#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 1.73 -3.45 3.04 0.00 -1.26 -4.87 120.51 115.70 1z8s n ALA 453 Ca 0.00 -0.57 -0.43 0.00 0.00 0.00 0.00 53.44 52.44 1z8s n ALA 453 Cb 0.00 0.20 -0.05 0.00 0.00 0.00 0.00 19.45 19.60 1z8s n ALA 453 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1z8s s LYS 454 N -2.27 3.07 -0.04 0.00 2.20 -1.26 -4.79 119.74 116.66 1z8s s LYS 454 Ca -0.18 -2.23 0.00 0.00 -0.36 0.00 0.00 55.97 53.20 1z8s s LYS 454 Cb 0.05 -4.16 -0.02 0.00 -1.51 0.00 0.00 37.83 32.18 1z8s s LYS 454 CO 0.30 -1.25 -0.03 0.36 -0.36 0.00 0.00 175.35 174.37 1z8s n LYS 455 N 4.24 0.09 -2.12 4.03 2.85 -1.26 -5.13 118.16 120.86 1z8s n LYS 455 Ca 0.04 0.02 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 1z8s n LYS 455 Cb 0.43 -1.04 0.00 0.00 -0.65 0.00 0.00 35.03 33.76 1z8s n LYS 455 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1z8s n LEU 456 N -2.65 -6.12 -3.77 -5.58 7.94 -1.26 -5.08 117.00 100.48 1z8s n LEU 456 Ca -0.07 2.92 -0.13 0.00 -1.11 0.00 0.00 56.01 57.62 1z8s n LEU 456 Cb 0.57 -3.08 -0.09 0.00 0.53 0.00 0.00 43.42 41.35 1z8s n LEU 456 CO 0.04 -2.17 -0.00 -1.48 -1.11 0.00 0.00 177.39 172.66 1z8s s LEU 457 N -0.52 0.92 0.00 -1.96 0.05 -1.26 -5.18 118.68 110.73 1z8s s LEU 457 Ca 0.00 0.10 -0.06 0.00 0.05 0.00 0.00 54.13 54.22 1z8s s LEU 457 Cb 0.00 1.19 0.09 0.00 -2.05 0.00 0.00 46.19 45.42 1z8s s LEU 457 CO 0.00 -0.41 0.38 -0.81 -0.55 0.00 0.00 176.35 174.96 1z8s n PRO 458 N 1.43 -1.33 -3.71 1.48 -0.04 -1.26 -5.07 135.00 126.51 1z8s n PRO 458 Ca -0.21 -0.59 -0.29 0.00 -0.04 0.00 0.00 63.50 62.37 1z8s n PRO 458 Cb 0.56 -0.50 -0.16 0.00 -0.04 0.00 0.00 33.50 33.36 1z8s n PRO 458 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1z8s s ALA 459 N -3.29 1.21 0.01 0.55 0.00 -1.26 -4.97 121.76 114.01 1z8s s ALA 459 Ca 0.23 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1z8s s ALA 459 Cb -0.02 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.68 1z8s s ALA 459 CO 0.17 -1.48 0.00 1.97 0.00 0.00 0.00 175.76 176.42 1z8s n PHE 460 N 4.98 -0.02 0.05 0.00 -1.74 -1.26 -4.62 117.46 114.85 1z8s n PHE 460 Ca -0.05 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.77 1z8s n PHE 460 Cb 0.44 0.11 0.08 0.00 1.52 0.00 0.00 39.48 41.62 1z8s n PHE 460 CO 0.00 0.00 0.00 0.37 -0.56 0.00 0.00 176.76 176.57 1z8s h GLN 461 N 0.00 0.37 -0.28 3.97 -0.00 -1.96 -2.58 115.11 114.63 1z8s h GLN 461 Ca 0.00 -0.26 -0.00 0.00 -0.00 0.00 0.00 58.65 58.38 1z8s h GLN 461 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.51 1z8s h GLN 461 CO 0.00 0.88 0.17 -0.97 0.00 0.00 0.00 178.83 178.91 1z8s h ASN 462 N 0.27 0.34 -0.77 -0.69 -1.24 -1.93 -0.99 115.58 110.57 1z8s h ASN 462 Ca -0.01 -0.05 -0.04 0.00 0.71 0.00 0.00 56.30 56.91 1z8s h ASN 462 Cb 1.16 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 40.09 1z8s h ASN 462 CO 0.11 0.29 0.32 0.00 -1.29 0.00 0.00 177.43 176.86 1z8s h ALA 463 N 1.07 1.11 -0.81 1.57 0.00 -1.80 -2.29 119.26 118.11 1z8s h ALA 463 Ca 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1z8s h ALA 463 Cb 0.01 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 1z8s h ALA 463 CO -0.02 0.64 0.45 1.49 0.00 0.00 0.00 179.25 181.81 1z8s h GLU 464 N 1.12 1.11 0.41 0.00 4.81 -1.03 -1.59 114.58 119.41 1z8s h GLU 464 Ca 0.26 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1z8s h GLU 464 Cb 0.19 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1z8s h GLU 464 CO -0.02 0.81 -0.20 -0.09 -0.73 0.00 0.00 179.01 178.78 1z8s h ARG 465 N 1.12 -0.53 -1.00 1.92 2.43 -0.64 -2.29 114.38 115.40 1z8s h ARG 465 Ca 0.29 0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.62 1z8s h ARG 465 Cb 0.02 0.12 -0.09 0.00 -0.42 0.00 0.00 29.97 29.60 1z8s h ARG 465 CO -0.05 -0.33 0.63 -0.07 -1.51 0.00 0.00 179.97 178.63 1z8s h LEU 466 N -0.58 0.90 -0.46 3.80 3.38 -1.25 0.45 115.31 121.56 1z8s h LEU 466 Ca -0.06 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1z8s h LEU 466 Cb 0.44 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 1z8s h LEU 466 CO 0.09 0.46 -0.18 0.25 0.09 0.00 0.00 178.44 179.15 1z8s h LEU 467 N 0.96 -0.63 -0.98 1.67 7.12 -0.78 0.51 115.31 123.18 1z8s h LEU 467 Ca 0.51 0.16 0.22 0.00 0.13 0.00 0.00 57.88 58.90 1z8s h LEU 467 Cb 0.54 0.36 -0.12 0.00 -0.53 0.00 0.00 40.66 40.91 1z8s h LEU 467 CO -0.28 -0.22 0.57 -0.07 -0.13 0.00 0.00 178.44 178.31 1z8s h LEU 468 N -0.08 0.66 -0.39 2.25 3.38 -0.38 0.46 115.31 121.21 1z8s h LEU 468 Ca 0.22 0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.37 1z8s h LEU 468 Cb 0.42 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1z8s h LEU 468 CO -0.51 0.14 0.10 0.00 0.09 0.00 0.00 178.44 178.26 1z8s h ALA 469 N 1.70 0.43 0.10 1.53 0.00 0.37 0.23 119.26 123.61 1z8s h ALA 469 Ca 0.61 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.58 1z8s h ALA 469 Cb 1.09 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1z8s h ALA 469 CO -0.45 -0.30 -0.05 0.45 0.00 0.00 0.00 179.25 178.90 1z8s h HIS 470 N 0.24 -0.12 -0.64 0.00 3.86 -0.23 -3.27 115.15 114.99 1z8s h HIS 470 Ca 0.18 -0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.53 1z8s h HIS 470 Cb 0.20 0.04 -0.04 0.00 1.06 0.00 0.00 27.41 28.67 1z8s h HIS 470 CO -0.18 0.16 0.43 0.00 0.86 0.00 0.00 177.93 179.20 1z8s h MET 471 N -1.00 0.27 0.00 2.45 -0.00 -0.26 0.37 114.93 116.75 1z8s h MET 471 Ca -0.01 -0.02 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 1z8s h MET 471 Cb 0.33 -0.06 0.00 0.00 -0.00 0.00 0.00 31.60 31.87 1z8s h MET 471 CO 0.02 0.18 0.00 0.00 -0.00 0.00 0.00 176.91 177.11 1z8s n MET 472 N -4.44 0.32 -0.10 -0.10 3.85 0.81 -3.83 117.12 113.62 1z8s n MET 472 Ca 0.12 0.05 -0.19 0.00 -1.00 0.00 0.00 57.70 56.67 1z8s n MET 472 Cb 0.51 -1.50 -0.08 0.00 -1.05 0.00 0.00 33.22 31.10 1z8s n MET 472 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 1z8s n ARG 473 N -1.31 0.54 -4.35 3.17 0.63 0.13 -3.82 116.66 111.66 1z8s n ARG 473 Ca 0.11 0.47 -0.26 0.00 -0.92 0.00 0.00 57.85 57.25 1z8s n ARG 473 Cb 0.22 -1.66 -0.13 0.00 0.45 0.00 0.00 32.46 31.35 1z8s n ARG 473 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1z8s s SER 474 N -6.70 2.97 0.28 6.15 0.01 -1.11 -4.23 113.70 111.08 1z8s s SER 474 Ca -0.28 -0.74 0.00 0.00 1.31 0.00 0.00 55.95 56.24 1z8s s SER 474 Cb 0.07 -0.19 0.42 0.00 0.21 0.00 0.00 66.02 66.53 1z8s s SER 474 CO 0.48 0.11 1.80 0.08 0.41 0.00 0.00 173.24 176.13 1z8s h ARG 475 N 3.87 0.72 -0.25 12.44 0.11 -1.83 -1.76 114.38 127.67 1z8s h ARG 475 Ca -0.48 -0.17 -0.04 0.00 0.10 0.00 0.00 59.98 59.39 1z8s h ARG 475 Cb 1.18 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 32.16 1z8s h ARG 475 CO 0.41 0.72 0.01 -0.44 0.10 0.00 0.00 179.97 180.77 1z8s h ASP 476 N 0.68 0.42 -0.55 0.08 3.32 -1.90 -2.52 116.42 115.93 1z8s h ASP 476 Ca 0.14 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.87 1z8s h ASP 476 Cb 0.39 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 1z8s h ASP 476 CO 0.01 0.61 0.27 1.62 -1.72 0.00 0.00 179.24 180.03 1z8s h VAL 477 N 0.21 1.20 -0.97 -1.35 3.04 -1.85 -0.96 116.25 115.57 1z8s h VAL 477 Ca 0.07 -0.56 0.12 0.00 -1.01 0.00 0.00 66.70 65.32 1z8s h VAL 477 Cb 0.38 0.46 -0.08 0.00 -2.01 0.00 0.00 31.29 30.04 1z8s h VAL 477 CO 0.01 0.23 0.61 0.00 -1.01 0.00 0.00 177.57 177.41 1z8s h ALA 478 N 1.48 1.59 -0.34 3.17 0.00 -0.92 0.54 119.26 124.77 1z8s h ALA 478 Ca 0.20 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1z8s h ALA 478 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1z8s h ALA 478 CO -0.03 0.18 -0.03 1.37 0.00 0.00 0.00 179.25 180.75 1z8s h LEU 479 N 0.94 0.51 -1.10 0.00 8.10 -0.79 -2.43 115.31 120.53 1z8s h LEU 479 Ca 0.47 -0.10 -0.03 0.00 0.11 0.00 0.00 57.88 58.32 1z8s h LEU 479 Cb 0.49 -0.13 -0.03 0.00 -0.44 0.00 0.00 40.66 40.55 1z8s h LEU 479 CO -0.23 0.59 0.24 0.58 -4.11 0.00 0.00 178.44 175.51 1z8s h VAL 480 N 0.51 1.21 0.21 0.15 2.07 0.47 0.12 116.25 120.99 1z8s h VAL 480 Ca 0.11 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1z8s h VAL 480 Cb 0.37 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1z8s h VAL 480 CO 0.01 0.27 -0.10 1.62 0.02 0.00 0.00 177.57 179.39 1z8s h VAL 481 N 0.87 0.81 -0.56 2.57 3.04 -0.83 -0.60 116.25 121.55 1z8s h VAL 481 Ca 0.21 -0.90 -0.09 0.00 -1.01 0.00 0.00 66.70 64.91 1z8s h VAL 481 Cb 0.17 1.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.71 1z8s h VAL 481 CO -0.02 0.18 -0.02 1.56 -1.01 0.00 0.00 177.57 178.26 1z8s h GLN 482 N -0.79 1.00 0.14 4.17 1.08 -1.45 1.35 115.11 120.60 1z8s h GLN 482 Ca -0.03 -0.33 -0.21 0.00 -1.45 0.00 0.00 58.65 56.63 1z8s h GLN 482 Cb 0.51 -0.09 0.02 0.00 -0.05 0.00 0.00 27.48 27.88 1z8s h GLN 482 CO 0.05 1.00 -0.91 0.93 -0.95 0.00 0.00 178.83 178.95 1z8s h GLU 483 N 0.88 0.38 -0.02 1.46 5.08 -0.86 -3.16 114.58 118.34 1z8s h GLU 483 Ca 0.16 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1z8s h GLU 483 Cb 0.57 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1z8s h GLU 483 CO 0.03 1.27 -0.37 0.54 -1.00 0.00 0.00 179.01 179.48 1z8s n ARG 484 N -4.06 1.47 0.00 2.33 1.74 -0.23 -4.75 116.66 113.16 1z8s n ARG 484 Ca -0.14 -1.20 0.00 0.00 -0.77 0.00 0.00 57.85 55.74 1z8s n ARG 484 Cb 0.86 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.83 1z8s n ARG 484 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1z8s n ILE 485 N 0.28 0.00 -1.42 0.55 -5.35 -0.20 -4.81 119.36 108.41 1z8s n ILE 485 Ca 0.10 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 1z8s n ILE 485 Cb 0.49 -0.47 0.00 0.00 -1.74 0.00 0.00 39.64 37.92 1z8s n ILE 485 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1z8s n GLY 486 N 1.75 -4.16 3.18 3.28 0.00 0.45 -4.83 105.19 104.85 1z8s n GLY 486 Ca 0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.07 1z8s n GLY 486 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1z8s s GLY 487 N -4.39 0.88 0.10 -0.02 0.00 -1.26 -4.96 107.32 97.66 1z8s s GLY 487 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.31 1z8s s GLY 487 CO 0.00 -1.45 0.00 -2.13 0.00 0.00 0.00 173.10 169.52 1z8s n ARG 488 N -0.09 0.00 -3.88 2.90 0.63 -1.26 -5.00 116.66 109.96 1z8s n ARG 488 Ca -0.10 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.48 1z8s n ARG 488 Cb 0.62 0.00 -0.13 0.00 0.45 0.00 0.00 32.46 33.39 1z8s n ARG 488 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 1z8s s PHE 489 N -2.00 3.28 0.08 -0.14 5.36 -1.26 -5.00 117.98 118.29 1z8s s PHE 489 Ca 0.00 -1.83 -0.10 0.00 -0.96 0.00 0.00 56.93 54.04 1z8s s PHE 489 Cb 0.00 -2.18 0.03 0.00 -0.34 0.00 0.00 43.02 40.53 1z8s s PHE 489 CO 0.00 -0.80 0.47 0.09 -1.46 0.00 0.00 175.22 173.52 1z8s n ASN 490 N 4.65 -0.78 -4.42 6.13 4.13 -1.26 -5.03 115.26 118.67 1z8s n ASN 490 Ca -0.13 -1.40 -0.33 0.00 1.68 0.00 0.00 54.58 54.41 1z8s n ASN 490 Cb 0.43 1.27 0.14 0.00 -1.54 0.00 0.00 39.78 40.08 1z8s n ASN 490 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1z8s n ILE 491 N -0.33 0.00 -0.08 2.41 2.08 -1.26 -4.48 119.36 117.69 1z8s n ILE 491 Ca -0.01 -0.19 -0.07 0.00 0.56 0.00 0.00 62.75 63.04 1z8s n ILE 491 Cb 0.27 -0.66 0.00 0.00 -0.75 0.00 0.00 39.64 38.49 1z8s n ILE 491 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1z8s h GLU 492 N -1.70 0.20 0.14 0.38 4.39 -2.01 0.67 114.58 116.65 1z8s h GLU 492 Ca -0.45 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.23 1z8s h GLU 492 Cb 1.29 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1z8s h GLU 492 CO 0.36 0.13 -0.07 0.93 -1.16 0.00 0.00 179.01 179.20 1z8s h GLU 493 N 0.21 -0.18 -0.87 2.33 3.07 -1.91 -0.58 114.58 116.65 1z8s h GLU 493 Ca 0.14 0.01 0.19 0.00 -0.50 0.00 0.00 59.36 59.20 1z8s h GLU 493 Cb 0.13 0.04 -0.11 0.00 -0.84 0.00 0.00 28.75 27.97 1z8s h GLU 493 CO -0.16 0.29 0.40 0.45 -1.40 0.00 0.00 179.01 178.58 1z8s h HIS 494 N -0.81 0.68 -0.19 4.33 3.86 -1.89 1.23 115.15 122.36 1z8s h HIS 494 Ca -0.02 0.04 -0.19 0.00 -1.16 0.00 0.00 60.37 59.04 1z8s h HIS 494 Cb 0.54 -0.17 0.01 0.00 1.06 0.00 0.00 27.41 28.85 1z8s h HIS 494 CO 0.09 0.05 -0.64 -0.09 0.86 0.00 0.00 177.93 178.20 1z8s h ARG 495 N 0.49 0.76 0.00 2.45 1.12 0.32 -2.48 114.38 117.04 1z8s h ARG 495 Ca 0.51 -0.57 -0.03 0.00 -1.11 0.00 0.00 59.98 58.78 1z8s h ARG 495 Cb 0.87 0.10 -0.00 0.00 -0.01 0.00 0.00 29.97 30.93 1z8s h ARG 495 CO -0.46 1.19 -0.15 0.00 -3.11 0.00 0.00 179.97 177.44 1z8s h ALA 496 N 0.57 1.02 0.16 2.80 0.00 0.68 -0.18 119.26 124.31 1z8s h ALA 496 Ca -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1z8s h ALA 496 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1z8s h ALA 496 CO 0.14 0.19 -0.08 -0.07 0.00 0.00 0.00 179.25 179.43 1z8s h LEU 497 N 0.00 -0.18 -1.46 0.00 -0.00 0.15 1.10 115.31 114.92 1z8s h LEU 497 Ca -0.00 -0.33 0.09 0.00 -0.00 0.00 0.00 57.88 57.64 1z8s h LEU 497 Cb 0.69 0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 41.35 1z8s h LEU 497 CO 0.02 0.39 0.47 0.00 -0.00 0.00 0.00 178.44 179.32 1z8s h ALA 498 N -0.42 1.84 -0.15 1.53 0.00 -1.41 -0.82 119.26 119.83 1z8s h ALA 498 Ca -0.02 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 1z8s h ALA 498 Cb 0.50 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1z8s h ALA 498 CO 0.04 0.01 -0.51 0.00 0.00 0.00 0.00 179.25 178.78 1z8s h ALA 499 N 1.64 0.27 -0.18 0.00 0.00 -0.96 -3.08 119.26 116.95 1z8s h ALA 499 Ca 0.32 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1z8s h ALA 499 Cb 0.45 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.14 1z8s h ALA 499 CO -0.11 0.45 -0.42 1.88 0.00 0.00 0.00 179.25 181.05 1z8s h TYR 500 N 0.27 -1.20 -0.91 0.00 0.05 0.27 -0.07 116.97 115.39 1z8s h TYR 500 Ca -0.02 0.05 0.14 0.00 0.05 0.00 0.00 58.73 58.95 1z8s h TYR 500 Cb 1.14 0.55 -0.09 0.00 1.01 0.00 0.00 36.73 39.34 1z8s h TYR 500 CO 0.10 -0.47 0.52 -0.84 -1.05 0.00 0.00 178.16 176.42 1z8s h ILE 501 N -0.46 0.80 -0.40 -2.88 3.07 -1.55 0.29 117.51 116.39 1z8s h ILE 501 Ca 0.09 -0.26 0.06 0.00 1.55 0.00 0.00 64.86 66.29 1z8s h ILE 501 Cb 0.62 -0.03 -0.08 0.00 -0.27 0.00 0.00 36.82 37.05 1z8s h ILE 501 CO -0.42 0.14 -0.51 0.22 -1.05 0.00 0.00 178.15 176.52 1z8s h TYR 502 N 0.77 -1.53 -0.11 0.16 3.20 -0.92 0.27 116.97 118.81 1z8s h TYR 502 Ca 0.48 0.08 -0.19 0.00 3.14 0.00 0.00 58.73 62.24 1z8s h TYR 502 Cb 0.60 0.72 -0.00 0.00 1.54 0.00 0.00 36.73 39.60 1z8s h TYR 502 CO -0.05 -0.48 -0.71 0.00 -1.64 0.00 0.00 178.16 175.28 1z8s h ALA 503 N 0.12 0.57 -0.24 1.82 0.00 -1.07 -3.11 119.26 117.34 1z8s h ALA 503 Ca 0.10 -0.59 0.07 0.00 0.00 0.00 0.00 54.91 54.49 1z8s h ALA 503 Cb 0.60 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1z8s h ALA 503 CO -0.58 0.74 0.26 0.74 0.00 0.00 0.00 179.25 180.40 1z8s h PHE 504 N 0.34 0.00 -0.42 0.00 -1.00 0.60 -1.63 116.94 114.83 1z8s h PHE 504 Ca -0.03 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.80 1z8s h PHE 504 Cb 1.29 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.80 1z8s h PHE 504 CO 0.05 0.00 0.17 1.88 -1.61 0.00 0.00 178.31 178.81 1z8s h TYR 505 N 0.00 0.32 -0.02 -0.55 0.05 -0.91 0.35 116.97 116.21 1z8s h TYR 505 Ca 0.11 0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.78 1z8s h TYR 505 Cb 0.63 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.27 1z8s h TYR 505 CO 0.00 0.14 -0.60 1.49 -1.05 0.00 0.00 178.16 178.14 1z8s h GLU 506 N 0.36 0.08 0.17 4.88 4.81 -1.50 -1.81 114.58 121.55 1z8s h GLU 506 Ca 0.19 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1z8s h GLU 506 Cb 0.15 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1z8s h GLU 506 CO -0.17 0.65 -0.08 0.93 -0.73 0.00 0.00 179.01 179.61 1z8s h GLU 507 N 0.06 -0.22 0.00 1.92 4.39 -0.91 -3.42 114.58 116.40 1z8s h GLU 507 Ca -0.01 0.01 -0.35 0.00 0.34 0.00 0.00 59.36 59.36 1z8s h GLU 507 Cb 1.08 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 29.71 1z8s h GLU 507 CO 0.08 -0.14 -2.32 0.41 -1.16 0.00 0.00 179.01 175.88 1z8s n GLY 508 N 0.94 -0.82 0.00 -3.84 0.00 0.11 -5.08 105.19 96.51 1z8s n GLY 508 Ca -0.03 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.80 0.00 0.00 1.61 8.25 -0.68 -4.82 115.22 116.77 1z8s n HIS 509 Ca -0.33 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.13 1z8s n HIS 509 Cb 1.09 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.20 1z8s n HIS 509 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1z8s n GLU 510 N 0.49 0.00 0.00 -0.41 1.02 -1.23 -4.86 120.64 115.65 1z8s n GLU 510 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1z8s n GLU 510 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1z8s n GLU 510 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1z8s n ALA 511 N 0.00 0.00 -3.52 0.62 0.00 -1.26 -4.19 120.51 112.17 1z8s n ALA 511 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1z8s n ALA 511 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1z8s n ALA 511 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1z8s s ASP 512 N 0.00 -1.17 -0.00 0.00 1.01 -1.26 -4.48 116.67 110.78 1z8s s ASP 512 Ca 0.00 1.37 -0.24 0.00 0.71 0.00 0.00 52.55 54.39 1z8s s ASP 512 Cb 0.00 2.23 -0.14 0.00 1.01 0.00 0.00 42.92 46.02 1z8s s ASP 512 CO 0.00 -0.22 1.04 1.55 0.21 0.00 0.00 175.17 177.75 1z8s h PRO 513 N 7.97 -0.63 0.00 8.23 0.13 -1.74 -3.03 132.00 142.94 1z8s h PRO 513 Ca -0.19 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 1z8s h PRO 513 Cb 1.12 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1z8s h PRO 513 CO 0.13 -0.33 0.00 0.78 -0.23 0.00 0.00 178.00 178.35 1z8s h GLY 514 N -1.04 0.00 0.00 1.56 0.00 -1.90 -2.45 103.07 99.24 1z8s h GLY 514 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1z8s h GLY 514 CO 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.62 1z8s h ALA 515 N 2.02 0.01 0.01 3.60 0.00 -1.95 -3.32 119.26 119.62 1z8s h ALA 515 Ca 0.00 -0.47 -0.24 0.00 0.00 0.00 0.00 54.91 54.19 1z8s h ALA 515 Cb 0.11 0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1z8s h ALA 515 CO 0.00 0.02 -1.00 1.37 0.00 0.00 0.00 179.25 179.64 1z8s h LEU 516 N -1.00 0.64 -2.04 0.00 8.10 -1.45 -3.10 115.31 116.46 1z8s h LEU 516 Ca -0.01 -0.52 0.11 0.00 0.11 0.00 0.00 57.88 57.57 1z8s h LEU 516 Cb 0.92 -0.20 -0.02 0.00 -0.44 0.00 0.00 40.66 40.93 1z8s h LEU 516 CO -0.01 1.33 0.30 0.40 -4.11 0.00 0.00 178.44 176.35 1z8s h ILE 517 N 0.27 0.70 -0.28 0.15 1.08 -1.63 0.79 117.51 118.59 1z8s h ILE 517 Ca -0.10 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.37 1z8s h ILE 517 Cb 1.64 0.79 -0.00 0.00 -3.07 0.00 0.00 36.82 36.18 1z8s h ILE 517 CO 0.18 0.00 0.00 -1.20 -0.69 0.00 0.00 178.15 176.44 1z8s n SER 518 N -4.25 3.28 -0.01 1.72 7.64 -1.17 -3.80 113.62 117.03 1z8s n SER 518 Ca 0.06 -2.45 -0.01 0.00 1.01 0.00 0.00 58.87 57.48 1z8s n SER 518 Cb 0.48 -0.59 -0.01 0.00 -1.01 0.00 0.00 64.21 63.09 1z8s n SER 518 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1z8s n ARG 519 N 0.29 0.03 -1.39 1.43 1.74 0.27 -4.97 116.66 114.06 1z8s n ARG 519 Ca 0.13 0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.92 1z8s n ARG 519 Cb 0.71 -0.82 -0.17 0.00 -1.02 0.00 0.00 32.46 31.16 1z8s n ARG 519 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1z8s n ILE 520 N -2.77 0.00 -2.01 0.55 -5.35 -0.86 -4.80 119.36 104.12 1z8s n ILE 520 Ca -0.03 -0.19 -0.41 0.00 -0.27 0.00 0.00 62.75 61.86 1z8s n ILE 520 Cb 0.52 -0.28 -0.02 0.00 -1.74 0.00 0.00 39.64 38.12 1z8s n ILE 520 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 1z8s s PRO 521 N 7.59 4.27 1.67 6.28 0.02 -1.26 -1.99 135.00 151.59 1z8s s PRO 521 Ca 1.24 2.31 0.00 0.00 0.02 0.00 0.00 61.00 64.57 1z8s s PRO 521 Cb -1.01 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 30.41 1z8s s PRO 521 CO 0.48 -0.39 0.00 0.41 -0.33 0.00 0.00 177.00 177.17 1z8s n GLY 522 N 1.89 2.23 0.13 0.52 0.00 -1.26 0.03 105.19 108.72 1z8s n GLY 522 Ca 0.05 0.41 0.09 0.00 0.00 0.00 0.00 46.02 46.57 1z8s n GLY 522 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1z8s n GLU 523 N 7.65 0.11 0.13 1.61 1.02 -1.26 -0.78 120.64 129.11 1z8s n GLU 523 Ca 0.00 0.60 -0.02 0.00 -0.02 0.00 0.00 57.16 57.73 1z8s n GLU 523 Cb 0.00 -1.87 0.16 0.00 -0.02 0.00 0.00 31.44 29.71 1z8s n GLU 523 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1z8s h LEU 524 N 0.00 0.04 0.51 -4.62 5.85 -0.58 -2.78 115.31 113.73 1z8s h LEU 524 Ca 0.00 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1z8s h LEU 524 Cb 0.02 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1z8s h LEU 524 CO 0.00 0.65 -0.24 1.56 -0.34 0.00 0.00 178.44 180.07 1z8s h GLN 525 N 0.03 -0.66 -0.94 1.25 4.20 -0.31 -0.99 115.11 117.69 1z8s h GLN 525 Ca -0.01 0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.83 1z8s h GLN 525 Cb 1.11 0.15 -0.07 0.00 0.30 0.00 0.00 27.48 28.96 1z8s h GLN 525 CO 0.08 -0.35 0.58 -1.00 -0.67 0.00 0.00 178.83 177.47 1z8s h PRO 526 N -1.00 0.98 0.32 1.46 0.13 -1.63 1.17 132.00 133.42 1z8s h PRO 526 Ca -0.07 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.99 1z8s h PRO 526 Cb 0.61 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 31.52 1z8s h PRO 526 CO 0.11 0.65 -0.15 -0.07 -0.23 0.00 0.00 178.00 178.31 1z8s h LEU 527 N 1.01 -0.36 -0.09 1.56 4.07 -1.52 -2.66 115.31 117.32 1z8s h LEU 527 Ca 0.43 -0.18 -0.08 0.00 0.08 0.00 0.00 57.88 58.13 1z8s h LEU 527 Cb 0.29 0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.12 1z8s h LEU 527 CO -0.21 0.08 -0.26 0.00 -1.08 0.00 0.00 178.44 176.97 1z8s h ALA 528 N -0.52 0.16 -0.49 1.53 0.00 -1.07 -1.71 119.26 117.16 1z8s h ALA 528 Ca -0.04 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 54.53 1z8s h ALA 528 Cb 0.52 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1z8s h ALA 528 CO 0.07 0.15 0.14 1.03 0.00 0.00 0.00 179.25 180.65 1z8s h SER 529 N -0.12 0.11 0.39 0.00 0.87 0.13 0.30 113.55 115.23 1z8s h SER 529 Ca -0.01 0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.55 1z8s h SER 529 Cb 0.87 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.89 1z8s h SER 529 CO 0.06 0.09 -0.35 -0.33 -0.53 0.00 0.00 176.83 175.77 1z8s h GLU 530 N 0.30 0.00 0.00 2.24 3.07 -1.53 -2.31 114.58 116.36 1z8s h GLU 530 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1z8s h GLU 530 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1z8s h GLU 530 CO -0.27 0.35 0.00 -0.07 -1.40 0.00 0.00 179.01 177.62 1z8s h LEU 531 N 0.00 0.00 -1.42 1.33 4.07 0.39 -3.17 115.31 116.51 1z8s h LEU 531 Ca -0.00 0.00 0.19 0.00 0.08 0.00 0.00 57.88 58.15 1z8s h LEU 531 Cb 0.64 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.35 1z8s h LEU 531 CO 0.05 0.00 0.85 0.28 -1.08 0.00 0.00 178.44 178.53 1z8s h SER 532 N 0.00 0.00 -0.19 -0.43 0.02 -0.01 -1.31 113.55 111.63 1z8s h SER 532 Ca 0.00 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.73 1z8s h SER 532 Cb 0.63 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 62.95 1z8s h SER 532 CO 0.00 0.00 -0.55 -0.11 -1.14 0.00 0.00 176.83 175.03 1z8s n LEU 533 N -3.36 -0.72 -0.32 5.07 -0.00 -1.24 -4.73 117.00 111.71 1z8s n LEU 533 Ca 0.14 -3.31 0.00 0.00 -0.00 0.00 0.00 56.01 52.84 1z8s n LEU 533 Cb 1.07 0.18 0.13 0.00 -0.00 0.00 0.00 43.42 44.80 1z8s n LEU 533 CO 0.23 1.63 1.21 0.17 -0.00 0.00 0.00 177.39 180.63 1z8s h LEU 534 N 1.80 0.89 -4.14 -1.96 8.10 -1.20 -3.37 115.31 115.42 1z8s h LEU 534 Ca -0.31 0.01 -0.12 0.00 0.11 0.00 0.00 57.88 57.57 1z8s h LEU 534 Cb 1.28 -0.18 -0.11 0.00 -0.44 0.00 0.00 40.66 41.21 1z8s h LEU 534 CO -0.01 0.59 -0.20 0.00 -4.11 0.00 0.00 178.44 174.71 1z8s n LEU 535 N -4.58 -1.02 0.00 0.17 -0.00 -1.26 -5.06 117.00 105.25 1z8s n LEU 535 Ca 0.12 -2.47 0.00 0.00 -0.00 0.00 0.00 56.01 53.66 1z8s n LEU 535 Cb 0.15 0.31 0.00 0.00 -0.00 0.00 0.00 43.42 43.88 1z8s n LEU 535 CO 0.32 1.48 0.00 2.30 -0.00 0.00 0.00 177.39 181.50 1z8s n ILE 536 N -1.00 0.00 -3.29 1.47 -5.35 -1.26 -4.97 119.36 104.96 1z8s n ILE 536 Ca -0.14 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.32 1z8s n ILE 536 Cb 0.75 -0.56 0.00 0.00 -1.74 0.00 0.00 39.64 38.10 1z8s n ILE 536 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1z8s n ALA 537 N -3.00 -0.28 -0.47 -1.28 0.00 -0.12 -4.97 120.51 110.40 1z8s n ALA 537 Ca 0.00 -0.27 0.39 0.00 0.00 0.00 0.00 53.44 53.56 1z8s n ALA 537 Cb 0.00 0.21 0.69 0.00 0.00 0.00 0.00 19.45 20.36 1z8s n ALA 537 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1z8s h ASP 538 N 0.39 0.17 -2.25 0.00 1.82 -2.02 -3.07 116.42 111.47 1z8s h ASP 538 Ca -0.06 0.08 -0.48 0.00 -0.39 0.00 0.00 57.03 56.18 1z8s h ASP 538 Cb 0.24 0.06 -0.35 0.00 0.68 0.00 0.00 39.33 39.97 1z8s h ASP 538 CO 0.08 -0.08 -0.78 1.51 -1.61 0.00 0.00 179.24 178.36 1z8s s ASP 539 N -4.55 1.94 0.12 2.28 -4.77 -1.26 -5.03 116.67 105.40 1z8s s ASP 539 Ca -0.07 -1.99 0.00 0.00 -3.30 0.00 0.00 52.55 47.20 1z8s s ASP 539 Cb 0.27 0.08 0.00 0.00 -1.09 0.00 0.00 42.92 42.18 1z8s s ASP 539 CO 0.83 -0.27 0.00 0.52 0.70 0.00 0.00 175.17 176.95 1z8s n VAL 540 N 4.00 0.00 0.00 2.11 0.31 -1.16 -4.52 118.33 119.07 1z8s n VAL 540 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1z8s n VAL 540 Cb 0.42 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 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 3.76 0.00 -0.10 4.52 2.88 -1.26 -0.94 113.62 122.47 1z8s n SER 541 Ca 0.00 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.47 1z8s n SER 541 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1z8s n SER 541 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1z8s h GLU 542 N 0.00 -0.20 -0.17 -1.46 4.22 -1.98 0.93 114.58 115.91 1z8s h GLU 542 Ca 0.00 0.01 0.04 0.00 0.08 0.00 0.00 59.36 59.50 1z8s h GLU 542 Cb 0.00 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.25 1z8s h GLU 542 CO 0.00 -0.14 -0.11 0.37 -2.18 0.00 0.00 179.01 176.95 1z8s h GLN 543 N -0.21 -0.10 0.01 1.92 4.15 -1.99 -1.77 115.11 117.11 1z8s h GLN 543 Ca 0.18 0.01 -0.22 0.00 0.77 0.00 0.00 58.65 59.39 1z8s h GLN 543 Cb 0.49 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.20 1z8s h GLN 543 CO -0.49 -0.07 -0.93 1.05 -1.93 0.00 0.00 178.83 176.46 1z8s h GLU 544 N -0.11 0.32 -0.19 1.69 4.11 -1.93 -2.73 114.58 115.75 1z8s h GLU 544 Ca 0.10 -0.35 0.05 0.00 0.07 0.00 0.00 59.36 59.23 1z8s h GLU 544 Cb 0.26 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 1z8s h GLU 544 CO -0.24 1.05 -0.11 1.25 0.07 0.00 0.00 179.01 181.03 1z8s h LEU 545 N 0.17 -0.36 -0.56 3.06 5.85 0.12 0.11 115.31 123.70 1z8s h LEU 545 Ca -0.07 0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.58 1z8s h LEU 545 Cb 1.57 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.78 1z8s h LEU 545 CO 0.15 -0.15 -0.64 -0.08 -0.34 0.00 0.00 178.44 177.39 1z8s h GLU 546 N -0.10 0.30 0.19 1.25 4.57 -1.41 -2.56 114.58 116.82 1z8s h GLU 546 Ca 0.11 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 58.06 1z8s h GLU 546 Cb 0.26 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 1z8s h GLU 546 CO -0.25 0.84 -0.09 -0.44 -1.18 0.00 0.00 179.01 177.89 1z8s h ASP 547 N 0.22 -0.22 0.96 1.04 5.19 -1.10 -2.69 116.42 119.81 1z8s h ASP 547 Ca -0.01 -0.30 -0.07 0.00 -0.62 0.00 0.00 57.03 56.02 1z8s h ASP 547 Cb 1.17 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 1z8s h ASP 547 CO 0.10 0.25 -0.35 0.10 -3.12 0.00 0.00 179.24 176.23 1z8s h TYR 548 N -0.76 0.00 -0.25 4.55 -0.00 -0.90 -2.46 116.97 117.15 1z8s h TYR 548 Ca -0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 58.62 1z8s h TYR 548 Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.23 1z8s h TYR 548 CO 0.06 0.35 -0.15 0.82 -0.00 0.00 0.00 178.16 179.23 1z8s h ILE 549 N 0.00 1.30 -1.00 -0.90 2.04 -1.53 -2.36 117.51 115.07 1z8s h ILE 549 Ca -0.00 -1.26 0.10 0.00 1.00 0.00 0.00 64.86 64.70 1z8s h ILE 549 Cb 0.92 1.58 -0.08 0.00 -0.74 0.00 0.00 36.82 38.50 1z8s h ILE 549 CO 0.04 0.39 0.63 0.03 0.00 0.00 0.00 178.15 179.25 1z8s h ARG 550 N 0.28 1.01 -0.88 2.37 3.08 -1.34 0.32 114.38 119.22 1z8s h ARG 550 Ca 0.05 -0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.15 1z8s h ARG 550 Cb 0.68 -0.23 -0.07 0.00 0.08 0.00 0.00 29.97 30.43 1z8s h ARG 550 CO 0.04 0.67 0.57 0.45 -1.07 0.00 0.00 179.97 180.63 1z8s h HIS 551 N 1.04 0.92 0.00 3.04 3.86 -0.95 0.49 115.15 123.55 1z8s h HIS 551 Ca 0.48 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.66 1z8s h HIS 551 Cb 0.39 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 1z8s h HIS 551 CO -0.00 0.41 -0.24 0.28 0.86 0.00 0.00 177.93 179.23 1z8s h VAL 552 N 0.84 1.17 -0.61 2.45 2.07 0.10 -2.47 116.25 119.79 1z8s h VAL 552 Ca 0.42 -0.84 0.18 0.00 0.82 0.00 0.00 66.70 67.27 1z8s h VAL 552 Cb 0.47 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1z8s h VAL 552 CO -0.18 0.24 0.60 0.25 0.02 0.00 0.00 177.57 178.50 1z8s h LEU 553 N 0.00 0.00 -2.51 2.57 5.85 0.65 -3.46 115.31 118.40 1z8s h LEU 553 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1z8s h LEU 553 Cb 0.44 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1z8s h LEU 553 CO 0.03 0.00 -0.25 -3.20 -0.34 0.00 0.00 178.44 174.68 1z8s n ASN 554 N -3.76 -6.17 -2.74 1.25 5.15 -0.93 -5.06 115.26 103.00 1z8s n ASN 554 Ca 0.12 0.26 0.02 0.00 -0.60 0.00 0.00 54.58 54.38 1z8s n ASN 554 Cb 0.83 -4.09 0.01 0.00 -0.53 0.00 0.00 39.78 36.00 1z8s n ASN 554 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1z8s s ARG 555 N -2.38 0.05 -0.54 1.20 3.52 -1.26 -5.06 118.95 114.48 1z8s s ARG 555 Ca 0.12 -0.01 -0.16 0.00 -0.13 0.00 0.00 55.73 55.55 1z8s s ARG 555 Cb -0.03 0.01 -0.15 0.00 -1.56 0.00 0.00 34.95 33.21 1z8s s ARG 555 CO 0.54 -0.08 1.77 -0.35 -0.81 0.00 0.00 175.30 176.37 1z8s n PRO 556 N 3.73 1.13 0.00 5.12 -0.04 -1.26 -3.59 135.00 140.09 1z8s n PRO 556 Ca 0.05 -1.37 0.00 0.00 -0.04 0.00 0.00 63.50 62.14 1z8s n PRO 556 Cb 0.64 -2.58 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 1z8s n PRO 556 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1z8s n LYS 557 N 6.17 0.00 0.01 0.54 4.01 -1.26 -4.93 118.16 122.70 1z8s n LYS 557 Ca 0.40 0.00 -0.10 0.00 -0.51 0.00 0.00 58.31 58.10 1z8s n LYS 557 Cb 0.28 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 34.76 1z8s n LYS 557 CO 0.00 0.00 0.00 2.35 -1.11 0.00 0.00 177.40 178.64 1z8s h TRP 558 N 0.00 -0.62 -0.56 2.13 7.01 -1.95 -2.68 115.95 119.29 1z8s h TRP 558 Ca 0.00 0.03 0.10 0.00 2.11 0.00 0.00 58.89 61.13 1z8s h TRP 558 Cb 0.00 0.29 -0.08 0.00 -2.10 0.00 0.00 29.16 27.27 1z8s h TRP 558 CO 0.00 -0.31 0.13 -0.07 -2.79 0.00 0.00 178.44 175.39 1z8s h LEU 559 N -0.30 0.03 -0.88 0.65 3.38 -1.90 -1.51 115.31 114.78 1z8s h LEU 559 Ca 0.10 0.10 0.11 0.00 0.09 0.00 0.00 57.88 58.27 1z8s h LEU 559 Cb 0.44 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.25 1z8s h LEU 559 CO -0.29 0.03 0.51 0.24 0.09 0.00 0.00 178.44 179.02 1z8s h MET 560 N 0.27 0.80 -0.23 1.13 2.86 -1.77 0.30 114.93 118.28 1z8s h MET 560 Ca 0.29 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.79 1z8s h MET 560 Cb 0.41 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 1z8s h MET 560 CO -0.36 0.53 -0.23 1.25 1.06 0.00 0.00 176.91 179.16 1z8s h LEU 561 N 0.82 0.60 -0.07 1.22 7.12 -1.16 0.82 115.31 124.66 1z8s h LEU 561 Ca 0.43 -0.47 0.00 0.00 0.13 0.00 0.00 57.88 57.97 1z8s h LEU 561 Cb 0.44 -0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 40.40 1z8s h LEU 561 CO -0.27 0.95 0.05 0.50 -0.13 0.00 0.00 178.44 179.54 1z8s h LYS 562 N 0.26 0.09 -0.63 1.25 3.11 -0.71 0.97 116.57 120.91 1z8s h LYS 562 Ca 0.04 -0.01 0.05 0.00 -2.81 0.00 0.00 60.65 57.92 1z8s h LYS 562 Cb 0.78 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.95 1z8s h LYS 562 CO 0.06 0.07 0.42 0.28 -2.81 0.00 0.00 179.45 177.46 1z8s h VAL 563 N 0.09 1.05 -0.29 2.00 2.07 -0.40 0.59 116.25 121.36 1z8s h VAL 563 Ca 0.03 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1z8s h VAL 563 Cb -0.00 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 1z8s h VAL 563 CO -0.01 0.13 -0.04 0.50 0.02 0.00 0.00 177.57 178.18 1z8s h LYS 564 N 0.69 0.45 -0.07 1.57 3.11 0.35 -1.24 116.57 121.44 1z8s h LYS 564 Ca 0.26 -0.10 0.04 0.00 -2.81 0.00 0.00 60.65 58.04 1z8s h LYS 564 Cb 0.17 -0.06 -0.06 0.00 -1.00 0.00 0.00 32.23 31.27 1z8s h LYS 564 CO -0.08 0.51 -0.34 0.93 -2.81 0.00 0.00 179.45 177.66 1z8s h GLU 565 N 0.43 -0.44 0.57 1.90 4.39 0.65 1.79 114.58 123.87 1z8s h GLU 565 Ca 0.09 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 1z8s h GLU 565 Cb 0.34 0.10 0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1z8s h GLU 565 CO 0.01 -0.29 -0.27 1.96 -1.16 0.00 0.00 179.01 179.26 1z8s h GLN 566 N -0.46 -0.74 -0.61 2.33 4.20 -1.30 -2.76 115.11 115.77 1z8s h GLN 566 Ca 0.08 0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 1z8s h GLN 566 Cb 0.57 0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.49 1z8s h GLN 566 CO -0.32 -0.43 0.19 0.93 -0.67 0.00 0.00 178.83 178.53 1z8s h GLU 567 N -1.07 0.92 -0.34 1.46 5.08 -1.16 -2.56 114.58 116.92 1z8s h GLU 567 Ca -0.08 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.16 1z8s h GLU 567 Cb 0.65 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.71 1z8s h GLU 567 CO 0.13 0.79 0.06 -0.22 -1.00 0.00 0.00 179.01 178.77 1z8s h LYS 568 N 0.89 0.17 -0.56 2.33 3.11 0.27 0.24 116.57 123.02 1z8s h LYS 568 Ca 0.20 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 58.02 1z8s h LYS 568 Cb 0.26 -0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 31.42 1z8s h LYS 568 CO -0.01 0.11 0.30 0.00 -2.81 0.00 0.00 179.45 177.04 1z8s h THR 569 N 0.17 1.19 -0.40 1.00 1.03 -1.28 0.88 112.91 115.50 1z8s h THR 569 Ca 0.16 -0.49 0.10 0.00 -0.01 0.00 0.00 66.41 66.16 1z8s h THR 569 Cb 0.18 0.50 -0.02 0.00 -1.07 0.00 0.00 68.15 67.74 1z8s h THR 569 CO -0.22 0.21 0.28 -0.33 -0.01 0.00 0.00 175.52 175.45 1z8s h GLU 570 N 0.75 0.10 0.00 0.00 3.07 -0.86 0.65 114.58 118.29 1z8s h GLU 570 Ca 0.20 -0.01 -0.20 0.00 -0.50 0.00 0.00 59.36 58.85 1z8s h GLU 570 Cb 0.06 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 27.92 1z8s h GLU 570 CO -0.03 0.07 -0.95 0.00 -1.40 0.00 0.00 179.01 176.69 1z8s h ALA 571 N 1.80 0.43 -0.10 3.43 0.00 0.21 -2.61 119.26 122.42 1z8s h ALA 571 Ca 0.19 -0.87 -0.14 0.00 0.00 0.00 0.00 54.91 54.09 1z8s h ALA 571 Cb 0.61 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1z8s h ALA 571 CO -0.02 1.19 -0.54 0.93 0.00 0.00 0.00 179.25 180.81 1z8s h GLU 572 N 0.00 0.29 0.01 0.00 5.08 0.62 1.79 114.58 122.36 1z8s h GLU 572 Ca -0.01 -0.18 -0.13 0.00 -1.00 0.00 0.00 59.36 58.04 1z8s h GLU 572 Cb 1.69 0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.97 1z8s h GLU 572 CO 0.12 0.76 -0.53 0.07 -1.00 0.00 0.00 179.01 178.44 1z8s h ARG 573 N 0.22 0.35 0.00 2.33 0.11 -0.68 -3.34 114.38 113.37 1z8s h ARG 573 Ca 0.00 -0.38 -0.23 0.00 0.10 0.00 0.00 59.98 59.47 1z8s h ARG 573 Cb 1.02 0.11 -0.04 0.00 1.11 0.00 0.00 29.97 32.17 1z8s h ARG 573 CO 0.09 1.07 -1.56 0.54 0.10 0.00 0.00 179.97 180.21 1z8s n ARG 574 N -4.28 0.63 -0.93 0.08 1.74 -0.99 -5.03 116.66 107.88 1z8s n ARG 574 Ca -0.10 0.26 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1z8s n ARG 574 Cb 0.64 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1z8s n ARG 574 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1z8s n LYS 575 N -2.97 -0.31 -3.46 5.56 3.00 0.61 -2.65 118.16 117.94 1z8s n LYS 575 Ca -0.13 0.32 -0.20 0.00 -0.00 0.00 0.00 58.31 58.30 1z8s n LYS 575 Cb 0.95 -0.23 0.08 0.00 0.00 0.00 0.00 35.03 35.82 1z8s n LYS 575 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1z8s n ASP 576 N 1.43 -4.16 -0.08 3.14 -0.08 -1.26 -4.77 116.55 110.77 1z8s n ASP 576 Ca 0.00 -0.56 -0.07 0.00 -1.51 0.00 0.00 54.79 52.66 1z8s n ASP 576 Cb 0.03 -4.89 -0.16 0.00 2.34 0.00 0.00 41.12 38.43 1z8s n ASP 576 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1z8s n PHE 577 N -4.46 0.00 0.00 -0.67 7.35 -1.08 -4.85 117.46 113.75 1z8s n PHE 577 Ca -0.13 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.56 1z8s n PHE 577 Cb 0.61 -0.91 0.00 0.00 0.35 0.00 0.00 39.48 39.53 1z8s n PHE 577 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1z8s n LEU 578 N -2.66 0.00 0.00 -2.13 7.94 -1.26 -4.95 117.00 113.94 1z8s n LEU 578 Ca -0.28 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.62 1z8s n LEU 578 Cb 1.06 0.00 0.00 0.00 0.53 0.00 0.00 43.42 45.01 1z8s n LEU 578 CO 0.43 0.00 0.02 1.07 -1.11 0.00 0.00 177.39 177.80 1z8s n THR 579 N 0.00 0.00 0.11 1.96 5.66 -1.26 -4.84 114.28 115.91 1z8s n THR 579 Ca 0.00 -0.22 -0.13 0.00 -3.05 0.00 0.00 64.05 60.64 1z8s n THR 579 Cb 0.00 1.09 -0.08 0.00 -1.55 0.00 0.00 70.33 69.79 1z8s n THR 579 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1z8s h ALA 580 N 0.00 -0.23 -0.84 1.79 0.00 -1.88 -2.63 119.26 115.47 1z8s h ALA 580 Ca 0.00 -0.11 0.16 0.00 0.00 0.00 0.00 54.91 54.96 1z8s h ALA 580 Cb 0.04 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1z8s h ALA 580 CO 0.00 -0.55 0.55 0.00 0.00 0.00 0.00 179.25 179.25 1z8s h ALA 581 N 0.41 2.04 -0.39 0.00 0.00 -1.86 0.72 119.26 120.19 1z8s h ALA 581 Ca -0.02 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1z8s h ALA 581 Cb 0.30 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1z8s h ALA 581 CO 0.04 -0.28 -0.15 0.00 0.00 0.00 0.00 179.25 178.86 1z8s h ARG 582 N 0.51 0.71 -0.04 0.00 3.08 -1.83 -2.60 114.38 114.20 1z8s h ARG 582 Ca 0.42 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.20 1z8s h ARG 582 Cb 0.89 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1z8s h ARG 582 CO -0.17 0.83 -0.07 0.82 -1.07 0.00 0.00 179.97 180.31 1z8s h ILE 583 N 0.64 1.43 0.06 2.04 2.04 -0.54 -2.39 117.51 120.79 1z8s h ILE 583 Ca 0.10 -1.37 0.01 0.00 1.00 0.00 0.00 64.86 64.60 1z8s h ILE 583 Cb 0.62 2.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 1z8s h ILE 583 CO 0.04 0.37 -0.14 0.00 0.00 0.00 0.00 178.15 178.43 1z8s h ALA 584 N 0.47 -0.21 -0.33 1.87 0.00 -1.29 -0.05 119.26 119.73 1z8s h ALA 584 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1z8s h ALA 584 Cb 0.64 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1z8s h ALA 584 CO 0.02 -0.65 0.16 -0.22 0.00 0.00 0.00 179.25 178.56 1z8s h LYS 585 N -0.26 0.48 0.24 0.00 3.11 -1.57 0.22 116.57 118.79 1z8s h LYS 585 Ca 0.03 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.79 1z8s h LYS 585 Cb 0.29 -0.09 0.00 0.00 -1.00 0.00 0.00 32.23 31.43 1z8s h LYS 585 CO -0.09 0.44 -0.11 1.49 -2.81 0.00 0.00 179.45 178.37 1z8s h GLU 586 N 0.40 -0.31 -0.02 1.90 4.81 -1.24 -2.48 114.58 117.64 1z8s h GLU 586 Ca 0.11 0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.19 1z8s h GLU 586 Cb 0.12 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1z8s h GLU 586 CO -0.01 -0.19 -0.76 0.52 -0.73 0.00 0.00 179.01 177.84 1z8s h MET 587 N -0.34 0.18 -0.93 1.92 0.00 -1.01 -1.87 114.93 112.88 1z8s h MET 587 Ca -0.03 -0.16 0.16 0.00 0.00 0.00 0.00 59.70 59.67 1z8s h MET 587 Cb 0.26 0.04 -0.08 0.00 0.00 0.00 0.00 31.60 31.83 1z8s h MET 587 CO 0.05 0.85 0.59 0.82 0.00 0.00 0.00 176.91 179.23 1z8s h ILE 588 N 0.12 0.78 -0.04 -1.22 5.03 -0.47 1.74 117.51 123.44 1z8s h ILE 588 Ca -0.02 -0.23 -0.14 0.00 -0.12 0.00 0.00 64.86 64.34 1z8s h ILE 588 Cb 1.33 0.05 -0.01 0.00 -3.03 0.00 0.00 36.82 35.16 1z8s h ILE 588 CO 0.11 0.12 -0.62 -0.33 -0.68 0.00 0.00 178.15 176.75 1z8s h GLU 589 N 0.67 0.15 -0.47 2.37 5.08 -1.12 -2.61 114.58 118.65 1z8s h GLU 589 Ca 0.48 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.67 1z8s h GLU 589 Cb 0.84 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1z8s h GLU 589 CO -0.24 0.72 0.01 0.52 -1.00 0.00 0.00 179.01 179.02 1z8s h MET 590 N 0.11 0.77 -0.52 2.33 2.86 0.32 0.11 114.93 120.91 1z8s h MET 590 Ca -0.01 -0.20 -0.11 0.00 -2.06 0.00 0.00 59.70 57.33 1z8s h MET 590 Cb 1.12 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.67 1z8s h MET 590 CO 0.09 0.77 -0.11 0.87 1.06 0.00 0.00 176.91 179.59 1z8s h LYS 591 N 0.72 0.96 0.11 1.72 6.56 0.16 -2.34 116.57 124.46 1z8s h LYS 591 Ca 0.14 -0.35 -0.01 0.00 -1.06 0.00 0.00 60.65 59.38 1z8s h LYS 591 Cb 0.43 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 1z8s h LYS 591 CO 0.02 1.01 -0.05 0.87 -2.06 0.00 0.00 179.45 179.24 1z8s h LYS 592 N 0.86 -0.14 -0.35 3.15 6.56 -1.06 -3.16 116.57 122.42 1z8s h LYS 592 Ca 0.14 0.01 0.10 0.00 -1.06 0.00 0.00 60.65 59.84 1z8s h LYS 592 Cb 0.65 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.33 1z8s h LYS 592 CO 0.05 0.30 0.27 0.00 -2.06 0.00 0.00 179.45 178.00 1z8s h MET 593 N -0.66 0.00 -0.64 3.15 -0.00 -0.81 -1.46 114.93 114.52 1z8s h MET 593 Ca -0.02 0.00 0.07 0.00 -0.00 0.00 0.00 59.70 59.75 1z8s h MET 593 Cb 0.51 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 32.05 1z8s h MET 593 CO 0.03 0.00 0.33 -0.07 -0.00 0.00 0.00 176.91 177.19 1z8s h LEU 594 N 0.00 0.46 -2.46 -0.10 3.38 -1.38 -3.48 115.31 111.73 1z8s h LEU 594 Ca 0.17 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1z8s h LEU 594 Cb 0.70 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 1z8s h LEU 594 CO -0.00 0.29 -0.72 -0.24 0.09 0.00 0.00 178.44 177.85 1z8s n SER 595 N -4.85 -4.04 -4.60 -0.43 2.88 -0.55 -5.02 113.62 97.01 1z8s n SER 595 Ca 0.08 0.85 -0.29 0.00 -1.33 0.00 0.00 58.87 58.18 1z8s n SER 595 Cb 0.20 -3.60 0.17 0.00 -0.75 0.00 0.00 64.21 60.23 1z8s n SER 595 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1z8s s SER 596 N -0.78 2.70 0.00 -3.46 0.01 -1.26 -5.15 113.70 105.75 1z8s s SER 596 Ca -0.06 1.00 0.30 0.00 1.31 0.00 0.00 55.95 58.50 1z8s s SER 596 Cb 0.00 -1.57 1.77 0.00 0.21 0.00 0.00 66.02 66.43 1z8s s SER 596 CO 0.48 -3.06 2.10 -0.24 0.41 0.00 0.00 173.24 172.92