#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8s n ALA 453 N 0.00 2.41 -2.26 3.17 0.00 -1.26 -4.92 120.51 117.64 1z8s n ALA 453 Ca 0.00 -1.10 -0.20 0.00 0.00 0.00 0.00 53.44 52.13 1z8s n ALA 453 Cb 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 1z8s n ALA 453 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1z8s n LYS 454 N 1.34 -1.59 -4.46 0.00 5.02 -1.26 -4.98 118.16 112.24 1z8s n LYS 454 Ca 0.21 1.02 -0.34 0.00 -2.02 0.00 0.00 58.31 57.18 1z8s n LYS 454 Cb 0.53 -5.61 -0.12 0.00 -0.02 0.00 0.00 35.03 29.82 1z8s n LYS 454 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1z8s s LYS 455 N -4.81 3.35 -0.09 1.97 3.01 -1.26 -4.88 119.74 117.03 1z8s s LYS 455 Ca 0.00 -0.51 -0.07 0.00 -1.01 0.00 0.00 55.97 54.38 1z8s s LYS 455 Cb 0.00 -2.82 0.03 0.00 -1.01 0.00 0.00 37.83 34.03 1z8s s LYS 455 CO 0.00 0.41 0.14 1.28 0.51 0.00 0.00 175.35 177.69 1z8s n LEU 456 N 3.01 -5.97 0.13 3.17 4.32 -1.26 -4.90 117.00 115.50 1z8s n LEU 456 Ca -0.18 2.33 0.00 0.00 -0.02 0.00 0.00 56.01 58.14 1z8s n LEU 456 Cb 0.53 -3.08 0.00 0.00 -1.62 0.00 0.00 43.42 39.24 1z8s n LEU 456 CO 0.31 -3.29 0.00 0.18 -1.22 0.00 0.00 177.39 173.36 1z8s n LEU 457 N 1.61 -2.42 -3.90 2.23 4.32 -1.26 -5.07 117.00 112.52 1z8s n LEU 457 Ca -0.23 0.54 -0.12 0.00 -0.02 0.00 0.00 56.01 56.17 1z8s n LEU 457 Cb 0.36 2.44 0.07 0.00 -1.62 0.00 0.00 43.42 44.67 1z8s n LEU 457 CO 0.22 -0.00 -0.24 -0.81 -1.22 0.00 0.00 177.39 175.34 1z8s n PRO 458 N -3.03 -1.00 0.00 3.23 -0.04 -1.26 -5.01 135.00 127.89 1z8s n PRO 458 Ca 0.00 -0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.17 1z8s n PRO 458 Cb 0.00 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1z8s n PRO 458 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1z8s n ALA 459 N -3.68 0.00 -0.01 0.55 0.00 -1.26 -4.54 120.51 111.57 1z8s n ALA 459 Ca 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.40 1z8s n ALA 459 Cb 0.24 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.82 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 -0.75 1.31 0.29 0.00 3.72 -1.26 -4.32 117.46 116.45 1z8s n PHE 460 Ca 0.00 -0.86 0.14 0.00 -0.05 0.00 0.00 57.45 56.67 1z8s n PHE 460 Cb 0.00 -0.48 0.85 0.00 -0.94 0.00 0.00 39.48 38.91 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 0.99 0.00 -0.30 -1.08 -0.00 -1.97 -2.13 115.11 110.62 1z8s h GLN 461 Ca 0.20 0.00 0.02 0.00 -0.00 0.00 0.00 58.65 58.87 1z8s h GLN 461 Cb 1.66 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 29.11 1z8s h GLN 461 CO 0.43 0.01 0.15 -0.97 0.00 0.00 0.00 178.83 178.45 1z8s h ASN 462 N 0.00 0.23 0.16 -0.69 -0.73 -1.92 0.52 115.58 113.15 1z8s h ASN 462 Ca -0.00 0.01 -0.12 0.00 1.87 0.00 0.00 56.30 58.06 1z8s h ASN 462 Cb 0.03 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 1z8s h ASN 462 CO 0.00 0.17 -0.43 0.00 -0.37 0.00 0.00 177.43 176.81 1z8s h ALA 463 N 1.15 1.01 -0.17 1.57 0.00 -1.68 -2.67 119.26 118.46 1z8s h ALA 463 Ca 0.12 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.44 1z8s h ALA 463 Cb 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1z8s h ALA 463 CO -0.08 0.62 -0.54 0.93 0.00 0.00 0.00 179.25 180.18 1z8s h GLU 464 N 0.28 0.52 0.18 0.00 4.39 -1.03 -2.06 114.58 116.85 1z8s h GLU 464 Ca 0.02 -0.32 -0.01 0.00 0.34 0.00 0.00 59.36 59.39 1z8s h GLU 464 Cb 0.87 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 1z8s h GLU 464 CO 0.07 0.92 -0.09 0.07 -1.16 0.00 0.00 179.01 178.83 1z8s h ARG 465 N 0.40 -0.23 -0.42 2.33 0.11 0.15 -2.22 114.38 114.50 1z8s h ARG 465 Ca 0.01 0.02 -0.03 0.00 0.10 0.00 0.00 59.98 60.07 1z8s h ARG 465 Cb 1.07 0.05 -0.02 0.00 1.11 0.00 0.00 29.97 32.19 1z8s h ARG 465 CO 0.10 0.18 0.14 1.37 0.10 0.00 0.00 179.97 181.87 1z8s h LEU 466 N -0.81 0.60 -0.98 0.08 -0.00 -1.58 -1.66 115.31 110.97 1z8s h LEU 466 Ca -0.02 -0.19 0.17 0.00 -0.00 0.00 0.00 57.88 57.83 1z8s h LEU 466 Cb 0.52 -0.16 -0.10 0.00 -0.00 0.00 0.00 40.66 40.92 1z8s h LEU 466 CO 0.04 0.63 0.58 0.25 -0.00 0.00 0.00 178.44 179.94 1z8s h LEU 467 N 0.53 0.76 -1.26 0.17 6.46 -1.47 0.87 115.31 121.37 1z8s h LEU 467 Ca 0.14 0.09 0.08 0.00 -0.12 0.00 0.00 57.88 58.07 1z8s h LEU 467 Cb 0.24 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 40.06 1z8s h LEU 467 CO -0.01 0.30 0.54 -0.07 -0.62 0.00 0.00 178.44 178.58 1z8s h LEU 468 N 0.78 0.76 -0.13 2.25 4.07 -0.67 0.64 115.31 123.01 1z8s h LEU 468 Ca 0.55 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 58.52 1z8s h LEU 468 Cb 0.79 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1z8s h LEU 468 CO -0.36 0.47 0.07 0.00 -1.08 0.00 0.00 178.44 177.54 1z8s h ALA 469 N 1.57 0.17 -0.00 1.53 0.00 0.15 0.32 119.26 123.00 1z8s h ALA 469 Ca 0.37 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1z8s h ALA 469 Cb 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1z8s h ALA 469 CO -0.14 -0.29 -0.16 1.25 0.00 0.00 0.00 179.25 179.90 1z8s h HIS 470 N 0.12 0.17 -0.61 0.00 -0.00 -1.01 -3.23 115.15 110.59 1z8s h HIS 470 Ca 0.05 -0.09 0.13 0.00 -0.00 0.00 0.00 60.37 60.46 1z8s h HIS 470 Cb 0.07 -0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.43 1z8s h HIS 470 CO -0.04 0.89 0.42 1.98 -0.00 0.00 0.00 177.93 181.17 1z8s h MET 471 N -0.60 0.25 0.00 5.26 -1.53 0.28 -0.36 114.93 118.22 1z8s h MET 471 Ca -0.02 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.22 1z8s h MET 471 Cb 0.93 -0.06 0.00 0.00 -0.55 0.00 0.00 31.60 31.93 1z8s h MET 471 CO 0.03 0.16 0.00 -1.33 0.14 0.00 0.00 176.91 175.92 1z8s n MET 472 N -4.44 0.10 -0.03 0.39 2.81 0.11 -3.73 117.12 112.33 1z8s n MET 472 Ca 0.11 0.23 -0.05 0.00 -1.81 0.00 0.00 57.70 56.18 1z8s n MET 472 Cb 0.50 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.48 1z8s n MET 472 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1z8s n ARG 473 N -1.34 0.17 -4.78 0.03 1.85 -0.15 -3.03 116.66 109.40 1z8s n ARG 473 Ca 0.04 0.04 -0.33 0.00 -1.00 0.00 0.00 57.85 56.60 1z8s n ARG 473 Cb 0.08 -1.09 -0.12 0.00 -1.05 0.00 0.00 32.46 30.28 1z8s n ARG 473 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1z8s s SER 474 N -4.76 4.26 0.48 2.89 0.01 -1.19 -3.45 113.70 111.94 1z8s s SER 474 Ca -0.09 -0.14 0.21 0.00 1.31 0.00 0.00 55.95 57.24 1z8s s SER 474 Cb 0.02 -1.01 1.19 0.00 0.21 0.00 0.00 66.02 66.44 1z8s s SER 474 CO 0.15 0.34 2.01 0.08 0.41 0.00 0.00 173.24 176.24 1z8s h ARG 475 N 5.38 0.00 -0.04 12.44 0.11 -1.87 -1.25 114.38 129.15 1z8s h ARG 475 Ca -0.46 0.00 -0.02 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 0.51 0.17 -0.04 0.22 0.10 0.00 0.00 179.97 180.93 1z8s h ASP 476 N 0.00 0.11 -0.54 0.08 3.58 -1.95 -2.14 116.42 115.56 1z8s h ASP 476 Ca -0.00 -0.50 -0.02 0.00 0.42 0.00 0.00 57.03 56.93 1z8s h ASP 476 Cb 0.37 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.36 1z8s h ASP 476 CO 0.02 0.58 0.28 1.62 -2.88 0.00 0.00 179.24 178.87 1z8s h VAL 477 N -0.37 1.19 -0.64 2.25 3.04 -1.84 -0.48 116.25 119.39 1z8s h VAL 477 Ca 0.01 -0.52 0.06 0.00 -1.01 0.00 0.00 66.70 65.23 1z8s h VAL 477 Cb 0.55 0.45 -0.04 0.00 -2.01 0.00 0.00 31.29 30.25 1z8s h VAL 477 CO 0.01 0.22 0.42 0.00 -1.01 0.00 0.00 177.57 177.21 1z8s h ALA 478 N 1.50 1.77 -0.20 3.17 0.00 -1.05 0.49 119.26 124.95 1z8s h ALA 478 Ca 0.20 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1z8s h ALA 478 Cb 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1z8s h ALA 478 CO -0.03 0.13 -0.22 1.37 0.00 0.00 0.00 179.25 180.50 1z8s h LEU 479 N 0.65 0.35 -0.15 0.00 8.10 -0.42 -2.73 115.31 121.11 1z8s h LEU 479 Ca 0.27 -0.10 -0.01 0.00 0.11 0.00 0.00 57.88 58.15 1z8s h LEU 479 Cb 0.25 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.37 1z8s h LEU 479 CO -0.08 0.58 0.06 0.58 -4.11 0.00 0.00 178.44 175.47 1z8s h VAL 480 N 0.32 1.15 0.02 0.15 2.07 0.37 0.43 116.25 120.77 1z8s h VAL 480 Ca 0.05 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.13 1z8s h VAL 480 Cb 0.57 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1z8s h VAL 480 CO 0.04 0.14 -0.14 1.62 0.02 0.00 0.00 177.57 179.26 1z8s h VAL 481 N 0.08 0.67 -0.08 2.57 3.04 -1.06 0.93 116.25 122.41 1z8s h VAL 481 Ca 0.05 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.72 1z8s h VAL 481 Cb 0.17 0.67 -0.00 0.00 -2.01 0.00 0.00 31.29 30.12 1z8s h VAL 481 CO -0.00 0.00 -0.01 -0.61 -1.01 0.00 0.00 177.57 175.94 1z8s h GLN 482 N -0.24 0.14 0.08 4.17 -0.00 -1.42 -1.36 115.11 116.49 1z8s h GLN 482 Ca 0.04 -0.05 -0.12 0.00 -0.00 0.00 0.00 58.65 58.52 1z8s h GLN 482 Cb 0.29 -0.01 0.01 0.00 0.00 0.00 0.00 27.48 27.77 1z8s h GLN 482 CO -0.12 0.44 -0.52 1.49 0.00 0.00 0.00 178.83 180.12 1z8s h GLU 483 N -0.17 0.20 -0.01 1.69 4.22 -0.08 -3.36 114.58 117.08 1z8s h GLU 483 Ca 0.02 -0.33 0.00 0.00 0.08 0.00 0.00 59.36 59.13 1z8s h GLU 483 Cb 0.38 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1z8s h GLU 483 CO 0.01 1.14 -0.20 0.54 -2.18 0.00 0.00 179.01 178.32 1z8s n ARG 484 N -4.30 1.04 -3.93 1.92 5.12 0.32 -4.94 116.66 111.89 1z8s n ARG 484 Ca -0.12 -0.62 -0.09 0.00 -1.93 0.00 0.00 57.85 55.08 1z8s n ARG 484 Cb 0.69 -1.49 -0.07 0.00 -1.16 0.00 0.00 32.46 30.44 1z8s n ARG 484 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1z8s s ILE 485 N -2.38 0.08 0.00 0.55 2.07 -0.51 -4.80 121.20 116.20 1z8s s ILE 485 Ca 0.27 -1.31 0.00 0.00 -1.41 0.00 0.00 60.65 58.20 1z8s s ILE 485 Cb 0.20 -1.74 0.00 0.00 0.13 0.00 0.00 42.46 41.05 1z8s s ILE 485 CO 0.48 -0.35 0.00 0.61 -1.91 0.00 0.00 174.94 173.77 1z8s n GLY 486 N -0.20 3.04 0.00 1.50 0.00 -1.25 -4.13 105.19 104.15 1z8s n GLY 486 Ca -0.09 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.64 3.83 -0.02 0.00 -1.26 -5.04 105.19 101.06 1z8s n GLY 487 Ca 0.00 0.58 -0.31 0.00 0.00 0.00 0.00 46.02 46.29 1z8s n GLY 487 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1z8s s ARG 488 N 0.00 3.17 -0.07 1.61 6.06 -1.26 -5.05 118.95 123.40 1z8s s ARG 488 Ca 0.00 0.93 -0.10 0.00 -2.50 0.00 0.00 55.73 54.06 1z8s s ARG 488 Cb 0.00 -2.02 -0.05 0.00 0.06 0.00 0.00 34.95 32.94 1z8s s ARG 488 CO 0.00 -0.91 0.25 -0.59 -2.50 0.00 0.00 175.30 171.55 1z8s s PHE 489 N -3.00 3.65 0.00 5.12 -0.12 -1.26 -5.03 117.98 117.33 1z8s s PHE 489 Ca 0.58 0.72 0.00 0.00 -0.05 0.00 0.00 56.93 58.17 1z8s s PHE 489 Cb -0.13 -2.09 0.00 0.00 -0.63 0.00 0.00 43.02 40.16 1z8s s PHE 489 CO 0.52 0.68 0.00 0.09 -0.05 0.00 0.00 175.22 176.46 1z8s n ASN 490 N 1.98 1.11 -4.27 1.98 3.02 -1.26 -5.05 115.26 112.77 1z8s n ASN 490 Ca -0.17 -0.72 -0.35 0.00 -0.03 0.00 0.00 54.58 53.31 1z8s n ASN 490 Cb 0.54 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.79 1z8s n ASN 490 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1z8s n ILE 491 N 0.00 0.19 -0.07 2.41 5.41 -1.26 -4.13 119.36 121.91 1z8s n ILE 491 Ca 0.00 -0.33 -0.08 0.00 1.00 0.00 0.00 62.75 63.34 1z8s n ILE 491 Cb 0.00 -0.40 -0.01 0.00 -0.71 0.00 0.00 39.64 38.52 1z8s n ILE 491 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1z8s h GLU 492 N -1.19 0.23 -0.51 0.38 5.08 -2.00 1.00 114.58 117.57 1z8s h GLU 492 Ca -0.44 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 57.99 1z8s h GLU 492 Cb 1.30 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 1z8s h GLU 492 CO 0.32 0.15 0.35 1.49 -1.00 0.00 0.00 179.01 180.32 1z8s h GLU 493 N 0.24 0.33 0.00 2.33 4.22 -1.91 0.83 114.58 120.62 1z8s h GLU 493 Ca 0.12 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.54 1z8s h GLU 493 Cb 0.08 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1z8s h GLU 493 CO -0.12 0.22 -0.40 0.45 -2.18 0.00 0.00 179.01 176.98 1z8s h HIS 494 N 0.34 0.00 -0.58 0.92 3.86 -1.71 -1.75 115.15 116.23 1z8s h HIS 494 Ca 0.23 0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.55 1z8s h HIS 494 Cb 0.48 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 28.87 1z8s h HIS 494 CO -0.00 0.02 0.15 -0.09 0.86 0.00 0.00 177.93 178.87 1z8s h ARG 495 N -1.00 0.28 -0.09 2.45 1.12 0.11 -0.65 114.38 116.59 1z8s h ARG 495 Ca -0.00 -0.02 -0.17 0.00 -1.11 0.00 0.00 59.98 58.68 1z8s h ARG 495 Cb 0.40 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.29 1z8s h ARG 495 CO -0.00 0.19 -0.65 0.00 -3.11 0.00 0.00 179.97 176.39 1z8s h ALA 496 N 1.44 0.70 -0.10 2.80 0.00 0.55 -1.85 119.26 122.79 1z8s h ALA 496 Ca 0.30 -0.57 0.04 0.00 0.00 0.00 0.00 54.91 54.68 1z8s h ALA 496 Cb 0.42 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1z8s h ALA 496 CO -0.36 0.74 -0.33 1.25 0.00 0.00 0.00 179.25 180.55 1z8s h LEU 497 N 0.27 -1.01 -1.56 0.00 7.12 -0.19 1.23 115.31 121.16 1z8s h LEU 497 Ca -0.01 0.14 0.00 0.00 0.13 0.00 0.00 57.88 58.14 1z8s h LEU 497 Cb 1.20 0.42 -0.02 0.00 -0.53 0.00 0.00 40.66 41.73 1z8s h LEU 497 CO 0.11 -0.37 0.30 0.00 -0.13 0.00 0.00 178.44 178.35 1z8s h ALA 498 N 0.36 1.68 0.42 1.25 0.00 -1.39 -2.50 119.26 119.08 1z8s h ALA 498 Ca 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1z8s h ALA 498 Cb 0.56 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1z8s h ALA 498 CO -0.34 0.30 -0.20 0.00 0.00 0.00 0.00 179.25 179.01 1z8s h ALA 499 N 1.72 -0.62 0.00 0.00 0.00 0.52 -2.92 119.26 117.95 1z8s h ALA 499 Ca 0.17 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1z8s h ALA 499 Cb -0.07 0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1z8s h ALA 499 CO -0.04 -0.58 0.00 0.10 0.00 0.00 0.00 179.25 178.74 1z8s h TYR 500 N -1.04 0.00 -0.02 0.00 -0.00 0.13 -1.34 116.97 114.70 1z8s h TYR 500 Ca -0.06 0.00 -0.21 0.00 -0.00 0.00 0.00 58.73 58.46 1z8s h TYR 500 Cb 0.43 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.16 1z8s h TYR 500 CO 0.01 0.00 -0.89 -0.84 -0.00 0.00 0.00 178.16 176.44 1z8s h ILE 501 N 0.00 1.41 -0.76 -0.90 -0.00 -1.53 -1.79 117.51 113.94 1z8s h ILE 501 Ca 0.00 -2.40 -0.00 0.00 -0.00 0.00 0.00 64.86 62.45 1z8s h ILE 501 Cb 0.31 2.36 -0.04 0.00 -0.00 0.00 0.00 36.82 39.45 1z8s h ILE 501 CO 0.00 0.72 0.46 0.22 -0.00 0.00 0.00 178.15 179.55 1z8s h TYR 502 N 0.23 1.00 -0.38 0.16 3.20 -1.05 -1.10 116.97 119.03 1z8s h TYR 502 Ca -0.06 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.73 1z8s h TYR 502 Cb 1.51 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 1z8s h TYR 502 CO 0.05 0.67 -0.09 0.00 -1.64 0.00 0.00 178.16 177.15 1z8s h ALA 503 N 1.25 1.12 -0.95 1.82 0.00 -1.38 -2.54 119.26 118.57 1z8s h ALA 503 Ca 0.27 -0.29 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1z8s h ALA 503 Cb -0.04 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.51 1z8s h ALA 503 CO -0.05 0.55 0.61 0.74 0.00 0.00 0.00 179.25 181.10 1z8s h PHE 504 N 0.61 1.02 -0.88 0.00 -1.00 -0.30 0.04 116.94 116.43 1z8s h PHE 504 Ca 0.11 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.93 1z8s h PHE 504 Cb 0.52 -0.33 -0.04 0.00 3.61 0.00 0.00 35.95 39.71 1z8s h PHE 504 CO 0.02 0.41 0.58 1.88 -1.61 0.00 0.00 178.31 179.59 1z8s h TYR 505 N 0.90 1.11 -0.73 -0.55 0.05 -0.98 -1.62 116.97 115.15 1z8s h TYR 505 Ca 0.47 0.02 0.03 0.00 0.05 0.00 0.00 58.73 59.30 1z8s h TYR 505 Cb 0.53 -0.38 -0.04 0.00 1.01 0.00 0.00 36.73 37.85 1z8s h TYR 505 CO -0.00 0.71 0.48 0.93 -1.05 0.00 0.00 178.16 179.23 1z8s h GLU 506 N 1.20 0.90 -0.02 4.88 4.39 -1.01 -2.49 114.58 122.43 1z8s h GLU 506 Ca 0.32 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.98 1z8s h GLU 506 Cb -0.13 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.31 1z8s h GLU 506 CO -0.07 0.59 -0.03 0.93 -1.16 0.00 0.00 179.01 179.28 1z8s h GLU 507 N 0.92 -0.04 0.00 2.33 5.08 -0.89 -3.48 114.58 118.50 1z8s h GLU 507 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1z8s h GLU 507 Cb 0.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1z8s h GLU 507 CO -0.08 -0.03 0.00 0.41 -1.00 0.00 0.00 179.01 178.32 1z8s n GLY 508 N -1.13 0.59 0.00 -3.84 0.00 -0.94 -4.99 105.19 94.88 1z8s n GLY 508 Ca -0.06 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1z8s n GLY 508 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1z8s n HIS 509 N 0.00 0.00 -0.41 1.61 1.44 -1.26 -5.10 115.22 111.50 1z8s n HIS 509 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1z8s n HIS 509 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1z8s n HIS 509 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 1z8s n GLU 510 N 0.00 0.00 0.00 -1.40 0.00 -1.22 -4.80 120.64 113.22 1z8s n GLU 510 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1z8s n GLU 510 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1z8s n GLU 510 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1z8s n ALA 511 N 0.39 0.00 -1.90 -1.84 0.00 -1.26 -4.82 120.51 111.08 1z8s n ALA 511 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1z8s n ALA 511 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1z8s n ALA 511 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1z8s n ASP 512 N -2.20 -3.14 0.01 0.00 -0.08 -1.22 -4.14 116.55 105.79 1z8s n ASP 512 Ca 0.00 0.48 -0.13 0.00 -1.51 0.00 0.00 54.79 53.64 1z8s n ASP 512 Cb 0.00 -2.47 -0.06 0.00 2.34 0.00 0.00 41.12 40.92 1z8s n ASP 512 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1z8s h PRO 513 N 1.16 -0.49 -0.53 -0.67 0.11 -1.77 1.15 132.00 130.97 1z8s h PRO 513 Ca -0.07 0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.16 1z8s h PRO 513 Cb 0.15 0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 1z8s h PRO 513 CO 0.02 -0.33 0.36 0.78 -0.21 0.00 0.00 178.00 178.62 1z8s h GLY 514 N -0.51 0.46 1.30 -0.55 0.00 -1.92 0.80 103.07 102.66 1z8s h GLY 514 Ca 0.07 -0.14 -0.33 0.00 0.00 0.00 0.00 47.33 46.93 1z8s h GLY 514 CO -0.38 0.09 -1.47 0.00 0.00 0.00 0.00 176.54 174.78 1z8s h ALA 515 N 1.73 -0.10 0.10 3.60 0.00 -1.51 -3.19 119.26 119.89 1z8s h ALA 515 Ca 0.24 -0.89 -0.00 0.00 0.00 0.00 0.00 54.91 54.26 1z8s h ALA 515 Cb 0.51 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1z8s h ALA 515 CO -0.06 0.76 -0.05 1.25 0.00 0.00 0.00 179.25 181.16 1z8s h LEU 516 N 0.13 -0.12 -2.01 0.00 6.46 0.22 -3.28 115.31 116.72 1z8s h LEU 516 Ca -0.24 -0.37 0.13 0.00 -0.12 0.00 0.00 57.88 57.27 1z8s h LEU 516 Cb 2.14 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 42.08 1z8s h LEU 516 CO 0.26 0.51 0.32 0.40 -0.62 0.00 0.00 178.44 179.31 1z8s h ILE 517 N -0.95 0.77 -1.72 4.05 1.08 0.41 -0.40 117.51 120.74 1z8s h ILE 517 Ca -0.01 0.00 -0.73 0.00 -0.39 0.00 0.00 64.86 63.72 1z8s h ILE 517 Cb 0.48 0.78 -0.27 0.00 -3.07 0.00 0.00 36.82 34.74 1z8s h ILE 517 CO 0.02 0.00 0.99 -0.24 -0.69 0.00 0.00 178.15 178.23 1z8s n SER 518 N -4.38 7.52 0.00 1.72 2.88 -1.20 -4.21 113.62 115.94 1z8s n SER 518 Ca 0.07 -3.79 0.00 0.00 -1.33 0.00 0.00 58.87 53.82 1z8s n SER 518 Cb 0.52 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 1z8s n SER 518 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1z8s n ARG 519 N -0.55 0.00 -1.55 -1.46 3.00 -0.16 -4.90 116.66 111.04 1z8s n ARG 519 Ca 0.55 0.00 -0.45 0.00 -0.00 0.00 0.00 57.85 57.96 1z8s n ARG 519 Cb 0.34 -0.51 -0.02 0.00 0.00 0.00 0.00 32.46 32.28 1z8s n ARG 519 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 1z8s n ILE 520 N -1.98 2.00 0.00 5.15 -0.00 -1.24 -4.88 119.36 118.42 1z8s n ILE 520 Ca 0.00 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.25 1z8s n ILE 520 Cb 0.13 -0.81 0.00 0.00 -0.00 0.00 0.00 39.64 38.97 1z8s n ILE 520 CO 0.00 0.00 0.00 -2.65 -0.00 0.00 0.00 176.55 173.90 1z8s n PRO 521 N 0.74 0.00 0.00 6.28 -0.01 -1.26 -4.50 135.00 136.25 1z8s n PRO 521 Ca 0.11 0.20 0.00 0.00 -0.01 0.00 0.00 63.50 63.80 1z8s n PRO 521 Cb 0.32 -0.48 0.00 0.00 -0.01 0.00 0.00 33.50 33.33 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 -0.58 -0.03 0.52 -1.23 0.00 -1.26 -4.87 105.19 97.74 1z8s n GLY 522 Ca 0.00 0.04 0.32 0.00 0.00 0.00 0.00 46.02 46.37 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 5.08 -2.03 0.94 114.58 120.18 1z8s h GLU 523 Ca 0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1z8s h GLU 523 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1z8s h GLU 523 CO 0.00 0.00 -0.49 -0.07 -1.00 0.00 0.00 179.01 177.45 1z8s h LEU 524 N 0.00 0.00 0.11 1.33 4.07 -1.91 -2.70 115.31 116.21 1z8s h LEU 524 Ca 0.50 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.47 1z8s h LEU 524 Cb 2.36 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 44.06 1z8s h LEU 524 CO -0.01 0.49 -0.46 1.56 -1.08 0.00 0.00 178.44 178.94 1z8s h GLN 525 N 0.00 -0.64 -0.46 1.13 1.08 0.71 0.68 115.11 117.61 1z8s h GLN 525 Ca -0.00 0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.18 1z8s h GLN 525 Cb 0.96 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 28.52 1z8s h GLN 525 CO 0.06 -0.42 0.03 -1.00 -0.95 0.00 0.00 178.83 176.55 1z8s h PRO 526 N -0.66 0.74 0.55 1.46 0.13 -1.69 -1.46 132.00 131.08 1z8s h PRO 526 Ca -0.01 -0.18 -0.03 0.00 -0.87 0.00 0.00 66.00 64.92 1z8s h PRO 526 Cb 0.66 -0.10 0.01 0.00 0.13 0.00 0.00 31.00 31.70 1z8s h PRO 526 CO -0.25 0.73 -0.27 -0.07 -0.23 0.00 0.00 178.00 177.92 1z8s h LEU 527 N 0.70 -0.63 -1.42 1.56 3.38 -1.06 -2.62 115.31 115.23 1z8s h LEU 527 Ca 0.14 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1z8s h LEU 527 Cb 0.39 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1z8s h LEU 527 CO 0.01 -0.35 0.20 0.00 0.09 0.00 0.00 178.44 178.40 1z8s h ALA 528 N -0.53 1.55 -0.46 1.53 0.00 0.35 -1.42 119.26 120.28 1z8s h ALA 528 Ca -0.08 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.81 1z8s h ALA 528 Cb 0.62 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1z8s h ALA 528 CO 0.12 0.36 0.13 1.03 0.00 0.00 0.00 179.25 180.90 1z8s h SER 529 N 0.60 0.10 0.62 0.00 0.87 -1.12 0.59 113.55 115.21 1z8s h SER 529 Ca 0.15 0.07 -0.13 0.00 -1.23 0.00 0.00 61.79 60.65 1z8s h SER 529 Cb 0.07 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 1z8s h SER 529 CO -0.02 0.09 -0.61 -0.33 -0.53 0.00 0.00 176.83 175.43 1z8s h GLU 530 N 0.29 0.00 0.00 2.24 4.39 -1.07 -2.84 114.58 117.59 1z8s h GLU 530 Ca 0.22 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.92 1z8s h GLU 530 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1z8s h GLU 530 CO -0.25 0.61 0.00 1.25 -1.16 0.00 0.00 179.01 179.46 1z8s h LEU 531 N 0.00 0.00 -1.67 1.33 5.85 -0.02 -3.31 115.31 117.49 1z8s h LEU 531 Ca -0.01 0.00 0.26 0.00 0.84 0.00 0.00 57.88 58.98 1z8s h LEU 531 Cb 1.08 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 1z8s h LEU 531 CO 0.08 0.00 0.87 -1.28 -0.34 0.00 0.00 178.44 177.77 1z8s h SER 532 N 0.00 0.00 -1.82 1.25 0.87 0.37 -2.17 113.55 112.05 1z8s h SER 532 Ca 0.00 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 60.09 1z8s h SER 532 Cb 0.68 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 62.24 1z8s h SER 532 CO 0.00 0.00 -1.11 -0.11 -0.53 0.00 0.00 176.83 175.08 1z8s n LEU 533 N -3.66 1.55 0.07 2.23 7.94 -1.25 -4.53 117.00 119.36 1z8s n LEU 533 Ca 0.19 -4.84 0.12 0.00 -1.11 0.00 0.00 56.01 50.38 1z8s n LEU 533 Cb 1.17 0.46 0.29 0.00 0.53 0.00 0.00 43.42 45.87 1z8s n LEU 533 CO 0.30 2.15 0.59 0.18 -1.11 0.00 0.00 177.39 179.51 1z8s n LEU 534 N 0.12 0.70 0.00 -1.96 4.77 -0.82 -4.61 117.00 115.20 1z8s n LEU 534 Ca 0.23 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 1z8s n LEU 534 Cb 0.66 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1z8s n LEU 534 CO 0.24 -0.09 0.00 -0.11 -1.33 0.00 0.00 177.39 176.10 1z8s n LEU 535 N -2.10 0.00 -3.65 2.23 7.94 -1.26 -4.84 117.00 115.32 1z8s n LEU 535 Ca 0.04 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.84 1z8s n LEU 535 Cb 0.42 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.30 1z8s n LEU 535 CO 0.33 0.00 0.33 0.27 -1.11 0.00 0.00 177.39 177.22 1z8s s ILE 536 N 0.00 -0.00 -0.27 1.96 -0.00 -1.26 -3.06 121.20 118.56 1z8s s ILE 536 Ca 0.00 0.01 -0.04 0.00 -0.00 0.00 0.00 60.65 60.62 1z8s s ILE 536 Cb 0.00 -0.94 0.09 0.00 -0.00 0.00 0.00 42.46 41.61 1z8s s ILE 536 CO 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 174.94 175.06 1z8s s ALA 537 N 1.08 0.73 0.00 2.27 0.00 -1.26 -4.77 121.76 119.81 1z8s s ALA 537 Ca -0.06 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1z8s s ALA 537 Cb -0.05 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.70 1z8s s ALA 537 CO -0.11 -1.58 0.00 -3.47 0.00 0.00 0.00 175.76 170.61 1z8s n ASP 538 N 5.19 0.00 -0.68 0.00 -0.08 -1.26 -2.89 116.55 116.83 1z8s n ASP 538 Ca -0.06 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.29 1z8s n ASP 538 Cb 0.43 0.00 0.15 0.00 2.34 0.00 0.00 41.12 44.04 1z8s n ASP 538 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1z8s n ASP 539 N 0.84 2.83 -1.44 1.67 8.00 -1.26 -5.10 116.55 122.10 1z8s n ASP 539 Ca 0.00 -1.89 0.13 0.00 0.71 0.00 0.00 54.79 53.74 1z8s n ASP 539 Cb 0.00 -0.20 -0.07 0.00 -0.02 0.00 0.00 41.12 40.82 1z8s n ASP 539 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1z8s n VAL 540 N 0.67 -1.30 -2.37 2.53 0.31 -1.14 -4.32 118.33 112.71 1z8s n VAL 540 Ca 0.12 1.01 -0.43 0.00 -0.01 0.00 0.00 64.34 65.03 1z8s n VAL 540 Cb 0.42 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 1z8s n VAL 540 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1z8s n SER 541 N -3.93 4.70 -0.23 4.52 2.88 -1.17 -4.63 113.62 115.75 1z8s n SER 541 Ca -0.07 -2.93 0.04 0.00 -1.33 0.00 0.00 58.87 54.58 1z8s n SER 541 Cb 0.61 -1.66 0.16 0.00 -0.75 0.00 0.00 64.21 62.56 1z8s n SER 541 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1z8s h GLU 542 N 6.82 0.21 -0.60 -1.46 4.11 -1.90 0.96 114.58 122.71 1z8s h GLU 542 Ca 0.46 -0.01 0.10 0.00 0.07 0.00 0.00 59.36 59.97 1z8s h GLU 542 Cb 0.77 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.90 1z8s h GLU 542 CO 1.57 0.14 0.20 1.96 0.07 0.00 0.00 179.01 182.95 1z8s h GLN 543 N 0.22 0.36 -0.19 1.06 7.50 -1.97 0.20 115.11 122.29 1z8s h GLN 543 Ca 0.39 -0.02 -0.11 0.00 0.50 0.00 0.00 58.65 59.41 1z8s h GLN 543 Cb 0.65 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 28.09 1z8s h GLN 543 CO -0.52 0.23 -0.35 0.93 -1.50 0.00 0.00 178.83 177.63 1z8s h GLU 544 N 0.37 0.40 -0.24 1.46 4.39 -1.14 -2.37 114.58 117.45 1z8s h GLU 544 Ca 0.31 -0.18 0.05 0.00 0.34 0.00 0.00 59.36 59.89 1z8s h GLU 544 Cb 0.41 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.99 1z8s h GLU 544 CO -0.33 0.70 -0.11 1.25 -1.16 0.00 0.00 179.01 179.35 1z8s h LEU 545 N 0.34 -0.38 -0.93 1.33 5.85 0.40 0.59 115.31 122.50 1z8s h LEU 545 Ca 0.04 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1z8s h LEU 545 Cb 0.78 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 1z8s h LEU 545 CO 0.06 -0.15 -0.29 -0.08 -0.34 0.00 0.00 178.44 177.64 1z8s h GLU 546 N -0.08 0.00 0.08 1.25 4.57 -1.35 -2.61 114.58 116.43 1z8s h GLU 546 Ca 0.13 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1z8s h GLU 546 Cb 0.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1z8s h GLU 546 CO -0.29 0.29 -0.04 -0.44 -1.18 0.00 0.00 179.01 177.35 1z8s h ASP 547 N 0.00 -0.09 0.69 1.04 3.32 -0.36 -2.82 116.42 118.20 1z8s h ASP 547 Ca -0.00 -0.50 -0.10 0.00 0.02 0.00 0.00 57.03 56.45 1z8s h ASP 547 Cb 0.86 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 1z8s h ASP 547 CO 0.04 0.50 -0.49 0.10 -1.72 0.00 0.00 179.24 177.67 1z8s h TYR 548 N -0.74 0.00 0.48 4.55 -0.00 -0.00 -2.39 116.97 118.87 1z8s h TYR 548 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.70 1z8s h TYR 548 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.32 1z8s h TYR 548 CO 0.12 0.49 -0.23 0.82 -0.00 0.00 0.00 178.16 179.35 1z8s h ILE 549 N 0.00 0.50 -0.69 -0.90 2.04 -1.53 -2.27 117.51 114.66 1z8s h ILE 549 Ca -0.00 -0.22 0.13 0.00 1.00 0.00 0.00 64.86 65.77 1z8s h ILE 549 Cb 0.97 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 1z8s h ILE 549 CO 0.06 0.04 0.46 0.08 0.00 0.00 0.00 178.15 178.79 1z8s h ARG 550 N -0.78 0.38 -0.71 2.37 0.11 -1.47 0.16 114.38 114.44 1z8s h ARG 550 Ca -0.07 -0.02 0.06 0.00 0.10 0.00 0.00 59.98 60.06 1z8s h ARG 550 Cb 0.56 -0.08 -0.06 0.00 1.11 0.00 0.00 29.97 31.49 1z8s h ARG 550 CO 0.11 0.25 0.40 0.45 0.10 0.00 0.00 179.97 181.28 1z8s h HIS 551 N 0.39 0.73 -0.04 4.08 3.86 -0.88 0.76 115.15 124.05 1z8s h HIS 551 Ca 0.33 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.48 1z8s h HIS 551 Cb 0.76 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 1z8s h HIS 551 CO -0.00 0.34 -0.40 0.28 0.86 0.00 0.00 177.93 179.01 1z8s h VAL 552 N 0.73 1.30 0.10 2.45 2.07 -0.47 -3.24 116.25 119.18 1z8s h VAL 552 Ca 0.32 -1.42 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 1z8s h VAL 552 Cb 0.21 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1z8s h VAL 552 CO -0.19 0.41 -0.05 0.25 0.02 0.00 0.00 177.57 178.01 1z8s h LEU 553 N 0.07 -0.11 -0.11 2.57 6.46 -0.61 -3.46 115.31 120.12 1z8s h LEU 553 Ca 0.00 -0.31 -0.00 0.00 -0.12 0.00 0.00 57.88 57.45 1z8s h LEU 553 Cb 0.74 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.70 1z8s h LEU 553 CO 0.05 0.50 -0.03 -0.46 -0.62 0.00 0.00 178.44 177.88 1z8s n ASN 554 N -4.83 -0.21 0.00 1.25 6.94 0.25 -4.62 115.26 114.04 1z8s n ASN 554 Ca -0.05 0.01 0.00 0.00 -0.02 0.00 0.00 54.58 54.52 1z8s n ASN 554 Cb 0.21 -0.05 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 1z8s n ASN 554 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1z8s n ARG 555 N 0.45 0.00 -0.05 -3.83 1.74 -1.26 -5.01 116.66 108.69 1z8s n ARG 555 Ca -0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 1z8s n ARG 555 Cb 0.02 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.33 1z8s n ARG 555 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1z8s h PRO 556 N 0.00 0.12 -6.25 5.56 0.13 -1.82 -3.36 132.00 126.38 1z8s h PRO 556 Ca 0.00 -0.20 -0.56 0.00 -0.87 0.00 0.00 66.00 64.37 1z8s h PRO 556 Cb 0.00 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.18 1z8s h PRO 556 CO 0.00 1.10 0.77 0.15 -0.23 0.00 0.00 178.00 179.78 1z8s s LYS 557 N -2.43 4.31 0.23 0.86 1.02 -1.26 -4.91 119.74 117.56 1z8s s LYS 557 Ca -0.25 1.65 0.12 0.00 0.02 0.00 0.00 55.97 57.51 1z8s s LYS 557 Cb 0.05 -3.63 0.12 0.00 -0.52 0.00 0.00 37.83 33.86 1z8s s LYS 557 CO 0.68 -0.53 1.47 0.11 -0.92 0.00 0.00 175.35 176.15 1z8s h TRP 558 N 7.69 0.00 -0.26 3.18 5.08 -1.97 -3.18 115.95 126.49 1z8s h TRP 558 Ca -0.31 0.00 0.08 0.00 1.08 0.00 0.00 58.89 59.74 1z8s h TRP 558 Cb 1.14 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.29 1z8s h TRP 558 CO 0.75 0.70 0.48 -0.07 -1.28 0.00 0.00 178.44 179.02 1z8s h LEU 559 N 0.00 0.00 -1.06 0.11 -0.00 -2.00 1.19 115.31 113.56 1z8s h LEU 559 Ca -0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 1z8s h LEU 559 Cb 1.39 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 42.01 1z8s h LEU 559 CO 0.09 0.00 0.38 -0.03 -0.00 0.00 0.00 178.44 178.88 1z8s h MET 560 N 0.00 1.04 -0.21 1.13 4.05 -1.91 -0.85 114.93 118.19 1z8s h MET 560 Ca 0.12 -0.13 -0.12 0.00 -0.28 0.00 0.00 59.70 59.29 1z8s h MET 560 Cb 1.07 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.66 1z8s h MET 560 CO -0.00 0.79 -0.39 1.25 0.23 0.00 0.00 176.91 178.78 1z8s h LEU 561 N 1.04 0.50 -0.87 3.39 7.12 0.12 -1.77 115.31 124.84 1z8s h LEU 561 Ca 0.26 -0.21 0.03 0.00 0.13 0.00 0.00 57.88 58.09 1z8s h LEU 561 Cb 0.07 -0.14 -0.05 0.00 -0.53 0.00 0.00 40.66 40.01 1z8s h LEU 561 CO -0.04 0.84 0.57 0.50 -0.13 0.00 0.00 178.44 180.18 1z8s h LYS 562 N 0.39 1.07 0.16 1.25 3.11 -0.80 1.02 116.57 122.78 1z8s h LYS 562 Ca 0.04 -0.06 -0.01 0.00 -2.81 0.00 0.00 60.65 57.80 1z8s h LYS 562 Cb 0.86 -0.24 0.00 0.00 -1.00 0.00 0.00 32.23 31.85 1z8s h LYS 562 CO 0.07 0.71 -0.08 0.28 -2.81 0.00 0.00 179.45 177.63 1z8s h VAL 563 N 1.11 0.95 -0.15 2.00 2.07 -1.02 -2.27 116.25 118.94 1z8s h VAL 563 Ca 0.34 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.34 1z8s h VAL 563 Cb -0.02 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1z8s h VAL 563 CO -0.11 0.13 0.11 0.11 0.02 0.00 0.00 177.57 177.82 1z8s h LYS 564 N -0.48 0.06 -0.82 1.57 1.57 -0.82 -0.79 116.57 116.86 1z8s h LYS 564 Ca -0.02 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1z8s h LYS 564 Cb 0.37 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 1z8s h LYS 564 CO 0.04 0.04 0.37 1.49 -0.57 0.00 0.00 179.45 180.81 1z8s h GLU 565 N 0.06 1.20 -0.43 3.15 4.81 0.15 0.98 114.58 124.51 1z8s h GLU 565 Ca 0.07 -0.19 -0.14 0.00 -0.13 0.00 0.00 59.36 58.96 1z8s h GLU 565 Cb 0.20 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1z8s h GLU 565 CO -0.01 0.94 -0.29 0.37 -0.73 0.00 0.00 179.01 179.29 1z8s h GLN 566 N 1.18 0.96 -0.03 1.92 -0.00 -0.59 1.18 115.11 119.72 1z8s h GLN 566 Ca 0.28 -0.46 -0.17 0.00 -0.00 0.00 0.00 58.65 58.30 1z8s h GLN 566 Cb 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.62 1z8s h GLN 566 CO -0.03 1.12 -0.75 0.93 0.00 0.00 0.00 178.83 180.10 1z8s h GLU 567 N 0.80 0.21 -0.10 1.69 4.39 -1.22 -1.66 114.58 118.68 1z8s h GLU 567 Ca 0.09 -0.18 -0.15 0.00 0.34 0.00 0.00 59.36 59.45 1z8s h GLU 567 Cb 0.88 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 1z8s h GLU 567 CO 0.08 0.86 -0.59 0.87 -1.16 0.00 0.00 179.01 179.07 1z8s h LYS 568 N 0.14 0.33 0.24 2.33 6.56 0.13 -1.68 116.57 124.62 1z8s h LYS 568 Ca -0.03 -0.22 -0.01 0.00 -1.06 0.00 0.00 60.65 59.33 1z8s h LYS 568 Cb 1.32 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 33.01 1z8s h LYS 568 CO 0.11 0.83 -0.12 1.15 -2.06 0.00 0.00 179.45 179.36 1z8s h THR 569 N 0.25 0.79 -0.18 -0.16 2.02 0.17 0.52 112.91 116.32 1z8s h THR 569 Ca -0.00 -0.74 0.05 0.00 0.77 0.00 0.00 66.41 66.48 1z8s h THR 569 Cb 1.10 1.18 -0.05 0.00 -1.74 0.00 0.00 68.15 68.65 1z8s h THR 569 CO 0.10 0.15 -0.13 -0.33 0.37 0.00 0.00 175.52 175.67 1z8s h GLU 570 N -0.74 -0.13 0.00 6.66 5.08 -1.32 0.59 114.58 124.72 1z8s h GLU 570 Ca -0.03 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1z8s h GLU 570 Cb 0.50 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1z8s h GLU 570 CO 0.05 -0.09 -0.25 0.00 -1.00 0.00 0.00 179.01 177.73 1z8s h ALA 571 N 0.98 1.50 -0.48 3.43 0.00 -1.33 -2.44 119.26 120.92 1z8s h ALA 571 Ca 0.11 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1z8s h ALA 571 Cb 0.30 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1z8s h ALA 571 CO -0.26 0.31 0.13 1.49 0.00 0.00 0.00 179.25 180.92 1z8s h GLU 572 N 0.00 0.27 0.01 0.00 4.22 0.24 3.13 114.58 122.45 1z8s h GLU 572 Ca -0.00 -0.02 -0.19 0.00 0.08 0.00 0.00 59.36 59.23 1z8s h GLU 572 Cb 0.47 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1z8s h GLU 572 CO 0.03 0.18 -0.87 0.07 -2.18 0.00 0.00 179.01 176.25 1z8s h ARG 573 N 0.28 0.11 0.00 1.92 0.11 -1.20 -3.30 114.38 112.31 1z8s h ARG 573 Ca 0.24 -0.13 -0.20 0.00 0.10 0.00 0.00 59.98 59.99 1z8s h ARG 573 Cb 0.28 0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.37 1z8s h ARG 573 CO -0.28 0.91 -1.34 0.00 0.10 0.00 0.00 179.97 179.36 1z8s h ARG 574 N 0.06 0.00 0.00 0.08 2.47 -0.91 -3.47 114.38 112.61 1z8s h ARG 574 Ca -0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1z8s h ARG 574 Cb 1.50 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.82 1z8s h ARG 574 CO 0.12 0.43 0.00 1.63 0.56 0.00 0.00 179.97 182.72 1z8s n LYS 575 N -3.01 0.27 0.00 0.04 4.76 1.04 -5.00 118.16 116.25 1z8s n LYS 575 Ca -0.09 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.35 1z8s n LYS 575 Cb 0.89 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 34.08 1z8s n LYS 575 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1z8s n ASP 576 N -2.70 0.00 -4.66 4.39 8.00 -1.26 -4.67 116.55 115.65 1z8s n ASP 576 Ca 0.00 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 1z8s n ASP 576 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.05 1z8s n ASP 576 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1z8s s PHE 577 N 0.00 3.38 -1.77 1.24 0.08 -1.26 -1.41 117.98 118.24 1z8s s PHE 577 Ca 0.00 1.13 0.00 0.00 0.12 0.00 0.00 56.93 58.18 1z8s s PHE 577 Cb 0.00 -2.97 0.00 0.00 -0.57 0.00 0.00 43.02 39.48 1z8s s PHE 577 CO 0.00 -0.27 0.00 1.28 -0.10 0.00 0.00 175.22 176.13 1z8s n LEU 578 N 5.41 -1.42 0.00 -0.37 4.77 -1.26 -4.60 117.00 119.54 1z8s n LEU 578 Ca 0.03 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 1z8s n LEU 578 Cb 0.49 -2.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.01 1z8s n LEU 578 CO 0.47 -0.68 0.00 0.35 -1.33 0.00 0.00 177.39 176.19 1z8s n THR 579 N -2.71 0.00 0.09 -5.08 -2.24 -1.24 -4.83 114.28 98.27 1z8s n THR 579 Ca -0.19 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 61.78 1z8s n THR 579 Cb 0.61 -0.12 0.74 0.00 -2.10 0.00 0.00 70.33 69.46 1z8s n THR 579 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1z8s h ALA 580 N 0.00 2.20 -0.80 6.98 0.00 -1.49 0.23 119.26 126.38 1z8s h ALA 580 Ca 0.00 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.13 1z8s h ALA 580 Cb 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1z8s h ALA 580 CO 0.00 -0.53 0.63 0.00 0.00 0.00 0.00 179.25 179.35 1z8s h ALA 581 N 1.70 2.70 -0.32 0.00 0.00 -1.88 0.61 119.26 122.06 1z8s h ALA 581 Ca 0.18 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1z8s h ALA 581 Cb 0.85 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1z8s h ALA 581 CO -0.00 -1.05 0.16 0.00 0.00 0.00 0.00 179.25 178.36 1z8s h ARG 582 N 0.00 0.46 0.10 0.00 3.08 -0.90 -0.16 114.38 116.96 1z8s h ARG 582 Ca 0.38 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.36 1z8s h ARG 582 Cb 1.64 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.61 1z8s h ARG 582 CO -0.00 0.42 -0.05 0.82 -1.07 0.00 0.00 179.97 180.09 1z8s h ILE 583 N 0.39 1.13 -0.59 2.04 1.08 -1.06 -2.47 117.51 118.02 1z8s h ILE 583 Ca 0.11 -1.15 -0.01 0.00 -0.39 0.00 0.00 64.86 63.42 1z8s h ILE 583 Cb 0.11 1.84 -0.03 0.00 -3.07 0.00 0.00 36.82 35.66 1z8s h ILE 583 CO -0.01 0.27 0.33 0.00 -0.69 0.00 0.00 178.15 178.05 1z8s h ALA 584 N 0.09 1.47 -0.25 1.87 0.00 -1.46 -2.41 119.26 118.56 1z8s h ALA 584 Ca -0.01 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 1z8s h ALA 584 Cb 0.54 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1z8s h ALA 584 CO 0.02 0.44 -0.45 -0.22 0.00 0.00 0.00 179.25 179.05 1z8s h LYS 585 N 0.82 0.65 0.14 0.00 1.63 -1.08 -2.61 116.57 116.12 1z8s h LYS 585 Ca 0.21 -0.36 -0.01 0.00 -0.85 0.00 0.00 60.65 59.64 1z8s h LYS 585 Cb 0.01 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1z8s h LYS 585 CO -0.04 0.97 -0.07 1.49 -3.45 0.00 0.00 179.45 178.36 1z8s h GLU 586 N 0.52 -0.18 0.45 1.90 4.57 -1.01 -1.27 114.58 119.56 1z8s h GLU 586 Ca 0.03 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1z8s h GLU 586 Cb 0.99 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.61 1z8s h GLU 586 CO 0.09 0.21 -0.34 1.98 -1.18 0.00 0.00 179.01 179.77 1z8s h MET 587 N -0.61 -0.74 -0.74 1.92 4.05 -1.53 0.39 114.93 117.66 1z8s h MET 587 Ca -0.02 0.05 0.21 0.00 -0.28 0.00 0.00 59.70 59.66 1z8s h MET 587 Cb 0.47 0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 31.41 1z8s h MET 587 CO 0.03 -0.50 0.53 0.82 0.23 0.00 0.00 176.91 178.03 1z8s h ILE 588 N -0.77 0.63 -0.19 1.77 5.03 -1.55 1.11 117.51 123.54 1z8s h ILE 588 Ca -0.04 -0.01 -0.20 0.00 -0.12 0.00 0.00 64.86 64.49 1z8s h ILE 588 Cb 0.66 0.62 0.00 0.00 -3.03 0.00 0.00 36.82 35.07 1z8s h ILE 588 CO 0.00 0.00 -0.68 -0.33 -0.68 0.00 0.00 178.15 176.47 1z8s h GLU 589 N 0.02 0.73 -0.02 2.37 4.39 0.15 -2.22 114.58 120.00 1z8s h GLU 589 Ca 0.35 -0.54 -0.13 0.00 0.34 0.00 0.00 59.36 59.38 1z8s h GLU 589 Cb 1.40 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 30.12 1z8s h GLU 589 CO -0.01 1.16 -0.60 0.52 -1.16 0.00 0.00 179.01 178.92 1z8s h MET 590 N 0.53 0.07 -0.04 2.33 2.86 0.48 -2.58 114.93 118.58 1z8s h MET 590 Ca -0.02 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.47 1z8s h MET 590 Cb 1.28 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.94 1z8s h MET 590 CO 0.14 0.65 -0.45 0.87 1.06 0.00 0.00 176.91 179.18 1z8s h LYS 591 N 0.05 0.08 -0.16 1.72 1.57 0.98 -1.94 116.57 118.87 1z8s h LYS 591 Ca -0.01 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1z8s h LYS 591 Cb 1.07 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.38 1z8s h LYS 591 CO 0.08 0.52 -0.18 -0.22 -0.57 0.00 0.00 179.45 179.08 1z8s h LYS 592 N 0.07 0.40 0.00 3.15 3.11 -1.08 -0.80 116.57 121.42 1z8s h LYS 592 Ca 0.00 -0.22 -0.03 0.00 -2.81 0.00 0.00 60.65 57.59 1z8s h LYS 592 Cb 0.82 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 32.06 1z8s h LYS 592 CO 0.06 0.79 -0.16 0.00 -2.81 0.00 0.00 179.45 177.33 1z8s h MET 593 N 0.03 0.00 0.02 1.90 -0.00 -1.34 -3.18 114.93 112.37 1z8s h MET 593 Ca 0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.63 1z8s h MET 593 Cb 0.73 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.32 1z8s h MET 593 CO 0.04 0.16 -0.49 -0.07 -0.00 0.00 0.00 176.91 176.55 1z8s h LEU 594 N 0.00 0.07 0.00 -0.10 3.38 -1.25 -3.41 115.31 114.00 1z8s h LEU 594 Ca -0.00 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.11 1z8s h LEU 594 Cb 0.53 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1z8s h LEU 594 CO 0.02 1.20 0.00 -1.20 0.09 0.00 0.00 178.44 178.55 1z8s n SER 595 N -4.47 0.71 0.01 -0.43 7.64 -0.32 -5.06 113.62 111.70 1z8s n SER 595 Ca -0.17 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.11 1z8s n SER 595 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1z8s n SER 595 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1z8s n SER 596 N -1.38 -0.10 0.00 6.43 2.88 -1.26 -4.71 113.62 115.48 1z8s n SER 596 Ca 0.00 0.51 0.15 0.00 -1.33 0.00 0.00 58.87 58.20 1z8s n SER 596 Cb 0.00 0.58 0.89 0.00 -0.75 0.00 0.00 64.21 64.93 1z8s n SER 596 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61