#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 -0.90 0.48 1.61 1.04 -1.26 -5.17 113.70 109.51 1whv s SER 424 Ca 0.00 1.41 -0.05 0.00 0.48 0.00 0.00 55.95 57.79 1whv s SER 424 Cb 0.00 1.72 -0.03 0.00 0.10 0.00 0.00 66.02 67.81 1whv s SER 424 CO 0.00 -0.23 0.77 -0.44 0.98 0.00 0.00 173.24 174.33 1whv s SER 425 N 2.30 6.20 0.00 7.02 0.01 -1.26 -5.10 113.70 122.88 1whv s SER 425 Ca -0.07 0.85 0.00 0.00 1.31 0.00 0.00 55.95 58.04 1whv s SER 425 Cb -0.09 -2.16 0.00 0.00 0.21 0.00 0.00 66.02 63.97 1whv s SER 425 CO -0.18 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 173.48 1whv n GLY 426 N -2.24 -0.48 3.68 3.44 0.00 -1.26 -4.87 105.19 103.46 1whv n GLY 426 Ca 0.00 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1whv n GLY 426 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1whv s SER 427 N -1.33 6.92 -0.09 1.61 0.01 -1.26 -5.02 113.70 114.55 1whv s SER 427 Ca 0.00 1.90 0.01 0.00 1.31 0.00 0.00 55.95 59.16 1whv s SER 427 Cb 0.00 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.65 1whv s SER 427 CO 0.00 -0.71 -0.09 -0.55 0.41 0.00 0.00 173.24 172.29 1whv s SER 428 N 1.94 4.41 0.00 2.44 0.15 -1.26 -5.02 113.70 116.36 1whv s SER 428 Ca 0.59 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.11 1whv s SER 428 Cb -0.26 -1.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.78 1whv s SER 428 CO 0.21 0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.56 1whv n GLY 429 N 2.67 -0.52 2.62 9.45 0.00 -1.26 -4.83 105.19 113.31 1whv n GLY 429 Ca -0.18 -1.55 -0.21 0.00 0.00 0.00 0.00 46.02 44.09 1whv n GLY 429 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1whv s GLY 430 N -1.83 0.32 0.23 -0.02 0.00 -1.25 -5.05 107.32 99.72 1whv s GLY 430 Ca 0.00 -1.44 -0.30 0.00 0.00 0.00 0.00 44.72 42.98 1whv s GLY 430 CO 0.00 2.55 1.28 2.56 0.00 0.00 0.00 173.10 179.49 1whv s PRO 431 N 1.00 4.41 1.20 2.90 0.04 -1.26 -2.56 135.00 140.73 1whv s PRO 431 Ca 0.22 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 63.13 1whv s PRO 431 Cb -0.12 -3.17 0.25 0.00 0.04 0.00 0.00 34.50 31.50 1whv s PRO 431 CO -0.05 -0.18 0.53 -3.47 0.04 0.00 0.00 177.00 173.86 1whv n ASP 432 N 2.12 -3.23 -3.75 6.66 2.03 -1.26 -4.86 116.55 114.27 1whv n ASP 432 Ca 0.04 -0.51 -0.42 0.00 0.52 0.00 0.00 54.79 54.43 1whv n ASP 432 Cb 0.43 -0.91 0.01 0.00 -0.72 0.00 0.00 41.12 39.92 1whv n ASP 432 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1whv n LEU 433 N -3.17 7.14 -4.00 -2.67 4.77 -1.26 -4.94 117.00 112.87 1whv n LEU 433 Ca 0.07 -5.02 -0.15 0.00 -0.03 0.00 0.00 56.01 50.89 1whv n LEU 433 Cb 0.48 -1.33 -0.13 0.00 -2.33 0.00 0.00 43.42 40.12 1whv n LEU 433 CO 0.36 1.79 -0.40 0.00 -1.33 0.00 0.00 177.39 177.81 1whv s GLN 434 N -1.88 0.47 0.44 3.23 -2.07 -1.26 -5.14 119.66 113.45 1whv s GLN 434 Ca 0.41 -0.42 -0.24 0.00 -1.82 0.00 0.00 55.36 53.29 1whv s GLN 434 Cb 0.13 -0.37 -0.08 0.00 -1.09 0.00 0.00 33.01 31.60 1whv s GLN 434 CO -0.02 0.09 1.17 -1.25 -1.32 0.00 0.00 175.29 173.95 1whv s PRO 435 N -0.72 3.84 -0.30 9.60 0.04 -1.26 -5.04 135.00 141.16 1whv s PRO 435 Ca -0.03 1.80 -0.03 0.00 0.04 0.00 0.00 61.00 62.78 1whv s PRO 435 Cb -0.05 -2.48 0.19 0.00 0.04 0.00 0.00 34.50 32.19 1whv s PRO 435 CO 0.00 -0.49 0.76 0.21 0.04 0.00 0.00 177.00 177.52 1whv s LYS 436 N -2.59 0.42 -1.40 4.56 2.20 -1.26 -4.94 119.74 116.73 1whv s LYS 436 Ca 0.62 0.62 -0.07 0.00 -0.36 0.00 0.00 55.97 56.78 1whv s LYS 436 Cb -0.29 0.33 0.01 0.00 -1.51 0.00 0.00 37.83 36.37 1whv s LYS 436 CO 0.36 -0.59 0.91 0.54 -0.36 0.00 0.00 175.35 176.21 1whv n ARG 437 N 5.40 -6.47 0.41 4.03 1.74 -1.26 -4.64 116.66 115.87 1whv n ARG 437 Ca 0.00 0.84 -0.17 0.00 -0.77 0.00 0.00 57.85 57.76 1whv n ARG 437 Cb 0.53 -5.74 -0.08 0.00 -1.02 0.00 0.00 32.46 26.15 1whv n ARG 437 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1whv h ASP 438 N -2.08 -0.90 -1.39 0.55 1.82 -1.98 -2.76 116.42 109.69 1whv h ASP 438 Ca -0.54 0.02 0.40 0.00 -0.39 0.00 0.00 57.03 56.53 1whv h ASP 438 Cb 1.36 0.23 -0.06 0.00 0.68 0.00 0.00 39.33 41.54 1whv h ASP 438 CO 0.55 -0.54 1.18 1.12 -1.61 0.00 0.00 179.24 179.94 1whv h HIS 439 N -1.25 0.00 -3.34 0.28 2.07 -1.94 -3.39 115.15 107.58 1whv h HIS 439 Ca -0.11 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.89 1whv h HIS 439 Cb 0.82 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.82 1whv h HIS 439 CO -0.00 0.00 0.59 0.08 -3.07 0.00 0.00 177.93 175.53 1whv s VAL 440 N -4.70 3.60 0.16 6.12 1.01 -1.04 -3.75 120.40 121.80 1whv s VAL 440 Ca -0.04 1.26 0.07 0.00 0.00 0.00 0.00 61.98 63.27 1whv s VAL 440 Cb 0.21 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1whv s VAL 440 CO 0.70 0.16 0.02 -0.76 0.00 0.00 0.00 175.10 175.22 1whv s LEU 441 N 0.25 3.41 -0.26 3.92 1.43 0.91 -1.58 118.68 126.76 1whv s LEU 441 Ca 0.56 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.35 1whv s LEU 441 Cb -0.33 -2.06 0.07 0.00 0.03 0.00 0.00 46.19 43.89 1whv s LEU 441 CO 0.34 0.10 -0.04 -2.28 0.23 0.00 0.00 176.35 174.69 1whv s HIS 442 N -1.69 2.75 -0.26 0.29 2.46 0.31 -0.94 115.29 118.21 1whv s HIS 442 Ca 0.28 -2.06 -0.07 0.00 0.47 0.00 0.00 55.06 53.67 1whv s HIS 442 Cb -0.10 -1.85 -0.02 0.00 -0.13 0.00 0.00 32.58 30.48 1whv s HIS 442 CO 0.19 -0.83 0.08 0.08 -2.47 0.00 0.00 174.74 171.79 1whv s VAL 443 N 1.27 4.28 -0.51 0.89 1.01 -1.23 -1.60 120.40 124.51 1whv s VAL 443 Ca -0.03 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 1whv s VAL 443 Cb -0.19 -3.05 0.07 0.00 0.00 0.00 0.00 36.38 33.20 1whv s VAL 443 CO -0.07 0.27 0.60 0.42 0.00 0.00 0.00 175.10 176.31 1whv s THR 444 N 1.59 4.93 0.19 3.92 -4.23 -0.69 -3.18 115.64 118.17 1whv s THR 444 Ca 0.06 -0.64 0.10 0.00 -1.18 0.00 0.00 61.69 60.03 1whv s THR 444 Cb -0.16 -4.29 -0.04 0.00 1.34 0.00 0.00 72.50 69.35 1whv s THR 444 CO 0.04 -0.81 -0.22 0.72 -0.54 0.00 0.00 174.62 173.81 1whv s PHE 445 N 2.47 2.14 0.39 3.99 -0.12 -1.21 -3.82 117.98 121.82 1whv s PHE 445 Ca 0.13 -0.39 -0.26 0.00 -0.05 0.00 0.00 56.93 56.36 1whv s PHE 445 Cb -0.21 -1.05 -0.09 0.00 -0.63 0.00 0.00 43.02 41.05 1whv s PHE 445 CO 0.10 0.47 1.19 -1.25 -0.05 0.00 0.00 175.22 175.68 1whv s PRO 446 N -2.80 4.07 0.29 1.99 0.04 -1.26 -4.28 135.00 133.06 1whv s PRO 446 Ca 0.20 1.90 0.01 0.00 0.04 0.00 0.00 61.00 63.15 1whv s PRO 446 Cb -0.07 -2.72 0.71 0.00 0.04 0.00 0.00 34.50 32.46 1whv s PRO 446 CO 0.09 -0.32 1.60 1.57 0.04 0.00 0.00 177.00 179.98 1whv h LYS 447 N 2.72 0.07 -1.07 4.56 2.10 -1.92 0.34 116.57 123.37 1whv h LYS 447 Ca -0.49 -0.00 0.39 0.00 -2.00 0.00 0.00 60.65 58.55 1whv h LYS 447 Cb 1.24 -0.02 -0.13 0.00 -0.90 0.00 0.00 32.23 32.42 1whv h LYS 447 CO 0.63 0.05 0.66 -0.85 -2.00 0.00 0.00 179.45 177.94 1whv n GLU 448 N -5.39 -0.04 -0.51 0.07 0.28 -1.26 -4.43 120.64 109.36 1whv n GLU 448 Ca 0.22 1.09 -0.29 0.00 -0.16 0.00 0.00 57.16 58.02 1whv n GLU 448 Cb 0.71 -2.09 0.22 0.00 1.43 0.00 0.00 31.44 31.71 1whv n GLU 448 CO 0.00 0.00 0.00 0.91 -0.16 0.00 0.00 177.13 177.88 1whv n TRP 449 N -4.54 -1.94 -3.74 -1.84 7.02 0.12 -5.06 117.44 107.46 1whv n TRP 449 Ca 0.33 -0.14 -0.10 0.00 -1.02 0.00 0.00 57.50 56.58 1whv n TRP 449 Cb 1.26 -1.53 -0.06 0.00 -2.42 0.00 0.00 31.31 28.56 1whv n TRP 449 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1whv s LYS 450 N -3.97 0.95 0.13 -0.99 -0.14 -1.26 -5.05 119.74 109.41 1whv s LYS 450 Ca 0.59 -0.82 -0.32 0.00 -1.36 0.00 0.00 55.97 54.05 1whv s LYS 450 Cb -0.15 0.41 -0.09 0.00 -1.68 0.00 0.00 37.83 36.32 1whv s LYS 450 CO 0.60 -0.34 1.56 1.15 -0.76 0.00 0.00 175.35 177.55 1whv h THR 451 N 2.57 0.03 -0.98 2.17 2.02 -1.97 0.26 112.91 117.02 1whv h THR 451 Ca -0.34 0.00 0.33 0.00 0.77 0.00 0.00 66.41 67.17 1whv h THR 451 Cb 1.23 0.03 -0.17 0.00 -1.74 0.00 0.00 68.15 67.50 1whv h THR 451 CO 0.51 0.00 0.33 0.28 0.37 0.00 0.00 175.52 177.02 1whv h SER 452 N -0.45 0.05 -0.09 4.18 0.02 -1.99 0.49 113.55 115.75 1whv h SER 452 Ca 0.07 0.25 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1whv h SER 452 Cb 0.62 0.32 -0.00 0.00 0.14 0.00 0.00 62.40 63.48 1whv h SER 452 CO -0.54 -0.32 0.05 -0.78 -1.14 0.00 0.00 176.83 174.10 1whv h ASP 453 N 0.09 0.12 0.46 3.07 3.58 -1.38 -1.39 116.42 120.97 1whv h ASP 453 Ca 0.70 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 58.05 1whv h ASP 453 Cb 1.65 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 42.65 1whv h ASP 453 CO -0.77 0.18 -0.44 -0.07 -2.88 0.00 0.00 179.24 175.26 1whv h LEU 454 N 0.05 -1.19 -0.25 2.28 -0.00 0.52 0.76 115.31 117.48 1whv h LEU 454 Ca 0.03 0.10 0.06 0.00 -0.00 0.00 0.00 57.88 58.07 1whv h LEU 454 Cb 0.09 0.39 -0.07 0.00 -0.00 0.00 0.00 40.66 41.07 1whv h LEU 454 CO -0.00 -0.60 -0.26 1.88 -0.00 0.00 0.00 178.44 179.45 1whv h TYR 455 N -0.91 -0.71 -0.55 1.13 0.05 -1.25 0.19 116.97 114.93 1whv h TYR 455 Ca -0.05 0.04 0.08 0.00 0.05 0.00 0.00 58.73 58.86 1whv h TYR 455 Cb 0.79 0.35 -0.07 0.00 1.01 0.00 0.00 36.73 38.82 1whv h TYR 455 CO -0.22 -0.34 0.18 1.96 -1.05 0.00 0.00 178.16 178.69 1whv h GLN 456 N -0.27 0.34 0.79 4.88 1.08 -1.07 1.85 115.11 122.70 1whv h GLN 456 Ca 0.14 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.28 1whv h GLN 456 Cb 0.48 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1whv h GLN 456 CO -0.40 0.22 -0.47 1.25 -0.95 0.00 0.00 178.83 178.48 1whv h LEU 457 N 0.35 -1.16 0.00 1.46 5.85 0.17 -2.23 115.31 119.74 1whv h LEU 457 Ca 0.27 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.06 1whv h LEU 457 Cb 0.33 0.33 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1whv h LEU 457 CO -0.30 -0.73 0.00 0.49 -0.34 0.00 0.00 178.44 177.57 1whv n PHE 458 N -5.61 0.00 -0.33 1.25 3.72 -0.04 -3.63 117.46 112.82 1whv n PHE 458 Ca -0.15 0.00 0.23 0.00 -0.05 0.00 0.00 57.45 57.48 1whv n PHE 458 Cb 0.49 -0.44 0.45 0.00 -0.94 0.00 0.00 39.48 39.04 1whv n PHE 458 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1whv h SER 459 N 0.00 0.36 -0.70 4.37 0.87 0.35 0.34 113.55 119.15 1whv h SER 459 Ca 0.00 0.21 0.27 0.00 -1.23 0.00 0.00 61.79 61.04 1whv h SER 459 Cb 0.30 0.19 -0.13 0.00 -0.44 0.00 0.00 62.40 62.33 1whv h SER 459 CO 0.00 -0.19 0.29 0.00 -0.53 0.00 0.00 176.83 176.39 1whv n ALA 460 N -2.39 0.63 -0.07 6.23 0.00 -1.24 -0.01 120.51 123.66 1whv n ALA 460 Ca 0.31 0.72 -0.10 0.00 0.00 0.00 0.00 53.44 54.36 1whv n ALA 460 Cb 0.97 -0.67 -0.08 0.00 0.00 0.00 0.00 19.45 19.67 1whv n ALA 460 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1whv h PHE 461 N 0.00 0.00 0.00 0.00 0.04 -1.24 -3.51 116.94 112.22 1whv h PHE 461 Ca 0.55 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.32 1whv h PHE 461 Cb 1.40 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.55 1whv h PHE 461 CO -0.09 0.68 0.00 0.41 -0.60 0.00 0.00 178.31 178.71 1whv n GLY 462 N 1.63 0.88 3.65 -1.45 0.00 0.98 -5.08 105.19 105.80 1whv n GLY 462 Ca -0.11 -1.86 -0.59 0.00 0.00 0.00 0.00 46.02 43.46 1whv n GLY 462 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1whv n ASN 463 N 0.00 1.41 -4.18 1.61 5.15 -1.26 -4.66 115.26 113.33 1whv n ASN 463 Ca 0.00 1.13 -0.11 0.00 -0.60 0.00 0.00 54.58 55.00 1whv n ASN 463 Cb 0.00 -1.04 -0.10 0.00 -0.53 0.00 0.00 39.78 38.11 1whv n ASN 463 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1whv s ILE 464 N 2.00 0.09 -0.40 -1.44 -4.36 -1.26 -5.02 121.20 110.80 1whv s ILE 464 Ca 0.96 -1.95 -0.05 0.00 -0.26 0.00 0.00 60.65 59.35 1whv s ILE 464 Cb -1.20 -2.24 0.10 0.00 1.25 0.00 0.00 42.46 40.36 1whv s ILE 464 CO 0.64 -0.27 0.20 -1.58 0.24 0.00 0.00 174.94 174.17 1whv s GLN 465 N -4.09 2.25 -0.46 0.37 0.74 -1.26 -5.06 119.66 112.15 1whv s GLN 465 Ca 0.30 -1.65 -0.24 0.00 0.05 0.00 0.00 55.36 53.82 1whv s GLN 465 Cb 0.07 -3.61 0.03 0.00 1.10 0.00 0.00 33.01 30.60 1whv s GLN 465 CO 0.06 -1.00 0.82 0.42 -0.55 0.00 0.00 175.29 175.04 1whv s ILE 466 N 1.25 4.60 -0.34 -2.34 1.01 -1.26 -3.79 121.20 120.32 1whv s ILE 466 Ca 0.05 0.46 -0.14 0.00 0.00 0.00 0.00 60.65 61.02 1whv s ILE 466 Cb -0.23 -4.36 -0.02 0.00 0.01 0.00 0.00 42.46 37.87 1whv s ILE 466 CO -0.02 -0.77 0.30 -0.44 0.00 0.00 0.00 174.94 174.01 1whv s SER 467 N 2.21 6.12 -0.50 3.58 0.01 -0.79 -4.94 113.70 119.39 1whv s SER 467 Ca 0.31 -0.33 -0.27 0.00 1.31 0.00 0.00 55.95 56.97 1whv s SER 467 Cb -0.12 -2.17 0.03 0.00 0.21 0.00 0.00 66.02 63.98 1whv s SER 467 CO 0.23 -0.28 1.07 0.26 0.41 0.00 0.00 173.24 174.93 1whv s TRP 468 N 1.86 2.80 -0.03 2.43 0.52 -1.26 -0.55 118.94 124.70 1whv s TRP 468 Ca 0.09 0.47 -0.02 0.00 0.02 0.00 0.00 56.10 56.66 1whv s TRP 468 Cb -0.17 -4.29 -0.01 0.00 -1.15 0.00 0.00 33.47 27.86 1whv s TRP 468 CO 0.11 -1.30 -0.03 0.82 0.02 0.00 0.00 176.95 176.56 1whv h ILE 469 N 6.15 0.00 -4.40 2.03 2.04 -1.73 -3.49 117.51 118.11 1whv h ILE 469 Ca -0.24 -0.22 -0.33 0.00 1.00 0.00 0.00 64.86 65.07 1whv h ILE 469 Cb 1.07 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 1whv h ILE 469 CO 1.11 0.00 -0.25 -0.67 0.00 0.00 0.00 178.15 178.34 1whv n ASP 470 N -2.76 2.29 0.23 1.72 2.03 -0.44 -4.96 116.55 114.65 1whv n ASP 470 Ca -0.01 -2.15 0.07 0.00 0.52 0.00 0.00 54.79 53.21 1whv n ASP 470 Cb 0.05 0.28 0.54 0.00 -0.72 0.00 0.00 41.12 41.27 1whv n ASP 470 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1whv h ASP 471 N 0.69 0.00 0.00 1.67 3.58 -1.97 -3.04 116.42 117.36 1whv h ASP 471 Ca -0.21 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.23 1whv h ASP 471 Cb 0.66 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.68 1whv h ASP 471 CO 0.34 0.21 -0.29 0.35 -2.88 0.00 0.00 179.24 176.97 1whv n THR 472 N -4.06 1.09 -4.33 2.25 -2.24 -1.26 -3.32 114.28 102.41 1whv n THR 472 Ca -0.02 -1.42 -0.20 0.00 -2.27 0.00 0.00 64.05 60.14 1whv n THR 472 Cb 0.28 0.11 -0.16 0.00 -2.10 0.00 0.00 70.33 68.47 1whv n THR 472 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1whv s SER 473 N -2.15 1.11 0.24 3.42 0.15 -1.15 -3.29 113.70 112.03 1whv s SER 473 Ca 0.21 -0.17 -0.02 0.00 0.70 0.00 0.00 55.95 56.67 1whv s SER 473 Cb 0.19 -0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 64.14 1whv s SER 473 CO -0.00 0.04 0.23 0.00 1.20 0.00 0.00 173.24 174.71 1whv s ALA 474 N 0.29 1.04 0.01 5.45 0.00 -1.19 -1.33 121.76 126.04 1whv s ALA 474 Ca -0.04 -1.63 0.04 0.00 0.00 0.00 0.00 51.96 50.33 1whv s ALA 474 Cb -0.09 1.34 -0.01 0.00 0.00 0.00 0.00 23.12 24.36 1whv s ALA 474 CO 0.00 -0.66 -0.11 -0.06 0.00 0.00 0.00 175.76 174.93 1whv s PHE 475 N -3.95 1.01 -0.26 0.00 0.08 0.29 -3.56 117.98 111.59 1whv s PHE 475 Ca 0.36 -0.27 -0.02 0.00 0.12 0.00 0.00 56.93 57.13 1whv s PHE 475 Cb 0.05 -0.63 0.08 0.00 -0.57 0.00 0.00 43.02 41.95 1whv s PHE 475 CO 0.15 -0.00 0.07 0.08 -0.10 0.00 0.00 175.22 175.42 1whv s VAL 476 N -0.56 0.67 -0.17 -0.44 1.01 -0.12 -1.88 120.40 118.91 1whv s VAL 476 Ca 0.02 -1.01 -0.16 0.00 0.00 0.00 0.00 61.98 60.83 1whv s VAL 476 Cb -0.06 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1whv s VAL 476 CO 0.00 -0.49 0.39 -0.44 0.00 0.00 0.00 175.10 174.56 1whv s SER 477 N 1.75 6.50 0.44 3.32 0.01 -1.25 -0.07 113.70 124.41 1whv s SER 477 Ca 0.05 0.59 0.08 0.00 1.31 0.00 0.00 55.95 57.98 1whv s SER 477 Cb -0.17 -2.23 -0.01 0.00 0.21 0.00 0.00 66.02 63.82 1whv s SER 477 CO -0.20 -0.00 0.42 -0.76 0.41 0.00 0.00 173.24 173.11 1whv s LEU 478 N 0.87 3.33 -0.10 2.44 1.43 -1.25 -4.26 118.68 121.14 1whv s LEU 478 Ca 0.20 -0.77 -0.27 0.00 -1.03 0.00 0.00 54.13 52.26 1whv s LEU 478 Cb -0.14 -2.00 -0.27 0.00 0.03 0.00 0.00 46.19 43.81 1whv s LEU 478 CO 0.07 -0.75 0.85 0.28 0.23 0.00 0.00 176.35 177.03 1whv h SER 479 N 0.92 0.13 -4.01 2.29 0.02 -1.95 -3.47 113.55 107.48 1whv h SER 479 Ca -0.40 -0.94 -0.68 0.00 -0.84 0.00 0.00 61.79 58.92 1whv h SER 479 Cb 1.27 -0.04 -0.23 0.00 0.14 0.00 0.00 62.40 63.54 1whv h SER 479 CO 0.55 1.06 -0.87 -1.10 -1.14 0.00 0.00 176.83 175.34 1whv s GLN 480 N -2.45 1.47 0.49 3.45 -0.21 -1.26 -5.02 119.66 116.12 1whv s GLN 480 Ca -0.17 -1.29 0.32 0.00 0.02 0.00 0.00 55.36 54.24 1whv s GLN 480 Cb -0.02 -1.88 1.32 0.00 1.00 0.00 0.00 33.01 33.43 1whv s GLN 480 CO 0.73 0.46 1.94 -1.00 -2.12 0.00 0.00 175.29 175.29 1whv h PRO 481 N 4.09 0.00 0.58 2.91 0.13 -1.91 -3.24 132.00 134.56 1whv h PRO 481 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1whv h PRO 481 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1whv h PRO 481 CO 0.40 0.00 -0.39 0.93 -0.23 0.00 0.00 178.00 178.71 1whv h GLU 482 N 0.00 -0.90 -0.97 0.86 4.39 -1.99 -2.52 114.58 113.46 1whv h GLU 482 Ca 0.00 0.06 0.37 0.00 0.34 0.00 0.00 59.36 60.13 1whv h GLU 482 Cb 0.46 0.20 -0.18 0.00 -0.10 0.00 0.00 28.75 29.14 1whv h GLU 482 CO 0.00 -0.60 0.39 1.04 -1.16 0.00 0.00 179.01 178.68 1whv n GLN 483 N -5.52 -0.06 -0.28 2.33 1.13 -1.22 -1.06 117.38 112.69 1whv n GLN 483 Ca -0.12 1.37 -0.07 0.00 -1.94 0.00 0.00 57.00 56.24 1whv n GLN 483 Cb 0.41 -2.39 -0.07 0.00 0.11 0.00 0.00 30.24 28.31 1whv n GLN 483 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1whv n VAL 484 N -5.27 -0.45 -0.31 5.09 0.31 -0.95 0.27 118.33 117.03 1whv n VAL 484 Ca 0.33 1.88 0.05 0.00 -0.01 0.00 0.00 64.34 66.59 1whv n VAL 484 Cb 1.12 -2.35 0.11 0.00 -0.91 0.00 0.00 33.84 31.81 1whv n VAL 484 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1whv n GLN 485 N -4.57 -0.09 0.16 5.55 3.00 -0.23 -0.45 117.38 120.76 1whv n GLN 485 Ca 0.01 1.35 -0.06 0.00 -0.01 0.00 0.00 57.00 58.29 1whv n GLN 485 Cb 0.17 -2.02 -0.03 0.00 0.00 0.00 0.00 30.24 28.37 1whv n GLN 485 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 1whv h ILE 486 N 0.00 0.00 -0.95 5.09 5.03 -0.32 0.95 117.51 127.30 1whv h ILE 486 Ca 0.41 -0.07 0.34 0.00 -0.12 0.00 0.00 64.86 65.42 1whv h ILE 486 Cb 0.62 0.00 -0.17 0.00 -3.03 0.00 0.00 36.82 34.24 1whv h ILE 486 CO -0.89 0.00 0.31 0.00 -0.68 0.00 0.00 178.15 176.89 1whv n ALA 487 N -2.26 0.78 -0.04 1.87 0.00 -0.50 0.65 120.51 121.01 1whv n ALA 487 Ca -0.05 0.99 -0.14 0.00 0.00 0.00 0.00 53.44 54.24 1whv n ALA 487 Cb 0.16 -0.88 -0.09 0.00 0.00 0.00 0.00 19.45 18.64 1whv n ALA 487 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1whv h VAL 488 N 0.00 1.41 -0.65 0.00 2.07 -0.70 -2.23 116.25 116.15 1whv h VAL 488 Ca 0.72 -1.54 0.13 0.00 0.82 0.00 0.00 66.70 66.83 1whv h VAL 488 Cb 1.76 2.19 -0.10 0.00 -1.52 0.00 0.00 31.29 33.61 1whv h VAL 488 CO -0.80 0.44 0.09 -1.13 0.02 0.00 0.00 177.57 176.19 1whv h ASN 489 N -0.16 -0.11 0.89 0.57 -0.73 0.28 0.47 115.58 116.79 1whv h ASN 489 Ca -0.00 0.14 -0.09 0.00 1.87 0.00 0.00 56.30 58.22 1whv h ASN 489 Cb 0.82 0.21 -0.01 0.00 0.27 0.00 0.00 38.32 39.61 1whv h ASN 489 CO 0.05 -0.06 -0.41 0.71 -0.37 0.00 0.00 177.43 177.35 1whv h THR 490 N 0.20 0.93 -0.01 -3.57 1.35 -1.24 -3.10 112.91 107.47 1whv h THR 490 Ca 0.35 -1.65 -0.21 0.00 -0.55 0.00 0.00 66.41 64.35 1whv h THR 490 Cb 0.56 2.00 -0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1whv h THR 490 CO -0.49 0.40 -0.90 0.77 -0.25 0.00 0.00 175.52 175.06 1whv h SER 491 N 0.00 0.45 -0.37 5.36 4.64 -0.01 -2.98 113.55 120.63 1whv h SER 491 Ca -0.00 -0.35 0.04 0.00 -0.47 0.00 0.00 61.79 61.00 1whv h SER 491 Cb 0.97 -0.14 -0.06 0.00 -0.31 0.00 0.00 62.40 62.86 1whv h SER 491 CO 0.05 1.15 -0.38 0.11 -0.87 0.00 0.00 176.83 176.89 1whv h LYS 492 N 0.20 -0.19 -0.48 4.77 1.57 -0.15 -1.80 116.57 120.48 1whv h LYS 492 Ca -0.06 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 1whv h LYS 492 Cb 1.53 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.86 1whv h LYS 492 CO 0.15 -0.13 0.06 0.10 -0.57 0.00 0.00 179.45 179.07 1whv h TYR 493 N -0.20 0.86 -1.01 -1.35 -0.00 -1.71 -3.43 116.97 110.13 1whv h TYR 493 Ca 0.06 -0.13 -0.80 0.00 0.00 0.00 0.00 58.73 57.87 1whv h TYR 493 Cb 0.36 -0.23 0.00 0.00 0.00 0.00 0.00 36.73 36.86 1whv h TYR 493 CO -0.77 0.80 0.93 0.00 -0.00 0.00 0.00 178.16 179.12 1whv n ALA 494 N -2.40 -0.51 -0.10 0.10 0.00 -0.68 -4.84 120.51 112.07 1whv n ALA 494 Ca 0.01 0.37 -0.22 0.00 0.00 0.00 0.00 53.44 53.59 1whv n ALA 494 Cb 0.26 -2.10 -0.12 0.00 0.00 0.00 0.00 19.45 17.50 1whv n ALA 494 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1whv n GLU 495 N 5.39 0.65 -0.19 0.00 1.02 -1.26 -4.47 120.64 121.78 1whv n GLU 495 Ca 0.34 0.25 -0.02 0.00 -0.02 0.00 0.00 57.16 57.72 1whv n GLU 495 Cb 0.03 -1.57 0.05 0.00 -0.02 0.00 0.00 31.44 29.92 1whv n GLU 495 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1whv h SER 496 N -0.37 -0.55 -1.90 1.62 0.87 -1.97 -3.42 113.55 107.84 1whv h SER 496 Ca -0.56 0.17 -0.60 0.00 -1.23 0.00 0.00 61.79 59.57 1whv h SER 496 Cb 1.78 0.36 -0.12 0.00 -0.44 0.00 0.00 62.40 63.99 1whv h SER 496 CO -0.16 -0.19 -0.64 -0.72 -0.53 0.00 0.00 176.83 174.59 1whv s TYR 497 N -6.23 2.50 -0.04 2.24 -0.85 -1.26 -4.94 117.35 108.77 1whv s TYR 497 Ca -0.14 -0.48 0.01 0.00 -0.52 0.00 0.00 57.07 55.94 1whv s TYR 497 Cb 0.18 -1.48 0.02 0.00 0.38 0.00 0.00 41.96 41.06 1whv s TYR 497 CO 0.73 0.51 -0.05 0.50 -1.52 0.00 0.00 175.55 175.72 1whv s ARG 498 N -3.68 0.78 0.01 -3.49 3.52 -1.25 -4.77 118.95 110.07 1whv s ARG 498 Ca 0.34 -0.13 0.07 0.00 -0.13 0.00 0.00 55.73 55.89 1whv s ARG 498 Cb 0.01 -0.78 -0.02 0.00 -1.56 0.00 0.00 34.95 32.60 1whv s ARG 498 CO 0.18 -0.04 -0.22 0.42 -0.81 0.00 0.00 175.30 174.83 1whv s ILE 499 N 0.73 1.79 0.33 4.11 1.01 -1.26 -1.71 121.20 126.21 1whv s ILE 499 Ca -0.10 -1.10 -0.04 0.00 0.00 0.00 0.00 60.65 59.41 1whv s ILE 499 Cb -0.13 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.83 1whv s ILE 499 CO 0.00 0.39 0.48 0.00 0.00 0.00 0.00 174.94 175.81 1whv s GLN 500 N -0.84 1.88 0.47 2.79 -2.07 -0.62 -4.90 119.66 116.36 1whv s GLN 500 Ca 0.09 -1.70 -0.09 0.00 -1.82 0.00 0.00 55.36 51.84 1whv s GLN 500 Cb -0.09 0.45 -0.05 0.00 -1.09 0.00 0.00 33.01 32.23 1whv s GLN 500 CO 0.00 -0.78 0.83 0.95 -1.32 0.00 0.00 175.29 174.98 1whv s THR 501 N -3.13 4.79 0.21 3.63 -4.23 -1.26 -0.53 115.64 115.12 1whv s THR 501 Ca 0.29 0.58 -0.09 0.00 -1.18 0.00 0.00 61.69 61.29 1whv s THR 501 Cb -0.00 -3.79 0.17 0.00 1.34 0.00 0.00 72.50 70.21 1whv s THR 501 CO 0.19 -0.73 1.72 0.22 -0.54 0.00 0.00 174.62 175.48 1whv h TYR 502 N 0.67 0.32 -0.73 3.99 3.20 -1.47 -0.95 116.97 122.00 1whv h TYR 502 Ca -0.47 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.48 1whv h TYR 502 Cb 1.19 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 39.37 1whv h TYR 502 CO 0.61 0.03 0.44 0.00 -1.64 0.00 0.00 178.16 177.60 1whv h ALA 503 N 1.47 0.98 -0.68 1.82 0.00 -1.82 -0.97 119.26 120.06 1whv h ALA 503 Ca 0.33 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.31 1whv h ALA 503 Cb 0.47 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1whv h ALA 503 CO -0.37 0.18 0.35 0.93 0.00 0.00 0.00 179.25 180.33 1whv h GLU 504 N 0.84 0.59 0.31 0.00 4.39 -1.56 0.50 114.58 119.65 1whv h GLU 504 Ca 0.31 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.96 1whv h GLU 504 Cb 0.11 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1whv h GLU 504 CO -0.15 0.39 -0.15 -0.92 -1.16 0.00 0.00 179.01 177.03 1whv h TYR 505 N 0.61 -0.39 -0.92 4.33 3.20 -1.00 -3.23 116.97 119.57 1whv h TYR 505 Ca 0.32 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.42 1whv h TYR 505 Cb 0.29 0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.63 1whv h TYR 505 CO -0.10 -0.24 0.62 -0.39 -1.64 0.00 0.00 178.16 176.41 1whv h VAL 506 N -0.66 0.61 -0.51 1.81 -1.51 -1.16 -2.32 116.25 112.51 1whv h VAL 506 Ca -0.04 -0.09 0.05 0.00 -1.23 0.00 0.00 66.70 65.39 1whv h VAL 506 Cb 0.32 0.32 -0.07 0.00 -2.13 0.00 0.00 31.29 29.73 1whv h VAL 506 CO 0.07 0.05 -0.40 1.23 -1.23 0.00 0.00 177.57 177.29 1whv h GLY 507 N 0.27 -1.38 0.37 5.19 0.00 0.01 0.42 103.07 107.94 1whv h GLY 507 Ca 0.47 0.85 -0.02 0.00 0.00 0.00 0.00 47.33 48.63 1whv h GLY 507 CO -0.13 -0.30 -0.07 0.07 0.00 0.00 0.00 176.54 176.11 1whv h LYS 508 N -0.12 0.06 -0.05 4.80 2.10 -1.58 -3.36 116.57 118.43 1whv h LYS 508 Ca 0.08 -0.05 0.01 0.00 -2.00 0.00 0.00 60.65 58.69 1whv h LYS 508 Cb 0.34 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 1whv h LYS 508 CO -0.54 0.74 -0.08 -0.22 -2.00 0.00 0.00 179.45 177.35 1whv h LYS 509 N -0.60 -0.06 -6.25 0.07 3.11 -1.16 -3.38 116.57 108.30 1whv h LYS 509 Ca -0.01 0.00 -0.55 0.00 -2.81 0.00 0.00 60.65 57.28 1whv h LYS 509 Cb 0.76 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 32.00 1whv h LYS 509 CO 0.01 -0.04 1.22 -0.65 -2.81 0.00 0.00 179.45 177.18 1whv s GLN 510 N -3.38 3.87 -0.17 1.90 -1.52 0.14 -4.96 119.66 115.53 1whv s GLN 510 Ca -0.02 2.14 -0.07 0.00 -1.95 0.00 0.00 55.36 55.47 1whv s GLN 510 Cb 0.01 -4.13 0.08 0.00 -0.22 0.00 0.00 33.01 28.75 1whv s GLN 510 CO 0.09 -1.24 0.37 -1.59 -0.25 0.00 0.00 175.29 172.67 1whv s LYS 511 N 4.77 0.28 0.00 2.91 -2.85 -1.26 -4.78 119.74 118.81 1whv s LYS 511 Ca 0.82 0.90 0.00 0.00 -1.00 0.00 0.00 55.97 56.70 1whv s LYS 511 Cb -0.34 0.17 0.00 0.00 -2.06 0.00 0.00 37.83 35.60 1whv s LYS 511 CO 0.34 -0.24 0.00 0.41 0.10 0.00 0.00 175.35 175.96 1whv n GLY 512 N 5.15 5.24 2.89 0.59 0.00 -1.26 -5.05 105.19 112.76 1whv n GLY 512 Ca -0.11 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.85 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 4.62 1.97 -0.29 1.61 2.47 -1.26 -4.73 119.74 124.13 1whv s LYS 513 Ca 0.00 -2.70 -0.18 0.00 -1.56 0.00 0.00 55.97 51.54 1whv s LYS 513 Cb 0.00 -3.16 0.17 0.00 -1.46 0.00 0.00 37.83 33.38 1whv s LYS 513 CO 0.00 -1.16 1.15 -1.14 0.16 0.00 0.00 175.35 174.35 1whv s GLN 514 N -0.47 0.22 -0.09 4.03 2.00 -1.26 -5.16 119.66 118.93 1whv s GLN 514 Ca 0.19 0.35 0.03 0.00 -2.00 0.00 0.00 55.36 53.93 1whv s GLN 514 Cb -0.20 0.06 -0.01 0.00 0.80 0.00 0.00 33.01 33.65 1whv s GLN 514 CO -0.04 -0.04 -0.17 0.14 -0.50 0.00 0.00 175.29 174.67 1whv s VAL 515 N 0.97 2.71 0.37 1.34 -7.23 -1.26 -3.86 120.40 113.44 1whv s VAL 515 Ca -0.06 -0.81 -0.27 0.00 -1.81 0.00 0.00 61.98 59.03 1whv s VAL 515 Cb -0.03 -2.08 -0.12 0.00 0.56 0.00 0.00 36.38 34.71 1whv s VAL 515 CO -0.12 0.55 1.20 2.29 -0.31 0.00 0.00 175.10 178.71 1whv n LYS 516 N 3.13 1.84 -2.33 4.82 2.85 -1.06 -4.90 118.16 122.50 1whv n LYS 516 Ca -0.18 0.65 -0.42 0.00 -1.05 0.00 0.00 58.31 57.31 1whv n LYS 516 Cb 0.52 -2.23 -0.03 0.00 -0.65 0.00 0.00 35.03 32.65 1whv n LYS 516 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1whv s SER 517 N -0.48 6.97 -0.35 -5.58 1.04 -1.26 -4.18 113.70 109.86 1whv s SER 517 Ca 0.59 2.05 -0.19 0.00 0.48 0.00 0.00 55.95 58.87 1whv s SER 517 Cb -0.57 -2.57 0.03 0.00 0.10 0.00 0.00 66.02 63.01 1whv s SER 517 CO 0.60 -0.59 0.44 0.61 0.98 0.00 0.00 173.24 175.27 1whv n GLY 518 N 3.41 -1.06 3.58 7.32 0.00 -1.26 -4.98 105.19 112.20 1whv n GLY 518 Ca 0.11 0.91 -0.30 0.00 0.00 0.00 0.00 46.02 46.74 1whv n GLY 518 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1whv s PRO 519 N -2.15 -1.41 -0.30 1.61 0.04 -1.26 -5.09 135.00 126.44 1whv s PRO 519 Ca 0.22 -0.13 -0.08 0.00 0.04 0.00 0.00 61.00 61.04 1whv s PRO 519 Cb -0.04 -1.58 0.16 0.00 0.04 0.00 0.00 34.50 33.08 1whv s PRO 519 CO 0.69 -3.82 0.73 -1.54 0.04 0.00 0.00 177.00 173.10 1whv s SER 520 N -3.95 -1.05 -0.17 6.66 1.04 -1.26 -5.15 113.70 109.81 1whv s SER 520 Ca 0.72 1.10 -0.11 0.00 0.48 0.00 0.00 55.95 58.13 1whv s SER 520 Cb -0.09 2.06 -0.05 0.00 0.10 0.00 0.00 66.02 68.05 1whv s SER 520 CO 0.56 -0.20 0.20 -0.55 0.98 0.00 0.00 173.24 174.23 1whv s SER 521 N 2.81 6.33 0.00 7.02 0.15 -1.26 -5.16 113.70 123.58 1whv s SER 521 Ca 0.03 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.06 1whv s SER 521 Cb -0.12 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 1whv s SER 521 CO -0.19 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.03