#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 2.17 -0.35 1.61 0.01 -1.26 -5.12 113.70 110.76 1whv s SER 424 Ca 0.00 -0.90 -0.16 0.00 1.31 0.00 0.00 55.95 56.20 1whv s SER 424 Cb 0.00 -0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.14 1whv s SER 424 CO 0.00 -0.17 0.41 -0.94 0.41 0.00 0.00 173.24 172.94 1whv s SER 425 N -2.81 6.22 -0.30 2.44 1.04 -1.26 -5.02 113.70 114.01 1whv s SER 425 Ca 0.14 -0.19 -0.13 0.00 0.48 0.00 0.00 55.95 56.25 1whv s SER 425 Cb -0.03 -2.22 0.14 0.00 0.10 0.00 0.00 66.02 64.02 1whv s SER 425 CO 0.04 -0.39 0.85 -0.83 0.98 0.00 0.00 173.24 173.89 1whv s GLY 426 N 1.74 -0.39 -0.25 7.32 0.00 -1.26 -5.11 107.32 109.37 1whv s GLY 426 Ca 0.14 2.77 0.03 0.00 0.00 0.00 0.00 44.72 47.66 1whv s GLY 426 CO 0.12 3.05 -0.10 -0.45 0.00 0.00 0.00 173.10 175.72 1whv s SER 427 N 2.42 4.32 -0.13 1.64 0.15 -1.26 -5.08 113.70 115.77 1whv s SER 427 Ca -0.05 -1.35 -0.04 0.00 0.70 0.00 0.00 55.95 55.22 1whv s SER 427 Cb -0.08 -1.49 0.06 0.00 -1.71 0.00 0.00 66.02 62.80 1whv s SER 427 CO -0.18 -0.19 0.16 -0.55 1.20 0.00 0.00 173.24 173.68 1whv s SER 428 N 1.15 1.18 -0.25 5.45 0.15 -1.26 -5.12 113.70 115.00 1whv s SER 428 Ca -0.08 0.03 -0.02 0.00 0.70 0.00 0.00 55.95 56.58 1whv s SER 428 Cb -0.20 0.21 0.13 0.00 -1.71 0.00 0.00 66.02 64.46 1whv s SER 428 CO -0.05 -0.28 0.36 -0.83 1.20 0.00 0.00 173.24 173.63 1whv s GLY 429 N 2.27 -0.38 0.00 9.45 0.00 -1.26 -5.10 107.32 112.31 1whv s GLY 429 Ca 0.04 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.38 1whv s GLY 429 CO -0.08 2.68 0.00 0.61 0.00 0.00 0.00 173.10 176.31 1whv n GLY 430 N 5.35 1.75 3.65 0.20 0.00 -1.26 -4.86 105.19 110.03 1whv n GLY 430 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 0.01 4.11 -0.47 1.61 0.04 -1.26 -4.96 135.00 134.08 1whv s PRO 431 Ca 0.00 1.93 -0.29 0.00 0.04 0.00 0.00 61.00 62.68 1whv s PRO 431 Cb 0.00 -3.94 0.02 0.00 0.04 0.00 0.00 34.50 30.63 1whv s PRO 431 CO 0.00 -0.90 1.22 0.16 0.04 0.00 0.00 177.00 177.52 1whv s ASP 432 N 3.16 6.53 0.17 6.66 1.47 -1.26 -4.98 116.67 128.41 1whv s ASP 432 Ca 0.68 0.52 -0.06 0.00 1.18 0.00 0.00 52.55 54.86 1whv s ASP 432 Cb -0.28 -2.55 -0.02 0.00 -0.34 0.00 0.00 42.92 39.73 1whv s ASP 432 CO 0.25 -1.33 0.23 -0.76 0.68 0.00 0.00 175.17 174.24 1whv s LEU 433 N 4.80 1.12 0.40 2.11 1.43 -1.26 -5.15 118.68 122.13 1whv s LEU 433 Ca 0.51 -1.02 -0.25 0.00 -1.03 0.00 0.00 54.13 52.34 1whv s LEU 433 Cb -0.09 0.93 -0.08 0.00 0.03 0.00 0.00 46.19 46.98 1whv s LEU 433 CO 0.32 -0.87 1.17 -1.10 0.23 0.00 0.00 176.35 176.10 1whv s GLN 434 N -4.01 4.06 0.63 1.70 -1.52 -1.26 -5.01 119.66 114.24 1whv s GLN 434 Ca 0.22 1.85 -0.16 0.00 -1.95 0.00 0.00 55.36 55.31 1whv s GLN 434 Cb 0.04 -2.68 -0.02 0.00 -0.22 0.00 0.00 33.01 30.14 1whv s GLN 434 CO 0.03 -0.32 1.12 -1.25 -0.25 0.00 0.00 175.29 174.61 1whv s PRO 435 N -2.30 2.95 0.14 2.91 0.04 -1.26 -5.03 135.00 132.45 1whv s PRO 435 Ca 0.57 1.45 -0.12 0.00 0.04 0.00 0.00 61.00 62.94 1whv s PRO 435 Cb -0.31 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 1whv s PRO 435 CO 0.39 -1.15 0.51 -1.59 0.04 0.00 0.00 177.00 175.20 1whv s LYS 436 N -3.88 3.89 -1.11 4.56 -2.85 -1.26 -4.24 119.74 114.86 1whv s LYS 436 Ca 0.69 0.37 -0.04 0.00 -1.00 0.00 0.00 55.97 55.99 1whv s LYS 436 Cb -0.21 -2.90 0.00 0.00 -2.06 0.00 0.00 37.83 32.66 1whv s LYS 436 CO 0.38 0.47 0.95 0.54 0.10 0.00 0.00 175.35 177.79 1whv n ARG 437 N 0.67 -6.35 0.35 1.78 1.74 -1.26 -4.25 116.66 109.34 1whv n ARG 437 Ca -0.05 0.72 -0.18 0.00 -0.77 0.00 0.00 57.85 57.57 1whv n ARG 437 Cb 0.52 -5.40 -0.09 0.00 -1.02 0.00 0.00 32.46 26.47 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 -2.02 -1.15 -1.24 0.55 3.58 -2.00 -2.21 116.42 111.93 1whv h ASP 438 Ca -0.50 0.07 0.40 0.00 0.42 0.00 0.00 57.03 57.43 1whv h ASP 438 Cb 1.31 0.35 -0.13 0.00 1.72 0.00 0.00 39.33 42.58 1whv h ASP 438 CO 0.46 -0.66 0.79 1.12 -2.88 0.00 0.00 179.24 178.07 1whv h HIS 439 N -1.03 0.59 -3.19 0.28 2.07 -1.89 -3.39 115.15 108.58 1whv h HIS 439 Ca -0.08 0.02 -0.53 0.00 -2.85 0.00 0.00 60.37 56.94 1whv h HIS 439 Cb 0.85 -0.15 0.03 0.00 2.57 0.00 0.00 27.41 30.72 1whv h HIS 439 CO -0.14 -0.17 0.72 0.08 -3.07 0.00 0.00 177.93 175.34 1whv s VAL 440 N -5.37 3.08 -0.07 6.12 1.01 -0.83 -2.94 120.40 121.41 1whv s VAL 440 Ca -0.08 0.84 0.03 0.00 0.00 0.00 0.00 61.98 62.77 1whv s VAL 440 Cb 0.29 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 33.14 1whv s VAL 440 CO 0.81 0.10 -0.17 -0.76 0.00 0.00 0.00 175.10 175.08 1whv s LEU 441 N 0.40 1.84 -0.48 3.92 1.43 0.18 -2.65 118.68 123.32 1whv s LEU 441 Ca 0.61 -0.39 -0.21 0.00 -1.03 0.00 0.00 54.13 53.12 1whv s LEU 441 Cb -0.38 -1.03 0.04 0.00 0.03 0.00 0.00 46.19 44.85 1whv s LEU 441 CO 0.36 0.10 0.70 -2.28 0.23 0.00 0.00 176.35 175.45 1whv s HIS 442 N 0.41 3.01 -0.29 0.29 5.65 0.05 -0.70 115.29 123.71 1whv s HIS 442 Ca -0.13 -0.17 -0.07 0.00 0.25 0.00 0.00 55.06 54.94 1whv s HIS 442 Cb -0.15 -3.55 0.01 0.00 -1.18 0.00 0.00 32.58 27.70 1whv s HIS 442 CO 0.05 -1.01 0.07 0.08 -0.65 0.00 0.00 174.74 173.28 1whv s VAL 443 N 2.99 3.96 -0.49 0.89 1.01 -1.22 -1.46 120.40 126.07 1whv s VAL 443 Ca 0.22 -0.65 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 1whv s VAL 443 Cb -0.15 -3.02 0.05 0.00 0.00 0.00 0.00 36.38 33.26 1whv s VAL 443 CO 0.17 0.11 0.60 0.42 0.00 0.00 0.00 175.10 176.40 1whv s THR 444 N 1.50 4.90 0.16 3.92 -4.23 -0.71 -3.70 115.64 117.49 1whv s THR 444 Ca 0.03 -0.46 0.08 0.00 -1.18 0.00 0.00 61.69 60.16 1whv s THR 444 Cb -0.17 -4.26 -0.04 0.00 1.34 0.00 0.00 72.50 69.37 1whv s THR 444 CO 0.02 -0.75 -0.17 0.72 -0.54 0.00 0.00 174.62 173.90 1whv s PHE 445 N 2.56 1.76 0.50 3.99 -0.12 -1.26 -3.81 117.98 121.59 1whv s PHE 445 Ca 0.15 -0.49 -0.21 0.00 -0.05 0.00 0.00 56.93 56.33 1whv s PHE 445 Cb -0.19 -0.88 -0.07 0.00 -0.63 0.00 0.00 43.02 41.26 1whv s PHE 445 CO 0.12 0.30 1.14 -1.25 -0.05 0.00 0.00 175.22 175.49 1whv s PRO 446 N -2.81 3.55 0.37 1.99 0.04 -1.26 -4.55 135.00 132.32 1whv s PRO 446 Ca 0.15 1.68 0.14 0.00 0.04 0.00 0.00 61.00 63.01 1whv s PRO 446 Cb -0.05 -2.19 0.97 0.00 0.04 0.00 0.00 34.50 33.27 1whv s PRO 446 CO 0.06 -0.70 1.78 1.57 0.04 0.00 0.00 177.00 179.75 1whv h LYS 447 N 1.60 0.51 -0.27 4.56 5.09 -1.93 0.15 116.57 126.27 1whv h LYS 447 Ca -0.50 -0.03 0.08 0.00 0.09 0.00 0.00 60.65 60.29 1whv h LYS 447 Cb 1.25 -0.11 -0.01 0.00 0.10 0.00 0.00 32.23 33.46 1whv h LYS 447 CO 0.58 0.34 0.81 1.05 -2.09 0.00 0.00 179.45 180.14 1whv h GLU 448 N 0.52 0.00 0.00 0.07 4.11 -1.91 -3.40 114.58 113.98 1whv h GLU 448 Ca 0.57 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.73 1whv h GLU 448 Cb 1.24 0.00 0.13 0.00 0.50 0.00 0.00 28.75 30.63 1whv h GLU 448 CO -0.32 0.00 0.10 0.91 0.07 0.00 0.00 179.01 179.77 1whv n TRP 449 N -2.91 -3.65 -3.67 2.06 7.02 0.52 -5.10 117.44 111.71 1whv n TRP 449 Ca 0.05 -0.70 -0.07 0.00 -1.02 0.00 0.00 57.50 55.77 1whv n TRP 449 Cb 0.91 -0.78 -0.02 0.00 -2.42 0.00 0.00 31.31 29.00 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 -4.74 1.29 0.15 -0.99 1.02 -1.26 -5.02 119.74 110.18 1whv s LYS 450 Ca 0.49 -0.64 -0.29 0.00 0.02 0.00 0.00 55.97 55.55 1whv s LYS 450 Cb -0.04 0.49 -0.03 0.00 -0.52 0.00 0.00 37.83 37.72 1whv s LYS 450 CO 0.37 -0.58 1.57 1.15 -0.92 0.00 0.00 175.35 176.94 1whv h THR 451 N 2.00 0.08 -1.26 2.17 2.02 -1.98 0.37 112.91 116.31 1whv h THR 451 Ca -0.24 0.00 0.36 0.00 0.77 0.00 0.00 66.41 67.30 1whv h THR 451 Cb 1.25 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 1whv h THR 451 CO 0.28 0.00 0.89 0.28 0.37 0.00 0.00 175.52 177.34 1whv h SER 452 N -0.36 0.08 -0.11 4.18 0.02 -1.99 0.33 113.55 115.70 1whv h SER 452 Ca 0.12 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 1whv h SER 452 Cb 0.59 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1whv h SER 452 CO -0.58 0.00 -0.24 -0.78 -1.14 0.00 0.00 176.83 174.09 1whv h ASP 453 N 0.06 0.41 0.82 3.07 1.82 -0.69 -1.88 116.42 120.03 1whv h ASP 453 Ca 0.62 -0.57 -0.04 0.00 -0.39 0.00 0.00 57.03 56.65 1whv h ASP 453 Cb 2.34 -0.12 0.01 0.00 0.68 0.00 0.00 39.33 42.24 1whv h ASP 453 CO -0.07 0.90 -0.39 -0.07 -1.61 0.00 0.00 179.24 178.00 1whv h LEU 454 N -0.07 -0.93 -0.60 2.28 -0.00 0.33 -0.77 115.31 115.55 1whv h LEU 454 Ca 0.00 0.03 0.11 0.00 -0.00 0.00 0.00 57.88 58.02 1whv h LEU 454 Cb 0.84 0.24 -0.08 0.00 -0.00 0.00 0.00 40.66 41.66 1whv h LEU 454 CO 0.05 -0.63 0.16 1.88 -0.00 0.00 0.00 178.44 179.90 1whv h TYR 455 N -1.17 0.26 0.13 1.13 0.05 -1.41 -0.65 116.97 115.32 1whv h TYR 455 Ca -0.11 0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.72 1whv h TYR 455 Cb 0.84 -0.03 -0.03 0.00 1.01 0.00 0.00 36.73 38.53 1whv h TYR 455 CO 0.03 0.01 -0.25 1.96 -1.05 0.00 0.00 178.16 178.86 1whv h GLN 456 N 0.30 -0.44 -0.15 4.88 1.08 -1.29 1.89 115.11 121.37 1whv h GLN 456 Ca 0.31 0.03 0.04 0.00 -1.45 0.00 0.00 58.65 57.58 1whv h GLN 456 Cb 0.44 0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.92 1whv h GLN 456 CO -0.37 -0.30 -0.13 1.25 -0.95 0.00 0.00 178.83 178.34 1whv h LEU 457 N -0.46 -0.40 0.00 1.46 5.85 -0.52 -0.19 115.31 121.04 1whv h LEU 457 Ca 0.03 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1whv h LEU 457 Cb 0.48 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1whv h LEU 457 CO -0.13 -0.17 0.00 0.49 -0.34 0.00 0.00 178.44 178.29 1whv n PHE 458 N -5.28 0.00 -0.44 1.25 3.72 -0.31 -3.75 117.46 112.66 1whv n PHE 458 Ca -0.03 0.00 0.36 0.00 -0.05 0.00 0.00 57.45 57.73 1whv n PHE 458 Cb 0.20 -0.46 0.66 0.00 -0.94 0.00 0.00 39.48 38.94 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 0.22 -1.00 4.37 0.87 0.49 0.10 113.55 118.60 1whv h SER 459 Ca 0.00 0.09 0.36 0.00 -1.23 0.00 0.00 61.79 61.01 1whv h SER 459 Cb 0.40 0.07 -0.18 0.00 -0.44 0.00 0.00 62.40 62.25 1whv h SER 459 CO 0.00 -0.09 0.32 0.00 -0.53 0.00 0.00 176.83 176.53 1whv n ALA 460 N -2.59 0.81 -0.07 6.23 0.00 -1.25 -1.37 120.51 122.28 1whv n ALA 460 Ca 0.34 1.04 -0.09 0.00 0.00 0.00 0.00 53.44 54.73 1whv n ALA 460 Cb 1.38 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 19.84 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 -1.12 -3.51 116.94 112.35 1whv h PHE 461 Ca 0.75 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.52 1whv h PHE 461 Cb 1.83 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.98 1whv h PHE 461 CO -0.22 0.61 0.00 0.41 -0.60 0.00 0.00 178.31 178.51 1whv n GLY 462 N 1.64 0.77 3.65 -1.45 0.00 -0.47 -5.08 105.19 104.25 1whv n GLY 462 Ca -0.10 -1.75 -0.52 0.00 0.00 0.00 0.00 46.02 43.65 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 2.30 -3.71 1.61 2.85 -1.26 -4.68 115.26 112.37 1whv n ASN 463 Ca 0.00 1.08 -0.16 0.00 -0.11 0.00 0.00 54.58 55.39 1whv n ASN 463 Cb 0.00 -1.23 -0.09 0.00 1.24 0.00 0.00 39.78 39.70 1whv n ASN 463 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 1whv s ILE 464 N 1.93 0.00 -0.36 -1.44 -4.36 -1.26 -4.95 121.20 110.75 1whv s ILE 464 Ca 0.89 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 59.27 1whv s ILE 464 Cb -0.92 -2.50 0.09 0.00 1.25 0.00 0.00 42.46 40.38 1whv s ILE 464 CO 0.52 0.00 0.11 -1.58 0.24 0.00 0.00 174.94 174.23 1whv s GLN 465 N -3.74 1.99 -0.28 0.37 -0.44 -1.25 -5.07 119.66 111.24 1whv s GLN 465 Ca 0.40 -1.69 -0.22 0.00 -2.50 0.00 0.00 55.36 51.35 1whv s GLN 465 Cb 0.04 -3.39 -0.01 0.00 -1.64 0.00 0.00 33.01 28.02 1whv s GLN 465 CO 0.21 -0.92 0.71 0.42 0.50 0.00 0.00 175.29 176.21 1whv s ILE 466 N 1.11 4.89 -0.29 -2.34 1.01 -1.26 -3.16 121.20 121.15 1whv s ILE 466 Ca 0.05 1.14 -0.13 0.00 0.00 0.00 0.00 60.65 61.71 1whv s ILE 466 Cb -0.21 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1whv s ILE 466 CO -0.04 -0.12 0.27 -0.44 0.00 0.00 0.00 174.94 174.61 1whv s SER 467 N 1.55 6.11 -0.49 3.58 0.01 -0.83 -4.96 113.70 118.66 1whv s SER 467 Ca 0.29 -0.00 -0.22 0.00 1.31 0.00 0.00 55.95 57.33 1whv s SER 467 Cb -0.15 -2.16 0.04 0.00 0.21 0.00 0.00 66.02 63.96 1whv s SER 467 CO 0.10 -0.15 0.79 0.26 0.41 0.00 0.00 173.24 174.65 1whv s TRP 468 N 1.88 2.95 -0.17 2.43 0.52 -1.26 -0.53 118.94 124.75 1whv s TRP 468 Ca 0.10 -0.05 -0.14 0.00 0.02 0.00 0.00 56.10 56.03 1whv s TRP 468 Cb -0.16 -3.74 -0.09 0.00 -1.15 0.00 0.00 33.47 28.33 1whv s TRP 468 CO 0.11 -1.10 -0.07 -0.89 0.02 0.00 0.00 176.95 175.02 1whv n ILE 469 N 6.03 1.47 -4.16 2.03 5.41 -1.04 -5.02 119.36 124.07 1whv n ILE 469 Ca 0.00 0.10 -0.11 0.00 1.00 0.00 0.00 62.75 63.75 1whv n ILE 469 Cb 0.47 -2.25 -0.04 0.00 -0.71 0.00 0.00 39.64 37.11 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 -4.53 -0.16 0.15 4.38 2.03 0.62 -4.98 116.55 114.07 1whv n ASP 470 Ca -0.18 -2.14 0.13 0.00 0.52 0.00 0.00 54.79 53.12 1whv n ASP 470 Cb 0.45 0.82 0.43 0.00 -0.72 0.00 0.00 41.12 42.11 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 1.03 0.00 0.00 1.67 2.03 -1.98 -3.21 116.42 115.96 1whv h ASP 471 Ca -0.13 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.17 1whv h ASP 471 Cb 0.63 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.13 1whv h ASP 471 CO 0.19 0.00 -0.22 0.35 -1.03 0.00 0.00 179.24 178.53 1whv n THR 472 N -2.46 0.65 -3.72 1.15 -2.24 -1.26 -3.85 114.28 102.54 1whv n THR 472 Ca 0.04 -0.76 -0.13 0.00 -2.27 0.00 0.00 64.05 60.93 1whv n THR 472 Cb 0.37 0.38 -0.13 0.00 -2.10 0.00 0.00 70.33 68.84 1whv n THR 472 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1whv s SER 473 N -1.36 -0.15 0.24 3.42 1.04 -1.21 -4.29 113.70 111.38 1whv s SER 473 Ca 0.09 0.49 -0.00 0.00 0.48 0.00 0.00 55.95 57.01 1whv s SER 473 Cb 0.08 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.57 1whv s SER 473 CO 0.01 -0.17 0.20 0.00 0.98 0.00 0.00 173.24 174.25 1whv s ALA 474 N 1.40 1.20 0.12 5.32 0.00 -1.24 -0.27 121.76 128.28 1whv s ALA 474 Ca -0.08 -1.71 0.06 0.00 0.00 0.00 0.00 51.96 50.23 1whv s ALA 474 Cb -0.11 1.38 -0.04 0.00 0.00 0.00 0.00 23.12 24.35 1whv s ALA 474 CO -0.08 -0.63 -0.14 -0.06 0.00 0.00 0.00 175.76 174.85 1whv s PHE 475 N -3.96 1.40 -0.21 0.00 0.08 0.31 -3.44 117.98 112.17 1whv s PHE 475 Ca 0.38 -0.55 -0.04 0.00 0.12 0.00 0.00 56.93 56.84 1whv s PHE 475 Cb 0.05 -0.74 0.07 0.00 -0.57 0.00 0.00 43.02 41.83 1whv s PHE 475 CO 0.15 0.14 0.07 0.08 -0.10 0.00 0.00 175.22 175.57 1whv s VAL 476 N -2.09 0.23 -0.11 -0.44 1.01 0.12 -1.97 120.40 117.15 1whv s VAL 476 Ca 0.08 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 1whv s VAL 476 Cb -0.05 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1whv s VAL 476 CO 0.03 -0.35 0.16 -0.55 0.00 0.00 0.00 175.10 174.39 1whv s SER 477 N 1.98 6.42 0.48 3.32 0.15 -1.19 0.50 113.70 125.35 1whv s SER 477 Ca 0.02 0.50 0.05 0.00 0.70 0.00 0.00 55.95 57.23 1whv s SER 477 Cb -0.17 -2.08 -0.01 0.00 -1.71 0.00 0.00 66.02 62.05 1whv s SER 477 CO -0.14 0.40 0.23 -0.76 1.20 0.00 0.00 173.24 174.18 1whv s LEU 478 N -1.05 2.83 -0.09 3.45 1.43 -1.15 -3.80 118.68 120.30 1whv s LEU 478 Ca 0.16 -1.24 -0.20 0.00 -1.03 0.00 0.00 54.13 51.82 1whv s LEU 478 Cb -0.12 -1.24 -0.28 0.00 0.03 0.00 0.00 46.19 44.58 1whv s LEU 478 CO 0.05 -0.80 0.69 -1.28 0.23 0.00 0.00 176.35 175.23 1whv h SER 479 N 1.16 0.36 -3.15 2.29 0.87 -1.92 -3.46 113.55 109.70 1whv h SER 479 Ca -0.41 -0.88 -0.64 0.00 -1.23 0.00 0.00 61.79 58.63 1whv h SER 479 Cb 1.28 -0.12 -0.16 0.00 -0.44 0.00 0.00 62.40 62.96 1whv h SER 479 CO 0.66 1.47 -0.77 -1.10 -0.53 0.00 0.00 176.83 176.56 1whv s GLN 480 N -2.43 1.83 0.16 2.24 -0.21 -1.26 -5.05 119.66 114.95 1whv s GLN 480 Ca -0.18 -1.36 -0.08 0.00 0.02 0.00 0.00 55.36 53.76 1whv s GLN 480 Cb 0.02 -2.04 0.03 0.00 1.00 0.00 0.00 33.01 32.02 1whv s GLN 480 CO 0.77 0.43 1.51 -1.00 -2.12 0.00 0.00 175.29 174.88 1whv h PRO 481 N 3.11 0.84 -0.75 2.91 0.13 -1.96 -3.26 132.00 133.02 1whv h PRO 481 Ca -0.47 -0.44 0.13 0.00 -0.87 0.00 0.00 66.00 64.35 1whv h PRO 481 Cb 1.20 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 1whv h PRO 481 CO 0.51 1.08 -0.30 0.93 -0.23 0.00 0.00 178.00 179.98 1whv h GLU 482 N 0.69 -0.07 -0.97 0.86 4.39 -2.00 0.24 114.58 117.71 1whv h GLU 482 Ca 0.06 0.00 0.30 0.00 0.34 0.00 0.00 59.36 60.06 1whv h GLU 482 Cb 0.97 0.02 -0.17 0.00 -0.10 0.00 0.00 28.75 29.46 1whv h GLU 482 CO 0.09 -0.05 0.20 1.96 -1.16 0.00 0.00 179.01 180.06 1whv h GLN 483 N -0.08 0.06 -0.67 2.33 7.50 -2.00 -0.96 115.11 121.29 1whv h GLN 483 Ca 0.31 -0.00 0.06 0.00 0.50 0.00 0.00 58.65 59.51 1whv h GLN 483 Cb 0.57 -0.01 -0.08 0.00 0.05 0.00 0.00 27.48 28.01 1whv h GLN 483 CO -0.79 0.04 -0.39 0.28 -1.50 0.00 0.00 178.83 176.46 1whv n VAL 484 N -5.37 -0.45 -0.04 -0.54 0.31 0.83 -0.56 118.33 112.51 1whv n VAL 484 Ca 0.26 2.03 -0.10 0.00 -0.01 0.00 0.00 64.34 66.53 1whv n VAL 484 Cb 0.87 -2.55 -0.07 0.00 -0.91 0.00 0.00 33.84 31.18 1whv n VAL 484 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1whv h GLN 485 N 0.00 -0.34 -0.75 5.55 5.75 -1.29 0.14 115.11 124.17 1whv h GLN 485 Ca 0.11 0.02 0.13 0.00 -0.15 0.00 0.00 58.65 58.76 1whv h GLN 485 Cb 0.27 0.08 -0.13 0.00 1.07 0.00 0.00 27.48 28.77 1whv h GLN 485 CO -0.63 -0.22 -0.34 0.82 -2.65 0.00 0.00 178.83 175.81 1whv h ILE 486 N -0.35 0.12 -0.08 2.39 5.03 -1.28 0.22 117.51 123.57 1whv h ILE 486 Ca 0.03 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.81 1whv h ILE 486 Cb 0.44 0.12 -0.04 0.00 -3.03 0.00 0.00 36.82 34.31 1whv h ILE 486 CO -0.34 0.00 -0.14 0.00 -0.68 0.00 0.00 178.15 176.99 1whv h ALA 487 N 1.23 -0.09 -0.31 1.87 0.00 -0.05 -2.50 119.26 119.40 1whv h ALA 487 Ca 0.29 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.29 1whv h ALA 487 Cb 0.57 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1whv h ALA 487 CO -0.80 -0.60 0.01 0.28 0.00 0.00 0.00 179.25 178.13 1whv h VAL 488 N -0.19 0.78 -0.52 0.00 2.07 0.12 0.28 116.25 118.79 1whv h VAL 488 Ca 0.07 -0.03 0.10 0.00 0.82 0.00 0.00 66.70 67.66 1whv h VAL 488 Cb 0.29 0.67 -0.10 0.00 -1.52 0.00 0.00 31.29 30.63 1whv h VAL 488 CO -0.19 0.02 -0.24 -1.13 0.02 0.00 0.00 177.57 176.04 1whv h ASN 489 N 0.10 -0.84 0.95 0.57 -1.24 -0.28 0.43 115.58 115.27 1whv h ASN 489 Ca 0.15 0.19 -0.02 0.00 0.71 0.00 0.00 56.30 57.33 1whv h ASN 489 Cb 0.20 0.45 -0.00 0.00 0.73 0.00 0.00 38.32 39.70 1whv h ASN 489 CO -0.25 -0.26 -0.11 0.71 -1.29 0.00 0.00 177.43 176.24 1whv h THR 490 N -0.12 0.28 0.00 -3.57 1.35 -1.03 -2.69 112.91 107.13 1whv h THR 490 Ca 0.23 -0.79 -0.10 0.00 -0.55 0.00 0.00 66.41 65.21 1whv h THR 490 Cb 0.49 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 1whv h THR 490 CO -0.59 0.10 -0.46 -1.28 -0.25 0.00 0.00 175.52 173.04 1whv h SER 491 N 0.00 0.00 0.20 5.36 0.87 0.19 -3.06 113.55 117.11 1whv h SER 491 Ca -0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1whv h SER 491 Cb 0.61 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 1whv h SER 491 CO 0.01 0.46 -0.25 0.11 -0.53 0.00 0.00 176.83 176.64 1whv h LYS 492 N 0.00 -0.44 -0.48 2.24 1.57 -0.45 -3.05 116.57 115.95 1whv h LYS 492 Ca -0.00 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1whv h LYS 492 Cb 1.20 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.59 1whv h LYS 492 CO 0.06 -0.29 0.26 0.10 -0.57 0.00 0.00 179.45 179.00 1whv h TYR 493 N -0.46 0.67 -0.89 -1.35 -0.00 -1.71 -3.43 116.97 109.80 1whv h TYR 493 Ca -0.02 -0.02 -0.82 0.00 0.00 0.00 0.00 58.73 57.87 1whv h TYR 493 Cb 0.41 -0.21 -0.00 0.00 0.00 0.00 0.00 36.73 36.92 1whv h TYR 493 CO -0.20 0.51 0.91 0.00 -0.00 0.00 0.00 178.16 179.38 1whv n ALA 494 N -2.28 -0.64 -0.12 0.10 0.00 -1.15 -4.83 120.51 111.58 1whv n ALA 494 Ca 0.02 0.38 -0.22 0.00 0.00 0.00 0.00 53.44 53.61 1whv n ALA 494 Cb 0.09 -2.05 -0.12 0.00 0.00 0.00 0.00 19.45 17.37 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 5.29 0.64 -0.11 0.00 1.02 -1.26 -4.50 120.64 121.72 1whv n GLU 495 Ca 0.36 0.21 -0.05 0.00 -0.02 0.00 0.00 57.16 57.67 1whv n GLU 495 Cb -0.00 -1.54 0.03 0.00 -0.02 0.00 0.00 31.44 29.90 1whv n GLU 495 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1whv h SER 496 N -0.33 -0.12 -3.86 1.62 0.02 -1.98 -3.42 113.55 105.50 1whv h SER 496 Ca -0.59 0.08 -0.68 0.00 -0.84 0.00 0.00 61.79 59.76 1whv h SER 496 Cb 1.81 0.14 -0.20 0.00 0.14 0.00 0.00 62.40 64.28 1whv h SER 496 CO -0.17 -0.02 -0.79 -0.72 -1.14 0.00 0.00 176.83 173.98 1whv s TYR 497 N -6.18 2.59 -0.10 3.45 -0.85 -1.26 -4.92 117.35 110.09 1whv s TYR 497 Ca -0.13 -0.23 0.04 0.00 -0.52 0.00 0.00 57.07 56.22 1whv s TYR 497 Cb 0.14 -1.45 0.00 0.00 0.38 0.00 0.00 41.96 41.03 1whv s TYR 497 CO 0.71 0.30 -0.22 0.50 -1.52 0.00 0.00 175.55 175.33 1whv s ARG 498 N -1.64 2.79 0.00 -3.49 6.06 -1.25 -4.73 118.95 116.69 1whv s ARG 498 Ca 0.16 -0.79 0.07 0.00 -2.50 0.00 0.00 55.73 52.67 1whv s ARG 498 Cb -0.11 -2.14 -0.02 0.00 0.06 0.00 0.00 34.95 32.74 1whv s ARG 498 CO 0.07 0.13 -0.22 0.42 -2.50 0.00 0.00 175.30 173.21 1whv s ILE 499 N 0.45 1.72 0.29 4.11 1.01 -1.26 -1.75 121.20 125.77 1whv s ILE 499 Ca -0.17 -1.03 -0.01 0.00 0.00 0.00 0.00 60.65 59.45 1whv s ILE 499 Cb -0.17 -1.45 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 1whv s ILE 499 CO 0.07 0.40 0.34 0.00 0.00 0.00 0.00 174.94 175.75 1whv s GLN 500 N -0.74 1.65 0.10 2.79 -2.07 -0.53 -4.91 119.66 115.96 1whv s GLN 500 Ca 0.08 -1.74 -0.10 0.00 -1.82 0.00 0.00 55.36 51.79 1whv s GLN 500 Cb -0.09 0.37 -0.06 0.00 -1.09 0.00 0.00 33.01 32.15 1whv s GLN 500 CO 0.00 -0.64 0.42 0.95 -1.32 0.00 0.00 175.29 174.70 1whv s THR 501 N -3.55 5.07 0.20 3.63 -4.23 -1.26 -0.77 115.64 114.72 1whv s THR 501 Ca 0.34 0.46 -0.18 0.00 -1.18 0.00 0.00 61.69 61.13 1whv s THR 501 Cb 0.02 -3.65 0.16 0.00 1.34 0.00 0.00 72.50 70.37 1whv s THR 501 CO 0.19 0.24 1.40 0.00 -0.54 0.00 0.00 174.62 175.91 1whv n TYR 502 N 0.77 -0.05 -0.29 3.99 9.36 -1.08 0.73 117.16 130.58 1whv n TYR 502 Ca -0.07 1.11 0.07 0.00 3.32 0.00 0.00 57.90 62.34 1whv n TYR 502 Cb 0.52 -0.79 0.18 0.00 -0.63 0.00 0.00 39.34 38.62 1whv n TYR 502 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1whv h ALA 503 N 1.09 0.82 -0.86 2.98 0.00 -1.85 0.47 119.26 121.91 1whv h ALA 503 Ca 0.28 0.29 0.03 0.00 0.00 0.00 0.00 54.91 55.51 1whv h ALA 503 Cb 0.51 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1whv h ALA 503 CO -0.89 -0.45 0.56 0.93 0.00 0.00 0.00 179.25 179.40 1whv h GLU 504 N 0.05 1.07 0.90 0.00 5.08 -0.08 -0.30 114.58 121.31 1whv h GLU 504 Ca 0.46 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.71 1whv h GLU 504 Cb 0.82 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.84 1whv h GLU 504 CO -0.79 0.71 -0.43 -0.92 -1.00 0.00 0.00 179.01 176.58 1whv h TYR 505 N 1.10 -1.12 -0.94 4.33 3.20 0.37 -2.61 116.97 121.30 1whv h TYR 505 Ca 0.33 -0.03 0.15 0.00 3.14 0.00 0.00 58.73 62.32 1whv h TYR 505 Cb -0.04 0.37 -0.08 0.00 1.54 0.00 0.00 36.73 38.52 1whv h TYR 505 CO -0.02 -0.69 0.60 -0.39 -1.64 0.00 0.00 178.16 176.02 1whv h VAL 506 N -1.31 0.83 -0.91 1.81 -1.51 -1.06 0.26 116.25 114.37 1whv h VAL 506 Ca -0.12 -0.27 0.05 0.00 -1.23 0.00 0.00 66.70 65.12 1whv h VAL 506 Cb 0.92 -0.02 -0.06 0.00 -2.13 0.00 0.00 31.29 30.01 1whv h VAL 506 CO 0.20 0.14 0.58 1.23 -1.23 0.00 0.00 177.57 178.50 1whv h GLY 507 N 0.78 1.34 0.00 5.19 0.00 -0.91 0.04 103.07 109.52 1whv h GLY 507 Ca 0.48 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1whv h GLY 507 CO -0.25 0.34 -0.01 0.50 0.00 0.00 0.00 176.54 177.12 1whv h LYS 508 N 1.10 0.00 -1.12 4.80 1.79 -0.80 -3.34 116.57 118.99 1whv h LYS 508 Ca 0.37 0.00 0.36 0.00 -2.18 0.00 0.00 60.65 59.20 1whv h LYS 508 Cb 0.07 0.00 -0.13 0.00 -1.58 0.00 0.00 32.23 30.59 1whv h LYS 508 CO -0.14 0.00 0.69 1.57 -1.08 0.00 0.00 179.45 180.49 1whv h LYS 509 N -0.68 0.22 -7.14 3.15 5.09 -1.06 -3.40 116.57 112.75 1whv h LYS 509 Ca 0.00 -0.01 -0.55 0.00 0.09 0.00 0.00 60.65 60.18 1whv h LYS 509 Cb 0.01 -0.05 0.16 0.00 0.10 0.00 0.00 32.23 32.45 1whv h LYS 509 CO 0.00 0.15 0.46 -0.65 -2.09 0.00 0.00 179.45 177.32 1whv s GLN 510 N -5.49 2.30 -0.22 0.07 -1.52 0.00 -5.02 119.66 109.78 1whv s GLN 510 Ca -0.09 1.96 -0.03 0.00 -1.95 0.00 0.00 55.36 55.25 1whv s GLN 510 Cb 0.29 -1.83 0.07 0.00 -0.22 0.00 0.00 33.01 31.33 1whv s GLN 510 CO 0.80 -1.76 0.07 0.15 -0.25 0.00 0.00 175.29 174.30 1whv s LYS 511 N -3.61 0.48 0.00 2.91 1.02 -1.26 -4.97 119.74 114.31 1whv s LYS 511 Ca 0.79 -0.49 0.00 0.00 0.02 0.00 0.00 55.97 56.30 1whv s LYS 511 Cb -0.34 -1.89 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 1whv s LYS 511 CO 0.43 -0.77 0.00 0.41 -0.92 0.00 0.00 175.35 174.50 1whv n GLY 512 N 5.09 4.29 3.50 -3.33 0.00 -1.26 -5.16 105.19 108.32 1whv n GLY 512 Ca -0.07 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1whv n GLY 512 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1whv s LYS 513 N 4.46 0.39 -0.29 1.61 -2.85 -1.26 -5.16 119.74 116.64 1whv s LYS 513 Ca 0.00 0.93 -0.20 0.00 -1.00 0.00 0.00 55.97 55.70 1whv s LYS 513 Cb 0.00 0.51 0.15 0.00 -2.06 0.00 0.00 37.83 36.43 1whv s LYS 513 CO 0.00 -0.13 1.10 -1.14 0.10 0.00 0.00 175.35 175.29 1whv s GLN 514 N 2.43 0.32 0.05 1.78 2.00 -1.26 -5.17 119.66 119.82 1whv s GLN 514 Ca -0.04 0.47 0.09 0.00 -2.00 0.00 0.00 55.36 53.88 1whv s GLN 514 Cb -0.07 0.11 -0.03 0.00 0.80 0.00 0.00 33.01 33.82 1whv s GLN 514 CO -0.18 -0.05 -0.26 0.14 -0.50 0.00 0.00 175.29 174.44 1whv s VAL 515 N 0.76 2.16 -0.10 1.34 -7.23 -1.26 -5.08 120.40 111.00 1whv s VAL 515 Ca -0.03 -1.43 -0.31 0.00 -1.81 0.00 0.00 61.98 58.40 1whv s VAL 515 Cb -0.04 -1.85 -0.09 0.00 0.56 0.00 0.00 36.38 34.96 1whv s VAL 515 CO -0.12 0.34 2.03 1.17 -0.31 0.00 0.00 175.10 178.21 1whv n LYS 516 N 1.69 2.27 -1.70 4.82 3.00 -1.26 -4.87 118.16 122.10 1whv n LYS 516 Ca -0.17 0.78 -0.42 0.00 -0.00 0.00 0.00 58.31 58.50 1whv n LYS 516 Cb 0.52 -2.90 -0.03 0.00 0.00 0.00 0.00 35.03 32.62 1whv n LYS 516 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1whv s SER 517 N 5.53 6.46 0.00 3.14 0.15 -1.26 -4.71 113.70 123.01 1whv s SER 517 Ca 0.95 2.65 0.00 0.00 0.70 0.00 0.00 55.95 60.25 1whv s SER 517 Cb -0.53 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.24 1whv s SER 517 CO 0.44 -1.04 0.00 0.61 1.20 0.00 0.00 173.24 174.45 1whv n GLY 518 N 4.47 1.89 0.11 9.45 0.00 -1.26 -4.86 105.19 114.99 1whv n GLY 518 Ca 0.19 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.26 1whv n GLY 518 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1whv h PRO 519 N 0.00 0.23 -6.36 1.61 0.13 -2.04 -3.44 132.00 122.13 1whv h PRO 519 Ca 0.00 -0.12 -0.69 0.00 -0.87 0.00 0.00 66.00 64.32 1whv h PRO 519 Cb 0.00 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 30.90 1whv h PRO 519 CO 0.00 0.65 -0.78 -1.12 -0.23 0.00 0.00 178.00 176.53 1whv s SER 520 N -5.98 3.99 0.01 1.44 0.01 -1.26 -5.09 113.70 106.82 1whv s SER 520 Ca -0.15 -0.23 -0.30 0.00 1.31 0.00 0.00 55.95 56.58 1whv s SER 520 Cb 0.04 -0.81 -0.06 0.00 0.21 0.00 0.00 66.02 65.40 1whv s SER 520 CO 0.73 0.33 1.37 -0.94 0.41 0.00 0.00 173.24 175.14 1whv s SER 521 N -0.82 6.88 0.00 2.44 1.04 -1.26 -5.07 113.70 116.91 1whv s SER 521 Ca 0.12 2.11 0.00 0.00 0.48 0.00 0.00 55.95 58.66 1whv s SER 521 Cb -0.11 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.45 1whv s SER 521 CO 0.01 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.16