#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 2.59 -0.16 1.61 0.01 -1.26 -5.10 113.70 111.39 1whv s SER 424 Ca 0.00 -1.42 -0.14 0.00 1.31 0.00 0.00 55.95 55.70 1whv s SER 424 Cb 0.00 -0.03 -0.05 0.00 0.21 0.00 0.00 66.02 66.16 1whv s SER 424 CO 0.00 -0.64 -0.27 -0.24 0.41 0.00 0.00 173.24 172.50 1whv n SER 425 N -0.79 1.77 0.00 2.44 2.88 -1.26 -5.13 113.62 113.53 1whv n SER 425 Ca -0.03 0.41 0.00 0.00 -1.33 0.00 0.00 58.87 57.92 1whv n SER 425 Cb 0.66 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 63.36 1whv n SER 425 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1whv n GLY 426 N 1.52 0.47 3.44 0.46 0.00 -1.26 -5.11 105.19 104.71 1whv n GLY 426 Ca -0.11 -1.57 -0.16 0.00 0.00 0.00 0.00 46.02 44.18 1whv n GLY 426 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1whv s SER 427 N -4.00 -0.53 0.13 1.61 1.04 -1.26 -5.18 113.70 105.51 1whv s SER 427 Ca 0.00 0.45 0.04 0.00 0.48 0.00 0.00 55.95 56.92 1whv s SER 427 Cb 0.00 0.49 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 1whv s SER 427 CO 0.00 -0.63 -0.09 -0.94 0.98 0.00 0.00 173.24 172.56 1whv s SER 428 N -1.47 1.60 0.64 7.02 1.04 -1.26 -5.16 113.70 116.11 1whv s SER 428 Ca -0.10 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.34 1whv s SER 428 Cb -0.01 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.13 1whv s SER 428 CO 0.05 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.52 1whv n GLY 429 N -0.11 -3.63 2.99 7.32 0.00 -1.26 -5.06 105.19 105.44 1whv n GLY 429 Ca -0.11 -1.21 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 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 -1.64 0.07 0.00 -0.02 0.00 -1.26 -5.02 107.32 99.46 1whv s GLY 430 Ca 0.00 -0.16 0.13 0.00 0.00 0.00 0.00 44.72 44.69 1whv s GLY 430 CO 0.00 -0.22 1.22 -1.55 0.00 0.00 0.00 173.10 172.54 1whv n PRO 431 N 2.20 0.49 -2.68 2.90 -0.04 -1.26 -4.77 135.00 131.83 1whv n PRO 431 Ca -0.19 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.87 1whv n PRO 431 Cb 0.57 -1.43 -0.06 0.00 -0.04 0.00 0.00 33.50 32.55 1whv n PRO 431 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1whv s ASP 432 N -1.93 7.55 0.93 3.54 1.11 -1.26 -5.00 116.67 121.61 1whv s ASP 432 Ca 0.20 2.03 -0.15 0.00 0.18 0.00 0.00 52.55 54.81 1whv s ASP 432 Cb 0.09 -2.61 -0.05 0.00 1.07 0.00 0.00 42.92 41.42 1whv s ASP 432 CO 0.15 0.08 -0.08 0.18 1.18 0.00 0.00 175.17 176.69 1whv n LEU 433 N 1.40 -2.52 -4.30 1.23 7.99 -1.26 -5.00 117.00 114.53 1whv n LEU 433 Ca -0.02 0.31 -0.29 0.00 -0.01 0.00 0.00 56.01 56.01 1whv n LEU 433 Cb 0.46 -1.02 -0.15 0.00 -0.11 0.00 0.00 43.42 42.61 1whv n LEU 433 CO 0.51 -4.57 -0.55 0.00 -1.51 0.00 0.00 177.39 171.26 1whv s GLN 434 N -2.82 1.70 0.66 3.23 0.00 -1.26 -5.12 119.66 116.05 1whv s GLN 434 Ca 0.51 -1.01 -0.11 0.00 -0.00 0.00 0.00 55.36 54.75 1whv s GLN 434 Cb -0.22 -1.81 0.17 0.00 0.00 0.00 0.00 33.01 31.14 1whv s GLN 434 CO 0.73 0.47 0.59 -0.35 0.00 0.00 0.00 175.29 176.73 1whv n PRO 435 N 1.95 -2.18 -0.98 9.60 -0.04 -1.26 -4.92 135.00 137.16 1whv n PRO 435 Ca -0.17 -0.94 -0.31 0.00 -0.04 0.00 0.00 63.50 62.04 1whv n PRO 435 Cb 0.52 -0.88 0.01 0.00 -0.04 0.00 0.00 33.50 33.11 1whv n PRO 435 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1whv n LYS 436 N -3.31 0.00 -2.28 0.54 4.76 -1.26 -4.90 118.16 111.70 1whv n LYS 436 Ca 0.08 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.36 1whv n LYS 436 Cb 0.32 -0.80 0.03 0.00 -1.84 0.00 0.00 35.03 32.74 1whv n LYS 436 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1whv n ARG 437 N 1.24 3.02 -0.03 1.97 -4.01 -1.26 -4.80 116.66 112.80 1whv n ARG 437 Ca 0.06 -3.97 -0.21 0.00 -1.04 0.00 0.00 57.85 52.70 1whv n ARG 437 Cb 0.38 -2.07 -0.13 0.00 -3.04 0.00 0.00 32.46 27.60 1whv n ARG 437 CO 0.00 0.00 0.00 -0.44 -3.04 0.00 0.00 177.63 174.15 1whv h ASP 438 N 2.32 0.25 0.00 2.89 3.32 -2.02 -3.32 116.42 119.86 1whv h ASP 438 Ca 0.21 -0.80 0.00 0.00 0.02 0.00 0.00 57.03 56.46 1whv h ASP 438 Cb 1.45 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.91 1whv h ASP 438 CO 0.58 1.51 0.25 1.12 -1.72 0.00 0.00 179.24 180.98 1whv h HIS 439 N -0.55 0.00 -2.87 4.55 2.07 -1.94 -3.40 115.15 113.02 1whv h HIS 439 Ca -0.27 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.71 1whv h HIS 439 Cb 1.56 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.56 1whv h HIS 439 CO 0.14 0.00 0.85 0.08 -3.07 0.00 0.00 177.93 175.93 1whv s VAL 440 N -3.92 3.31 -0.20 6.12 1.01 -1.25 -4.13 120.40 121.35 1whv s VAL 440 Ca -0.03 0.82 -0.05 0.00 0.00 0.00 0.00 61.98 62.72 1whv s VAL 440 Cb 0.08 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1whv s VAL 440 CO 0.26 0.02 -0.00 -0.76 0.00 0.00 0.00 175.10 174.62 1whv s LEU 441 N 1.98 3.27 -0.52 3.92 1.43 0.35 -1.49 118.68 127.62 1whv s LEU 441 Ca 0.67 -0.19 -0.27 0.00 -1.03 0.00 0.00 54.13 53.32 1whv s LEU 441 Cb -0.36 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.06 1whv s LEU 441 CO 0.30 0.08 1.05 -2.28 0.23 0.00 0.00 176.35 175.72 1whv s HIS 442 N 0.92 2.78 -0.29 0.29 5.65 0.23 -1.57 115.29 123.30 1whv s HIS 442 Ca 0.01 0.38 -0.05 0.00 0.25 0.00 0.00 55.06 55.65 1whv s HIS 442 Cb -0.14 -4.26 0.02 0.00 -1.18 0.00 0.00 32.58 27.03 1whv s HIS 442 CO 0.02 -1.34 0.04 0.08 -0.65 0.00 0.00 174.74 172.89 1whv s VAL 443 N 4.30 3.54 -0.41 0.89 1.01 -1.20 -1.36 120.40 127.17 1whv s VAL 443 Ca 0.40 -0.95 -0.16 0.00 0.00 0.00 0.00 61.98 61.27 1whv s VAL 443 Cb -0.09 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1whv s VAL 443 CO 0.26 0.03 0.35 -0.89 0.00 0.00 0.00 175.10 174.85 1whv s THR 444 N 1.41 5.19 0.20 3.92 2.01 -0.78 -2.93 115.64 124.65 1whv s THR 444 Ca 0.00 -0.51 0.10 0.00 0.31 0.00 0.00 61.69 61.59 1whv s THR 444 Cb -0.18 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 1whv s THR 444 CO 0.00 -0.34 -0.21 0.72 -0.69 0.00 0.00 174.62 174.11 1whv s PHE 445 N 1.86 2.10 0.35 4.92 -0.12 -1.17 -3.63 117.98 122.29 1whv s PHE 445 Ca 0.08 -0.40 -0.28 0.00 -0.05 0.00 0.00 56.93 56.28 1whv s PHE 445 Cb -0.18 -1.01 -0.09 0.00 -0.63 0.00 0.00 43.02 41.10 1whv s PHE 445 CO 0.11 0.47 1.21 -1.25 -0.05 0.00 0.00 175.22 175.72 1whv s PRO 446 N -2.92 4.29 0.30 1.99 0.04 -1.26 -4.33 135.00 133.10 1whv s PRO 446 Ca 0.21 1.99 -0.02 0.00 0.04 0.00 0.00 61.00 63.22 1whv s PRO 446 Cb -0.06 -2.95 0.63 0.00 0.04 0.00 0.00 34.50 32.16 1whv s PRO 446 CO 0.09 -0.16 1.55 0.36 0.04 0.00 0.00 177.00 178.89 1whv n LYS 447 N 0.60 -0.08 -0.24 4.56 2.85 -1.25 0.26 118.16 124.85 1whv n LYS 447 Ca 0.01 1.52 0.21 0.00 -1.05 0.00 0.00 58.31 59.00 1whv n LYS 447 Cb 0.44 -2.34 0.39 0.00 -0.65 0.00 0.00 35.03 32.86 1whv n LYS 447 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1whv n GLU 448 N -5.55 -0.05 -0.49 -1.58 0.28 -1.26 -4.41 120.64 107.59 1whv n GLU 448 Ca 0.20 1.04 -0.17 0.00 -0.16 0.00 0.00 57.16 58.07 1whv n GLU 448 Cb 0.65 -1.82 0.16 0.00 1.43 0.00 0.00 31.44 31.86 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 -4.75 -2.53 -3.49 -1.84 7.02 0.14 -5.05 117.44 106.94 1whv n TRP 449 Ca 0.26 -0.08 -0.11 0.00 -1.02 0.00 0.00 57.50 56.54 1whv n TRP 449 Cb 0.86 -1.37 -0.03 0.00 -2.42 0.00 0.00 31.31 28.36 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 -3.59 1.24 0.19 -0.99 1.02 -1.26 -5.02 119.74 111.33 1whv s LYS 450 Ca 0.36 -0.55 -0.22 0.00 0.02 0.00 0.00 55.97 55.59 1whv s LYS 450 Cb -0.06 0.56 0.11 0.00 -0.52 0.00 0.00 37.83 37.92 1whv s LYS 450 CO 0.32 -0.53 1.57 1.15 -0.92 0.00 0.00 175.35 176.94 1whv h THR 451 N 2.09 0.11 -0.95 2.17 2.02 -1.97 0.51 112.91 116.90 1whv h THR 451 Ca -0.34 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.06 1whv h THR 451 Cb 1.29 0.11 -0.08 0.00 -1.74 0.00 0.00 68.15 67.74 1whv h THR 451 CO 0.40 0.00 0.62 0.28 0.37 0.00 0.00 175.52 177.18 1whv h SER 452 N -0.15 0.47 -0.36 4.18 0.02 -2.00 0.16 113.55 115.88 1whv h SER 452 Ca 0.23 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 1whv h SER 452 Cb 0.56 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1whv h SER 452 CO -0.74 0.17 0.12 -0.78 -1.14 0.00 0.00 176.83 174.45 1whv h ASP 453 N 0.46 0.51 0.76 3.07 1.82 -0.39 -1.21 116.42 121.44 1whv h ASP 453 Ca 0.51 -0.20 -0.04 0.00 -0.39 0.00 0.00 57.03 56.91 1whv h ASP 453 Cb 1.19 -0.13 0.01 0.00 0.68 0.00 0.00 39.33 41.07 1whv h ASP 453 CO -0.22 0.57 -0.37 -0.07 -1.61 0.00 0.00 179.24 177.54 1whv h LEU 454 N 0.42 -0.87 -0.54 2.28 -0.00 -0.29 -0.43 115.31 115.89 1whv h LEU 454 Ca 0.12 0.03 0.11 0.00 -0.00 0.00 0.00 57.88 58.13 1whv h LEU 454 Cb 0.24 0.22 -0.10 0.00 -0.00 0.00 0.00 40.66 41.03 1whv h LEU 454 CO -0.00 -0.62 -0.10 1.88 -0.00 0.00 0.00 178.44 179.60 1whv h TYR 455 N -1.03 -0.22 -0.50 1.13 0.05 -1.45 -0.58 116.97 114.38 1whv h TYR 455 Ca -0.10 0.05 0.07 0.00 0.05 0.00 0.00 58.73 58.79 1whv h TYR 455 Cb 0.79 0.18 -0.06 0.00 1.01 0.00 0.00 36.73 38.65 1whv h TYR 455 CO 0.06 -0.21 0.18 1.96 -1.05 0.00 0.00 178.16 179.10 1whv h GLN 456 N 0.03 0.35 0.18 4.88 4.20 -1.16 1.07 115.11 124.66 1whv h GLN 456 Ca 0.26 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 1whv h GLN 456 Cb 0.41 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 1whv h GLN 456 CO -0.53 0.23 -0.12 1.25 -0.67 0.00 0.00 178.83 179.00 1whv h LEU 457 N 0.36 -0.30 -0.39 1.46 5.85 0.43 -2.40 115.31 120.33 1whv h LEU 457 Ca 0.24 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1whv h LEU 457 Cb 0.25 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1whv h LEU 457 CO -0.24 -0.18 0.00 0.49 -0.34 0.00 0.00 178.44 178.17 1whv n PHE 458 N -2.94 0.28 -0.54 1.25 3.01 -0.57 -3.27 117.46 114.67 1whv n PHE 458 Ca -0.03 0.13 0.43 0.00 1.01 0.00 0.00 57.45 58.98 1whv n PHE 458 Cb 0.12 -0.70 0.68 0.00 -0.01 0.00 0.00 39.48 39.57 1whv n PHE 458 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1whv n SER 459 N -1.77 0.11 -0.32 4.37 2.88 0.37 -0.04 113.62 119.21 1whv n SER 459 Ca 0.01 1.11 0.24 0.00 -1.33 0.00 0.00 58.87 58.91 1whv n SER 459 Cb 0.10 -0.55 0.46 0.00 -0.75 0.00 0.00 64.21 63.47 1whv n SER 459 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1whv n ALA 460 N -2.68 0.80 -0.07 -1.46 0.00 -1.20 -1.27 120.51 114.62 1whv n ALA 460 Ca 0.39 1.00 -0.09 0.00 0.00 0.00 0.00 53.44 54.74 1whv n ALA 460 Cb 1.64 -0.89 -0.07 0.00 0.00 0.00 0.00 19.45 20.13 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 -1.00 -0.79 -3.51 116.94 111.64 1whv h PHE 461 Ca 0.73 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.51 1whv h PHE 461 Cb 1.79 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.35 1whv h PHE 461 CO -0.19 0.59 0.00 0.41 -1.61 0.00 0.00 178.31 177.50 1whv n GLY 462 N 1.64 0.62 3.68 -1.45 0.00 -0.40 -5.07 105.19 104.21 1whv n GLY 462 Ca -0.10 -1.54 -0.52 0.00 0.00 0.00 0.00 46.02 43.86 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 2.84 -3.75 1.61 3.02 -1.26 -4.67 115.26 113.05 1whv n ASN 463 Ca 0.00 1.04 -0.17 0.00 -0.03 0.00 0.00 54.58 55.42 1whv n ASN 463 Cb 0.00 -1.27 -0.09 0.00 -0.61 0.00 0.00 39.78 37.81 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 3.20 0.05 -0.28 2.41 -4.36 -1.26 -4.97 121.20 115.99 1whv s ILE 464 Ca 0.93 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 59.32 1whv s ILE 464 Cb -0.86 -2.50 0.06 0.00 1.25 0.00 0.00 42.46 40.41 1whv s ILE 464 CO 0.55 0.00 -0.05 -1.58 0.24 0.00 0.00 174.94 174.11 1whv s GLN 465 N -3.75 2.31 -0.29 0.37 2.00 -1.25 -5.06 119.66 113.99 1whv s GLN 465 Ca 0.39 -1.33 -0.18 0.00 -2.00 0.00 0.00 55.36 52.25 1whv s GLN 465 Cb 0.04 -3.06 -0.02 0.00 0.80 0.00 0.00 33.01 30.78 1whv s GLN 465 CO 0.21 -0.61 0.50 0.42 -0.50 0.00 0.00 175.29 175.31 1whv s ILE 466 N 1.17 5.06 -0.22 -2.34 1.01 -1.26 -3.05 121.20 121.57 1whv s ILE 466 Ca -0.06 0.67 -0.08 0.00 0.00 0.00 0.00 60.65 61.17 1whv s ILE 466 Cb -0.20 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 1whv s ILE 466 CO -0.03 -0.01 0.09 -0.44 0.00 0.00 0.00 174.94 174.55 1whv s SER 467 N 1.63 5.60 -0.45 3.58 0.01 -0.39 -4.95 113.70 118.73 1whv s SER 467 Ca 0.20 -0.01 -0.20 0.00 1.31 0.00 0.00 55.95 57.25 1whv s SER 467 Cb -0.16 -1.99 0.03 0.00 0.21 0.00 0.00 66.02 64.12 1whv s SER 467 CO 0.11 0.08 0.63 0.26 0.41 0.00 0.00 173.24 174.72 1whv s TRP 468 N 0.97 3.06 -0.08 2.43 0.52 -1.26 -0.27 118.94 124.31 1whv s TRP 468 Ca 0.05 -0.17 -0.06 0.00 0.02 0.00 0.00 56.10 55.94 1whv s TRP 468 Cb -0.14 -3.35 -0.02 0.00 -1.15 0.00 0.00 33.47 28.81 1whv s TRP 468 CO 0.03 -0.89 -0.11 -0.89 0.02 0.00 0.00 176.95 175.11 1whv n ILE 469 N 5.78 0.81 -4.28 2.03 5.41 -0.32 -5.00 119.36 123.80 1whv n ILE 469 Ca -0.03 0.34 -0.14 0.00 1.00 0.00 0.00 62.75 63.92 1whv n ILE 469 Cb 0.47 -2.01 -0.04 0.00 -0.71 0.00 0.00 39.64 37.36 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 -3.61 1.30 -0.06 4.38 2.03 0.31 -4.94 116.55 115.96 1whv n ASP 470 Ca -0.04 -2.15 0.06 0.00 0.52 0.00 0.00 54.79 53.17 1whv n ASP 470 Cb 0.16 0.50 0.41 0.00 -0.72 0.00 0.00 41.12 41.47 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 0.83 0.52 0.00 1.67 3.04 -1.97 -2.87 116.42 117.64 1whv h ASP 471 Ca -0.17 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.61 1whv h ASP 471 Cb 0.64 -0.12 0.00 0.00 -1.04 0.00 0.00 39.33 38.81 1whv h ASP 471 CO 0.28 0.36 -0.11 0.35 -2.04 0.00 0.00 179.24 178.07 1whv n THR 472 N -4.47 1.17 -4.76 1.15 -2.24 -1.26 -3.91 114.28 99.95 1whv n THR 472 Ca 0.06 -1.37 -0.29 0.00 -2.27 0.00 0.00 64.05 60.18 1whv n THR 472 Cb 0.14 0.15 -0.17 0.00 -2.10 0.00 0.00 70.33 68.35 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 -1.92 2.53 0.28 3.42 0.01 -1.08 -3.03 113.70 113.91 1whv s SER 473 Ca 0.17 -0.45 0.03 0.00 1.31 0.00 0.00 55.95 57.01 1whv s SER 473 Cb 0.15 -1.15 -0.03 0.00 0.21 0.00 0.00 66.02 65.20 1whv s SER 473 CO 0.02 0.07 0.25 0.00 0.41 0.00 0.00 173.24 173.99 1whv s ALA 474 N 0.67 1.45 0.02 1.44 0.00 -1.15 -0.53 121.76 123.66 1whv s ALA 474 Ca -0.13 -1.85 0.00 0.00 0.00 0.00 0.00 51.96 49.98 1whv s ALA 474 Cb -0.16 1.40 -0.02 0.00 0.00 0.00 0.00 23.12 24.34 1whv s ALA 474 CO 0.03 -0.66 -0.04 -0.06 0.00 0.00 0.00 175.76 175.04 1whv s PHE 475 N -3.67 0.31 -0.17 0.00 0.08 0.62 -3.25 117.98 111.90 1whv s PHE 475 Ca 0.39 -0.49 -0.02 0.00 0.12 0.00 0.00 56.93 56.93 1whv s PHE 475 Cb 0.04 -0.21 0.05 0.00 -0.57 0.00 0.00 43.02 42.32 1whv s PHE 475 CO 0.21 -0.16 0.01 0.08 -0.10 0.00 0.00 175.22 175.26 1whv s VAL 476 N -1.34 0.64 -0.17 -0.44 1.01 -0.61 -1.26 120.40 118.24 1whv s VAL 476 Ca -0.14 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.26 1whv s VAL 476 Cb -0.09 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 1whv s VAL 476 CO -0.01 -0.08 0.10 -0.55 0.00 0.00 0.00 175.10 174.56 1whv s SER 477 N 1.82 6.03 0.54 3.32 0.15 -1.17 -0.50 113.70 123.88 1whv s SER 477 Ca -0.00 0.25 0.06 0.00 0.70 0.00 0.00 55.95 56.96 1whv s SER 477 Cb -0.16 -2.00 0.04 0.00 -1.71 0.00 0.00 66.02 62.18 1whv s SER 477 CO -0.07 0.25 0.47 -0.76 1.20 0.00 0.00 173.24 174.32 1whv s LEU 478 N -0.09 2.83 -0.01 3.45 1.43 -1.26 -3.77 118.68 121.25 1whv s LEU 478 Ca 0.09 -1.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.00 1whv s LEU 478 Cb -0.12 -1.33 -0.29 0.00 0.03 0.00 0.00 46.19 44.49 1whv s LEU 478 CO 0.00 -1.11 0.81 0.77 0.23 0.00 0.00 176.35 177.06 1whv h SER 479 N 0.68 0.46 -4.43 2.29 4.64 -1.95 -3.48 113.55 111.77 1whv h SER 479 Ca -0.36 -0.65 -0.29 0.00 -0.47 0.00 0.00 61.79 60.02 1whv h SER 479 Cb 1.30 -0.15 -0.17 0.00 -0.31 0.00 0.00 62.40 63.07 1whv h SER 479 CO 0.55 1.54 -0.72 -1.10 -0.87 0.00 0.00 176.83 176.23 1whv s GLN 480 N -2.61 0.84 0.13 4.77 -1.52 -1.26 -5.06 119.66 114.95 1whv s GLN 480 Ca -0.11 -1.20 -0.12 0.00 -1.95 0.00 0.00 55.36 51.98 1whv s GLN 480 Cb 0.06 -0.43 -0.06 0.00 -0.22 0.00 0.00 33.01 32.36 1whv s GLN 480 CO 0.86 0.05 1.46 -1.00 -0.25 0.00 0.00 175.29 176.40 1whv h PRO 481 N 3.40 0.86 -0.81 2.91 0.13 -1.94 -3.24 132.00 133.31 1whv h PRO 481 Ca -0.37 -0.45 0.24 0.00 -0.87 0.00 0.00 66.00 64.55 1whv h PRO 481 Cb 1.18 0.02 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1whv h PRO 481 CO 0.56 1.10 0.07 0.39 -0.23 0.00 0.00 178.00 179.89 1whv n GLU 482 N -4.13 -0.06 -0.26 0.86 -0.58 -1.26 0.23 120.64 115.43 1whv n GLU 482 Ca -0.03 1.21 -0.02 0.00 -0.42 0.00 0.00 57.16 57.90 1whv n GLU 482 Cb 0.52 -1.95 0.09 0.00 -0.57 0.00 0.00 31.44 29.54 1whv n GLU 482 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 1whv h GLN 483 N 0.00 0.86 -0.83 3.49 4.20 -2.00 -2.79 115.11 118.03 1whv h GLN 483 Ca 0.52 -0.05 0.15 0.00 0.06 0.00 0.00 58.65 59.33 1whv h GLN 483 Cb 1.13 -0.19 -0.15 0.00 0.30 0.00 0.00 27.48 28.56 1whv h GLN 483 CO -0.75 0.57 -0.25 0.28 -0.67 0.00 0.00 178.83 178.01 1whv n VAL 484 N -4.66 -0.38 0.12 -0.54 0.31 0.62 -0.02 118.33 113.78 1whv n VAL 484 Ca 0.09 1.93 -0.15 0.00 -0.01 0.00 0.00 64.34 66.20 1whv n VAL 484 Cb 0.11 -2.62 -0.08 0.00 -0.91 0.00 0.00 33.84 30.34 1whv n VAL 484 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1whv h GLN 485 N 0.00 -0.65 0.30 5.55 1.08 -1.55 -1.09 115.11 118.76 1whv h GLN 485 Ca 0.36 0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.60 1whv h GLN 485 Cb 0.57 0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 28.13 1whv h GLN 485 CO -0.85 -0.43 -0.31 0.82 -0.95 0.00 0.00 178.83 177.11 1whv h ILE 486 N -0.67 0.00 -0.99 2.54 5.03 -0.55 0.24 117.51 123.11 1whv h ILE 486 Ca 0.02 0.00 0.32 0.00 -0.12 0.00 0.00 64.86 65.08 1whv h ILE 486 Cb 0.69 0.00 -0.18 0.00 -3.03 0.00 0.00 36.82 34.30 1whv h ILE 486 CO -0.24 0.00 0.20 0.00 -0.68 0.00 0.00 178.15 177.43 1whv n ALA 487 N -2.60 0.68 -0.05 1.87 0.00 -0.14 0.40 120.51 120.68 1whv n ALA 487 Ca -0.07 1.04 -0.13 0.00 0.00 0.00 0.00 53.44 54.27 1whv n ALA 487 Cb 0.28 -0.86 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 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 1.37 -0.65 0.00 2.07 -0.71 -3.03 116.25 115.31 1whv h VAL 488 Ca 0.68 -1.39 0.08 0.00 0.82 0.00 0.00 66.70 66.90 1whv h VAL 488 Cb 1.58 2.01 -0.11 0.00 -1.52 0.00 0.00 31.29 33.25 1whv h VAL 488 CO -0.87 0.40 -0.49 -1.13 0.02 0.00 0.00 177.57 175.50 1whv h ASN 489 N -0.09 -1.72 -0.94 0.57 -1.24 0.34 0.19 115.58 112.70 1whv h ASN 489 Ca 0.01 0.27 0.07 0.00 0.71 0.00 0.00 56.30 57.36 1whv h ASN 489 Cb 0.72 0.76 -0.07 0.00 0.73 0.00 0.00 38.32 40.47 1whv h ASN 489 CO 0.04 -0.33 0.59 0.71 -1.29 0.00 0.00 177.43 177.15 1whv h THR 490 N -0.21 1.03 -0.70 -3.57 1.35 -1.48 -1.10 112.91 108.22 1whv h THR 490 Ca 0.16 -0.36 0.10 0.00 -0.55 0.00 0.00 66.41 65.76 1whv h THR 490 Cb 0.55 -0.10 -0.05 0.00 -1.73 0.00 0.00 68.15 66.82 1whv h THR 490 CO -0.74 0.19 0.46 0.77 -0.25 0.00 0.00 175.52 175.96 1whv h SER 491 N 1.05 0.51 -0.53 5.36 4.64 -0.54 -2.37 113.55 121.67 1whv h SER 491 Ca 0.42 0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.80 1whv h SER 491 Cb 0.23 -0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 62.15 1whv h SER 491 CO -0.19 0.31 -0.43 0.11 -0.87 0.00 0.00 176.83 175.76 1whv h LYS 492 N 0.57 -0.14 -0.23 4.77 1.79 0.02 -1.96 116.57 121.40 1whv h LYS 492 Ca 0.32 0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.74 1whv h LYS 492 Cb 0.51 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1whv h LYS 492 CO -0.11 -0.09 -0.09 0.10 -1.08 0.00 0.00 179.45 178.18 1whv h TYR 493 N -0.14 0.54 -1.05 -1.35 -0.00 -1.64 -3.44 116.97 109.89 1whv h TYR 493 Ca 0.09 -0.13 -0.74 0.00 0.00 0.00 0.00 58.73 57.95 1whv h TYR 493 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 36.73 36.97 1whv h TYR 493 CO -0.86 0.73 1.13 0.00 -0.00 0.00 0.00 178.16 179.16 1whv n ALA 494 N -2.40 0.18 -0.12 0.10 0.00 -0.74 -4.82 120.51 112.71 1whv n ALA 494 Ca -0.04 0.22 -0.16 0.00 0.00 0.00 0.00 53.44 53.45 1whv n ALA 494 Cb 0.32 -2.27 -0.13 0.00 0.00 0.00 0.00 19.45 17.38 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 6.56 0.66 -0.21 0.00 -0.58 -1.26 -4.49 120.64 121.32 1whv n GLU 495 Ca 0.37 0.12 0.01 0.00 -0.42 0.00 0.00 57.16 57.25 1whv n GLU 495 Cb 0.11 -1.52 0.11 0.00 -0.57 0.00 0.00 31.44 29.57 1whv n GLU 495 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1whv h SER 496 N 0.00 -0.32 -2.28 1.62 0.87 -1.96 -3.42 113.55 108.06 1whv h SER 496 Ca -0.57 0.16 -0.61 0.00 -1.23 0.00 0.00 61.79 59.54 1whv h SER 496 Cb 1.96 0.29 -0.14 0.00 -0.44 0.00 0.00 62.40 64.08 1whv h SER 496 CO -0.07 -0.13 -0.75 -0.72 -0.53 0.00 0.00 176.83 174.63 1whv s TYR 497 N -6.15 2.33 -0.06 2.24 -0.85 -1.26 -4.94 117.35 108.65 1whv s TYR 497 Ca -0.14 -0.32 0.05 0.00 -0.52 0.00 0.00 57.07 56.14 1whv s TYR 497 Cb 0.19 -1.02 -0.01 0.00 0.38 0.00 0.00 41.96 41.51 1whv s TYR 497 CO 0.74 0.69 -0.22 0.50 -1.52 0.00 0.00 175.55 175.74 1whv s ARG 498 N -3.46 2.39 -0.03 -3.49 3.52 -1.24 -4.82 118.95 111.81 1whv s ARG 498 Ca 0.29 -0.80 0.02 0.00 -0.13 0.00 0.00 55.73 55.12 1whv s ARG 498 Cb -0.05 -1.99 0.01 0.00 -1.56 0.00 0.00 34.95 31.36 1whv s ARG 498 CO 0.15 0.30 -0.08 0.42 -0.81 0.00 0.00 175.30 175.28 1whv s ILE 499 N 0.01 0.71 0.32 4.11 1.01 -1.26 -1.87 121.20 124.23 1whv s ILE 499 Ca -0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 1whv s ILE 499 Cb -0.14 -0.65 -0.00 0.00 0.01 0.00 0.00 42.46 41.68 1whv s ILE 499 CO 0.04 0.23 0.44 0.00 0.00 0.00 0.00 174.94 175.65 1whv s GLN 500 N 0.27 1.82 0.32 2.79 0.00 -0.47 -4.92 119.66 119.47 1whv s GLN 500 Ca -0.04 -1.72 -0.22 0.00 -0.00 0.00 0.00 55.36 53.39 1whv s GLN 500 Cb -0.09 0.43 -0.10 0.00 0.00 0.00 0.00 33.01 33.25 1whv s GLN 500 CO 0.00 -0.74 0.85 0.95 0.00 0.00 0.00 175.29 176.36 1whv s THR 501 N -3.24 4.41 0.21 3.63 -4.23 -1.26 0.77 115.64 115.93 1whv s THR 501 Ca 0.31 1.48 -0.06 0.00 -1.18 0.00 0.00 61.69 62.24 1whv s THR 501 Cb 0.00 -3.83 0.34 0.00 1.34 0.00 0.00 72.50 70.36 1whv s THR 501 CO 0.19 0.02 1.18 0.00 -0.54 0.00 0.00 174.62 175.48 1whv n TYR 502 N 0.23 0.27 0.14 3.99 4.19 -0.55 0.74 117.16 126.17 1whv n TYR 502 Ca 0.02 0.93 -0.14 0.00 3.31 0.00 0.00 57.90 62.02 1whv n TYR 502 Cb 0.52 -0.94 -0.08 0.00 0.49 0.00 0.00 39.34 39.33 1whv n TYR 502 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1whv h ALA 503 N 1.50 -0.31 -1.10 2.98 0.00 -1.87 -2.29 119.26 118.17 1whv h ALA 503 Ca 0.36 -0.10 0.32 0.00 0.00 0.00 0.00 54.91 55.49 1whv h ALA 503 Cb 0.55 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1whv h ALA 503 CO -0.78 -0.63 1.05 0.93 0.00 0.00 0.00 179.25 179.82 1whv h GLU 504 N -0.41 0.00 0.00 0.00 4.39 -0.05 0.52 114.58 119.04 1whv h GLU 504 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1whv h GLU 504 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1whv h GLU 504 CO 0.05 0.00 0.00 0.98 -1.16 0.00 0.00 179.01 178.88 1whv n TYR 505 N -3.58 0.00 0.19 4.33 9.36 -0.89 -3.89 117.16 122.67 1whv n TYR 505 Ca 0.24 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.61 1whv n TYR 505 Cb 1.39 -0.20 0.56 0.00 -0.63 0.00 0.00 39.34 40.47 1whv n TYR 505 CO 0.00 0.00 0.00 -0.39 0.22 0.00 0.00 176.86 176.69 1whv h VAL 506 N 0.00 0.09 0.44 2.97 -1.51 -1.10 -0.88 116.25 116.27 1whv h VAL 506 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.45 1whv h VAL 506 Cb 0.00 0.41 0.00 0.00 -2.13 0.00 0.00 31.29 29.58 1whv h VAL 506 CO 0.00 0.00 -0.21 1.23 -1.23 0.00 0.00 177.57 177.36 1whv h GLY 507 N 0.00 -0.62 -0.99 5.19 0.00 -0.12 -2.96 103.07 103.57 1whv h GLY 507 Ca 0.13 0.23 0.18 0.00 0.00 0.00 0.00 47.33 47.86 1whv h GLY 507 CO -0.00 -0.22 -0.31 0.28 0.00 0.00 0.00 176.54 176.29 1whv n LYS 508 N -5.29 -0.15 0.00 4.80 5.02 -0.33 -1.84 118.16 120.36 1whv n LYS 508 Ca -0.11 1.53 0.00 0.00 -2.02 0.00 0.00 58.31 57.71 1whv n LYS 508 Cb 0.28 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.01 1whv n LYS 508 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1whv n LYS 509 N -5.54 0.00 -0.84 1.97 5.02 -1.18 -4.71 118.16 112.88 1whv n LYS 509 Ca 0.13 0.57 -0.31 0.00 -2.02 0.00 0.00 58.31 56.68 1whv n LYS 509 Cb 0.45 -1.44 0.15 0.00 -0.02 0.00 0.00 35.03 34.17 1whv n LYS 509 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1whv s GLN 510 N -2.78 1.29 -0.22 1.97 -2.07 -0.77 -5.03 119.66 112.05 1whv s GLN 510 Ca 0.00 1.52 -0.03 0.00 -1.82 0.00 0.00 55.36 55.04 1whv s GLN 510 Cb 0.00 -1.76 0.07 0.00 -1.09 0.00 0.00 33.01 30.23 1whv s GLN 510 CO 0.00 -2.43 0.06 0.21 -1.32 0.00 0.00 175.29 171.81 1whv s LYS 511 N -4.61 0.59 0.00 9.60 2.20 -1.26 -4.84 119.74 121.42 1whv s LYS 511 Ca 0.67 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.76 1whv s LYS 511 Cb -0.23 -2.00 0.00 0.00 -1.51 0.00 0.00 37.83 34.10 1whv s LYS 511 CO 0.56 -0.73 0.00 0.41 -0.36 0.00 0.00 175.35 175.23 1whv n GLY 512 N 5.05 0.00 3.16 5.54 0.00 -1.26 -5.15 105.19 112.53 1whv n GLY 512 Ca -0.07 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.99 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 0.33 -0.20 1.61 2.36 -1.26 -5.16 119.74 117.42 1whv s LYS 513 Ca 0.00 0.60 -0.11 0.00 -2.55 0.00 0.00 55.97 53.91 1whv s LYS 513 Cb 0.00 0.33 0.07 0.00 -1.05 0.00 0.00 37.83 37.18 1whv s LYS 513 CO 0.00 -0.35 0.50 -1.14 1.55 0.00 0.00 175.35 175.90 1whv s GLN 514 N 2.90 0.49 0.18 4.03 0.74 -1.26 -5.12 119.66 121.62 1whv s GLN 514 Ca 0.07 0.93 0.10 0.00 0.05 0.00 0.00 55.36 56.50 1whv s GLN 514 Cb -0.12 0.03 -0.04 0.00 1.10 0.00 0.00 33.01 33.98 1whv s GLN 514 CO -0.15 -0.16 -0.21 0.14 -0.55 0.00 0.00 175.29 174.37 1whv s VAL 515 N 1.49 2.06 -0.74 1.34 -7.23 -1.26 -5.05 120.40 111.02 1whv s VAL 515 Ca -0.10 -1.98 -0.25 0.00 -1.81 0.00 0.00 61.98 57.84 1whv s VAL 515 Cb -0.07 -1.97 -0.14 0.00 0.56 0.00 0.00 36.38 34.76 1whv s VAL 515 CO -0.15 -0.24 2.41 1.17 -0.31 0.00 0.00 175.10 177.98 1whv n LYS 516 N 0.24 0.63 -4.14 4.82 3.00 -1.26 -4.88 118.16 116.59 1whv n LYS 516 Ca -0.13 -0.62 -0.11 0.00 -0.00 0.00 0.00 58.31 57.46 1whv n LYS 516 Cb 0.57 -3.49 -0.10 0.00 0.00 0.00 0.00 35.03 32.00 1whv n LYS 516 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1whv s SER 517 N 10.68 1.05 0.01 3.14 0.01 -1.26 -5.16 113.70 122.17 1whv s SER 517 Ca 0.97 -0.87 0.05 0.00 1.31 0.00 0.00 55.95 57.41 1whv s SER 517 Cb -0.19 0.08 -0.02 0.00 0.21 0.00 0.00 66.02 66.10 1whv s SER 517 CO 0.15 -0.39 -0.14 -0.83 0.41 0.00 0.00 173.24 172.44 1whv s GLY 518 N -2.59 0.75 0.72 3.44 0.00 -1.26 -5.14 107.32 103.23 1whv s GLY 518 Ca 0.05 -0.71 -0.12 0.00 0.00 0.00 0.00 44.72 43.94 1whv s GLY 518 CO -0.03 -0.64 1.10 2.56 0.00 0.00 0.00 173.10 176.09 1whv s PRO 519 N -0.67 2.49 -0.30 2.90 0.04 -1.26 -5.06 135.00 133.14 1whv s PRO 519 Ca 0.04 1.26 -0.14 0.00 0.04 0.00 0.00 61.00 62.20 1whv s PRO 519 Cb -0.06 -1.92 0.18 0.00 0.04 0.00 0.00 34.50 32.73 1whv s PRO 519 CO 0.00 -1.48 1.06 -1.54 0.04 0.00 0.00 177.00 175.08 1whv s SER 520 N -3.05 -0.45 0.29 6.66 1.04 -1.26 -5.18 113.70 111.75 1whv s SER 520 Ca 0.64 0.38 -0.00 0.00 0.48 0.00 0.00 55.95 57.45 1whv s SER 520 Cb -0.19 1.42 -0.02 0.00 0.10 0.00 0.00 66.02 67.33 1whv s SER 520 CO 0.50 -0.09 0.33 -0.44 0.98 0.00 0.00 173.24 174.52 1whv s SER 521 N 2.75 0.86 0.00 7.02 0.01 -1.26 -5.12 113.70 117.95 1whv s SER 521 Ca -0.01 -1.49 0.00 0.00 1.31 0.00 0.00 55.95 55.76 1whv s SER 521 Cb -0.08 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.70 1whv s SER 521 CO -0.13 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.04