#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w5e s HIS -6 N 0.00 2.01 -0.62 5.64 3.76 -1.26 -5.10 115.29 119.73 2w5e s HIS -6 Ca 0.00 -0.43 -0.22 0.00 -0.15 0.00 0.00 55.06 54.26 2w5e s HIS -6 Cb 0.00 -0.95 0.07 0.00 1.11 0.00 0.00 32.58 32.82 2w5e s HIS -6 CO 0.00 0.47 0.88 -1.01 -0.85 0.00 0.00 174.74 174.23 2w5e s HIS -5 N -2.31 2.79 -0.88 1.40 3.76 -1.26 -4.99 115.29 113.80 2w5e s HIS -5 Ca 0.22 -0.58 -0.09 0.00 -0.15 0.00 0.00 55.06 54.46 2w5e s HIS -5 Cb -0.05 -4.14 0.23 0.00 1.11 0.00 0.00 32.58 29.72 2w5e s HIS -5 CO 0.10 -1.49 0.81 -3.38 -0.85 0.00 0.00 174.74 169.93 2w5e s HIS -4 N 3.63 3.86 0.50 1.40 -3.43 -1.26 -4.98 115.29 115.02 2w5e s HIS -4 Ca 0.20 -2.45 0.03 0.00 -0.80 0.00 0.00 55.06 52.04 2w5e s HIS -4 Cb -0.18 -3.65 0.02 0.00 -1.43 0.00 0.00 32.58 27.34 2w5e s HIS -4 CO 0.10 -0.92 0.71 -1.01 -2.00 0.00 0.00 174.74 171.62 2w5e s HIS -3 N -0.48 2.92 0.14 0.38 3.76 -1.26 -5.06 115.29 115.69 2w5e s HIS -3 Ca 0.23 -0.05 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2w5e s HIS -3 Cb -0.11 -2.58 -0.04 0.00 1.11 0.00 0.00 32.58 30.96 2w5e s HIS -3 CO -0.08 -0.67 -0.02 -1.01 -0.85 0.00 0.00 174.74 172.12 2w5e s HIS -2 N -2.63 1.02 -1.35 1.40 3.76 0.14 -4.88 115.29 112.76 2w5e s HIS -2 Ca 0.55 -1.02 -0.02 0.00 -0.15 0.00 0.00 55.06 54.42 2w5e s HIS -2 Cb -0.10 -0.59 0.01 0.00 1.11 0.00 0.00 32.58 33.01 2w5e s HIS -2 CO 0.37 -0.24 0.73 0.72 -0.85 0.00 0.00 174.74 175.47 2w5e n HIS -1 N -0.14 -1.96 -2.79 1.40 8.25 -1.26 -2.42 115.22 116.30 2w5e n HIS -1 Ca -0.09 0.85 -0.42 0.00 -0.26 0.00 0.00 57.72 57.80 2w5e n HIS -1 Cb 0.62 -4.30 -0.03 0.00 1.12 0.00 0.00 29.99 27.40 2w5e n HIS -1 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2w5e s ILE 432 N -3.63 4.73 -0.57 1.59 1.01 -1.26 -4.33 121.20 118.74 2w5e s ILE 432 Ca 0.11 1.66 0.04 0.00 0.00 0.00 0.00 60.65 62.46 2w5e s ILE 432 Cb -0.05 -4.22 0.15 0.00 0.01 0.00 0.00 42.46 38.35 2w5e s ILE 432 CO 0.82 -0.20 0.37 -0.54 0.00 0.00 0.00 174.94 175.39 2w5e s LYS 433 N 3.09 1.88 0.42 2.79 1.02 -1.26 -4.93 119.74 122.74 2w5e s LYS 433 Ca 0.39 -2.73 0.29 0.00 0.02 0.00 0.00 55.97 53.94 2w5e s LYS 433 Cb -0.14 -2.86 1.38 0.00 -0.52 0.00 0.00 37.83 35.69 2w5e s LYS 433 CO 0.09 -1.24 1.88 -1.35 -0.92 0.00 0.00 175.35 173.81 2w5e h PRO 434 N 5.93 0.00 0.00 -1.68 0.11 -1.99 -2.15 132.00 132.22 2w5e h PRO 434 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2w5e h PRO 434 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2w5e h PRO 434 CO 0.61 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.81 2w5e n GLY 435 N -0.49 -1.33 0.13 -0.55 0.00 -1.26 -2.37 105.19 99.33 2w5e n GLY 435 Ca -0.00 -0.09 0.14 0.00 0.00 0.00 0.00 46.02 46.07 2w5e n GLY 435 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w5e n ALA 436 N -1.49 2.64 -2.84 4.61 0.00 -0.81 -3.98 120.51 118.66 2w5e n ALA 436 Ca 0.06 -0.26 -0.32 0.00 0.00 0.00 0.00 53.44 52.92 2w5e n ALA 436 Cb 0.28 -1.38 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 2w5e n ALA 436 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2w5e s LEU 437 N -1.90 4.35 0.23 0.00 1.43 -1.00 -1.48 118.68 120.31 2w5e s LEU 437 Ca 0.42 0.41 0.01 0.00 -1.03 0.00 0.00 54.13 53.93 2w5e s LEU 437 Cb 0.20 -2.89 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 2w5e s LEU 437 CO 0.33 0.18 0.16 0.00 0.23 0.00 0.00 176.35 177.25 2w5e s VAL 439 N -4.00 4.00 -0.13 0.00 1.01 -0.71 -0.96 120.40 119.62 2w5e s VAL 439 Ca 0.39 -0.32 -0.14 0.00 0.00 0.00 0.00 61.98 61.91 2w5e s VAL 439 Cb 0.06 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 2w5e s VAL 439 CO 0.15 0.50 0.31 -0.63 0.00 0.00 0.00 175.10 175.43 2w5e s ILE 440 N 0.28 5.27 -0.07 2.22 -1.09 -0.35 -0.44 121.20 127.02 2w5e s ILE 440 Ca -0.02 0.60 0.03 0.00 -2.23 0.00 0.00 60.65 59.03 2w5e s ILE 440 Cb -0.14 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 2w5e s ILE 440 CO 0.03 0.43 -0.18 -0.62 -1.23 0.00 0.00 174.94 173.37 2w5e s ASP 441 N 0.13 2.39 0.22 3.58 2.15 0.88 -1.17 116.67 124.85 2w5e s ASP 441 Ca 0.18 -0.41 0.02 0.00 0.43 0.00 0.00 52.55 52.76 2w5e s ASP 441 Cb -0.14 -1.01 -0.05 0.00 -0.30 0.00 0.00 42.92 41.43 2w5e s ASP 441 CO 0.06 0.11 0.05 0.42 -0.17 0.00 0.00 175.17 175.63 2w5e s THR 442 N 0.40 0.64 0.44 1.71 -4.23 -0.05 -0.91 115.64 113.64 2w5e s THR 442 Ca -0.14 -1.99 0.15 0.00 -1.18 0.00 0.00 61.69 58.53 2w5e s THR 442 Cb -0.16 -2.38 0.34 0.00 1.34 0.00 0.00 72.50 71.64 2w5e s THR 442 CO 0.05 -0.24 1.97 -0.65 -0.54 0.00 0.00 174.62 175.22 2w5e h PRO 443 N 2.53 0.36 0.00 3.99 0.11 -1.97 -2.65 132.00 134.37 2w5e h PRO 443 Ca -0.38 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.64 2w5e h PRO 443 Cb 1.23 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2w5e h PRO 443 CO 0.62 0.24 -0.34 0.93 -0.21 0.00 0.00 178.00 179.23 2w5e h GLU 444 N 0.37 0.00 0.00 1.05 3.07 -1.96 -3.49 114.58 113.62 2w5e h GLU 444 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 2w5e h GLU 444 Cb 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.53 2w5e h GLU 444 CO -0.08 0.34 0.00 0.41 -1.40 0.00 0.00 179.01 178.29 2w5e n GLY 445 N 1.05 -0.99 3.31 -3.84 0.00 -1.00 -5.16 105.19 98.56 2w5e n GLY 445 Ca 0.02 -1.15 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 2w5e n GLY 445 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w5e s LYS 446 N -1.86 1.20 0.31 1.61 1.02 -1.26 -0.87 119.74 119.89 2w5e s LYS 446 Ca 0.00 -1.28 0.06 0.00 0.02 0.00 0.00 55.97 54.77 2w5e s LYS 446 Cb 0.00 -1.39 -0.02 0.00 -0.52 0.00 0.00 37.83 35.89 2w5e s LYS 446 CO 0.00 0.31 0.29 0.41 -0.92 0.00 0.00 175.35 175.44 2w5e n GLY 447 N 0.74 2.86 3.86 -3.33 0.00 -0.32 -4.92 105.19 104.09 2w5e n GLY 447 Ca -0.17 -1.83 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 2w5e n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w5e s THR 448 N -3.17 5.32 0.29 2.61 2.01 0.30 -1.21 115.64 121.79 2w5e s THR 448 Ca 0.35 0.44 0.09 0.00 0.31 0.00 0.00 61.69 62.88 2w5e s THR 448 Cb 0.01 -3.52 -0.06 0.00 0.01 0.00 0.00 72.50 68.94 2w5e s THR 448 CO 0.25 0.59 -0.10 -0.83 -0.69 0.00 0.00 174.62 173.83 2w5e s GLY 449 N -1.09 1.92 -0.03 4.40 0.00 -0.14 -4.09 107.32 108.29 2w5e s GLY 449 Ca 0.19 -1.94 -0.05 0.00 0.00 0.00 0.00 44.72 42.93 2w5e s GLY 449 CO 0.08 -1.92 0.11 -0.11 0.00 0.00 0.00 173.10 171.26 2w5e s PHE 450 N -2.78 -0.04 0.00 1.90 -0.71 -0.31 -1.30 117.98 114.73 2w5e s PHE 450 Ca 0.30 0.11 -0.28 0.00 -1.04 0.00 0.00 56.93 56.01 2w5e s PHE 450 Cb 0.01 -0.01 -0.04 0.00 -1.21 0.00 0.00 43.02 41.78 2w5e s PHE 450 CO 0.13 -0.14 0.90 -0.06 -1.34 0.00 0.00 175.22 174.72 2w5e s PHE 451 N -0.49 3.66 -0.16 3.49 0.08 -0.55 -0.38 117.98 123.63 2w5e s PHE 451 Ca -0.06 1.59 -0.06 0.00 0.12 0.00 0.00 56.93 58.53 2w5e s PHE 451 Cb -0.04 -3.02 0.07 0.00 -0.57 0.00 0.00 43.02 39.46 2w5e s PHE 451 CO 0.00 0.06 0.33 0.45 -0.10 0.00 0.00 175.22 175.96 2w5e s SER 452 N 0.78 0.05 1.95 1.36 0.15 -0.66 -0.21 113.70 117.12 2w5e s SER 452 Ca 0.47 0.75 0.00 0.00 0.70 0.00 0.00 55.95 57.88 2w5e s SER 452 Cb -0.20 0.93 0.00 0.00 -1.71 0.00 0.00 66.02 65.03 2w5e s SER 452 CO 0.26 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.08 2w5e n GLY 453 N 5.25 3.62 0.96 9.45 0.00 -1.26 -1.12 105.19 122.09 2w5e n GLY 453 Ca -0.09 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 45.95 2w5e n GLY 453 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2w5e n ASN 454 N 5.87 2.83 -4.81 1.61 5.15 -1.26 -4.97 115.26 119.67 2w5e n ASN 454 Ca 0.00 -1.95 -0.22 0.00 -0.60 0.00 0.00 54.58 51.81 2w5e n ASN 454 Cb 0.00 -0.29 -0.05 0.00 -0.53 0.00 0.00 39.78 38.91 2w5e n ASN 454 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2w5e s ASP 455 N -1.22 5.48 -0.17 1.20 1.01 -0.28 -1.54 116.67 121.16 2w5e s ASP 455 Ca 0.36 -0.27 -0.03 0.00 0.71 0.00 0.00 52.55 53.32 2w5e s ASP 455 Cb 0.20 -1.38 -0.02 0.00 1.01 0.00 0.00 42.92 42.73 2w5e s ASP 455 CO 0.27 -0.03 -0.05 -0.63 0.21 0.00 0.00 175.17 174.94 2w5e s ILE 456 N -2.13 3.70 -0.05 0.77 1.01 0.23 -1.65 121.20 123.09 2w5e s ILE 456 Ca 0.33 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.58 2w5e s ILE 456 Cb -0.08 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2w5e s ILE 456 CO 0.25 0.48 -0.10 -0.69 0.00 0.00 0.00 174.94 174.88 2w5e s VAL 457 N 0.63 3.46 0.38 2.92 1.01 0.48 -0.29 120.40 129.00 2w5e s VAL 457 Ca -0.03 -0.63 -0.10 0.00 0.00 0.00 0.00 61.98 61.23 2w5e s VAL 457 Cb -0.15 -2.41 0.04 0.00 0.00 0.00 0.00 36.38 33.86 2w5e s VAL 457 CO 0.02 0.56 0.67 1.07 0.00 0.00 0.00 175.10 177.41 2w5e n THR 458 N 2.12 0.00 -2.57 3.92 5.66 -0.93 -1.16 114.28 121.32 2w5e n THR 458 Ca -0.17 -1.30 -0.39 0.00 -3.05 0.00 0.00 64.05 59.13 2w5e n THR 458 Cb 0.53 1.03 -0.05 0.00 -1.55 0.00 0.00 70.33 70.28 2w5e n THR 458 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2w5e s ALA 459 N -2.35 3.33 0.28 1.79 0.00 -1.26 -0.94 121.76 122.61 2w5e s ALA 459 Ca 0.21 0.78 0.02 0.00 0.00 0.00 0.00 51.96 52.97 2w5e s ALA 459 Cb -0.03 -3.28 0.62 0.00 0.00 0.00 0.00 23.12 20.43 2w5e s ALA 459 CO 0.15 -0.06 1.76 0.00 0.00 0.00 0.00 175.76 177.62 2w5e h ALA 460 N 3.66 1.43 0.00 0.00 0.00 -1.57 -1.90 119.26 120.87 2w5e h ALA 460 Ca -0.47 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2w5e h ALA 460 Cb 1.21 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2w5e h ALA 460 CO 0.66 -0.09 0.00 1.12 0.00 0.00 0.00 179.25 180.94 2w5e h HIS 461 N 0.66 0.00 -0.45 0.00 2.07 -1.93 0.70 115.15 116.20 2w5e h HIS 461 Ca 0.51 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.98 2w5e h HIS 461 Cb 0.77 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.74 2w5e h HIS 461 CO -0.07 0.00 0.07 0.28 -3.07 0.00 0.00 177.93 175.14 2w5e h VAL 462 N 0.00 1.25 0.22 6.12 2.07 -1.74 -3.29 116.25 120.88 2w5e h VAL 462 Ca 0.00 -0.92 -0.30 0.00 0.82 0.00 0.00 66.70 66.31 2w5e h VAL 462 Cb 0.51 0.97 0.03 0.00 -1.52 0.00 0.00 31.29 31.28 2w5e h VAL 462 CO 0.00 0.32 -1.30 0.58 0.02 0.00 0.00 177.57 177.19 2w5e h VAL 463 N 0.61 1.34 0.00 2.57 2.07 -1.40 -3.46 116.25 117.98 2w5e h VAL 463 Ca 0.14 -2.64 0.00 0.00 0.82 0.00 0.00 66.70 65.02 2w5e h VAL 463 Cb 0.40 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 2w5e h VAL 463 CO 0.01 0.78 0.00 0.61 0.02 0.00 0.00 177.57 178.99 2w5e n GLY 464 N 1.68 3.47 0.70 2.17 0.00 0.17 -2.48 105.19 110.89 2w5e n GLY 464 Ca -0.16 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 45.87 2w5e n GLY 464 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2w5e n ASN 465 N 5.36 2.19 -4.77 1.61 3.02 -1.26 -4.97 115.26 116.45 2w5e n ASN 465 Ca 0.00 -1.73 -0.40 0.00 -0.03 0.00 0.00 54.58 52.42 2w5e n ASN 465 Cb 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.18 2w5e n ASN 465 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2w5e s ASN 466 N -2.00 6.01 -0.05 6.41 -0.87 -1.04 -4.94 114.94 118.45 2w5e s ASN 466 Ca 0.33 2.90 0.18 0.00 -1.57 0.00 0.00 52.86 54.70 2w5e s ASN 466 Cb 0.21 -2.65 -0.22 0.00 -0.02 0.00 0.00 41.25 38.56 2w5e s ASN 466 CO 0.32 -1.08 0.49 0.35 -2.57 0.00 0.00 177.10 174.61 2w5e n THR 467 N -0.05 1.05 -4.24 1.60 -2.24 -1.26 -4.83 114.28 104.30 2w5e n THR 467 Ca 0.04 -0.72 -0.18 0.00 -2.27 0.00 0.00 64.05 60.93 2w5e n THR 467 Cb 0.42 -0.52 -0.13 0.00 -2.10 0.00 0.00 70.33 68.00 2w5e n THR 467 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2w5e s PHE 468 N -2.88 1.07 0.12 4.78 0.08 -1.26 -0.99 117.98 118.89 2w5e s PHE 468 Ca -0.06 -0.38 0.04 0.00 0.12 0.00 0.00 56.93 56.65 2w5e s PHE 468 Cb 0.09 -0.63 -0.04 0.00 -0.57 0.00 0.00 43.02 41.87 2w5e s PHE 468 CO 0.84 0.02 -0.11 0.14 -0.10 0.00 0.00 175.22 176.00 2w5e s VAL 469 N -0.99 1.09 0.07 -0.44 -7.23 0.09 -4.95 120.40 108.03 2w5e s VAL 469 Ca -0.01 -1.76 -0.23 0.00 -1.81 0.00 0.00 61.98 58.16 2w5e s VAL 469 Cb -0.08 -1.52 -0.06 0.00 0.56 0.00 0.00 36.38 35.27 2w5e s VAL 469 CO 0.01 -0.57 0.69 0.20 -0.31 0.00 0.00 175.10 175.12 2w5e s ASN 470 N -2.63 7.17 -0.11 4.85 0.01 -0.09 -0.84 114.94 123.29 2w5e s ASN 470 Ca 0.09 1.39 0.03 0.00 -0.71 0.00 0.00 52.86 53.66 2w5e s ASN 470 Cb -0.02 -2.43 0.01 0.00 0.41 0.00 0.00 41.25 39.22 2w5e s ASN 470 CO 0.01 0.13 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.84 2w5e s VAL 471 N -0.54 1.83 -0.19 1.60 1.01 0.52 -0.08 120.40 124.56 2w5e s VAL 471 Ca 0.34 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.41 2w5e s VAL 471 Cb -0.20 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 2w5e s VAL 471 CO 0.22 0.51 -0.01 0.00 0.00 0.00 0.00 175.10 175.81 2w5e s TYR 473 N 0.81 -0.49 -1.31 0.00 5.04 -0.78 -1.73 117.35 118.89 2w5e s TYR 473 Ca 0.00 1.07 -0.10 0.00 -2.44 0.00 0.00 57.07 55.60 2w5e s TYR 473 Cb -0.14 0.11 0.08 0.00 0.35 0.00 0.00 41.96 42.35 2w5e s TYR 473 CO 0.02 -0.34 0.51 0.39 -1.34 0.00 0.00 175.55 174.79 2w5e n GLU 474 N 4.79 -3.41 -0.56 4.97 -0.58 -1.26 -1.98 120.64 122.61 2w5e n GLU 474 Ca -0.16 0.47 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 2w5e n GLU 474 Cb 0.52 -5.18 0.00 0.00 -0.57 0.00 0.00 31.44 26.21 2w5e n GLU 474 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2w5e n GLY 475 N -1.19 0.78 3.36 0.62 0.00 -1.26 -5.05 105.19 102.44 2w5e n GLY 475 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2w5e n GLY 475 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2w5e s LEU 476 N 0.00 2.66 -0.00 0.99 2.96 -0.84 -5.11 118.68 119.33 2w5e s LEU 476 Ca 0.00 -0.34 -0.20 0.00 -0.22 0.00 0.00 54.13 53.36 2w5e s LEU 476 Cb 0.00 -1.59 -0.05 0.00 0.50 0.00 0.00 46.19 45.05 2w5e s LEU 476 CO 0.00 0.17 0.59 -0.04 -1.32 0.00 0.00 176.35 175.75 2w5e s MET 477 N 0.29 4.31 0.19 1.98 -1.94 -1.26 -1.86 119.30 121.01 2w5e s MET 477 Ca -0.11 0.72 0.10 0.00 -1.71 0.00 0.00 55.69 54.70 2w5e s MET 477 Cb -0.16 -3.34 -0.04 0.00 2.01 0.00 0.00 34.83 33.30 2w5e s MET 477 CO 0.06 0.38 -0.21 0.71 -0.01 0.00 0.00 175.02 175.94 2w5e s TYR 478 N -0.21 2.10 -0.14 -0.03 2.02 0.14 -4.93 117.35 116.30 2w5e s TYR 478 Ca 0.31 -0.40 -0.11 0.00 -0.37 0.00 0.00 57.07 56.49 2w5e s TYR 478 Cb -0.18 -1.02 -0.05 0.00 -0.40 0.00 0.00 41.96 40.31 2w5e s TYR 478 CO 0.17 0.46 0.23 -1.21 -1.57 0.00 0.00 175.55 173.63 2w5e s GLU 479 N -2.85 3.98 0.01 -0.62 2.02 -1.26 -0.35 118.70 119.63 2w5e s GLU 479 Ca 0.20 0.01 0.02 0.00 0.02 0.00 0.00 54.97 55.22 2w5e s GLU 479 Cb -0.06 -3.33 -0.01 0.00 0.10 0.00 0.00 34.13 30.82 2w5e s GLU 479 CO 0.09 0.46 -0.06 0.00 0.02 0.00 0.00 175.26 175.77 2w5e s ALA 480 N -0.16 0.50 -0.10 5.21 0.00 -0.02 -4.79 121.76 122.40 2w5e s ALA 480 Ca 0.15 -0.42 -0.17 0.00 0.00 0.00 0.00 51.96 51.53 2w5e s ALA 480 Cb -0.13 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 22.88 2w5e s ALA 480 CO 0.04 0.07 0.43 0.21 0.00 0.00 0.00 175.76 176.51 2w5e s LYS 481 N -0.62 4.24 0.05 0.00 2.20 -1.26 -0.73 119.74 123.62 2w5e s LYS 481 Ca -0.02 0.39 -0.31 0.00 -0.36 0.00 0.00 55.97 55.67 2w5e s LYS 481 Cb -0.05 -3.39 -0.07 0.00 -1.51 0.00 0.00 37.83 32.81 2w5e s LYS 481 CO 0.00 0.29 1.51 0.08 -0.36 0.00 0.00 175.35 176.87 2w5e s VAL 482 N 0.22 3.35 -0.22 4.02 1.01 -0.16 -1.19 120.40 127.43 2w5e s VAL 482 Ca 0.24 0.81 -0.18 0.00 0.00 0.00 0.00 61.98 62.85 2w5e s VAL 482 Cb -0.15 -3.52 -0.18 0.00 0.00 0.00 0.00 36.38 32.53 2w5e s VAL 482 CO 0.10 0.01 0.06 -1.14 0.00 0.00 0.00 175.10 174.13 2w5e n ARG 483 N 5.26 0.59 -3.69 2.72 0.63 0.12 -4.86 116.66 117.43 2w5e n ARG 483 Ca 0.14 0.46 -0.11 0.00 -0.92 0.00 0.00 57.85 57.42 2w5e n ARG 483 Cb 0.42 -1.67 -0.10 0.00 0.45 0.00 0.00 32.46 31.56 2w5e n ARG 483 CO 0.00 0.00 0.00 -0.47 -2.51 0.00 0.00 177.63 174.65 2w5e s TYR 484 N -2.42 -0.65 -0.42 -0.14 5.04 -0.78 -5.02 117.35 112.96 2w5e s TYR 484 Ca -0.31 1.40 0.03 0.00 -2.44 0.00 0.00 57.07 55.74 2w5e s TYR 484 Cb 0.08 0.30 0.12 0.00 0.35 0.00 0.00 41.96 42.81 2w5e s TYR 484 CO 0.58 -0.35 0.18 -1.64 -1.34 0.00 0.00 175.55 172.98 2w5e s MET 485 N 1.15 1.48 1.00 4.97 -1.94 -1.26 -1.20 119.30 123.50 2w5e s MET 485 Ca -0.07 -2.04 -0.17 0.00 -1.71 0.00 0.00 55.69 51.69 2w5e s MET 485 Cb -0.07 -2.84 0.24 0.00 2.01 0.00 0.00 34.83 34.18 2w5e s MET 485 CO -0.10 -1.06 1.04 -0.35 -0.01 0.00 0.00 175.02 174.53 2w5e n PRO 486 N 3.77 -2.25 -0.25 2.03 -0.04 -1.26 -4.97 135.00 132.02 2w5e n PRO 486 Ca 0.05 -1.64 -0.07 0.00 -0.04 0.00 0.00 63.50 61.79 2w5e n PRO 486 Cb 0.37 -1.35 0.05 0.00 -0.04 0.00 0.00 33.50 32.52 2w5e n PRO 486 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2w5e h GLU 487 N 0.00 1.13 -6.85 0.54 4.81 -1.97 -3.44 114.58 108.80 2w5e h GLU 487 Ca -0.37 -0.27 -0.57 0.00 -0.13 0.00 0.00 59.36 58.02 2w5e h GLU 487 Cb 1.08 -0.15 0.16 0.00 0.63 0.00 0.00 28.75 30.47 2w5e h GLU 487 CO 0.25 0.99 0.19 1.63 -0.73 0.00 0.00 179.01 181.34 2w5e n LYS 488 N -4.25 1.03 -0.83 1.92 5.02 -1.26 -4.86 118.16 114.94 2w5e n LYS 488 Ca 0.05 0.39 -0.11 0.00 -2.02 0.00 0.00 58.31 56.63 2w5e n LYS 488 Cb 0.26 -2.21 -0.13 0.00 -0.02 0.00 0.00 35.03 32.92 2w5e n LYS 488 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2w5e n ASP 489 N -0.73 4.40 -4.29 4.39 8.00 -1.26 -4.79 116.55 122.27 2w5e n ASP 489 Ca 0.13 -2.31 -0.24 0.00 0.71 0.00 0.00 54.79 53.09 2w5e n ASP 489 Cb 0.46 -1.17 -0.12 0.00 -0.02 0.00 0.00 41.12 40.27 2w5e n ASP 489 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2w5e s ILE 490 N 1.43 1.73 -0.02 0.53 1.01 -1.26 -1.82 121.20 122.80 2w5e s ILE 490 Ca 0.55 -1.57 0.06 0.00 0.00 0.00 0.00 60.65 59.68 2w5e s ILE 490 Cb 0.26 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 41.13 2w5e s ILE 490 CO -0.00 -0.07 -0.18 0.00 0.00 0.00 0.00 174.94 174.68 2w5e s ALA 491 N -1.21 1.53 -0.19 9.38 0.00 -0.11 -4.13 121.76 127.02 2w5e s ALA 491 Ca 0.07 -0.78 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 2w5e s ALA 491 Cb -0.10 -0.40 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 2w5e s ALA 491 CO 0.04 0.37 -0.09 -0.06 0.00 0.00 0.00 175.76 176.02 2w5e s PHE 492 N -0.39 2.89 -0.13 0.00 0.08 -0.34 -2.18 117.98 117.91 2w5e s PHE 492 Ca 0.06 -1.03 0.00 0.00 0.12 0.00 0.00 56.93 56.08 2w5e s PHE 492 Cb -0.07 -2.02 -0.01 0.00 -0.57 0.00 0.00 43.02 40.34 2w5e s PHE 492 CO -0.00 -0.54 -0.14 0.42 -0.10 0.00 0.00 175.22 174.85 2w5e s ILE 493 N 1.23 2.97 0.03 0.64 1.01 0.61 0.14 121.20 127.82 2w5e s ILE 493 Ca 0.03 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.68 2w5e s ILE 493 Cb -0.14 -2.24 -0.07 0.00 0.01 0.00 0.00 42.46 40.02 2w5e s ILE 493 CO -0.04 0.53 1.68 -0.89 0.00 0.00 0.00 174.94 176.22 2w5e s THR 494 N 0.35 3.22 0.14 2.92 2.01 -0.33 0.78 115.64 124.72 2w5e s THR 494 Ca -0.12 0.51 -0.31 0.00 0.31 0.00 0.00 61.69 62.08 2w5e s THR 494 Cb -0.16 -3.33 -0.09 0.00 0.01 0.00 0.00 72.50 68.92 2w5e s THR 494 CO 0.06 -0.02 1.57 0.00 -0.69 0.00 0.00 174.62 175.54 2w5e n PRO 496 N 4.33 1.73 0.26 0.00 -0.02 -1.26 -4.88 135.00 135.15 2w5e n PRO 496 Ca 0.14 0.61 0.09 0.00 -2.02 0.00 0.00 63.50 62.32 2w5e n PRO 496 Cb 0.39 -2.21 0.67 0.00 -0.02 0.00 0.00 33.50 32.33 2w5e n PRO 496 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2w5e h GLY 497 N 1.99 0.00 -0.32 -1.23 0.00 -1.95 -2.26 103.07 99.31 2w5e h GLY 497 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2w5e h GLY 497 CO 0.59 0.00 -0.23 2.09 0.00 0.00 0.00 176.54 178.99 2w5e n ASP 498 N -4.43 1.47 -4.49 0.19 5.75 -1.26 -4.78 116.55 109.01 2w5e n ASP 498 Ca -0.03 -1.22 -0.43 0.00 -0.01 0.00 0.00 54.79 53.10 2w5e n ASP 498 Cb 0.10 0.17 -0.07 0.00 -1.03 0.00 0.00 41.12 40.29 2w5e n ASP 498 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2w5e s LEU 499 N -2.36 4.71 -0.61 -2.12 2.96 -0.85 -5.02 118.68 115.39 2w5e s LEU 499 Ca 0.26 -0.60 -0.04 0.00 -0.22 0.00 0.00 54.13 53.52 2w5e s LEU 499 Cb 0.19 -2.58 0.16 0.00 0.50 0.00 0.00 46.19 44.47 2w5e s LEU 499 CO 0.48 -0.81 0.44 -1.00 -1.32 0.00 0.00 176.35 174.14 2w5e s HIS 500 N 2.70 3.47 0.49 5.38 3.76 -1.26 -4.76 115.29 125.06 2w5e s HIS 500 Ca 0.19 -2.55 -0.22 0.00 -0.15 0.00 0.00 55.06 52.33 2w5e s HIS 500 Cb -0.16 -3.29 -0.07 0.00 1.11 0.00 0.00 32.58 30.17 2w5e s HIS 500 CO 0.16 -0.88 1.14 -1.25 -0.85 0.00 0.00 174.74 173.05 2w5e s PRO 501 N 0.19 3.65 0.14 8.40 0.04 -1.26 -4.93 135.00 141.24 2w5e s PRO 501 Ca 0.15 1.68 0.27 0.00 0.04 0.00 0.00 61.00 63.13 2w5e s PRO 501 Cb -0.20 -2.26 0.95 0.00 0.04 0.00 0.00 34.50 33.03 2w5e s PRO 501 CO -0.04 -0.62 1.81 0.25 0.04 0.00 0.00 177.00 178.44 2w5e n THR 502 N -0.77 0.44 -3.61 1.26 -2.24 -1.26 -4.85 114.28 103.26 2w5e n THR 502 Ca 0.09 -0.15 -0.16 0.00 -2.27 0.00 0.00 64.05 61.55 2w5e n THR 502 Cb 0.49 -0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 2w5e n THR 502 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w5e s ALA 503 N -3.08 -1.42 0.08 6.98 0.00 -1.26 -4.97 121.76 118.10 2w5e s ALA 503 Ca 0.11 0.98 0.03 0.00 0.00 0.00 0.00 51.96 53.08 2w5e s ALA 503 Cb 0.14 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2w5e s ALA 503 CO 0.55 -0.33 -0.08 1.03 0.00 0.00 0.00 175.76 176.93 2w5e s ARG 504 N -1.21 0.77 -0.14 0.00 0.52 -1.26 -3.90 118.95 113.73 2w5e s ARG 504 Ca -0.12 -1.14 -0.10 0.00 -0.52 0.00 0.00 55.73 53.86 2w5e s ARG 504 Cb -0.02 -0.34 -0.05 0.00 0.52 0.00 0.00 34.95 35.06 2w5e s ARG 504 CO 0.08 0.03 0.18 -0.51 0.02 0.00 0.00 175.30 175.10 2w5e s LEU 505 N -2.49 4.31 0.21 2.53 1.43 0.70 -4.97 118.68 120.41 2w5e s LEU 505 Ca 0.04 0.43 0.02 0.00 -1.03 0.00 0.00 54.13 53.60 2w5e s LEU 505 Cb -0.01 -2.16 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 2w5e s LEU 505 CO -0.02 0.28 0.37 -0.54 0.23 0.00 0.00 176.35 176.67 2w5e s LYS 506 N -0.35 3.47 0.49 1.70 1.02 -1.26 -4.37 119.74 120.44 2w5e s LYS 506 Ca 0.13 -0.55 -0.08 0.00 0.02 0.00 0.00 55.97 55.49 2w5e s LYS 506 Cb -0.12 -2.87 -0.05 0.00 -0.52 0.00 0.00 37.83 34.27 2w5e s LYS 506 CO 0.03 0.42 0.84 -0.51 -0.92 0.00 0.00 175.35 175.20 2w5e s LEU 507 N -3.61 3.61 0.09 3.17 1.02 -1.26 -0.98 118.68 120.72 2w5e s LEU 507 Ca 0.36 1.11 -0.25 0.00 0.02 0.00 0.00 54.13 55.37 2w5e s LEU 507 Cb -0.10 -4.06 -0.06 0.00 0.02 0.00 0.00 46.19 41.98 2w5e s LEU 507 CO 0.30 -0.58 0.77 -0.55 0.02 0.00 0.00 176.35 176.30 2w5e s SER 508 N -3.80 7.28 -0.08 2.29 0.15 -1.24 -4.82 113.70 113.48 2w5e s SER 508 Ca 0.50 1.52 -0.20 0.00 0.70 0.00 0.00 55.95 58.48 2w5e s SER 508 Cb -0.10 -2.48 -0.29 0.00 -1.71 0.00 0.00 66.02 61.43 2w5e s SER 508 CO 0.42 0.09 0.75 0.11 1.20 0.00 0.00 173.24 175.81 2w5e h LYS 509 N 5.16 0.26 -3.17 5.44 1.57 -1.97 -3.41 116.57 120.45 2w5e h LYS 509 Ca -0.45 -0.44 -0.67 0.00 -1.87 0.00 0.00 60.65 57.22 2w5e h LYS 509 Cb 1.21 0.16 -0.38 0.00 0.08 0.00 0.00 32.23 33.30 2w5e h LYS 509 CO 0.69 1.21 -0.27 0.09 -0.57 0.00 0.00 179.45 180.60 2w5e n ASN 510 N -4.08 3.80 -4.66 0.86 3.02 -1.26 -5.08 115.26 107.85 2w5e n ASN 510 Ca -0.18 -3.18 -0.43 0.00 -0.03 0.00 0.00 54.58 50.76 2w5e n ASN 510 Cb 0.83 -0.93 -0.02 0.00 -0.61 0.00 0.00 39.78 39.05 2w5e n ASN 510 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 2w5e s PRO 511 N -1.50 4.23 -0.43 3.52 0.02 -1.26 -4.99 135.00 134.58 2w5e s PRO 511 Ca 0.27 1.85 -0.13 0.00 0.02 0.00 0.00 61.00 63.01 2w5e s PRO 511 Cb -0.05 -3.80 0.06 0.00 0.02 0.00 0.00 34.50 30.73 2w5e s PRO 511 CO -0.13 -0.72 0.30 0.34 -0.33 0.00 0.00 177.00 176.46 2w5e s ASP 512 N 2.35 5.92 0.00 2.53 2.15 -1.26 -4.96 116.67 123.40 2w5e s ASP 512 Ca 0.61 -1.24 0.31 0.00 0.43 0.00 0.00 52.55 52.66 2w5e s ASP 512 Cb -0.26 -2.09 1.60 0.00 -0.30 0.00 0.00 42.92 41.87 2w5e s ASP 512 CO 0.21 -0.53 2.06 -1.22 -0.17 0.00 0.00 175.17 175.51 2w5e n TYR 513 N 5.08 0.00 0.19 -5.34 4.01 -1.26 -4.21 117.16 115.63 2w5e n TYR 513 Ca -0.11 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.66 2w5e n TYR 513 Cb 0.44 -0.00 0.36 0.00 -0.31 0.00 0.00 39.34 39.83 2w5e n TYR 513 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2w5e h SER 514 N 0.81 0.00 -5.05 7.72 4.64 -1.93 -3.38 113.55 116.35 2w5e h SER 514 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2w5e h SER 514 Cb 0.18 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.09 2w5e h SER 514 CO 0.00 0.38 -0.38 0.00 -0.87 0.00 0.00 176.83 175.97 2w5e s VAL 516 N -2.37 0.19 -0.11 0.00 -7.23 0.54 -4.08 120.40 107.34 2w5e s VAL 516 Ca -0.07 -1.87 0.03 0.00 -1.81 0.00 0.00 61.98 58.27 2w5e s VAL 516 Cb -0.02 -1.79 0.01 0.00 0.56 0.00 0.00 36.38 35.14 2w5e s VAL 516 CO -0.03 -0.73 -0.20 -0.89 -0.31 0.00 0.00 175.10 172.94 2w5e s THR 517 N -3.97 1.84 -0.14 5.32 2.01 0.64 -1.59 115.64 119.75 2w5e s THR 517 Ca 0.16 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.27 2w5e s THR 517 Cb 0.08 -1.62 -0.02 0.00 0.01 0.00 0.00 72.50 70.94 2w5e s THR 517 CO -0.04 0.51 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.62 2w5e s VAL 518 N 0.62 3.45 -0.05 3.82 1.01 0.52 -0.24 120.40 129.53 2w5e s VAL 518 Ca -0.13 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.37 2w5e s VAL 518 Cb -0.16 -2.48 -0.00 0.00 0.00 0.00 0.00 36.38 33.74 2w5e s VAL 518 CO 0.04 0.51 -0.19 -0.04 0.00 0.00 0.00 175.10 175.42 2w5e s MET 519 N 0.30 2.06 -0.02 2.72 -1.94 -1.14 -1.72 119.30 119.56 2w5e s MET 519 Ca -0.07 -0.68 -0.24 0.00 -1.71 0.00 0.00 55.69 52.99 2w5e s MET 519 Cb -0.15 -1.74 0.05 0.00 2.01 0.00 0.00 34.83 35.00 2w5e s MET 519 CO 0.04 0.25 0.52 0.00 -0.01 0.00 0.00 175.02 175.82 2w5e s ALA 520 N 0.07 -1.33 -0.22 3.03 0.00 -0.71 -3.67 121.76 118.93 2w5e s ALA 520 Ca -0.06 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.55 2w5e s ALA 520 Cb -0.13 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 2w5e s ALA 520 CO 0.03 -0.36 0.48 0.71 0.00 0.00 0.00 175.76 176.62 2w5e s TYR 521 N -1.50 3.35 -0.25 0.00 2.02 -1.26 -0.48 117.35 119.22 2w5e s TYR 521 Ca -0.11 0.69 0.02 0.00 -0.37 0.00 0.00 57.07 57.30 2w5e s TYR 521 Cb -0.02 -2.64 0.06 0.00 -0.40 0.00 0.00 41.96 38.97 2w5e s TYR 521 CO 0.06 -0.12 -0.07 0.08 -1.57 0.00 0.00 175.55 173.93 2w5e s VAL 522 N 1.70 1.86 0.00 0.71 1.01 0.77 -4.75 120.40 121.70 2w5e s VAL 522 Ca 0.22 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.71 2w5e s VAL 522 Cb -0.15 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.15 2w5e s VAL 522 CO 0.09 -0.11 0.00 0.59 0.00 0.00 0.00 175.10 175.67 2w5e n ASN 523 N 4.54 0.00 0.01 3.32 3.02 -1.26 -1.46 115.26 123.41 2w5e n ASN 523 Ca -0.12 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.56 2w5e n ASN 523 Cb 0.43 0.00 0.31 0.00 -0.61 0.00 0.00 39.78 39.91 2w5e n ASN 523 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2w5e n GLU 524 N 12.59 0.03 -4.18 3.52 1.02 -1.26 -4.97 120.64 127.39 2w5e n GLU 524 Ca 0.00 0.01 -0.31 0.00 -0.02 0.00 0.00 57.16 56.83 2w5e n GLU 524 Cb 0.00 -1.52 -0.08 0.00 -0.02 0.00 0.00 31.44 29.82 2w5e n GLU 524 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2w5e s ASP 525 N -3.11 5.23 0.15 1.62 1.01 -0.54 -5.10 116.67 115.93 2w5e s ASP 525 Ca 0.11 -0.04 -0.30 0.00 0.71 0.00 0.00 52.55 53.03 2w5e s ASP 525 Cb 0.17 -1.36 -0.07 0.00 1.01 0.00 0.00 42.92 42.68 2w5e s ASP 525 CO 0.67 0.23 1.02 -0.22 0.21 0.00 0.00 175.17 177.07 2w5e s LEU 526 N -1.95 4.51 -0.13 1.23 2.96 -1.26 -0.17 118.68 123.88 2w5e s LEU 526 Ca 0.24 1.93 -0.01 0.00 -0.22 0.00 0.00 54.13 56.07 2w5e s LEU 526 Cb -0.12 -3.60 0.03 0.00 0.50 0.00 0.00 46.19 43.01 2w5e s LEU 526 CO 0.15 -0.11 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.35 2w5e s VAL 527 N -0.21 0.81 -0.08 1.68 1.01 0.36 -4.91 120.40 119.07 2w5e s VAL 527 Ca 0.47 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.19 2w5e s VAL 527 Cb -0.26 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 2w5e s VAL 527 CO 0.32 0.20 -0.23 -0.69 0.00 0.00 0.00 175.10 174.70 2w5e s VAL 528 N 1.78 1.94 -0.04 2.92 1.01 -1.26 -1.74 120.40 125.01 2w5e s VAL 528 Ca 0.03 -0.98 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 2w5e s VAL 528 Cb -0.14 -1.67 0.02 0.00 0.00 0.00 0.00 36.38 34.59 2w5e s VAL 528 CO -0.07 0.54 0.27 -0.94 0.00 0.00 0.00 175.10 174.90 2w5e s SER 529 N 0.15 -0.18 0.28 3.32 1.04 -0.70 -5.00 113.70 112.62 2w5e s SER 529 Ca -0.12 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.45 2w5e s SER 529 Cb -0.16 0.37 -0.05 0.00 0.10 0.00 0.00 66.02 66.29 2w5e s SER 529 CO 0.06 -0.34 0.52 0.42 0.98 0.00 0.00 173.24 174.89 2w5e s THR 530 N -0.93 5.07 0.08 2.02 -4.23 -1.26 -0.35 115.64 116.04 2w5e s THR 530 Ca -0.10 -0.13 -0.24 0.00 -1.18 0.00 0.00 61.69 60.04 2w5e s THR 530 Cb -0.05 -3.76 0.06 0.00 1.34 0.00 0.00 72.50 70.09 2w5e s THR 530 CO 0.03 -0.34 0.57 0.00 -0.54 0.00 0.00 174.62 174.34 2w5e s ALA 531 N -2.09 -1.49 0.46 3.99 0.00 -0.62 -4.96 121.76 117.04 2w5e s ALA 531 Ca 0.42 0.65 -0.20 0.00 0.00 0.00 0.00 51.96 52.83 2w5e s ALA 531 Cb -0.11 0.52 -0.10 0.00 0.00 0.00 0.00 23.12 23.44 2w5e s ALA 531 CO 0.31 -0.59 0.99 0.00 0.00 0.00 0.00 175.76 176.47 2w5e s ALA 532 N -2.80 2.98 0.08 0.00 0.00 -1.26 -0.34 121.76 120.42 2w5e s ALA 532 Ca -0.03 0.46 0.02 0.00 0.00 0.00 0.00 51.96 52.41 2w5e s ALA 532 Cb -0.00 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 2w5e s ALA 532 CO -0.04 -0.07 -0.08 0.00 0.00 0.00 0.00 175.76 175.57 2w5e s ALA 533 N -2.15 0.90 0.02 0.00 0.00 -0.57 -4.33 121.76 115.63 2w5e s ALA 533 Ca 0.64 -1.13 0.06 0.00 0.00 0.00 0.00 51.96 51.53 2w5e s ALA 533 Cb -0.12 0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.07 2w5e s ALA 533 CO 0.17 -0.11 -0.19 0.00 0.00 0.00 0.00 175.76 175.63 2w5e s MET 534 N -2.85 1.38 -0.11 0.00 0.23 0.10 -4.50 119.30 113.55 2w5e s MET 534 Ca 0.03 -0.80 -0.12 0.00 -1.03 0.00 0.00 55.69 53.77 2w5e s MET 534 Cb -0.02 -1.41 -0.05 0.00 -1.53 0.00 0.00 34.83 31.82 2w5e s MET 534 CO -0.02 0.37 0.28 0.08 -2.03 0.00 0.00 175.02 173.71 2w5e s VAL 535 N -0.65 5.28 -0.32 5.16 1.01 -1.26 -0.72 120.40 128.90 2w5e s VAL 535 Ca 0.07 0.54 -0.01 0.00 0.00 0.00 0.00 61.98 62.58 2w5e s VAL 535 Cb -0.08 -3.60 0.11 0.00 0.00 0.00 0.00 36.38 32.81 2w5e s VAL 535 CO 0.01 0.49 0.12 -0.31 0.00 0.00 0.00 175.10 175.40 2w5e s TYR 536 N -0.25 1.62 0.00 5.22 2.02 -0.07 -5.01 117.35 120.88 2w5e s TYR 536 Ca 0.18 -1.75 0.00 0.00 -0.37 0.00 0.00 57.07 55.12 2w5e s TYR 536 Cb -0.14 -1.66 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 2w5e s TYR 536 CO 0.06 -0.86 0.00 0.41 -1.57 0.00 0.00 175.55 173.59 2w5e n GLY 537 N 4.71 3.25 0.63 0.71 0.00 -1.26 -1.37 105.19 111.86 2w5e n GLY 537 Ca -0.01 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2w5e n GLY 537 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2w5e n ASN 538 N 9.82 1.90 -4.60 1.61 4.13 -1.26 -4.94 115.26 121.92 2w5e n ASN 538 Ca 0.00 -1.71 -0.29 0.00 1.68 0.00 0.00 54.58 54.26 2w5e n ASN 538 Cb 0.00 -0.09 -0.09 0.00 -1.54 0.00 0.00 39.78 38.06 2w5e n ASN 538 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2w5e s THR 539 N -1.82 3.45 -0.04 3.41 2.01 -0.47 -1.05 115.64 121.12 2w5e s THR 539 Ca 0.34 -1.31 0.07 0.00 0.31 0.00 0.00 61.69 61.10 2w5e s THR 539 Cb 0.19 -2.64 -0.01 0.00 0.01 0.00 0.00 72.50 70.04 2w5e s THR 539 CO 0.29 0.06 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.81 2w5e s LEU 540 N -2.38 2.04 -0.01 4.42 2.96 -0.04 -0.89 118.68 124.78 2w5e s LEU 540 Ca 0.23 -0.46 0.07 0.00 -0.22 0.00 0.00 54.13 53.75 2w5e s LEU 540 Cb -0.11 -1.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 2w5e s LEU 540 CO 0.15 0.27 -0.24 -0.44 -1.32 0.00 0.00 176.35 174.77 2w5e s SER 541 N -0.37 2.80 0.08 3.68 0.01 0.10 -1.29 113.70 118.70 2w5e s SER 541 Ca 0.04 -0.44 -0.26 0.00 1.31 0.00 0.00 55.95 56.60 2w5e s SER 541 Cb -0.11 -0.31 0.08 0.00 0.21 0.00 0.00 66.02 65.89 2w5e s SER 541 CO 0.01 0.29 0.69 -0.72 0.41 0.00 0.00 173.24 173.92 2w5e s TYR 542 N -0.58 -0.51 0.33 2.43 -0.85 -1.03 -0.72 117.35 116.43 2w5e s TYR 542 Ca 0.09 0.45 -0.27 0.00 -0.52 0.00 0.00 57.07 56.83 2w5e s TYR 542 Cb -0.09 0.53 -0.09 0.00 0.38 0.00 0.00 41.96 42.68 2w5e s TYR 542 CO -0.01 -0.72 1.08 0.00 -1.52 0.00 0.00 175.55 174.38 2w5e s ALA 543 N -3.06 3.26 0.32 9.51 0.00 -1.26 0.61 121.76 131.14 2w5e s ALA 543 Ca -0.00 0.81 0.09 0.00 0.00 0.00 0.00 51.96 52.86 2w5e s ALA 543 Cb -0.01 -3.30 -0.06 0.00 0.00 0.00 0.00 23.12 19.75 2w5e s ALA 543 CO -0.08 -0.19 -0.11 0.14 0.00 0.00 0.00 175.76 175.53 2w5e s VAL 544 N -1.37 2.16 -2.56 0.00 -7.23 0.07 -4.78 120.40 106.70 2w5e s VAL 544 Ca 0.50 -2.23 0.21 0.00 -1.81 0.00 0.00 61.98 58.66 2w5e s VAL 544 Cb -0.28 -2.53 0.15 0.00 0.56 0.00 0.00 36.38 34.28 2w5e s VAL 544 CO 0.35 -0.26 1.15 0.54 -0.31 0.00 0.00 175.10 176.57 2w5e n ARG 545 N -0.71 1.88 -3.82 4.82 5.12 -1.26 -4.80 116.66 117.89 2w5e n ARG 545 Ca -0.05 -1.68 -0.11 0.00 -1.93 0.00 0.00 57.85 54.08 2w5e n ARG 545 Cb 0.63 -1.40 -0.09 0.00 -1.16 0.00 0.00 32.46 30.44 2w5e n ARG 545 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2w5e s THR 546 N -1.80 0.09 -0.55 0.55 -1.32 -1.26 -5.04 115.64 106.31 2w5e s THR 546 Ca 0.24 -0.74 0.22 0.00 -1.21 0.00 0.00 61.69 60.21 2w5e s THR 546 Cb 0.17 -0.77 -0.19 0.00 -1.51 0.00 0.00 72.50 70.20 2w5e s THR 546 CO 0.29 -0.40 0.86 0.00 -2.21 0.00 0.00 174.62 173.16 2w5e n GLN 547 N 0.93 0.32 -0.63 7.08 6.02 -1.26 -4.87 117.38 124.96 2w5e n GLN 547 Ca -0.20 -0.05 -0.30 0.00 -0.01 0.00 0.00 57.00 56.44 2w5e n GLN 547 Cb 0.58 -1.56 0.28 0.00 1.02 0.00 0.00 30.24 30.55 2w5e n GLN 547 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2w5e n ASP 548 N -1.94 -3.17 -4.67 1.08 8.00 -1.26 -4.89 116.55 109.70 2w5e n ASP 548 Ca 0.01 -1.03 -0.42 0.00 0.71 0.00 0.00 54.79 54.06 2w5e n ASP 548 Cb 0.45 -1.01 -0.03 0.00 -0.02 0.00 0.00 41.12 40.51 2w5e n ASP 548 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2w5e s GLY 549 N -3.79 1.53 0.00 0.44 0.00 -1.26 -4.87 107.32 99.36 2w5e s GLY 549 Ca 0.70 1.06 0.00 0.00 0.00 0.00 0.00 44.72 46.48 2w5e s GLY 549 CO 0.56 3.08 0.61 1.03 0.00 0.00 0.00 173.10 178.38 2w5e n MET 550 N 6.88 0.63 -1.61 2.90 2.81 -1.26 -4.48 117.12 122.98 2w5e n MET 550 Ca 0.17 -0.78 -0.50 0.00 -1.81 0.00 0.00 57.70 54.78 2w5e n MET 550 Cb 0.42 -0.88 -0.05 0.00 -0.71 0.00 0.00 33.22 32.00 2w5e n MET 550 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2w5e n SER 551 N -0.17 2.08 0.00 7.83 7.64 -1.26 -1.63 113.62 128.11 2w5e n SER 551 Ca 0.00 1.11 0.00 0.00 1.01 0.00 0.00 58.87 60.99 2w5e n SER 551 Cb 0.17 -1.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.11 2w5e n SER 551 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2w5e n GLY 552 N 2.73 2.89 3.57 0.23 0.00 -0.31 -0.54 105.19 113.76 2w5e n GLY 552 Ca 0.17 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.71 2w5e n GLY 552 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w5e n ALA 553 N -1.42 -0.92 -1.97 4.61 0.00 -0.64 -4.48 120.51 115.68 2w5e n ALA 553 Ca 0.00 0.46 -0.41 0.00 0.00 0.00 0.00 53.44 53.50 2w5e n ALA 553 Cb 0.00 -2.01 -0.04 0.00 0.00 0.00 0.00 19.45 17.41 2w5e n ALA 553 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2w5e s PRO 554 N -0.42 4.53 -0.34 0.00 0.04 -1.24 -0.44 135.00 137.12 2w5e s PRO 554 Ca 0.73 1.87 -0.08 0.00 0.04 0.00 0.00 61.00 63.56 2w5e s PRO 554 Cb -0.86 -3.22 0.03 0.00 0.04 0.00 0.00 34.50 30.49 2w5e s PRO 554 CO 0.53 -0.01 0.13 0.08 0.04 0.00 0.00 177.00 177.77 2w5e s VAL 555 N -0.40 4.02 0.20 -0.36 1.01 0.08 -2.89 120.40 122.06 2w5e s VAL 555 Ca 0.50 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 61.52 2w5e s VAL 555 Cb -0.33 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 2w5e s VAL 555 CO 0.39 -0.17 0.20 0.00 0.00 0.00 0.00 175.10 175.52 2w5e n ASP 557 N -0.76 -1.22 0.06 0.00 5.68 0.31 -0.26 116.55 120.36 2w5e n ASP 557 Ca -0.08 -1.17 0.08 0.00 -0.50 0.00 0.00 54.79 53.12 2w5e n ASP 557 Cb 0.56 -0.83 0.35 0.00 -1.14 0.00 0.00 41.12 40.06 2w5e n ASP 557 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2w5e n LYS 558 N -3.93 0.08 -0.13 0.11 2.85 -1.26 -1.57 118.16 114.31 2w5e n LYS 558 Ca 0.13 0.41 0.08 0.00 -1.05 0.00 0.00 58.31 57.88 2w5e n LYS 558 Cb 0.48 -1.68 0.15 0.00 -0.65 0.00 0.00 35.03 33.32 2w5e n LYS 558 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2w5e n TYR 559 N -1.84 0.34 -0.73 5.58 4.01 -1.26 0.25 117.16 123.50 2w5e n TYR 559 Ca 0.02 -0.25 0.00 0.00 -0.16 0.00 0.00 57.90 57.51 2w5e n TYR 559 Cb 0.14 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 2w5e n TYR 559 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2w5e s ARG 561 N -0.27 4.46 0.01 0.00 1.81 -1.26 -4.66 118.95 119.04 2w5e s ARG 561 Ca 0.00 1.02 -0.30 0.00 -1.72 0.00 0.00 55.73 54.73 2w5e s ARG 561 Cb 0.00 -3.29 -0.05 0.00 -0.45 0.00 0.00 34.95 31.17 2w5e s ARG 561 CO 0.00 0.51 1.20 0.54 -0.68 0.00 0.00 175.30 176.87 2w5e s VAL 562 N -0.83 4.14 -0.17 3.52 0.11 -0.15 -0.53 120.40 126.49 2w5e s VAL 562 Ca 0.35 1.51 0.16 0.00 -2.93 0.00 0.00 61.98 61.07 2w5e s VAL 562 Cb -0.21 -3.97 -0.22 0.00 -1.53 0.00 0.00 36.38 30.44 2w5e s VAL 562 CO 0.23 0.07 0.07 0.18 -3.33 0.00 0.00 175.10 172.32 2w5e n LEU 563 N 4.49 0.00 -3.69 2.54 4.77 0.87 -3.74 117.00 122.25 2w5e n LEU 563 Ca 0.10 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 2w5e n LEU 563 Cb 0.46 0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 41.96 2w5e n LEU 563 CO 0.55 0.43 0.50 0.00 -1.33 0.00 0.00 177.39 177.55 2w5e s ALA 564 N -2.45 -1.44 -0.19 -1.18 0.00 -0.92 -1.49 121.76 114.09 2w5e s ALA 564 Ca -0.09 0.09 -0.00 0.00 0.00 0.00 0.00 51.96 51.97 2w5e s ALA 564 Cb 0.05 0.80 0.01 0.00 0.00 0.00 0.00 23.12 23.98 2w5e s ALA 564 CO 0.73 -0.93 -0.16 0.08 0.00 0.00 0.00 175.76 175.48 2w5e s VAL 565 N -3.71 2.40 0.20 0.00 1.01 -0.55 -0.74 120.40 119.01 2w5e s VAL 565 Ca 0.08 -0.83 -0.32 0.00 0.00 0.00 0.00 61.98 60.91 2w5e s VAL 565 Cb -0.03 -2.03 -0.11 0.00 0.00 0.00 0.00 36.38 34.20 2w5e s VAL 565 CO -0.01 0.51 1.67 -2.28 0.00 0.00 0.00 175.10 175.00 2w5e s HIS 566 N 1.29 2.94 -0.07 5.22 2.46 0.42 -1.94 115.29 125.60 2w5e s HIS 566 Ca 0.04 0.45 -0.10 0.00 0.47 0.00 0.00 55.06 55.92 2w5e s HIS 566 Cb -0.14 -4.08 -0.04 0.00 -0.13 0.00 0.00 32.58 28.20 2w5e s HIS 566 CO -0.10 -4.03 -0.20 1.04 -2.47 0.00 0.00 174.74 168.98 2w5e n GLN 567 N 3.86 0.31 -4.01 2.88 1.13 0.50 -1.16 117.38 120.88 2w5e n GLN 567 Ca 0.15 0.12 -0.10 0.00 -1.94 0.00 0.00 57.00 55.24 2w5e n GLN 567 Cb 0.36 -1.04 -0.06 0.00 0.11 0.00 0.00 30.24 29.61 2w5e n GLN 567 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 2w5e s THR 568 N -2.50 0.02 0.04 5.09 -1.32 -0.96 -4.60 115.64 111.41 2w5e s THR 568 Ca -0.17 -1.47 0.03 0.00 -1.21 0.00 0.00 61.69 58.86 2w5e s THR 568 Cb 0.03 -2.14 -0.02 0.00 -1.51 0.00 0.00 72.50 68.86 2w5e s THR 568 CO 0.25 -0.07 -0.09 0.54 -2.21 0.00 0.00 174.62 173.03 2w5e s ASN 569 N -3.02 1.07 -0.28 8.08 4.22 -1.26 -0.62 114.94 123.12 2w5e s ASN 569 Ca 0.23 -0.51 0.03 0.00 -2.14 0.00 0.00 52.86 50.47 2w5e s ASN 569 Cb 0.01 -0.01 0.07 0.00 1.28 0.00 0.00 41.25 42.61 2w5e s ASN 569 CO 0.07 -0.13 -0.05 0.42 -2.04 0.00 0.00 177.10 175.37 2w5e s THR 570 N -1.18 2.06 0.00 0.54 -4.23 -0.25 -4.99 115.64 107.59 2w5e s THR 570 Ca -0.06 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2w5e s THR 570 Cb -0.09 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.45 2w5e s THR 570 CO 0.01 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 2w5e n GLY 571 N 4.43 3.55 1.30 3.99 0.00 -1.26 -2.10 105.19 115.10 2w5e n GLY 571 Ca -0.08 -0.03 0.07 0.00 0.00 0.00 0.00 46.02 45.98 2w5e n GLY 571 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2w5e n TYR 572 N 14.00 1.17 -3.69 1.61 4.01 -1.26 -4.64 117.16 128.36 2w5e n TYR 572 Ca 0.00 -0.47 -0.37 0.00 -0.16 0.00 0.00 57.90 56.90 2w5e n TYR 572 Cb 0.00 -0.20 -0.11 0.00 -0.31 0.00 0.00 39.34 38.72 2w5e n TYR 572 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2w5e s THR 573 N -1.78 4.97 0.28 -0.72 2.01 -0.89 -0.75 115.64 118.76 2w5e s THR 573 Ca 0.40 0.05 -0.00 0.00 0.31 0.00 0.00 61.69 62.45 2w5e s THR 573 Cb 0.26 -3.34 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 2w5e s THR 573 CO 0.19 0.31 0.48 -0.83 -0.69 0.00 0.00 174.62 174.08 2w5e s GLY 574 N 1.49 1.54 -0.01 4.40 0.00 0.20 -1.09 107.32 113.85 2w5e s GLY 574 Ca 0.07 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.92 2w5e s GLY 574 CO 0.07 -0.82 0.01 -0.32 0.00 0.00 0.00 173.10 172.04 2w5e s GLY 575 N -3.63 0.10 0.13 0.20 0.00 0.20 -2.45 107.32 101.88 2w5e s GLY 575 Ca 0.39 0.15 0.04 0.00 0.00 0.00 0.00 44.72 45.30 2w5e s GLY 575 CO 0.32 0.39 -0.10 0.00 0.00 0.00 0.00 173.10 173.72 2w5e s ALA 576 N 0.63 1.32 -0.18 3.20 0.00 -0.41 -0.37 121.76 125.94 2w5e s ALA 576 Ca -0.06 -1.40 -0.07 0.00 0.00 0.00 0.00 51.96 50.44 2w5e s ALA 576 Cb -0.08 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 2w5e s ALA 576 CO -0.02 -0.09 0.05 0.08 0.00 0.00 0.00 175.76 175.78 2w5e s VAL 577 N -3.13 4.67 0.27 0.00 1.01 -0.82 -0.86 120.40 121.54 2w5e s VAL 577 Ca 0.13 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 2w5e s VAL 577 Cb 0.01 -3.10 -0.11 0.00 0.00 0.00 0.00 36.38 33.18 2w5e s VAL 577 CO -0.00 0.46 1.55 -0.63 0.00 0.00 0.00 175.10 176.48 2w5e s ILE 578 N 0.43 2.29 -0.06 2.22 1.09 -0.22 -1.48 121.20 125.47 2w5e s ILE 578 Ca 0.02 0.24 0.02 0.00 -1.10 0.00 0.00 60.65 59.82 2w5e s ILE 578 Cb -0.13 -3.15 -0.03 0.00 -1.06 0.00 0.00 42.46 38.09 2w5e s ILE 578 CO 0.01 0.04 -0.08 -0.51 -0.10 0.00 0.00 174.94 174.29 2w5e s ILE 579 N 0.14 3.58 0.13 2.92 2.07 -0.55 -4.91 121.20 124.57 2w5e s ILE 579 Ca 0.63 -0.55 0.01 0.00 -1.41 0.00 0.00 60.65 59.34 2w5e s ILE 579 Cb -0.46 -2.46 -0.04 0.00 0.13 0.00 0.00 42.46 39.63 2w5e s ILE 579 CO 0.44 0.58 -0.02 1.51 -1.91 0.00 0.00 174.94 175.55 2w5e s ASP 580 N -0.84 1.04 0.50 4.50 1.47 -1.26 -4.73 116.67 117.34 2w5e s ASP 580 Ca 0.13 -1.10 0.30 0.00 1.18 0.00 0.00 52.55 53.06 2w5e s ASP 580 Cb -0.11 0.13 1.40 0.00 -0.34 0.00 0.00 42.92 44.01 2w5e s ASP 580 CO 0.02 -0.55 1.81 -0.65 0.68 0.00 0.00 175.17 176.48 2w5e h PRO 581 N 2.85 0.12 0.00 2.11 0.11 -2.00 -0.24 132.00 134.95 2w5e h PRO 581 Ca -0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2w5e h PRO 581 Cb 1.18 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2w5e h PRO 581 CO 0.63 0.08 0.00 0.25 -0.21 0.00 0.00 178.00 178.75 2w5e n THR 582 N -4.33 0.80 0.21 -1.15 -2.24 -1.26 -2.74 114.28 103.57 2w5e n THR 582 Ca 0.24 0.16 0.10 0.00 -2.27 0.00 0.00 64.05 62.28 2w5e n THR 582 Cb 1.08 -1.06 0.38 0.00 -2.10 0.00 0.00 70.33 68.64 2w5e n THR 582 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2w5e h ASP 583 N 0.00 0.00 0.19 3.42 3.32 -1.45 -3.31 116.42 118.59 2w5e h ASP 583 Ca 0.00 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2w5e h ASP 583 Cb 0.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2w5e h ASP 583 CO 0.00 0.23 -0.28 -0.26 -1.72 0.00 0.00 179.24 177.21 2w5e h PHE 584 N 0.00 0.18 -3.94 4.55 -1.00 -1.68 -3.45 116.94 111.59 2w5e h PHE 584 Ca -0.00 -0.03 -0.26 0.00 2.81 0.00 0.00 57.97 60.48 2w5e h PHE 584 Cb 0.85 -0.05 -0.23 0.00 3.61 0.00 0.00 35.95 40.14 2w5e h PHE 584 CO 0.00 0.43 -0.73 -1.01 -1.61 0.00 0.00 178.31 175.39 2w5e s HIS 585 N -4.41 0.50 -2.00 -0.55 3.76 -1.25 -4.97 115.29 106.38 2w5e s HIS 585 Ca -0.04 -0.39 0.27 0.00 -0.15 0.00 0.00 55.06 54.75 2w5e s HIS 585 Cb 0.15 -0.31 1.61 0.00 1.11 0.00 0.00 32.58 35.14 2w5e s HIS 585 CO 0.74 -0.08 1.96 -0.35 -0.85 0.00 0.00 174.74 176.16