#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whv s SER 424 N 0.00 0.15 0.39 1.61 1.04 -1.26 -5.17 113.70 110.47 1whv s SER 424 Ca 0.00 -0.35 0.08 0.00 0.48 0.00 0.00 55.95 56.16 1whv s SER 424 Cb 0.00 0.12 -0.03 0.00 0.10 0.00 0.00 66.02 66.22 1whv s SER 424 CO 0.00 -0.28 0.32 -0.94 0.98 0.00 0.00 173.24 173.32 1whv s SER 425 N -1.24 4.98 0.00 7.02 1.04 -1.26 -5.05 113.70 119.19 1whv s SER 425 Ca -0.13 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.55 1whv s SER 425 Cb -0.08 -0.64 0.00 0.00 0.10 0.00 0.00 66.02 65.40 1whv s SER 425 CO -0.00 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1whv n GLY 426 N -1.44 -1.26 2.93 7.32 0.00 -1.26 -4.96 105.19 106.51 1whv n GLY 426 Ca 0.01 -1.51 -0.30 0.00 0.00 0.00 0.00 46.02 44.22 1whv n GLY 426 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1whv s SER 427 N -2.48 4.15 0.44 1.61 0.15 -1.26 -5.11 113.70 111.20 1whv s SER 427 Ca 0.00 -1.52 0.03 0.00 0.70 0.00 0.00 55.95 55.16 1whv s SER 427 Cb 0.00 -1.26 -0.03 0.00 -1.71 0.00 0.00 66.02 63.03 1whv s SER 427 CO 0.00 -0.30 0.07 -0.94 1.20 0.00 0.00 173.24 173.26 1whv s SER 428 N 1.29 3.33 0.00 5.45 1.04 -1.26 -5.16 113.70 118.39 1whv s SER 428 Ca 0.01 -1.62 0.00 0.00 0.48 0.00 0.00 55.95 54.82 1whv s SER 428 Cb -0.19 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.32 1whv s SER 428 CO -0.10 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 173.89 1whv n GLY 429 N -1.02 -0.37 0.00 7.32 0.00 -1.26 -5.01 105.19 104.85 1whv n GLY 429 Ca -0.10 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1whv n GLY 429 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1whv n GLY 430 N 5.00 -0.75 3.70 -0.02 0.00 -1.26 -5.11 105.19 106.74 1whv n GLY 430 Ca 0.00 0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 1whv n GLY 430 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1whv s PRO 431 N 0.00 4.30 1.22 1.61 0.04 -1.26 -5.01 135.00 135.90 1whv s PRO 431 Ca 0.00 2.03 -0.14 0.00 0.04 0.00 0.00 61.00 62.93 1whv s PRO 431 Cb 0.00 -3.42 0.31 0.00 0.04 0.00 0.00 34.50 31.43 1whv s PRO 431 CO 0.00 -0.51 1.01 -0.51 0.04 0.00 0.00 177.00 177.03 1whv s ASP 432 N 1.53 0.50 -0.11 6.66 1.01 -1.26 -5.01 116.67 120.00 1whv s ASP 432 Ca 0.65 1.44 -0.06 0.00 0.71 0.00 0.00 52.55 55.29 1whv s ASP 432 Cb -0.34 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 1whv s ASP 432 CO 0.29 -4.49 0.12 -0.22 0.21 0.00 0.00 175.17 171.08 1whv s LEU 433 N -7.38 4.23 0.05 1.23 2.96 -1.26 -5.10 118.68 113.41 1whv s LEU 433 Ca 0.69 0.40 -0.11 0.00 -0.22 0.00 0.00 54.13 54.89 1whv s LEU 433 Cb -0.25 -2.06 -0.06 0.00 0.50 0.00 0.00 46.19 44.33 1whv s LEU 433 CO 0.65 0.39 0.39 0.00 -1.32 0.00 0.00 176.35 176.46 1whv s GLN 434 N -1.07 3.77 0.88 1.98 -2.07 -1.26 -5.09 119.66 116.80 1whv s GLN 434 Ca 0.15 0.20 -0.11 0.00 -1.82 0.00 0.00 55.36 53.78 1whv s GLN 434 Cb -0.12 -3.05 0.12 0.00 -1.09 0.00 0.00 33.01 28.87 1whv s GLN 434 CO 0.05 0.60 1.09 -1.25 -1.32 0.00 0.00 175.29 174.46 1whv s PRO 435 N -1.71 1.43 0.19 9.60 0.04 -1.26 -4.92 135.00 138.37 1whv s PRO 435 Ca 0.30 0.88 -0.30 0.00 0.04 0.00 0.00 61.00 61.92 1whv s PRO 435 Cb -0.14 -1.82 -0.17 0.00 0.04 0.00 0.00 34.50 32.41 1whv s PRO 435 CO 0.17 -2.14 0.70 1.63 0.04 0.00 0.00 177.00 177.40 1whv n LYS 436 N -3.82 0.29 -2.38 4.56 5.02 -1.26 -4.80 118.16 115.77 1whv n LYS 436 Ca 0.07 0.10 -0.43 0.00 -2.02 0.00 0.00 58.31 56.04 1whv n LYS 436 Cb 0.55 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.31 1whv n LYS 436 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1whv n ARG 437 N 1.06 3.25 -0.08 1.97 1.74 -1.26 -4.64 116.66 118.71 1whv n ARG 437 Ca 0.17 -3.30 -0.22 0.00 -0.77 0.00 0.00 57.85 53.73 1whv n ARG 437 Cb 0.24 -3.19 -0.12 0.00 -1.02 0.00 0.00 32.46 28.37 1whv n ARG 437 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1whv n ASP 438 N 6.01 1.94 0.01 0.55 5.75 -1.26 -4.03 116.55 125.52 1whv n ASP 438 Ca 0.45 0.34 0.16 0.00 -0.01 0.00 0.00 54.79 55.73 1whv n ASP 438 Cb 0.41 -0.92 0.62 0.00 -1.03 0.00 0.00 41.12 40.21 1whv n ASP 438 CO 0.00 0.00 0.00 1.12 -0.11 0.00 0.00 177.20 178.21 1whv h HIS 439 N -0.68 0.14 -3.92 2.11 2.07 -1.91 -3.42 115.15 109.54 1whv h HIS 439 Ca -0.40 0.00 -0.48 0.00 -2.85 0.00 0.00 60.37 56.64 1whv h HIS 439 Cb 1.55 -0.04 0.01 0.00 2.57 0.00 0.00 27.41 31.49 1whv h HIS 439 CO 0.08 0.06 0.41 0.08 -3.07 0.00 0.00 177.93 175.49 1whv s VAL 440 N -5.14 3.79 -0.04 6.12 1.01 -1.26 -2.92 120.40 121.96 1whv s VAL 440 Ca -0.06 1.45 0.01 0.00 0.00 0.00 0.00 61.98 63.39 1whv s VAL 440 Cb 0.19 -3.79 0.02 0.00 0.00 0.00 0.00 36.38 32.80 1whv s VAL 440 CO 0.73 0.09 -0.06 -0.76 0.00 0.00 0.00 175.10 175.10 1whv s LEU 441 N -2.34 1.41 -0.48 3.92 1.43 -0.30 -3.42 118.68 118.90 1whv s LEU 441 Ca 0.54 -0.15 -0.24 0.00 -1.03 0.00 0.00 54.13 53.26 1whv s LEU 441 Cb -0.23 -0.49 0.03 0.00 0.03 0.00 0.00 46.19 45.53 1whv s LEU 441 CO 0.29 -0.04 0.84 -2.28 0.23 0.00 0.00 176.35 175.39 1whv s HIS 442 N 0.82 2.93 -0.16 0.29 5.65 0.16 -1.50 115.29 123.47 1whv s HIS 442 Ca -0.12 0.12 -0.02 0.00 0.25 0.00 0.00 55.06 55.29 1whv s HIS 442 Cb -0.14 -3.81 -0.01 0.00 -1.18 0.00 0.00 32.58 27.43 1whv s HIS 442 CO 0.01 -1.10 -0.09 0.08 -0.65 0.00 0.00 174.74 172.99 1whv s VAL 443 N 3.50 3.26 -0.34 0.89 1.01 -1.13 -1.44 120.40 126.16 1whv s VAL 443 Ca 0.30 -0.57 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 1whv s VAL 443 Cb -0.12 -2.42 0.07 0.00 0.00 0.00 0.00 36.38 33.91 1whv s VAL 443 CO 0.22 0.49 0.07 0.42 0.00 0.00 0.00 175.10 176.29 1whv s THR 444 N 0.74 3.12 0.25 3.92 -4.23 -0.55 -2.57 115.64 116.33 1whv s THR 444 Ca -0.04 -1.59 0.11 0.00 -1.18 0.00 0.00 61.69 59.00 1whv s THR 444 Cb -0.15 -2.91 -0.05 0.00 1.34 0.00 0.00 72.50 70.74 1whv s THR 444 CO 0.02 -0.30 -0.19 0.72 -0.54 0.00 0.00 174.62 174.33 1whv s PHE 445 N 1.22 2.35 0.48 3.99 -0.12 -1.23 -3.13 117.98 121.55 1whv s PHE 445 Ca -0.00 -0.32 -0.22 0.00 -0.05 0.00 0.00 56.93 56.33 1whv s PHE 445 Cb -0.21 -1.06 -0.07 0.00 -0.63 0.00 0.00 43.02 41.05 1whv s PHE 445 CO -0.02 0.64 1.15 -1.25 -0.05 0.00 0.00 175.22 175.70 1whv s PRO 446 N -3.28 3.64 0.32 1.99 0.04 -1.26 -4.40 135.00 132.05 1whv s PRO 446 Ca 0.28 1.72 0.10 0.00 0.04 0.00 0.00 61.00 63.13 1whv s PRO 446 Cb -0.06 -2.28 0.90 0.00 0.04 0.00 0.00 34.50 33.09 1whv s PRO 446 CO 0.14 -0.64 1.71 1.57 0.04 0.00 0.00 177.00 179.83 1whv h LYS 447 N 1.79 0.51 -1.40 4.56 2.10 -1.96 0.24 116.57 122.41 1whv h LYS 447 Ca -0.50 -0.03 0.41 0.00 -2.00 0.00 0.00 60.65 58.53 1whv h LYS 447 Cb 1.25 -0.11 -0.06 0.00 -0.90 0.00 0.00 32.23 32.41 1whv h LYS 447 CO 0.59 0.33 1.17 1.05 -2.00 0.00 0.00 179.45 180.59 1whv h GLU 448 N 0.52 0.00 0.00 0.07 4.11 -1.91 -3.39 114.58 113.97 1whv h GLU 448 Ca 0.65 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.87 1whv h GLU 448 Cb 1.28 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.64 1whv h GLU 448 CO -0.50 0.00 0.01 0.91 0.07 0.00 0.00 179.01 179.50 1whv n TRP 449 N -3.76 -3.31 -3.67 2.06 7.02 0.83 -5.09 117.44 111.53 1whv n TRP 449 Ca 0.31 -0.51 -0.05 0.00 -1.02 0.00 0.00 57.50 56.23 1whv n TRP 449 Cb 1.60 -0.64 -0.02 0.00 -2.42 0.00 0.00 31.31 29.84 1whv n TRP 449 CO 0.00 0.00 0.00 -1.59 -2.02 0.00 0.00 177.69 174.08 1whv s LYS 450 N -4.27 1.08 0.58 -0.99 -2.85 -1.26 -4.99 119.74 107.03 1whv s LYS 450 Ca 0.38 -0.54 0.30 0.00 -1.00 0.00 0.00 55.97 55.11 1whv s LYS 450 Cb -0.05 0.40 1.42 0.00 -2.06 0.00 0.00 37.83 37.55 1whv s LYS 450 CO 0.30 -0.49 1.81 1.15 0.10 0.00 0.00 175.35 178.22 1whv h THR 451 N 2.00 0.34 -0.25 3.79 2.02 -1.98 0.30 112.91 119.13 1whv h THR 451 Ca -0.24 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 66.77 1whv h THR 451 Cb 1.24 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1whv h THR 451 CO 0.27 0.00 -0.54 -1.28 0.37 0.00 0.00 175.52 174.35 1whv h SER 452 N 0.00 0.90 -0.58 4.18 0.87 -1.99 -2.23 113.55 114.70 1whv h SER 452 Ca 0.32 -0.55 -0.09 0.00 -1.23 0.00 0.00 61.79 60.24 1whv h SER 452 Cb 1.62 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 63.30 1whv h SER 452 CO -0.00 1.29 0.01 0.44 -0.53 0.00 0.00 176.83 178.03 1whv h ASP 453 N 0.55 1.00 0.30 6.23 3.32 -0.81 -1.48 116.42 125.54 1whv h ASP 453 Ca 0.00 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 1whv h ASP 453 Cb 1.15 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1whv h ASP 453 CO 0.12 1.06 -0.15 -0.07 -1.72 0.00 0.00 179.24 178.48 1whv h LEU 454 N 0.91 -0.34 -0.45 1.55 -0.00 -1.42 -0.56 115.31 114.99 1whv h LEU 454 Ca 0.17 0.01 0.09 0.00 -0.00 0.00 0.00 57.88 58.15 1whv h LEU 454 Cb 0.54 0.09 -0.10 0.00 -0.00 0.00 0.00 40.66 41.20 1whv h LEU 454 CO 0.03 -0.19 -0.28 1.88 -0.00 0.00 0.00 178.44 179.88 1whv h TYR 455 N -0.52 -0.75 -0.15 1.13 0.05 -1.49 0.08 116.97 115.33 1whv h TYR 455 Ca -0.04 0.06 0.05 0.00 0.05 0.00 0.00 58.73 58.84 1whv h TYR 455 Cb 0.31 0.40 -0.05 0.00 1.01 0.00 0.00 36.73 38.40 1whv h TYR 455 CO 0.10 -0.35 -0.16 1.96 -1.05 0.00 0.00 178.16 178.66 1whv h GLN 456 N -0.19 -0.18 0.17 4.88 1.08 -1.34 1.14 115.11 120.67 1whv h GLN 456 Ca 0.20 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.41 1whv h GLN 456 Cb 0.51 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 1whv h GLN 456 CO -0.56 -0.12 -0.21 1.25 -0.95 0.00 0.00 178.83 178.24 1whv h LEU 457 N -0.19 -0.59 0.00 1.46 5.85 -0.04 -1.26 115.31 120.54 1whv h LEU 457 Ca 0.10 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1whv h LEU 457 Cb 0.34 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.57 1whv h LEU 457 CO -0.27 -0.26 0.00 0.49 -0.34 0.00 0.00 178.44 178.06 1whv n PHE 458 N -3.61 0.00 -0.39 1.25 3.01 -0.08 -3.13 117.46 114.51 1whv n PHE 458 Ca -0.05 0.00 0.32 0.00 1.01 0.00 0.00 57.45 58.74 1whv n PHE 458 Cb 0.18 -0.43 0.62 0.00 -0.01 0.00 0.00 39.48 39.85 1whv n PHE 458 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1whv h SER 459 N 0.00 0.26 -1.00 4.37 0.87 0.26 0.73 113.55 119.04 1whv h SER 459 Ca 0.00 0.08 0.40 0.00 -1.23 0.00 0.00 61.79 61.04 1whv h SER 459 Cb 0.13 0.05 -0.18 0.00 -0.44 0.00 0.00 62.40 61.96 1whv h SER 459 CO 0.00 -0.03 0.49 0.00 -0.53 0.00 0.00 176.83 176.75 1whv h ALA 460 N 1.54 2.04 0.01 6.23 0.00 -1.69 0.76 119.26 128.15 1whv h ALA 460 Ca 0.69 0.27 -0.05 0.00 0.00 0.00 0.00 54.91 55.82 1whv h ALA 460 Cb 2.18 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 20.31 1whv h ALA 460 CO -0.27 -0.88 -0.26 0.74 0.00 0.00 0.00 179.25 178.57 1whv h PHE 461 N 0.03 0.04 0.00 0.00 0.04 -1.16 -3.51 116.94 112.38 1whv h PHE 461 Ca 0.81 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.55 1whv h PHE 461 Cb 2.09 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.24 1whv h PHE 461 CO -0.06 1.10 0.00 0.41 -0.60 0.00 0.00 178.31 179.16 1whv n GLY 462 N 1.59 0.76 3.66 -1.45 0.00 0.26 -5.07 105.19 104.94 1whv n GLY 462 Ca -0.14 -1.81 -0.50 0.00 0.00 0.00 0.00 46.02 43.57 1whv n GLY 462 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1whv n ASN 463 N 0.00 2.70 -3.84 1.61 3.02 -1.26 -4.62 115.26 112.87 1whv n ASN 463 Ca 0.00 1.07 -0.16 0.00 -0.03 0.00 0.00 54.58 55.45 1whv n ASN 463 Cb 0.00 -1.31 -0.09 0.00 -0.61 0.00 0.00 39.78 37.77 1whv n ASN 463 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1whv s ILE 464 N 1.93 0.07 -0.35 2.41 -4.36 -1.26 -5.00 121.20 114.64 1whv s ILE 464 Ca 0.86 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 59.27 1whv s ILE 464 Cb -0.81 -2.50 0.10 0.00 1.25 0.00 0.00 42.46 40.49 1whv s ILE 464 CO 0.48 0.00 0.09 -1.58 0.24 0.00 0.00 174.94 174.16 1whv s GLN 465 N -3.82 1.78 -0.28 0.37 2.00 -1.26 -5.04 119.66 113.42 1whv s GLN 465 Ca 0.39 -1.77 -0.22 0.00 -2.00 0.00 0.00 55.36 51.76 1whv s GLN 465 Cb 0.05 -3.31 -0.01 0.00 0.80 0.00 0.00 33.01 30.54 1whv s GLN 465 CO 0.19 -0.93 0.70 0.42 -0.50 0.00 0.00 175.29 175.17 1whv s ILE 466 N 1.02 4.90 -0.24 -2.34 1.01 -1.26 -3.62 121.20 120.67 1whv s ILE 466 Ca 0.07 1.14 -0.08 0.00 0.00 0.00 0.00 60.65 61.78 1whv s ILE 466 Cb -0.20 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 1whv s ILE 466 CO -0.06 -0.10 0.09 -0.55 0.00 0.00 0.00 174.94 174.32 1whv s SER 467 N 1.53 5.44 -0.48 3.58 0.15 -0.93 -4.96 113.70 118.03 1whv s SER 467 Ca 0.29 -0.09 -0.22 0.00 0.70 0.00 0.00 55.95 56.62 1whv s SER 467 Cb -0.15 -1.97 0.03 0.00 -1.71 0.00 0.00 66.02 62.22 1whv s SER 467 CO 0.10 0.02 0.78 0.26 1.20 0.00 0.00 173.24 175.60 1whv s TRP 468 N 1.32 2.96 -0.05 3.44 0.52 -1.26 -1.07 118.94 124.80 1whv s TRP 468 Ca 0.05 0.00 -0.04 0.00 0.02 0.00 0.00 56.10 56.14 1whv s TRP 468 Cb -0.15 -3.70 -0.01 0.00 -1.15 0.00 0.00 33.47 28.46 1whv s TRP 468 CO 0.04 -1.06 -0.07 -0.89 0.02 0.00 0.00 176.95 174.99 1whv n ILE 469 N 6.05 0.54 -4.33 2.03 5.41 -0.11 -5.01 119.36 123.94 1whv n ILE 469 Ca 0.01 0.39 -0.15 0.00 1.00 0.00 0.00 62.75 64.00 1whv n ILE 469 Cb 0.48 -1.84 -0.04 0.00 -0.71 0.00 0.00 39.64 37.53 1whv n ILE 469 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1whv n ASP 470 N -3.16 1.88 0.08 4.38 2.03 -0.12 -4.94 116.55 116.71 1whv n ASP 470 Ca -0.03 -2.15 0.08 0.00 0.52 0.00 0.00 54.79 53.21 1whv n ASP 470 Cb 0.10 0.37 0.54 0.00 -0.72 0.00 0.00 41.12 41.42 1whv n ASP 470 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 1whv h ASP 471 N 0.75 0.24 0.00 1.67 2.03 -1.97 -2.88 116.42 116.25 1whv h ASP 471 Ca -0.19 -0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.10 1whv h ASP 471 Cb 0.65 -0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 39.08 1whv h ASP 471 CO 0.31 0.16 -0.29 0.35 -1.03 0.00 0.00 179.24 178.74 1whv n THR 472 N -4.49 0.92 -4.37 1.15 -2.24 -1.26 -4.04 114.28 99.96 1whv n THR 472 Ca 0.02 -1.16 -0.30 0.00 -2.27 0.00 0.00 64.05 60.34 1whv n THR 472 Cb 0.17 0.16 -0.17 0.00 -2.10 0.00 0.00 70.33 68.39 1whv n THR 472 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1whv s SER 473 N -1.95 2.65 0.10 3.42 0.01 -1.09 -3.48 113.70 113.36 1whv s SER 473 Ca 0.17 -0.48 -0.02 0.00 1.31 0.00 0.00 55.95 56.92 1whv s SER 473 Cb 0.15 -1.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.16 1whv s SER 473 CO 0.01 0.01 0.06 0.00 0.41 0.00 0.00 173.24 173.72 1whv s ALA 474 N 1.10 0.57 0.12 1.44 0.00 -1.06 -0.93 121.76 123.00 1whv s ALA 474 Ca -0.03 -1.26 0.08 0.00 0.00 0.00 0.00 51.96 50.75 1whv s ALA 474 Cb -0.14 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 1whv s ALA 474 CO -0.05 -0.46 -0.20 -0.06 0.00 0.00 0.00 175.76 174.99 1whv s PHE 475 N -3.98 1.79 0.01 0.00 0.08 -0.23 -2.82 117.98 112.82 1whv s PHE 475 Ca 0.16 -0.43 0.05 0.00 0.12 0.00 0.00 56.93 56.83 1whv s PHE 475 Cb 0.07 -0.96 -0.02 0.00 -0.57 0.00 0.00 43.02 41.54 1whv s PHE 475 CO -0.04 0.24 -0.16 0.08 -0.10 0.00 0.00 175.22 175.23 1whv s VAL 476 N -1.39 1.30 -0.09 -0.44 1.01 -0.56 -2.18 120.40 118.05 1whv s VAL 476 Ca 0.09 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.28 1whv s VAL 476 Cb -0.09 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1whv s VAL 476 CO 0.05 0.27 -0.20 -0.94 0.00 0.00 0.00 175.10 174.28 1whv s SER 477 N -0.64 2.66 0.44 3.32 1.04 -1.24 -1.14 113.70 118.14 1whv s SER 477 Ca 0.06 -0.48 0.06 0.00 0.48 0.00 0.00 55.95 56.07 1whv s SER 477 Cb -0.07 -1.22 -0.05 0.00 0.10 0.00 0.00 66.02 64.79 1whv s SER 477 CO 0.00 0.11 0.13 -0.76 0.98 0.00 0.00 173.24 173.70 1whv s LEU 478 N 0.51 2.90 -0.22 2.42 1.43 -1.15 -4.18 118.68 120.38 1whv s LEU 478 Ca -0.16 -1.26 -0.17 0.00 -1.03 0.00 0.00 54.13 51.51 1whv s LEU 478 Cb -0.17 -1.17 -0.18 0.00 0.03 0.00 0.00 46.19 44.71 1whv s LEU 478 CO 0.06 -0.61 0.04 -0.24 0.23 0.00 0.00 176.35 175.83 1whv n SER 479 N -1.22 1.91 -4.57 2.29 2.88 -1.26 -4.89 113.62 108.77 1whv n SER 479 Ca -0.05 0.36 -0.30 0.00 -1.33 0.00 0.00 58.87 57.56 1whv n SER 479 Cb 0.66 -0.90 -0.10 0.00 -0.75 0.00 0.00 64.21 63.12 1whv n SER 479 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1whv s GLN 480 N -2.43 2.09 0.29 -1.46 -2.07 -1.26 -5.03 119.66 109.80 1whv s GLN 480 Ca -0.31 -1.05 0.08 0.00 -1.82 0.00 0.00 55.36 52.25 1whv s GLN 480 Cb 0.09 -2.28 0.45 0.00 -1.09 0.00 0.00 33.01 30.17 1whv s GLN 480 CO 0.58 0.50 1.68 -1.00 -1.32 0.00 0.00 175.29 175.73 1whv h PRO 481 N 3.58 0.17 -0.44 9.60 0.13 -1.95 -3.22 132.00 139.87 1whv h PRO 481 Ca -0.49 -0.09 0.09 0.00 -0.87 0.00 0.00 66.00 64.64 1whv h PRO 481 Cb 1.17 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.21 1whv h PRO 481 CO 0.52 0.60 -0.17 0.93 -0.23 0.00 0.00 178.00 179.65 1whv h GLU 482 N 0.14 -0.07 -0.96 0.86 4.39 -2.00 -0.09 114.58 116.85 1whv h GLU 482 Ca 0.01 0.00 0.25 0.00 0.34 0.00 0.00 59.36 59.97 1whv h GLU 482 Cb 0.88 0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 29.41 1whv h GLU 482 CO 0.07 -0.05 0.49 1.96 -1.16 0.00 0.00 179.01 180.32 1whv h GLN 483 N -0.07 0.41 -0.96 2.33 1.08 -2.00 -1.00 115.11 114.91 1whv h GLN 483 Ca 0.21 -0.02 0.16 0.00 -1.45 0.00 0.00 58.65 57.55 1whv h GLN 483 Cb 0.40 -0.09 -0.16 0.00 -0.05 0.00 0.00 27.48 27.58 1whv h GLN 483 CO -0.49 0.27 -0.36 0.28 -0.95 0.00 0.00 178.83 177.58 1whv h VAL 484 N 0.42 0.02 -0.55 -0.54 2.07 -1.16 -0.13 116.25 116.38 1whv h VAL 484 Ca 0.63 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.21 1whv h VAL 484 Cb 1.27 0.02 -0.09 0.00 -1.52 0.00 0.00 31.29 30.98 1whv h VAL 484 CO -0.54 0.00 -0.51 -0.61 0.02 0.00 0.00 177.57 175.93 1whv h GLN 485 N -0.02 -0.23 0.22 1.57 -0.00 -1.28 -0.20 115.11 115.18 1whv h GLN 485 Ca 0.36 0.02 0.01 0.00 -0.00 0.00 0.00 58.65 59.03 1whv h GLN 485 Cb 0.61 0.05 -0.04 0.00 0.00 0.00 0.00 27.48 28.11 1whv h GLN 485 CO -0.96 -0.15 -0.41 0.82 0.00 0.00 0.00 178.83 178.12 1whv h ILE 486 N -0.23 0.17 -0.45 2.39 5.03 -1.19 0.21 117.51 123.44 1whv h ILE 486 Ca 0.09 0.00 0.13 0.00 -0.12 0.00 0.00 64.86 64.96 1whv h ILE 486 Cb 0.48 0.17 -0.02 0.00 -3.03 0.00 0.00 36.82 34.42 1whv h ILE 486 CO -0.64 0.00 0.73 0.00 -0.68 0.00 0.00 178.15 177.56 1whv h ALA 487 N -0.27 2.18 0.06 1.87 0.00 -0.51 0.56 119.26 123.15 1whv h ALA 487 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.55 1whv h ALA 487 Cb 0.70 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1whv h ALA 487 CO -0.18 -0.96 -2.00 0.28 0.00 0.00 0.00 179.25 176.39 1whv n VAL 488 N -3.22 1.66 0.27 0.00 0.31 -0.03 -3.66 118.33 113.66 1whv n VAL 488 Ca 0.09 -0.71 0.16 0.00 -0.01 0.00 0.00 64.34 63.87 1whv n VAL 488 Cb 0.89 -1.37 0.68 0.00 -0.91 0.00 0.00 33.84 33.14 1whv n VAL 488 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 1whv h ASN 489 N 0.03 0.00 0.39 4.52 -1.24 0.30 -2.81 115.58 116.77 1whv h ASN 489 Ca -0.41 0.00 -0.32 0.00 0.71 0.00 0.00 56.30 56.28 1whv h ASN 489 Cb 2.03 0.00 0.01 0.00 0.73 0.00 0.00 38.32 41.09 1whv h ASN 489 CO 0.06 0.05 -1.51 0.71 -1.29 0.00 0.00 177.43 175.45 1whv h THR 490 N 0.00 1.21 0.00 -3.57 1.35 -1.16 -3.29 112.91 107.45 1whv h THR 490 Ca -0.00 -2.77 -0.02 0.00 -0.55 0.00 0.00 66.41 63.07 1whv h THR 490 Cb 0.51 2.87 -0.00 0.00 -1.73 0.00 0.00 68.15 69.80 1whv h THR 490 CO 0.01 0.84 -0.11 0.77 -0.25 0.00 0.00 175.52 176.77 1whv h SER 491 N 0.10 0.00 0.04 5.36 4.64 -1.59 -2.76 113.55 119.34 1whv h SER 491 Ca -0.25 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.09 1whv h SER 491 Cb 2.07 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.12 1whv h SER 491 CO 0.20 0.11 -0.38 0.11 -0.87 0.00 0.00 176.83 176.00 1whv h LYS 492 N 0.00 -0.49 -0.07 4.77 1.79 -1.57 -2.88 116.57 118.11 1whv h LYS 492 Ca -0.00 0.03 -0.21 0.00 -2.18 0.00 0.00 60.65 58.30 1whv h LYS 492 Cb 0.58 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1whv h LYS 492 CO 0.01 -0.33 -0.80 0.10 -1.08 0.00 0.00 179.45 177.35 1whv h TYR 493 N -0.51 0.71 -2.16 -1.35 -0.00 -1.75 -3.43 116.97 108.47 1whv h TYR 493 Ca 0.00 -0.33 -0.56 0.00 0.00 0.00 0.00 58.73 57.84 1whv h TYR 493 Cb 0.53 -0.10 0.01 0.00 0.00 0.00 0.00 36.73 37.17 1whv h TYR 493 CO -0.45 1.12 1.38 0.00 -0.00 0.00 0.00 178.16 180.21 1whv s ALA 494 N -3.56 3.12 -0.15 0.10 0.00 -1.04 -4.84 121.76 115.39 1whv s ALA 494 Ca -0.07 1.04 0.06 0.00 0.00 0.00 0.00 51.96 52.99 1whv s ALA 494 Cb 0.09 -3.97 -0.23 0.00 0.00 0.00 0.00 23.12 19.01 1whv s ALA 494 CO 0.86 -2.23 0.25 -0.85 0.00 0.00 0.00 175.76 173.80 1whv n GLU 495 N 8.20 0.69 -0.18 0.00 0.28 -1.26 -4.36 120.64 124.01 1whv n GLU 495 Ca 0.25 0.19 -0.02 0.00 -0.16 0.00 0.00 57.16 57.42 1whv n GLU 495 Cb 0.43 -1.65 0.06 0.00 1.43 0.00 0.00 31.44 31.71 1whv n GLU 495 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 177.13 177.74 1whv h SER 496 N 0.02 -0.38 -1.69 -1.84 0.02 -1.95 -3.42 113.55 104.30 1whv h SER 496 Ca -0.45 0.15 -0.61 0.00 -0.84 0.00 0.00 61.79 60.05 1whv h SER 496 Cb 2.05 0.29 -0.12 0.00 0.14 0.00 0.00 62.40 64.76 1whv h SER 496 CO 0.03 -0.14 -0.58 -0.72 -1.14 0.00 0.00 176.83 174.28 1whv s TYR 497 N -6.20 2.54 -0.03 3.45 -0.85 -1.26 -4.66 117.35 110.34 1whv s TYR 497 Ca -0.14 -0.61 -0.00 0.00 -0.52 0.00 0.00 57.07 55.80 1whv s TYR 497 Cb 0.17 -1.77 0.03 0.00 0.38 0.00 0.00 41.96 40.78 1whv s TYR 497 CO 0.73 0.39 0.02 0.50 -1.52 0.00 0.00 175.55 175.67 1whv s ARG 498 N -3.76 0.11 -0.03 -3.49 3.52 -1.18 -4.82 118.95 109.30 1whv s ARG 498 Ca 0.36 0.16 0.08 0.00 -0.13 0.00 0.00 55.73 56.20 1whv s ARG 498 Cb 0.07 -0.38 -0.02 0.00 -1.56 0.00 0.00 34.95 33.05 1whv s ARG 498 CO 0.19 -0.17 -0.26 0.42 -0.81 0.00 0.00 175.30 174.67 1whv s ILE 499 N 1.17 2.05 0.17 4.11 1.01 -1.26 -1.48 121.20 126.96 1whv s ILE 499 Ca -0.08 -1.10 -0.14 0.00 0.00 0.00 0.00 60.65 59.33 1whv s ILE 499 Cb -0.13 -1.70 0.02 0.00 0.01 0.00 0.00 42.46 40.65 1whv s ILE 499 CO -0.03 0.58 0.41 0.00 0.00 0.00 0.00 174.94 175.90 1whv s GLN 500 N -0.53 1.23 0.43 2.79 -2.07 -0.52 -4.93 119.66 116.06 1whv s GLN 500 Ca 0.07 -0.93 -0.24 0.00 -1.82 0.00 0.00 55.36 52.45 1whv s GLN 500 Cb -0.11 0.46 -0.08 0.00 -1.09 0.00 0.00 33.01 32.19 1whv s GLN 500 CO -0.00 -0.49 1.12 0.95 -1.32 0.00 0.00 175.29 175.55 1whv s THR 501 N -3.89 3.34 0.20 3.63 -4.23 -1.26 0.35 115.64 113.79 1whv s THR 501 Ca 0.10 1.03 -0.17 0.00 -1.18 0.00 0.00 61.69 61.47 1whv s THR 501 Cb 0.01 -3.53 0.19 0.00 1.34 0.00 0.00 72.50 70.51 1whv s THR 501 CO -0.04 0.01 1.61 0.22 -0.54 0.00 0.00 174.62 175.87 1whv h TYR 502 N 2.29 -0.60 -0.52 3.99 5.03 -1.69 0.68 116.97 126.15 1whv h TYR 502 Ca -0.49 0.06 0.05 0.00 2.58 0.00 0.00 58.73 60.94 1whv h TYR 502 Cb 1.23 0.36 -0.05 0.00 1.55 0.00 0.00 36.73 39.82 1whv h TYR 502 CO 0.55 -0.33 0.24 0.00 -1.32 0.00 0.00 178.16 177.30 1whv h ALA 503 N 1.35 0.66 -0.42 1.82 0.00 -1.91 -0.87 119.26 119.89 1whv h ALA 503 Ca 0.28 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1whv h ALA 503 Cb 0.52 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1whv h ALA 503 CO -0.67 -0.13 0.18 0.93 0.00 0.00 0.00 179.25 179.56 1whv h GLU 504 N 0.46 0.36 0.67 0.00 4.39 -1.31 0.32 114.58 119.47 1whv h GLU 504 Ca 0.24 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.88 1whv h GLU 504 Cb 0.18 -0.08 0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1whv h GLU 504 CO -0.19 0.24 -0.32 -0.92 -1.16 0.00 0.00 179.01 176.65 1whv h TYR 505 N 0.37 -0.84 -0.85 4.33 3.20 -0.55 -3.12 116.97 119.51 1whv h TYR 505 Ca 0.19 -0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.18 1whv h TYR 505 Cb 0.13 0.28 -0.09 0.00 1.54 0.00 0.00 36.73 38.59 1whv h TYR 505 CO -0.12 -0.52 0.44 -0.39 -1.64 0.00 0.00 178.16 175.92 1whv h VAL 506 N -0.96 0.74 -0.81 1.81 -1.51 -1.13 -2.28 116.25 112.10 1whv h VAL 506 Ca -0.09 -0.22 0.17 0.00 -1.23 0.00 0.00 66.70 65.33 1whv h VAL 506 Cb 0.69 0.05 -0.15 0.00 -2.13 0.00 0.00 31.29 29.75 1whv h VAL 506 CO 0.15 0.12 -0.18 0.61 -1.23 0.00 0.00 177.57 177.04 1whv n GLY 507 N -1.32 -1.33 0.31 5.19 0.00 0.11 0.20 105.19 108.35 1whv n GLY 507 Ca 0.17 0.86 -0.14 0.00 0.00 0.00 0.00 46.02 46.90 1whv n GLY 507 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1whv h LYS 508 N 0.00 -0.56 0.40 1.61 1.79 -1.47 -3.17 116.57 115.16 1whv h LYS 508 Ca 0.40 0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.90 1whv h LYS 508 Cb 0.64 0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.40 1whv h LYS 508 CO -0.83 -0.38 -0.42 0.87 -1.08 0.00 0.00 179.45 177.62 1whv h LYS 509 N -0.59 -0.79 -6.18 3.15 1.57 -0.35 -3.43 116.57 109.95 1whv h LYS 509 Ca -0.01 0.05 -0.60 0.00 -1.87 0.00 0.00 60.65 58.23 1whv h LYS 509 Cb 0.54 0.18 -0.26 0.00 0.08 0.00 0.00 32.23 32.77 1whv h LYS 509 CO -0.06 -0.53 -0.85 1.14 -0.57 0.00 0.00 179.45 178.59 1whv s GLN 510 N -5.31 1.45 -0.18 3.15 -2.07 -0.08 -5.12 119.66 111.50 1whv s GLN 510 Ca -0.14 -0.97 -0.05 0.00 -1.82 0.00 0.00 55.36 52.38 1whv s GLN 510 Cb 0.03 -1.57 0.06 0.00 -1.09 0.00 0.00 33.01 30.44 1whv s GLN 510 CO 0.49 0.40 0.09 -1.59 -1.32 0.00 0.00 175.29 173.36 1whv s LYS 511 N -1.19 0.13 0.00 9.60 -2.85 -1.25 -3.83 119.74 120.35 1whv s LYS 511 Ca 0.08 -0.14 0.00 0.00 -1.00 0.00 0.00 55.97 54.91 1whv s LYS 511 Cb -0.09 -1.83 0.00 0.00 -2.06 0.00 0.00 37.83 33.85 1whv s LYS 511 CO 0.02 -0.68 0.00 0.41 0.10 0.00 0.00 175.35 175.19 1whv n GLY 512 N 5.25 -1.42 2.74 0.59 0.00 -1.26 -4.96 105.19 106.13 1whv n GLY 512 Ca -0.07 -0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.34 1whv n GLY 512 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1whv s LYS 513 N 0.00 1.71 -0.29 1.61 2.20 -1.26 -5.05 119.74 118.66 1whv s LYS 513 Ca 0.00 -2.59 -0.14 0.00 -0.36 0.00 0.00 55.97 52.87 1whv s LYS 513 Cb 0.00 -2.64 0.13 0.00 -1.51 0.00 0.00 37.83 33.81 1whv s LYS 513 CO 0.00 -1.25 0.84 -1.14 -0.36 0.00 0.00 175.35 173.44 1whv s GLN 514 N -0.45 0.48 0.25 4.03 -0.44 -1.26 -5.14 119.66 117.13 1whv s GLN 514 Ca 0.23 0.99 -0.25 0.00 -2.50 0.00 0.00 55.36 53.83 1whv s GLN 514 Cb -0.11 0.36 -0.16 0.00 -1.64 0.00 0.00 33.01 31.46 1whv s GLN 514 CO -0.10 -0.13 0.38 1.55 0.50 0.00 0.00 175.29 177.49 1whv n VAL 515 N 4.54 1.56 -4.20 1.34 3.14 -1.26 -4.96 118.33 118.50 1whv n VAL 515 Ca -0.15 -0.49 -0.28 0.00 -2.96 0.00 0.00 64.34 60.46 1whv n VAL 515 Cb 0.55 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.25 1whv n VAL 515 CO 0.00 0.00 0.00 -1.59 -6.46 0.00 0.00 176.83 168.78 1whv s LYS 516 N -0.97 2.37 -0.03 1.45 0.00 -1.26 -5.13 119.74 116.17 1whv s LYS 516 Ca 0.61 -1.04 -0.07 0.00 0.00 0.00 0.00 55.97 55.46 1whv s LYS 516 Cb -0.82 -2.38 0.01 0.00 0.00 0.00 0.00 37.83 34.64 1whv s LYS 516 CO 0.56 0.48 0.17 0.45 0.00 0.00 0.00 175.35 177.01 1whv s SER 517 N -2.67 -0.08 -0.62 0.03 0.15 -1.26 -5.11 113.70 104.14 1whv s SER 517 Ca 0.26 0.05 0.04 0.00 0.70 0.00 0.00 55.95 57.00 1whv s SER 517 Cb -0.10 0.28 0.16 0.00 -1.71 0.00 0.00 66.02 64.65 1whv s SER 517 CO 0.17 -0.25 0.40 -0.83 1.20 0.00 0.00 173.24 173.94 1whv s GLY 518 N -0.78 2.61 0.00 9.45 0.00 -1.26 -4.91 107.32 112.43 1whv s GLY 518 Ca -0.09 -3.51 0.15 0.00 0.00 0.00 0.00 44.72 41.27 1whv s GLY 518 CO 0.01 1.16 1.42 -1.55 0.00 0.00 0.00 173.10 174.15 1whv n PRO 519 N 2.43 0.16 -4.43 2.90 -0.04 -1.26 -4.73 135.00 130.03 1whv n PRO 519 Ca 0.16 0.17 -0.27 0.00 -0.04 0.00 0.00 63.50 63.52 1whv n PRO 519 Cb 0.35 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.22 1whv n PRO 519 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1whv s SER 520 N -2.68 4.14 -0.56 3.54 1.04 -1.26 -5.02 113.70 112.90 1whv s SER 520 Ca 0.12 -1.30 -0.40 0.00 0.48 0.00 0.00 55.95 54.85 1whv s SER 520 Cb 0.10 -0.27 -0.19 0.00 0.10 0.00 0.00 66.02 65.76 1whv s SER 520 CO 0.23 -0.56 2.15 -1.54 0.98 0.00 0.00 173.24 174.49 1whv n SER 521 N -1.14 0.65 0.00 7.02 3.41 -1.26 -5.23 113.62 117.07 1whv n SER 521 Ca -0.05 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 1whv n SER 521 Cb 0.66 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 1whv n SER 521 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49