 0.00 0.00 0.00 61.98 60.68 3pcg s VAL 526 Cb -0.09 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.11 3pcg s VAL 526 CO 0.01 0.15 0.75 -0.76 0.00 0.00 0.00 175.10 175.25 3pcg s LEU 527 N 1.18 3.47 0.34 3.92 1.43 0.23 -4.90 118.68 124.35 3pcg s LEU 527 Ca -0.04 0.33 -0.27 0.00 -1.03 0.00 0.00 54.13 53.12 3pcg s LEU 527 Cb -0.18 -3.19 -0.13 0.00 0.03 0.00 0.00 46.19 42.73 3pcg s LEU 527 CO -0.07 -0.88 1.14 0.54 0.23 0.00 0.00 176.35 177.31 3pcg n ARG 528 N -2.25 1.71 -2.11 1.70 1.74 -1.26 -1.19 116.66 114.99 3pcg n ARG 528 Ca 0.03 0.60 -0.41 0.00 -0.77 0.00 0.00 57.85 57.31 3pcg n ARG 528 Cb 0.58 -2.10 -0.02 0.00 -1.02 0.00 0.00 32.46 29.90 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 -0.48 3.00 -0.17 -0.13 0.00 -1.26 -4.29 107.32 104.00 3pcg s GLY 529 Ca 0.58 1.26 -0.04 0.00 0.00 0.00 0.00 44.72 46.51 3pcg s GLY 529 CO 0.60 1.90 -0.03 1.62 0.00 0.00 0.00 173.10 177.19 3pcg s GLN 530 N -1.83 3.66 0.11 2.90 0.74 -1.26 -1.09 119.66 122.90 3pcg s GLN 530 Ca 0.49 -0.52 0.03 0.00 0.05 0.00 0.00 55.36 55.41 3pcg s GLN 530 Cb -0.40 -2.95 -0.04 0.00 1.10 0.00 0.00 33.01 30.72 3pcg s GLN 530 CO 0.53 0.19 -0.09 -0.98 -0.55 0.00 0.00 175.29 174.39 3pcg s ARG 531 N 0.51 0.91 0.65 1.67 1.70 -0.36 -4.97 118.95 119.05 3pcg s ARG 531 Ca -0.03 -1.32 -0.11 0.00 -0.47 0.00 0.00 55.73 53.80 3pcg s ARG 531 Cb -0.14 -0.42 -0.02 0.00 -0.57 0.00 0.00 34.95 33.80 3pcg s ARG 531 CO 0.03 0.04 1.05 -1.59 -1.08 0.00 0.00 175.30 173.74 3pcg s LYS 532 N -3.52 3.35 0.64 3.89 -2.85 -1.26 -0.46 119.74 119.53 3pcg s LYS 532 Ca 0.11 0.75 -0.12 0.00 -1.00 0.00 0.00 55.97 55.71 3pcg s LYS 532 Cb 0.02 -2.05 -0.02 0.00 -2.06 0.00 0.00 37.83 33.72 3pcg s LYS 532 CO -0.02 -0.75 1.04 0.95 0.10 0.00 0.00 175.35 176.68 3pcg s THR 533 N -3.18 4.21 -0.20 3.79 -4.23 -1.14 -4.70 115.64 110.20 3pcg s THR 533 Ca 0.56 0.81 -0.20 0.00 -1.18 0.00 0.00 61.69 61.68 3pcg s THR 533 Cb -0.12 -3.54 0.05 0.00 1.34 0.00 0.00 72.50 70.23 3pcg s THR 533 CO 0.54 -0.85 0.55 -1.38 -0.54 0.00 0.00 174.62 172.94 3pcg s HIS 534 N -2.93 -0.60 -0.64 3.99 -3.43 -1.26 -4.94 115.29 105.48 3pcg s HIS 534 Ca 0.58 1.44 -0.00 0.00 -0.80 0.00 0.00 55.06 56.28 3pcg s HIS 534 Cb -0.13 0.21 0.00 0.00 -1.43 0.00 0.00 32.58 31.23 3pcg s HIS 534 CO 0.49 -0.31 0.01 1.19 -2.00 0.00 0.00 174.74 174.12 3pcg n PHE 535 N 2.66 -1.65 1.61 0.38 3.72 -1.26 -5.25 117.46 117.66 3pcg n PHE 535 Ca -0.14 0.01 0.14 0.00 -0.05 0.00 0.00 57.45 57.41 3pcg n PHE 535 Cb 0.56 -2.05 0.61 0.00 -0.94 0.00 0.00 39.48 37.66 3pcg n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10