#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8s h ALA 453 N 0.00 2.01 -3.29 3.04 0.00 -2.13 -3.35 119.26 115.54 1z8s h ALA 453 Ca 0.00 -0.01 -0.60 0.00 0.00 0.00 0.00 54.91 54.31 1z8s h ALA 453 Cb 0.00 -0.03 -0.40 0.00 0.00 0.00 0.00 17.79 17.37 1z8s h ALA 453 CO 0.00 -0.03 -0.75 -1.59 0.00 0.00 0.00 179.25 176.88 1z8s s LYS 454 N -5.14 0.90 0.50 0.00 -2.85 -1.26 -5.12 119.74 106.77 1z8s s LYS 454 Ca -0.06 -1.22 0.05 0.00 -1.00 0.00 0.00 55.97 53.74 1z8s s LYS 454 Cb 0.17 -2.27 0.00 0.00 -2.06 0.00 0.00 37.83 33.68 1z8s s LYS 454 CO 0.69 -0.95 0.27 -1.59 0.10 0.00 0.00 175.35 173.87 1z8s s LYS 455 N 1.47 2.25 0.34 1.78 -2.85 -1.26 -5.16 119.74 116.31 1z8s s LYS 455 Ca 0.09 -2.03 0.07 0.00 -1.00 0.00 0.00 55.97 53.10 1z8s s LYS 455 Cb -0.18 -1.98 -0.03 0.00 -2.06 0.00 0.00 37.83 33.59 1z8s s LYS 455 CO -0.21 -0.43 0.25 1.47 0.10 0.00 0.00 175.35 176.53 1z8s n LEU 456 N -1.53 0.00 -3.44 2.77 -0.00 -1.26 -4.93 117.00 108.61 1z8s n LEU 456 Ca -0.05 -3.09 -0.17 0.00 -0.00 0.00 0.00 56.01 52.71 1z8s n LEU 456 Cb 0.65 1.49 0.09 0.00 -0.00 0.00 0.00 43.42 45.65 1z8s n LEU 456 CO 0.41 -0.50 0.10 -0.11 -0.00 0.00 0.00 177.39 177.28 1z8s n LEU 457 N 0.00 -4.04 -4.89 1.47 7.94 -1.26 -5.00 117.00 111.23 1z8s n LEU 457 Ca 0.05 -0.63 -0.29 0.00 -1.11 0.00 0.00 56.01 54.02 1z8s n LEU 457 Cb 0.59 -3.11 0.00 0.00 0.53 0.00 0.00 43.42 41.44 1z8s n LEU 457 CO 0.31 0.37 0.58 -2.16 -1.11 0.00 0.00 177.39 175.38 1z8s s PRO 458 N -5.37 3.56 0.62 1.96 0.04 -1.26 -4.93 135.00 129.62 1z8s s PRO 458 Ca 0.01 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.51 1z8s s PRO 458 Cb -0.00 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1z8s s PRO 458 CO 0.73 -0.39 0.00 0.00 0.04 0.00 0.00 177.00 177.39 1z8s n ALA 459 N -2.50 -3.52 -2.10 8.56 0.00 -1.26 -4.76 120.51 114.94 1z8s n ALA 459 Ca 0.03 0.87 -0.23 0.00 0.00 0.00 0.00 53.44 54.11 1z8s n ALA 459 Cb 0.55 -1.57 0.02 0.00 0.00 0.00 0.00 19.45 18.45 1z8s n ALA 459 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1z8s n PHE 460 N -4.10 2.71 0.29 0.00 3.72 -1.26 -4.78 117.46 114.03 1z8s n PHE 460 Ca -0.08 -2.28 0.15 0.00 -0.05 0.00 0.00 57.45 55.20 1z8s n PHE 460 Cb 0.65 -0.32 0.87 0.00 -0.94 0.00 0.00 39.48 39.75 1z8s n PHE 460 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1z8s h GLN 461 N 2.23 0.00 -0.06 -1.08 4.15 -1.99 -2.62 115.11 115.75 1z8s h GLN 461 Ca 0.34 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.72 1z8s h GLN 461 Cb 1.48 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.17 1z8s h GLN 461 CO 0.73 0.05 -0.10 -0.97 -1.93 0.00 0.00 178.83 176.62 1z8s h ASN 462 N 0.00 0.18 0.27 -0.69 -0.73 -1.95 -2.26 115.58 110.39 1z8s h ASN 462 Ca -0.00 -0.55 -0.01 0.00 1.87 0.00 0.00 56.30 57.61 1z8s h ASN 462 Cb 0.17 -0.05 0.00 0.00 0.27 0.00 0.00 38.32 38.72 1z8s h ASN 462 CO 0.01 0.70 -0.13 0.00 -0.37 0.00 0.00 177.43 177.64 1z8s h ALA 463 N 0.49 -0.36 -0.99 1.57 0.00 -1.78 -2.76 119.26 115.43 1z8s h ALA 463 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.80 1z8s h ALA 463 Cb 0.66 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 1z8s h ALA 463 CO 0.02 -0.46 0.64 0.93 0.00 0.00 0.00 179.25 180.38 1z8s h GLU 464 N -0.84 1.08 0.27 0.00 4.39 -1.61 0.11 114.58 117.98 1z8s h GLU 464 Ca -0.04 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1z8s h GLU 464 Cb 0.51 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1z8s h GLU 464 CO 0.06 0.72 -0.13 0.00 -1.16 0.00 0.00 179.01 178.50 1z8s h ARG 465 N 1.11 -0.35 -0.15 2.33 2.47 -1.46 -2.34 114.38 115.99 1z8s h ARG 465 Ca 0.44 0.02 -0.07 0.00 -1.26 0.00 0.00 59.98 59.12 1z8s h ARG 465 Cb 0.26 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.65 1z8s h ARG 465 CO -0.19 -0.00 -0.17 -0.07 0.56 0.00 0.00 179.97 180.09 1z8s h LEU 466 N -0.77 0.42 -0.96 3.04 3.38 -1.41 -2.57 115.31 116.43 1z8s h LEU 466 Ca -0.04 -0.49 0.21 0.00 0.09 0.00 0.00 57.88 57.65 1z8s h LEU 466 Cb 0.50 -0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.02 1z8s h LEU 466 CO 0.06 0.82 0.54 0.25 0.09 0.00 0.00 178.44 180.20 1z8s h LEU 467 N 0.02 0.63 -0.94 1.67 6.46 -0.89 0.90 115.31 123.16 1z8s h LEU 467 Ca 0.02 0.12 0.03 0.00 -0.12 0.00 0.00 57.88 57.93 1z8s h LEU 467 Cb 0.71 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.61 1z8s h LEU 467 CO 0.04 0.16 0.61 -0.07 -0.62 0.00 0.00 178.44 178.56 1z8s h LEU 468 N 0.62 1.03 -0.30 2.25 4.07 -1.23 0.30 115.31 122.05 1z8s h LEU 468 Ca 0.58 -0.01 0.05 0.00 0.08 0.00 0.00 57.88 58.57 1z8s h LEU 468 Cb 1.00 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 42.46 1z8s h LEU 468 CO -0.44 0.71 0.04 0.00 -1.08 0.00 0.00 178.44 177.67 1z8s h ALA 469 N 1.38 0.30 0.00 1.53 0.00 0.12 0.55 119.26 123.14 1z8s h ALA 469 Ca 0.37 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 1z8s h ALA 469 Cb -0.02 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1z8s h ALA 469 CO -0.11 -0.37 -0.00 1.25 0.00 0.00 0.00 179.25 180.02 1z8s h HIS 470 N 0.14 -0.00 -0.77 0.00 -0.00 -1.17 -3.26 115.15 110.09 1z8s h HIS 470 Ca 0.14 -0.00 0.19 0.00 -0.00 0.00 0.00 60.37 60.70 1z8s h HIS 470 Cb 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 27.53 1z8s h HIS 470 CO -0.19 0.85 0.53 1.98 -0.00 0.00 0.00 177.93 181.10 1z8s h MET 471 N -0.86 0.20 0.00 5.26 -1.53 -0.34 0.33 114.93 117.99 1z8s h MET 471 Ca -0.00 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.25 1z8s h MET 471 Cb 0.85 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 31.85 1z8s h MET 471 CO 0.00 0.13 0.00 -1.33 0.14 0.00 0.00 176.91 175.85 1z8s n MET 472 N -4.41 0.09 -0.04 0.39 2.81 0.19 -3.84 117.12 112.31 1z8s n MET 472 Ca 0.15 0.24 -0.05 0.00 -1.81 0.00 0.00 57.70 56.23 1z8s n MET 472 Cb 0.70 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.69 1z8s n MET 472 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1z8s n ARG 473 N -1.33 0.30 -4.52 0.03 1.74 0.12 -3.44 116.66 109.56 1z8s n ARG 473 Ca 0.03 0.12 -0.32 0.00 -0.77 0.00 0.00 57.85 56.92 1z8s n ARG 473 Cb 0.07 -1.00 -0.11 0.00 -1.02 0.00 0.00 32.46 30.40 1z8s n ARG 473 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1z8s s SER 474 N -5.47 4.34 0.55 0.55 0.15 -1.22 -4.71 113.70 107.90 1z8s s SER 474 Ca -0.17 -0.25 0.37 0.00 0.70 0.00 0.00 55.95 56.60 1z8s s SER 474 Cb 0.02 -0.91 1.79 0.00 -1.71 0.00 0.00 66.02 65.21 1z8s s SER 474 CO 0.25 0.27 2.10 0.08 1.20 0.00 0.00 173.24 177.14 1z8s h ARG 475 N 4.49 0.00 0.05 5.44 0.11 -1.84 -2.11 114.38 120.52 1z8s h ARG 475 Ca -0.48 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.60 1z8s h ARG 475 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1z8s h ARG 475 CO 0.52 0.00 -0.02 0.22 0.10 0.00 0.00 179.97 180.78 1z8s h ASP 476 N 0.00 -0.06 -0.52 0.08 3.58 -1.94 -1.39 116.42 116.17 1z8s h ASP 476 Ca 0.00 -0.45 -0.02 0.00 0.42 0.00 0.00 57.03 56.98 1z8s h ASP 476 Cb 0.22 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.26 1z8s h ASP 476 CO 0.00 0.44 0.28 1.62 -2.88 0.00 0.00 179.24 178.70 1z8s h VAL 477 N -0.57 1.18 -0.51 2.25 3.04 -1.85 0.86 116.25 120.66 1z8s h VAL 477 Ca -0.01 -0.49 0.09 0.00 -1.01 0.00 0.00 66.70 65.28 1z8s h VAL 477 Cb 0.51 0.46 -0.03 0.00 -2.01 0.00 0.00 31.29 30.22 1z8s h VAL 477 CO 0.01 0.21 0.34 0.00 -1.01 0.00 0.00 177.57 177.12 1z8s h ALA 478 N 1.53 2.07 -0.23 3.17 0.00 -1.14 0.93 119.26 125.58 1z8s h ALA 478 Ca 0.19 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 1z8s h ALA 478 Cb 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1z8s h ALA 478 CO -0.03 -0.18 -0.24 1.37 0.00 0.00 0.00 179.25 180.17 1z8s h LEU 479 N 0.31 0.44 -0.17 0.00 8.10 0.30 -2.39 115.31 121.90 1z8s h LEU 479 Ca 0.23 -0.14 -0.02 0.00 0.11 0.00 0.00 57.88 58.06 1z8s h LEU 479 Cb 0.51 -0.12 -0.01 0.00 -0.44 0.00 0.00 40.66 40.61 1z8s h LEU 479 CO -0.05 0.69 0.02 0.58 -4.11 0.00 0.00 178.44 175.56 1z8s h VAL 480 N 0.39 1.23 0.07 0.15 2.07 0.12 0.58 116.25 120.87 1z8s h VAL 480 Ca 0.06 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.83 1z8s h VAL 480 Cb 0.64 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1z8s h VAL 480 CO 0.05 0.23 -0.13 1.62 0.02 0.00 0.00 177.57 179.36 1z8s h VAL 481 N 0.06 0.70 -0.10 2.57 3.04 -0.84 0.93 116.25 122.62 1z8s h VAL 481 Ca 0.05 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.72 1z8s h VAL 481 Cb 0.33 0.70 -0.00 0.00 -2.01 0.00 0.00 31.29 30.31 1z8s h VAL 481 CO 0.01 0.00 -0.02 -0.61 -1.01 0.00 0.00 177.57 175.94 1z8s h GLN 482 N -0.25 0.18 0.09 4.17 -0.00 -1.40 2.00 115.11 119.89 1z8s h GLN 482 Ca 0.02 -0.07 -0.12 0.00 -0.00 0.00 0.00 58.65 58.48 1z8s h GLN 482 Cb 0.27 -0.01 0.01 0.00 0.00 0.00 0.00 27.48 27.75 1z8s h GLN 482 CO -0.07 0.48 -0.53 1.49 0.00 0.00 0.00 178.83 180.20 1z8s h GLU 483 N -0.13 0.21 -0.01 1.69 4.57 0.25 -1.69 114.58 119.47 1z8s h GLU 483 Ca 0.03 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1z8s h GLU 483 Cb 0.40 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.12 1z8s h GLU 483 CO 0.01 1.15 -0.15 0.54 -1.18 0.00 0.00 179.01 179.37 1z8s n ARG 484 N -4.30 0.95 0.00 1.92 1.74 0.32 -4.57 116.66 112.73 1z8s n ARG 484 Ca -0.12 -0.48 0.00 0.00 -0.77 0.00 0.00 57.85 56.47 1z8s n ARG 484 Cb 0.70 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 1z8s n ARG 484 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 1z8s n ILE 485 N -0.60 0.00 0.00 0.55 3.06 -0.91 -4.79 119.36 116.67 1z8s n ILE 485 Ca 0.15 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.40 1z8s n ILE 485 Cb 0.32 -0.01 0.00 0.00 0.54 0.00 0.00 39.64 40.49 1z8s n ILE 485 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1z8s n GLY 486 N 0.76 2.19 0.00 4.50 0.00 0.67 -4.57 105.19 108.75 1z8s n GLY 486 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1z8s n GLY 486 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z8s n GLY 487 N 0.00 0.52 3.65 -0.02 0.00 -1.26 -4.38 105.19 103.70 1z8s n GLY 487 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1z8s n GLY 487 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1z8s s ARG 488 N 0.00 -1.03 -0.00 1.61 0.52 -1.26 -4.98 118.95 113.80 1z8s s ARG 488 Ca 0.00 -0.20 -0.17 0.00 -0.52 0.00 0.00 55.73 54.84 1z8s s ARG 488 Cb 0.00 -1.63 -0.06 0.00 0.52 0.00 0.00 34.95 33.78 1z8s s ARG 488 CO 0.00 -3.56 0.47 -0.59 0.02 0.00 0.00 175.30 171.64 1z8s s PHE 489 N -3.19 3.70 0.00 -0.53 -0.12 -1.26 -4.55 117.98 112.03 1z8s s PHE 489 Ca 0.72 1.06 0.00 0.00 -0.05 0.00 0.00 56.93 58.66 1z8s s PHE 489 Cb -0.07 -2.41 0.00 0.00 -0.63 0.00 0.00 43.02 39.90 1z8s s PHE 489 CO 0.55 0.52 0.00 0.09 -0.05 0.00 0.00 175.22 176.33 1z8s n ASN 490 N 2.21 0.00 -4.30 1.98 3.02 -1.26 -5.04 115.26 111.88 1z8s n ASN 490 Ca -0.11 0.00 -0.19 0.00 -0.03 0.00 0.00 54.58 54.24 1z8s n ASN 490 Cb 0.52 0.05 -0.11 0.00 -0.61 0.00 0.00 39.78 39.62 1z8s n ASN 490 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1z8s s ILE 491 N -0.17 1.61 0.12 2.41 1.09 -1.26 -4.99 121.20 120.00 1z8s s ILE 491 Ca 0.00 -1.92 -0.20 0.00 -1.10 0.00 0.00 60.65 57.43 1z8s s ILE 491 Cb 0.00 -1.78 -0.07 0.00 -1.06 0.00 0.00 42.46 39.54 1z8s s ILE 491 CO 0.00 -0.43 1.76 -0.33 -0.10 0.00 0.00 174.94 175.84 1z8s h GLU 492 N 3.17 0.25 -0.53 2.79 5.08 -2.00 0.96 114.58 124.30 1z8s h GLU 492 Ca -0.40 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.04 1z8s h GLU 492 Cb 1.21 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 1z8s h GLU 492 CO 0.54 0.18 0.36 1.49 -1.00 0.00 0.00 179.01 180.58 1z8s h GLU 493 N 0.25 0.27 0.00 2.33 4.22 -1.93 0.85 114.58 120.57 1z8s h GLU 493 Ca 0.07 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.49 1z8s h GLU 493 Cb -0.01 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1z8s h GLU 493 CO -0.01 0.18 -0.40 0.45 -2.18 0.00 0.00 179.01 177.05 1z8s h HIS 494 N 0.28 0.00 -0.59 0.92 -0.00 -1.77 -2.17 115.15 111.81 1z8s h HIS 494 Ca 0.25 0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.70 1z8s h HIS 494 Cb 0.60 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 27.95 1z8s h HIS 494 CO -0.00 0.00 0.24 -0.09 -0.00 0.00 0.00 177.93 178.08 1z8s h ARG 495 N -0.98 0.43 -0.21 2.45 1.12 0.99 -2.02 114.38 116.17 1z8s h ARG 495 Ca 0.00 -0.03 -0.20 0.00 -1.11 0.00 0.00 59.98 58.65 1z8s h ARG 495 Cb 0.40 -0.10 0.01 0.00 -0.01 0.00 0.00 29.97 30.26 1z8s h ARG 495 CO 0.00 0.28 -0.64 0.00 -3.11 0.00 0.00 179.97 176.50 1z8s h ALA 496 N 1.38 0.36 -0.11 2.80 0.00 0.59 -1.37 119.26 122.91 1z8s h ALA 496 Ca 0.29 -0.55 0.04 0.00 0.00 0.00 0.00 54.91 54.70 1z8s h ALA 496 Cb 0.32 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1z8s h ALA 496 CO -0.27 0.64 -0.32 -0.07 0.00 0.00 0.00 179.25 179.23 1z8s h LEU 497 N 0.54 -0.98 -1.44 0.00 -0.00 -0.77 1.41 115.31 114.07 1z8s h LEU 497 Ca -0.02 0.14 -0.01 0.00 -0.00 0.00 0.00 57.88 57.99 1z8s h LEU 497 Cb 1.26 0.41 -0.02 0.00 -0.00 0.00 0.00 40.66 42.31 1z8s h LEU 497 CO 0.14 -0.36 0.27 0.00 -0.00 0.00 0.00 178.44 178.49 1z8s h ALA 498 N 0.40 1.58 0.28 1.53 0.00 -1.45 -2.37 119.26 119.24 1z8s h ALA 498 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1z8s h ALA 498 Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1z8s h ALA 498 CO -0.34 0.36 -0.14 0.00 0.00 0.00 0.00 179.25 179.14 1z8s h ALA 499 N 1.64 -0.44 0.00 0.00 0.00 0.52 -2.97 119.26 118.02 1z8s h ALA 499 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1z8s h ALA 499 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1z8s h ALA 499 CO -0.03 -0.41 0.00 0.10 0.00 0.00 0.00 179.25 178.91 1z8s h TYR 500 N -0.93 0.00 0.04 0.00 -0.00 0.17 -1.26 116.97 114.99 1z8s h TYR 500 Ca -0.04 0.00 -0.22 0.00 -0.00 0.00 0.00 58.73 58.47 1z8s h TYR 500 Cb 0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.01 1z8s h TYR 500 CO 0.01 0.00 -1.02 0.97 -0.00 0.00 0.00 178.16 178.13 1z8s h ILE 501 N 0.00 1.56 -0.53 -0.90 6.09 -1.53 -2.64 117.51 119.56 1z8s h ILE 501 Ca 0.00 -2.98 -0.11 0.00 -1.37 0.00 0.00 64.86 60.40 1z8s h ILE 501 Cb 0.23 2.71 -0.02 0.00 0.47 0.00 0.00 36.82 40.22 1z8s h ILE 501 CO 0.00 0.86 -0.10 0.22 -3.07 0.00 0.00 178.15 176.07 1z8s h TYR 502 N 0.07 1.09 -0.52 2.19 3.20 -1.07 -2.42 116.97 119.51 1z8s h TYR 502 Ca -0.06 -0.22 -0.02 0.00 3.14 0.00 0.00 58.73 61.57 1z8s h TYR 502 Cb 1.71 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 39.69 1z8s h TYR 502 CO 0.03 1.01 0.23 0.00 -1.64 0.00 0.00 178.16 177.80 1z8s h ALA 503 N 1.00 0.67 -0.91 1.82 0.00 -1.45 0.61 119.26 121.01 1z8s h ALA 503 Ca 0.14 -0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.04 1z8s h ALA 503 Cb 0.65 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 1z8s h ALA 503 CO 0.04 0.25 0.58 0.74 0.00 0.00 0.00 179.25 180.87 1z8s h PHE 504 N 0.69 0.92 -0.01 0.00 -1.00 -1.18 0.12 116.94 116.49 1z8s h PHE 504 Ca 0.18 0.03 -0.17 0.00 2.81 0.00 0.00 57.97 60.81 1z8s h PHE 504 Cb 0.15 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.40 1z8s h PHE 504 CO -0.00 0.37 -0.79 1.88 -1.61 0.00 0.00 178.31 178.16 1z8s h TYR 505 N 0.81 0.17 -0.55 -0.55 0.05 -0.88 0.15 116.97 116.17 1z8s h TYR 505 Ca 0.44 -0.09 0.10 0.00 0.05 0.00 0.00 58.73 59.23 1z8s h TYR 505 Cb 0.57 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 1z8s h TYR 505 CO -0.00 0.86 0.37 0.93 -1.05 0.00 0.00 178.16 179.27 1z8s h GLU 506 N 0.07 0.32 0.00 4.88 4.39 0.15 -1.35 114.58 123.05 1z8s h GLU 506 Ca -0.02 -0.02 -0.26 0.00 0.34 0.00 0.00 59.36 59.39 1z8s h GLU 506 Cb 1.39 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.91 1z8s h GLU 506 CO 0.11 0.21 -2.01 -1.91 -1.16 0.00 0.00 179.01 174.25 1z8s n GLU 507 N -4.46 0.66 -0.33 2.33 4.07 -0.93 -5.06 120.64 116.91 1z8s n GLU 507 Ca 0.09 0.07 0.00 0.00 -0.06 0.00 0.00 57.16 57.26 1z8s n GLU 507 Cb 0.38 -1.63 0.00 0.00 -0.06 0.00 0.00 31.44 30.13 1z8s n GLU 507 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1z8s n GLY 508 N 1.58 -0.76 0.00 8.31 0.00 0.48 -5.08 105.19 109.73 1z8s n GLY 508 Ca -0.21 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1z8s n GLY 508 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1z8s n HIS 509 N 0.11 0.00 -1.21 1.61 8.25 -1.04 -4.96 115.22 117.97 1z8s n HIS 509 Ca 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.39 1z8s n HIS 509 Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 1z8s n HIS 509 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1z8s n GLU 510 N 0.00 -1.41 -2.79 -0.41 2.13 -1.26 -4.20 120.64 112.70 1z8s n GLU 510 Ca 0.00 0.70 -0.03 0.00 0.66 0.00 0.00 57.16 58.49 1z8s n GLU 510 Cb 0.06 -4.91 -0.03 0.00 0.27 0.00 0.00 31.44 26.83 1z8s n GLU 510 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1z8s n ALA 511 N 1.14 -2.74 -2.58 4.31 0.00 -1.26 -3.45 120.51 115.93 1z8s n ALA 511 Ca -0.07 1.46 -0.40 0.00 0.00 0.00 0.00 53.44 54.42 1z8s n ALA 511 Cb 0.47 -3.04 -0.08 0.00 0.00 0.00 0.00 19.45 16.79 1z8s n ALA 511 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1z8s s ASP 512 N -0.51 6.30 0.19 0.00 -1.08 -1.26 -4.64 116.67 115.67 1z8s s ASP 512 Ca -0.17 0.13 -0.22 0.00 -0.52 0.00 0.00 52.55 51.77 1z8s s ASP 512 Cb 0.01 -2.25 0.11 0.00 -1.46 0.00 0.00 42.92 39.34 1z8s s ASP 512 CO 0.51 -0.35 1.57 -0.65 0.52 0.00 0.00 175.17 176.77 1z8s h PRO 513 N 8.30 -0.15 -0.68 4.34 0.11 -1.84 1.30 132.00 143.39 1z8s h PRO 513 Ca -0.29 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.89 1z8s h PRO 513 Cb 1.14 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 1z8s h PRO 513 CO 0.72 -0.10 0.38 0.78 -0.21 0.00 0.00 178.00 179.57 1z8s h GLY 514 N -0.15 1.00 0.00 -0.55 0.00 -1.94 -0.80 103.07 100.63 1z8s h GLY 514 Ca 0.23 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1z8s h GLY 514 CO -0.73 0.16 -0.07 0.00 0.00 0.00 0.00 176.54 175.90 1z8s h ALA 515 N 1.35 0.01 -0.49 3.60 0.00 -1.63 -3.32 119.26 118.78 1z8s h ALA 515 Ca 0.31 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 55.03 1z8s h ALA 515 Cb 0.19 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 17.94 1z8s h ALA 515 CO -0.18 0.04 -0.07 1.25 0.00 0.00 0.00 179.25 180.29 1z8s h LEU 516 N -1.00 -0.35 -2.00 0.00 5.85 0.16 0.16 115.31 118.13 1z8s h LEU 516 Ca -0.01 0.13 0.13 0.00 0.84 0.00 0.00 57.88 58.97 1z8s h LEU 516 Cb 0.52 0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1z8s h LEU 516 CO -0.01 -0.12 0.32 0.40 -0.34 0.00 0.00 178.44 178.69 1z8s h ILE 517 N 0.05 0.77 -1.74 4.05 1.08 -1.29 -1.09 117.51 119.34 1z8s h ILE 517 Ca 0.24 0.00 -0.71 0.00 -0.39 0.00 0.00 64.86 64.00 1z8s h ILE 517 Cb 0.37 0.78 -0.23 0.00 -3.07 0.00 0.00 36.82 34.67 1z8s h ILE 517 CO -0.47 0.00 1.03 -1.54 -0.69 0.00 0.00 178.15 176.49 1z8s n SER 518 N -4.40 7.30 0.00 1.72 3.41 0.55 -4.18 113.62 118.02 1z8s n SER 518 Ca 0.08 -3.59 0.00 0.00 -0.26 0.00 0.00 58.87 55.10 1z8s n SER 518 Cb 0.53 -1.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1z8s n SER 518 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1z8s n ARG 519 N 0.12 0.00 -1.52 4.33 5.12 -0.41 -4.97 116.66 119.33 1z8s n ARG 519 Ca 0.52 0.00 -0.46 0.00 -1.93 0.00 0.00 57.85 55.99 1z8s n ARG 519 Cb 0.32 -0.24 -0.02 0.00 -1.16 0.00 0.00 32.46 31.36 1z8s n ARG 519 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1z8s n ILE 520 N -2.41 1.98 0.00 0.55 -5.35 -1.25 -4.88 119.36 108.00 1z8s n ILE 520 Ca 0.00 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 1z8s n ILE 520 Cb 0.12 -0.63 0.00 0.00 -1.74 0.00 0.00 39.64 37.39 1z8s n ILE 520 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1z8s n PRO 521 N 0.80 0.00 0.00 6.28 -0.01 -1.26 -4.40 135.00 136.42 1z8s n PRO 521 Ca 0.13 0.09 0.00 0.00 -0.01 0.00 0.00 63.50 63.71 1z8s n PRO 521 Cb 0.30 -0.37 0.00 0.00 -0.01 0.00 0.00 33.50 33.42 1z8s n PRO 521 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1z8s n GLY 522 N -0.26 0.18 0.48 -1.23 0.00 -1.26 -4.82 105.19 98.28 1z8s n GLY 522 Ca 0.00 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.29 1z8s n GLY 522 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1z8s h GLU 523 N 0.00 0.00 0.00 1.61 3.07 -2.02 0.89 114.58 118.13 1z8s h GLU 523 Ca 0.00 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.72 1z8s h GLU 523 Cb 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 1z8s h GLU 523 CO 0.00 0.00 -0.65 -0.07 -1.40 0.00 0.00 179.01 176.89 1z8s h LEU 524 N 0.00 0.00 0.36 1.33 4.07 -1.90 -2.73 115.31 116.44 1z8s h LEU 524 Ca 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.35 1z8s h LEU 524 Cb 2.18 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.90 1z8s h LEU 524 CO -0.00 0.65 -0.36 1.56 -1.08 0.00 0.00 178.44 179.21 1z8s h GLN 525 N 0.00 -0.71 -0.69 1.13 4.20 0.62 0.70 115.11 120.37 1z8s h GLN 525 Ca -0.01 0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.69 1z8s h GLN 525 Cb 1.28 0.16 -0.03 0.00 0.30 0.00 0.00 27.48 29.20 1z8s h GLN 525 CO 0.08 -0.48 0.18 -1.35 -0.67 0.00 0.00 178.83 176.60 1z8s h PRO 526 N -0.74 1.09 0.56 1.46 0.11 -1.66 -0.95 132.00 131.87 1z8s h PRO 526 Ca -0.02 -0.26 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 1z8s h PRO 526 Cb 0.67 -0.15 0.01 0.00 0.11 0.00 0.00 31.00 31.64 1z8s h PRO 526 CO -0.06 0.96 -0.27 -0.07 -0.21 0.00 0.00 178.00 178.35 1z8s h LEU 527 N 1.02 -0.64 -1.36 2.35 4.07 -1.17 -2.64 115.31 116.95 1z8s h LEU 527 Ca 0.22 -0.03 0.01 0.00 0.08 0.00 0.00 57.88 58.16 1z8s h LEU 527 Cb 0.35 0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.22 1z8s h LEU 527 CO 0.00 -0.36 0.44 0.00 -1.08 0.00 0.00 178.44 177.44 1z8s h ALA 528 N -0.53 1.55 -0.47 1.53 0.00 0.40 -1.36 119.26 120.39 1z8s h ALA 528 Ca -0.08 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1z8s h ALA 528 Cb 0.63 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 1z8s h ALA 528 CO 0.13 0.40 0.14 1.03 0.00 0.00 0.00 179.25 180.95 1z8s h SER 529 N 0.87 0.11 0.61 0.00 0.87 -1.03 -0.20 113.55 114.79 1z8s h SER 529 Ca 0.25 0.07 -0.12 0.00 -1.23 0.00 0.00 61.79 60.75 1z8s h SER 529 Cb -0.06 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 1z8s h SER 529 CO -0.06 0.09 -0.59 -0.08 -0.53 0.00 0.00 176.83 175.66 1z8s h GLU 530 N 0.30 0.00 0.00 2.24 4.57 -1.07 -2.89 114.58 117.73 1z8s h GLU 530 Ca 0.23 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.41 1z8s h GLU 530 Cb 0.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1z8s h GLU 530 CO -0.26 0.59 0.00 -0.07 -1.18 0.00 0.00 179.01 178.09 1z8s h LEU 531 N 0.00 0.00 -1.21 1.64 4.07 -0.01 -3.27 115.31 116.53 1z8s h LEU 531 Ca -0.01 0.00 0.10 0.00 0.08 0.00 0.00 57.88 58.06 1z8s h LEU 531 Cb 1.06 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 1z8s h LEU 531 CO 0.08 0.00 0.77 0.28 -1.08 0.00 0.00 178.44 178.48 1z8s h SER 532 N 0.00 0.00 -1.21 -0.43 0.02 -0.88 -1.63 113.55 109.42 1z8s h SER 532 Ca 0.00 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.57 1z8s h SER 532 Cb 0.46 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 62.65 1z8s h SER 532 CO 0.00 0.00 -1.04 -0.11 -1.14 0.00 0.00 176.83 174.54 1z8s n LEU 533 N -3.05 0.50 0.20 5.07 0.00 -1.23 -4.68 117.00 113.80 1z8s n LEU 533 Ca 0.07 -4.21 0.06 0.00 0.00 0.00 0.00 56.01 51.93 1z8s n LEU 533 Cb 0.90 0.56 0.40 0.00 0.00 0.00 0.00 43.42 45.27 1z8s n LEU 533 CO 0.15 1.94 0.73 -0.07 0.00 0.00 0.00 177.39 180.14 1z8s h LEU 534 N 2.90 0.00 -0.19 -1.96 3.38 -1.49 -3.40 115.31 114.56 1z8s h LEU 534 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1z8s h LEU 534 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1z8s h LEU 534 CO 0.41 0.34 0.00 0.00 0.09 0.00 0.00 178.44 179.27 1z8s n LEU 535 N -3.61 0.00 -4.31 1.67 -0.00 -1.26 -5.02 117.00 104.47 1z8s n LEU 535 Ca -0.01 -0.33 -0.32 0.00 -0.00 0.00 0.00 56.01 55.36 1z8s n LEU 535 Cb 0.46 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.72 1z8s n LEU 535 CO 0.36 0.52 -0.54 0.27 -0.00 0.00 0.00 177.39 178.00 1z8s s ILE 536 N 0.00 2.30 -0.27 1.47 -0.00 -1.26 -2.81 121.20 120.62 1z8s s ILE 536 Ca 0.00 -0.98 -0.03 0.00 -0.00 0.00 0.00 60.65 59.64 1z8s s ILE 536 Cb 0.00 -1.86 0.09 0.00 -0.00 0.00 0.00 42.46 40.69 1z8s s ILE 536 CO 0.00 0.57 0.11 0.00 -0.00 0.00 0.00 174.94 175.62 1z8s s ALA 537 N -0.18 0.79 0.00 2.27 0.00 -1.26 -4.73 121.76 118.64 1z8s s ALA 537 Ca -0.02 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1z8s s ALA 537 Cb -0.14 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.60 1z8s s ALA 537 CO 0.03 -1.57 0.00 -3.47 0.00 0.00 0.00 175.76 170.75 1z8s n ASP 538 N 5.17 0.00 -0.71 0.00 2.03 -1.26 -2.77 116.55 119.01 1z8s n ASP 538 Ca -0.06 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.32 1z8s n ASP 538 Cb 0.43 0.00 0.14 0.00 -0.72 0.00 0.00 41.12 40.97 1z8s n ASP 538 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1z8s n ASP 539 N 0.74 2.80 -1.38 1.67 2.03 -1.26 -5.10 116.55 116.06 1z8s n ASP 539 Ca 0.00 -1.85 0.15 0.00 0.52 0.00 0.00 54.79 53.61 1z8s n ASP 539 Cb 0.00 -0.19 -0.09 0.00 -0.72 0.00 0.00 41.12 40.13 1z8s n ASP 539 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1z8s n VAL 540 N 0.77 -0.94 -2.81 5.18 0.31 -1.11 -4.36 118.33 115.37 1z8s n VAL 540 Ca 0.12 0.90 -0.44 0.00 -0.01 0.00 0.00 64.34 64.91 1z8s n VAL 540 Cb 0.43 -1.35 -0.00 0.00 -0.91 0.00 0.00 33.84 32.00 1z8s n VAL 540 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1z8s s SER 541 N -7.03 6.96 0.28 4.52 0.15 -1.12 -4.66 113.70 112.80 1z8s s SER 541 Ca 0.00 -2.72 0.02 0.00 0.70 0.00 0.00 55.95 53.95 1z8s s SER 541 Cb 0.00 -2.47 0.66 0.00 -1.71 0.00 0.00 66.02 62.50 1z8s s SER 541 CO 0.00 -0.93 1.71 -0.08 1.20 0.00 0.00 173.24 175.14 1z8s h GLU 542 N 7.45 0.43 -0.66 5.44 4.57 -1.91 0.72 114.58 130.63 1z8s h GLU 542 Ca 0.35 -0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.60 1z8s h GLU 542 Cb 0.88 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 29.30 1z8s h GLU 542 CO 1.32 0.29 0.29 0.37 -1.18 0.00 0.00 179.01 180.10 1z8s h GLN 543 N 0.45 0.50 -0.12 1.92 4.15 -1.90 0.38 115.11 120.48 1z8s h GLN 543 Ca 0.53 -0.03 -0.16 0.00 0.77 0.00 0.00 58.65 59.76 1z8s h GLN 543 Cb 0.93 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 1z8s h GLN 543 CO -0.48 0.33 -0.59 1.49 -1.93 0.00 0.00 178.83 177.64 1z8s h GLU 544 N 0.51 0.38 -0.19 1.69 4.81 -0.92 -2.02 114.58 118.85 1z8s h GLU 544 Ca 0.33 -0.26 0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1z8s h GLU 544 Cb 0.37 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.73 1z8s h GLU 544 CO -0.28 0.86 -0.12 1.25 -0.73 0.00 0.00 179.01 179.99 1z8s h LEU 545 N 0.29 -0.39 -0.97 1.64 5.85 0.24 0.24 115.31 122.21 1z8s h LEU 545 Ca -0.00 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 1z8s h LEU 545 Cb 1.12 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 1z8s h LEU 545 CO 0.10 -0.16 -0.26 -0.33 -0.34 0.00 0.00 178.44 177.46 1z8s h GLU 546 N -0.11 0.00 0.01 1.25 4.39 -1.29 -2.76 114.58 116.08 1z8s h GLU 546 Ca 0.11 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 1z8s h GLU 546 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1z8s h GLU 546 CO -0.26 0.26 -0.01 0.22 -1.16 0.00 0.00 179.01 178.06 1z8s h ASP 547 N 0.00 -0.01 0.20 1.42 3.58 -0.17 -2.58 116.42 118.85 1z8s h ASP 547 Ca -0.00 -0.51 -0.20 0.00 0.42 0.00 0.00 57.03 56.74 1z8s h ASP 547 Cb 0.82 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.88 1z8s h ASP 547 CO 0.03 0.51 -0.80 0.10 -2.88 0.00 0.00 179.24 176.20 1z8s h TYR 548 N -0.54 0.66 -0.75 0.28 -0.00 -0.68 -2.50 116.97 113.45 1z8s h TYR 548 Ca -0.00 -0.31 0.02 0.00 0.00 0.00 0.00 58.73 58.44 1z8s h TYR 548 Cb 0.52 -0.10 -0.04 0.00 0.00 0.00 0.00 36.73 37.11 1z8s h TYR 548 CO 0.11 1.10 0.49 0.82 -0.00 0.00 0.00 178.16 180.67 1z8s h ILE 549 N 0.31 1.15 -0.95 -0.90 2.04 -1.58 -0.46 117.51 117.11 1z8s h ILE 549 Ca -0.05 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.53 1z8s h ILE 549 Cb 1.40 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 1z8s h ILE 549 CO 0.14 0.18 0.62 -0.09 0.00 0.00 0.00 178.15 179.00 1z8s h ARG 550 N 0.97 1.10 -0.89 2.37 1.12 -1.37 -0.64 114.38 117.04 1z8s h ARG 550 Ca 0.29 -0.07 0.09 0.00 -1.11 0.00 0.00 59.98 59.18 1z8s h ARG 550 Cb -0.05 -0.25 -0.07 0.00 -0.01 0.00 0.00 29.97 29.59 1z8s h ARG 550 CO -0.09 0.73 0.54 0.45 -3.11 0.00 0.00 179.97 178.50 1z8s h HIS 551 N 1.13 1.00 -0.35 2.20 3.86 -0.63 0.15 115.15 122.51 1z8s h HIS 551 Ca 0.40 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.61 1z8s h HIS 551 Cb 0.13 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 1z8s h HIS 551 CO -0.00 0.45 0.08 0.28 0.86 0.00 0.00 177.93 179.59 1z8s h VAL 552 N 0.93 1.17 0.54 2.45 2.07 -0.62 -2.93 116.25 119.85 1z8s h VAL 552 Ca 0.42 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 1z8s h VAL 552 Cb 0.31 0.82 0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1z8s h VAL 552 CO -0.22 0.21 -0.26 0.25 0.02 0.00 0.00 177.57 177.57 1z8s h LEU 553 N 0.50 -0.61 -3.26 2.57 5.85 -0.26 -3.48 115.31 116.62 1z8s h LEU 553 Ca 0.12 -0.03 -0.35 0.00 0.84 0.00 0.00 57.88 58.46 1z8s h LEU 553 Cb 0.20 0.16 0.02 0.00 0.37 0.00 0.00 40.66 41.41 1z8s h LEU 553 CO -0.00 -0.34 -1.11 -0.46 -0.34 0.00 0.00 178.44 176.18 1z8s n ASN 554 N -5.35 -5.05 0.00 1.25 6.94 -0.69 -4.70 115.26 107.66 1z8s n ASN 554 Ca -0.12 -0.13 0.00 0.00 -0.02 0.00 0.00 54.58 54.32 1z8s n ASN 554 Cb 0.32 -1.45 0.00 0.00 -2.36 0.00 0.00 39.78 36.29 1z8s n ASN 554 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 1z8s n ARG 555 N -0.09 0.00 0.08 -3.83 0.63 -1.26 -4.97 116.66 107.22 1z8s n ARG 555 Ca -0.08 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.75 1z8s n ARG 555 Cb 0.62 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 33.42 1z8s n ARG 555 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1z8s h PRO 556 N 0.00 0.12 -3.13 -0.14 0.13 -1.96 -3.47 132.00 123.55 1z8s h PRO 556 Ca 0.00 -0.20 -0.37 0.00 -0.87 0.00 0.00 66.00 64.56 1z8s h PRO 556 Cb 0.00 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.18 1z8s h PRO 556 CO 0.00 1.08 -0.47 1.63 -0.23 0.00 0.00 178.00 180.01 1z8s n LYS 557 N -3.45 -1.82 -0.05 0.86 4.76 -1.26 -4.88 118.16 112.32 1z8s n LYS 557 Ca -0.04 0.91 -0.13 0.00 -2.87 0.00 0.00 58.31 56.18 1z8s n LYS 557 Cb 0.96 -5.54 -0.12 0.00 -1.84 0.00 0.00 35.03 28.49 1z8s n LYS 557 CO 0.00 0.00 0.00 2.35 -1.37 0.00 0.00 177.40 178.38 1z8s h TRP 558 N 0.00 -0.01 -0.45 2.13 7.01 -1.95 -3.29 115.95 119.39 1z8s h TRP 558 Ca -0.44 -0.00 0.13 0.00 2.11 0.00 0.00 58.89 60.69 1z8s h TRP 558 Cb 1.32 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 28.37 1z8s h TRP 558 CO 0.60 0.80 0.45 -0.07 -2.79 0.00 0.00 178.44 177.42 1z8s h LEU 559 N -0.86 0.00 -0.01 0.65 4.07 -1.90 -0.48 115.31 116.77 1z8s h LEU 559 Ca -0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 1z8s h LEU 559 Cb 0.81 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.54 1z8s h LEU 559 CO 0.00 0.00 -0.07 -0.03 -1.08 0.00 0.00 178.44 177.26 1z8s h MET 560 N 0.00 -0.12 -0.40 1.13 4.05 -1.83 0.84 114.93 118.60 1z8s h MET 560 Ca 0.21 0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.55 1z8s h MET 560 Cb 1.11 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.92 1z8s h MET 560 CO -0.00 -0.08 -0.12 1.25 0.23 0.00 0.00 176.91 178.18 1z8s h LEU 561 N -0.12 0.71 -1.11 3.39 6.46 -1.27 -2.14 115.31 121.22 1z8s h LEU 561 Ca 0.03 -0.21 -0.03 0.00 -0.12 0.00 0.00 57.88 57.55 1z8s h LEU 561 Cb 0.16 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 1z8s h LEU 561 CO -0.08 0.85 0.25 0.50 -0.62 0.00 0.00 178.44 179.34 1z8s h LYS 562 N 0.65 0.88 -0.44 1.25 1.63 -0.59 0.94 116.57 120.90 1z8s h LYS 562 Ca 0.11 -0.13 0.02 0.00 -0.85 0.00 0.00 60.65 59.80 1z8s h LYS 562 Cb 0.58 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 32.03 1z8s h LYS 562 CO 0.04 0.71 0.25 0.28 -3.45 0.00 0.00 179.45 177.28 1z8s h VAL 563 N 0.87 1.03 -0.02 2.00 2.07 0.13 0.71 116.25 123.04 1z8s h VAL 563 Ca 0.21 -0.17 -0.16 0.00 0.82 0.00 0.00 66.70 67.39 1z8s h VAL 563 Cb 0.16 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1z8s h VAL 563 CO -0.02 0.09 -0.73 0.11 0.02 0.00 0.00 177.57 177.04 1z8s h LYS 564 N 0.50 0.12 -0.50 1.57 6.56 -1.00 -2.48 116.57 121.35 1z8s h LYS 564 Ca 0.18 -0.11 -0.05 0.00 -1.06 0.00 0.00 60.65 59.61 1z8s h LYS 564 Cb 0.03 0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 31.70 1z8s h LYS 564 CO -0.09 0.79 0.13 1.49 -2.06 0.00 0.00 179.45 179.71 1z8s h GLU 565 N 0.08 0.79 -0.03 3.15 4.22 0.19 0.10 114.58 123.09 1z8s h GLU 565 Ca -0.02 -0.19 -0.11 0.00 0.08 0.00 0.00 59.36 59.13 1z8s h GLU 565 Cb 1.28 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 1z8s h GLU 565 CO 0.10 0.76 -0.49 1.96 -2.18 0.00 0.00 179.01 179.17 1z8s h GLN 566 N 0.69 0.09 0.15 1.92 4.20 0.47 1.18 115.11 123.81 1z8s h GLN 566 Ca 0.16 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 1z8s h GLN 566 Cb 0.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1z8s h GLN 566 CO 0.00 0.56 -0.07 0.93 -0.67 0.00 0.00 178.83 179.57 1z8s h GLU 567 N 0.07 -0.20 -0.33 1.46 4.39 -1.14 -2.56 114.58 116.26 1z8s h GLU 567 Ca 0.00 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1z8s h GLU 567 Cb 0.89 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.57 1z8s h GLU 567 CO 0.07 0.23 0.16 0.87 -1.16 0.00 0.00 179.01 179.17 1z8s h LYS 568 N -0.89 0.46 -0.60 2.33 1.79 -0.80 -1.26 116.57 117.60 1z8s h LYS 568 Ca -0.02 -0.05 0.12 0.00 -2.18 0.00 0.00 60.65 58.52 1z8s h LYS 568 Cb 0.52 -0.09 -0.09 0.00 -1.58 0.00 0.00 32.23 30.99 1z8s h LYS 568 CO 0.03 0.36 0.11 1.15 -1.08 0.00 0.00 179.45 180.02 1z8s h THR 569 N 0.46 0.62 -0.87 -0.16 2.02 0.15 1.61 112.91 116.74 1z8s h THR 569 Ca 0.12 -0.08 0.09 0.00 0.77 0.00 0.00 66.41 67.31 1z8s h THR 569 Cb 0.05 0.36 -0.07 0.00 -1.74 0.00 0.00 68.15 66.75 1z8s h THR 569 CO -0.02 0.04 0.52 -0.33 0.37 0.00 0.00 175.52 176.11 1z8s h GLU 570 N 0.24 0.85 -0.04 6.66 5.08 -0.81 1.09 114.58 127.64 1z8s h GLU 570 Ca 0.32 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 1z8s h GLU 570 Cb 0.48 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1z8s h GLU 570 CO -0.42 0.56 -0.08 0.00 -1.00 0.00 0.00 179.01 178.07 1z8s h ALA 571 N 1.47 1.80 -0.22 3.43 0.00 0.21 -1.89 119.26 124.05 1z8s h ALA 571 Ca 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1z8s h ALA 571 Cb 0.36 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1z8s h ALA 571 CO -0.24 0.16 0.08 1.49 0.00 0.00 0.00 179.25 180.74 1z8s h GLU 572 N 0.05 0.33 -0.76 0.00 4.81 0.98 3.21 114.58 123.20 1z8s h GLU 572 Ca 0.01 -0.06 0.16 0.00 -0.13 0.00 0.00 59.36 59.34 1z8s h GLU 572 Cb 0.18 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 1z8s h GLU 572 CO 0.01 0.39 0.51 0.00 -0.73 0.00 0.00 179.01 179.19 1z8s h ARG 573 N 0.20 0.37 0.00 1.92 3.08 -0.33 0.26 114.38 119.88 1z8s h ARG 573 Ca 0.07 -0.02 -0.20 0.00 0.07 0.00 0.00 59.98 59.90 1z8s h ARG 573 Cb 0.19 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1z8s h ARG 573 CO -0.01 0.25 -1.37 -0.09 -1.07 0.00 0.00 179.97 177.68 1z8s h ARG 574 N 0.39 0.00 0.00 0.04 1.12 -0.86 -3.46 114.38 111.60 1z8s h ARG 574 Ca 0.37 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.24 1z8s h ARG 574 Cb 0.90 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.86 1z8s h ARG 574 CO -0.12 0.41 0.00 1.63 -3.11 0.00 0.00 179.97 178.79 1z8s n LYS 575 N -3.00 0.00 -1.18 0.20 4.76 1.06 -5.02 118.16 114.99 1z8s n LYS 575 Ca -0.10 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.47 1z8s n LYS 575 Cb 0.89 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 34.02 1z8s n LYS 575 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1z8s n ASP 576 N 0.00 -5.80 0.00 4.39 5.68 -0.67 -4.51 116.55 115.63 1z8s n ASP 576 Ca 0.00 0.90 0.00 0.00 -0.50 0.00 0.00 54.79 55.19 1z8s n ASP 576 Cb 0.00 -3.89 0.00 0.00 -1.14 0.00 0.00 41.12 36.09 1z8s n ASP 576 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1z8s n PHE 577 N -3.81 0.00 0.06 2.11 3.01 -1.26 -2.61 117.46 114.96 1z8s n PHE 577 Ca -0.05 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.36 1z8s n PHE 577 Cb 0.55 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.00 1z8s n PHE 577 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1z8s h LEU 578 N 0.00 -0.21 -3.43 4.37 4.07 -2.00 -3.34 115.31 114.78 1z8s h LEU 578 Ca 0.00 -0.05 -0.35 0.00 0.08 0.00 0.00 57.88 57.56 1z8s h LEU 578 Cb 0.00 0.05 -0.21 0.00 1.08 0.00 0.00 40.66 41.59 1z8s h LEU 578 CO 0.00 0.28 0.44 0.35 -1.08 0.00 0.00 178.44 178.43 1z8s n THR 579 N -4.94 2.59 0.19 0.22 -2.24 -1.07 -4.46 114.28 104.57 1z8s n THR 579 Ca -0.04 -1.39 0.06 0.00 -2.27 0.00 0.00 64.05 60.41 1z8s n THR 579 Cb 0.12 -0.58 0.29 0.00 -2.10 0.00 0.00 70.33 68.07 1z8s n THR 579 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1z8s n ALA 580 N -0.60 1.22 -0.18 6.98 0.00 -1.24 -2.86 120.51 123.84 1z8s n ALA 580 Ca 0.42 0.06 0.29 0.00 0.00 0.00 0.00 53.44 54.21 1z8s n ALA 580 Cb 1.34 -1.18 0.73 0.00 0.00 0.00 0.00 19.45 20.33 1z8s n ALA 580 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1z8s h ALA 581 N 2.13 2.85 -0.34 0.00 0.00 -1.89 -0.67 119.26 121.34 1z8s h ALA 581 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1z8s h ALA 581 Cb 0.10 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1z8s h ALA 581 CO 0.00 -1.12 0.08 0.00 0.00 0.00 0.00 179.25 178.21 1z8s h ARG 582 N 0.00 0.19 0.10 0.00 2.47 -1.93 0.76 114.38 115.97 1z8s h ARG 582 Ca 0.43 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 59.13 1z8s h ARG 582 Cb 1.73 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 30.01 1z8s h ARG 582 CO -0.00 0.13 -0.05 0.82 0.56 0.00 0.00 179.97 181.43 1z8s h ILE 583 N 0.20 1.13 0.09 2.04 1.08 -1.41 -2.30 117.51 118.34 1z8s h ILE 583 Ca 0.16 -1.15 0.01 0.00 -0.39 0.00 0.00 64.86 63.49 1z8s h ILE 583 Cb 0.18 1.83 -0.02 0.00 -3.07 0.00 0.00 36.82 35.74 1z8s h ILE 583 CO -0.21 0.27 -0.12 0.00 -0.69 0.00 0.00 178.15 177.40 1z8s h ALA 584 N 0.09 -0.21 -0.88 1.87 0.00 -1.33 0.58 119.26 119.37 1z8s h ALA 584 Ca -0.01 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1z8s h ALA 584 Cb 0.54 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 1z8s h ALA 584 CO 0.02 -0.64 0.55 -0.22 0.00 0.00 0.00 179.25 178.96 1z8s h LYS 585 N -0.25 0.97 -0.09 0.00 3.64 0.44 0.25 116.57 121.53 1z8s h LYS 585 Ca 0.02 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 1z8s h LYS 585 Cb 0.26 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1z8s h LYS 585 CO -0.06 0.64 -0.14 1.49 -2.27 0.00 0.00 179.45 179.11 1z8s h GLU 586 N 1.00 0.25 -0.99 1.90 4.81 -1.00 -2.17 114.58 118.39 1z8s h GLU 586 Ca 0.38 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.48 1z8s h GLU 586 Cb 0.17 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.51 1z8s h GLU 586 CO -0.17 0.72 0.65 0.52 -0.73 0.00 0.00 179.01 180.00 1z8s h MET 587 N -0.19 1.26 -0.64 1.92 2.86 0.50 0.42 114.93 121.06 1z8s h MET 587 Ca 0.01 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1z8s h MET 587 Cb 0.70 -0.28 -0.03 0.00 0.06 0.00 0.00 31.60 32.04 1z8s h MET 587 CO 0.03 0.83 0.40 0.82 1.06 0.00 0.00 176.91 180.05 1z8s h ILE 588 N 1.30 1.18 -0.12 -1.22 5.03 -0.46 0.90 117.51 124.11 1z8s h ILE 588 Ca 0.38 -0.37 -0.17 0.00 -0.12 0.00 0.00 64.86 64.58 1z8s h ILE 588 Cb -0.08 0.26 -0.01 0.00 -3.03 0.00 0.00 36.82 33.96 1z8s h ILE 588 CO -0.10 0.18 -0.63 -0.33 -0.68 0.00 0.00 178.15 176.59 1z8s h GLU 589 N 0.88 0.43 -0.02 2.37 4.39 -0.32 -2.41 114.58 119.90 1z8s h GLU 589 Ca 0.23 -0.30 -0.13 0.00 0.34 0.00 0.00 59.36 59.50 1z8s h GLU 589 Cb -0.05 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1z8s h GLU 589 CO -0.05 0.92 -0.60 0.52 -1.16 0.00 0.00 179.01 178.64 1z8s h MET 590 N 0.31 0.05 -0.09 2.33 2.86 0.15 -2.59 114.93 117.95 1z8s h MET 590 Ca -0.01 -0.04 -0.15 0.00 -2.06 0.00 0.00 59.70 57.44 1z8s h MET 590 Cb 1.17 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.83 1z8s h MET 590 CO 0.11 0.64 -0.60 0.87 1.06 0.00 0.00 176.91 178.99 1z8s h LYS 591 N 0.04 0.32 -0.27 1.72 1.57 0.94 -2.24 116.57 118.65 1z8s h LYS 591 Ca -0.01 -0.21 -0.13 0.00 -1.87 0.00 0.00 60.65 58.43 1z8s h LYS 591 Cb 1.07 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 1z8s h LYS 591 CO 0.08 0.82 -0.33 0.87 -0.57 0.00 0.00 179.45 180.32 1z8s h LYS 592 N 0.24 0.71 -0.41 3.15 6.56 -1.27 -0.10 116.57 125.44 1z8s h LYS 592 Ca -0.00 -0.39 -0.13 0.00 -1.06 0.00 0.00 60.65 59.07 1z8s h LYS 592 Cb 1.11 0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.79 1z8s h LYS 592 CO 0.10 1.01 -0.23 0.00 -2.06 0.00 0.00 179.45 178.27 1z8s h MET 593 N 0.44 0.89 0.00 3.15 -0.00 -1.45 -3.08 114.93 114.88 1z8s h MET 593 Ca 0.04 -0.40 -0.12 0.00 -0.00 0.00 0.00 59.70 59.22 1z8s h MET 593 Cb 0.91 -0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 32.47 1z8s h MET 593 CO 0.08 1.05 -0.57 1.37 -0.00 0.00 0.00 176.91 178.84 1z8s h LEU 594 N 0.71 0.00 -7.55 -0.10 8.10 -1.44 -3.41 115.31 111.61 1z8s h LEU 594 Ca 0.09 0.00 -0.61 0.00 0.11 0.00 0.00 57.88 57.47 1z8s h LEU 594 Cb 0.80 0.00 -0.39 0.00 -0.44 0.00 0.00 40.66 40.63 1z8s h LEU 594 CO 0.07 0.57 -0.77 -0.44 -4.11 0.00 0.00 178.44 173.75 1z8s s SER 595 N -6.53 3.99 0.19 0.17 0.01 -0.05 -4.94 113.70 106.53 1z8s s SER 595 Ca 0.02 -1.39 0.00 0.00 1.31 0.00 0.00 55.95 55.89 1z8s s SER 595 Cb 0.10 -1.18 0.00 0.00 0.21 0.00 0.00 66.02 65.15 1z8s s SER 595 CO 0.74 -0.29 0.00 -1.54 0.41 0.00 0.00 173.24 172.56 1z8s n SER 596 N 4.65 0.26 0.00 2.44 3.41 -1.24 -4.35 113.62 118.78 1z8s n SER 596 Ca -0.08 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 1z8s n SER 596 Cb 0.43 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1z8s n SER 596 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64