#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c4z n PRO 498 N 0.00 0.10 -3.85 1.20 -0.05 -1.26 -5.00 135.00 126.15 1c4z n PRO 498 Ca 0.00 -0.02 -0.31 0.00 -0.05 0.00 0.00 63.50 63.12 1c4z n PRO 498 Cb 0.00 -1.52 -0.04 0.00 -0.05 0.00 0.00 33.50 31.89 1c4z n PRO 498 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 175.50 176.16 1c4z s TYR 499 N -3.08 3.51 0.00 0.54 1.51 -1.26 -2.89 117.35 115.68 1c4z s TYR 499 Ca 0.06 0.35 0.00 0.00 -1.01 0.00 0.00 57.07 56.47 1c4z s TYR 499 Cb 0.16 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 40.17 1c4z s TYR 499 CO 0.84 0.55 0.00 -0.11 -1.11 0.00 0.00 175.55 175.72 1c4z n LEU 500 N 0.29 0.02 -0.47 -1.29 0.00 -0.78 -4.87 117.00 109.90 1c4z n LEU 500 Ca -0.05 0.05 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1c4z n LEU 500 Cb 0.51 -0.47 0.00 0.00 0.00 0.00 0.00 43.42 43.47 1c4z n LEU 500 CO 0.50 -0.47 0.00 0.54 0.00 0.00 0.00 177.39 177.97 1c4z n ARG 501 N -2.38 0.00 -3.97 1.96 1.74 -1.26 -4.95 116.66 107.80 1c4z n ARG 501 Ca 0.00 0.43 -0.20 0.00 -0.77 0.00 0.00 57.85 57.31 1c4z n ARG 501 Cb 0.00 -0.03 -0.17 0.00 -1.02 0.00 0.00 32.46 31.24 1c4z n ARG 501 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1c4z s LEU 502 N 0.00 1.04 -0.19 0.55 1.43 -0.11 -4.93 118.68 116.47 1c4z s LEU 502 Ca 0.00 -0.08 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 1c4z s LEU 502 Cb 0.00 -0.37 -0.00 0.00 0.03 0.00 0.00 46.19 45.85 1c4z s LEU 502 CO 0.00 -0.11 -0.10 -0.75 0.23 0.00 0.00 176.35 175.62 1c4z s LYS 503 N 1.28 3.31 0.18 1.70 2.20 -1.26 0.76 119.74 127.91 1c4z s LYS 503 Ca -0.06 -0.68 -0.02 0.00 -0.36 0.00 0.00 55.97 54.85 1c4z s LYS 503 Cb -0.13 -2.82 -0.04 0.00 -1.51 0.00 0.00 37.83 33.33 1c4z s LYS 503 CO -0.02 -0.08 0.14 0.14 -0.36 0.00 0.00 175.35 175.17 1c4z s VAL 504 N 1.11 0.03 -0.10 4.02 -7.23 0.54 -4.82 120.40 113.95 1c4z s VAL 504 Ca 0.01 -1.90 0.03 0.00 -1.81 0.00 0.00 61.98 58.31 1c4z s VAL 504 Cb -0.14 -2.32 -0.00 0.00 0.56 0.00 0.00 36.38 34.47 1c4z s VAL 504 CO -0.03 -0.14 -0.22 0.00 -0.31 0.00 0.00 175.10 174.40 1c4z s ARG 505 N -4.11 3.10 0.46 4.82 1.70 -1.26 0.94 118.95 124.61 1c4z s ARG 505 Ca 0.33 -0.85 -0.23 0.00 -0.47 0.00 0.00 55.73 54.51 1c4z s ARG 505 Cb 0.06 -2.36 -0.09 0.00 -0.57 0.00 0.00 34.95 32.00 1c4z s ARG 505 CO 0.08 0.19 1.03 0.54 -1.08 0.00 0.00 175.30 176.06 1c4z n ARG 506 N 3.51 1.33 -2.30 3.89 1.74 -1.26 -1.77 116.66 121.80 1c4z n ARG 506 Ca -0.19 0.48 -0.01 0.00 -0.77 0.00 0.00 57.85 57.36 1c4z n ARG 506 Cb 0.53 -2.12 0.00 0.00 -1.02 0.00 0.00 32.46 29.86 1c4z n ARG 506 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1c4z n ASP 507 N 0.19 -4.86 0.00 0.55 10.43 -1.26 -4.70 116.55 116.90 1c4z n ASP 507 Ca 0.10 -0.07 0.00 0.00 2.57 0.00 0.00 54.79 57.39 1c4z n ASP 507 Cb 0.41 -3.15 0.00 0.00 1.84 0.00 0.00 41.12 40.23 1c4z n ASP 507 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 1c4z n HIS 508 N -1.50 0.00 -0.01 1.24 8.25 -1.10 -5.07 115.22 117.02 1c4z n HIS 508 Ca -0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.35 1c4z n HIS 508 Cb 0.51 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.58 1c4z n HIS 508 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1c4z h ILE 509 N 0.00 0.26 0.17 1.59 2.04 -1.63 -1.75 117.51 118.20 1c4z h ILE 509 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.87 1c4z h ILE 509 Cb 0.00 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 1c4z h ILE 509 CO 0.00 0.00 -0.27 0.40 0.00 0.00 0.00 178.15 178.28 1c4z h ILE 510 N -0.39 0.42 0.81 -0.67 2.04 -1.98 -0.75 117.51 117.00 1c4z h ILE 510 Ca 0.10 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 1c4z h ILE 510 Cb 0.56 0.42 0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1c4z h ILE 510 CO -0.38 0.00 -0.39 0.44 0.00 0.00 0.00 178.15 177.82 1c4z h ASP 511 N -0.51 -0.92 -0.92 1.72 5.19 -1.96 0.09 116.42 119.11 1c4z h ASP 511 Ca 0.02 0.02 0.23 0.00 -0.62 0.00 0.00 57.03 56.68 1c4z h ASP 511 Cb 0.51 0.24 -0.06 0.00 0.18 0.00 0.00 39.33 40.20 1c4z h ASP 511 CO -0.12 -0.61 0.62 0.44 -3.12 0.00 0.00 179.24 176.46 1c4z h ASP 512 N -1.19 0.26 0.07 6.45 3.45 -1.34 -1.06 116.42 123.06 1c4z h ASP 512 Ca -0.11 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.38 1c4z h ASP 512 Cb 0.85 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.60 1c4z h ASP 512 CO 0.18 0.09 -0.04 0.00 -1.57 0.00 0.00 179.24 177.91 1c4z h ALA 513 N 1.59 -0.10 -0.01 3.45 0.00 -0.70 -2.81 119.26 120.68 1c4z h ALA 513 Ca 0.47 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1c4z h ALA 513 Cb 1.41 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 1c4z h ALA 513 CO -0.13 -0.33 -0.24 1.25 0.00 0.00 0.00 179.25 179.80 1c4z h LEU 514 N -0.55 -0.70 -0.68 0.00 6.46 0.22 0.14 115.31 120.18 1c4z h LEU 514 Ca -0.01 0.10 0.12 0.00 -0.12 0.00 0.00 57.88 57.97 1c4z h LEU 514 Cb 0.47 0.29 -0.09 0.00 -0.73 0.00 0.00 40.66 40.60 1c4z h LEU 514 CO 0.02 -0.31 0.24 0.58 -0.62 0.00 0.00 178.44 178.35 1c4z h VAL 515 N -0.37 0.68 -0.03 1.05 2.07 -1.34 -1.05 116.25 117.27 1c4z h VAL 515 Ca 0.06 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 1c4z h VAL 515 Cb 0.45 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1c4z h VAL 515 CO -0.22 0.07 -0.16 -0.09 0.02 0.00 0.00 177.57 177.20 1c4z h ARG 516 N 0.39 0.16 -0.98 1.57 9.65 -1.13 -2.47 114.38 121.57 1c4z h ARG 516 Ca 0.37 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 59.12 1c4z h ARG 516 Cb 0.53 0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.09 1c4z h ARG 516 CO -0.38 0.80 0.63 -0.07 2.80 0.00 0.00 179.97 183.75 1c4z h LEU 517 N -0.45 1.14 -0.19 3.80 3.38 -0.59 -0.43 115.31 121.97 1c4z h LEU 517 Ca -0.01 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1c4z h LEU 517 Cb 0.83 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1c4z h LEU 517 CO 0.03 0.85 0.07 -0.08 0.09 0.00 0.00 178.44 179.40 1c4z h GLU 518 N 1.34 0.16 -0.60 1.13 4.57 -1.25 0.20 114.58 120.13 1c4z h GLU 518 Ca 0.36 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.50 1c4z h GLU 518 Cb -0.12 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.41 1c4z h GLU 518 CO -0.07 0.11 0.26 1.98 -1.18 0.00 0.00 179.01 180.11 1c4z h MET 519 N 0.17 0.89 -0.18 1.92 4.05 -0.91 -2.39 114.93 118.48 1c4z h MET 519 Ca 0.08 -0.15 -0.05 0.00 -0.28 0.00 0.00 59.70 59.30 1c4z h MET 519 Cb 0.04 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.68 1c4z h MET 519 CO -0.08 0.74 -0.13 0.82 0.23 0.00 0.00 176.91 178.49 1c4z h ILE 520 N 0.83 1.19 0.56 1.77 2.04 -0.46 -2.37 117.51 121.08 1c4z h ILE 520 Ca 0.20 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 1c4z h ILE 520 Cb 0.16 1.21 0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1c4z h ILE 520 CO -0.02 0.27 -0.27 0.00 0.00 0.00 0.00 178.15 178.12 1c4z h ALA 521 N 1.60 -0.76 -0.53 1.87 0.00 -0.14 -3.21 119.26 118.09 1c4z h ALA 521 Ca 0.05 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1c4z h ALA 521 Cb 0.41 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1c4z h ALA 521 CO 0.02 -0.88 -0.44 1.98 0.00 0.00 0.00 179.25 179.94 1c4z h MET 522 N -0.85 -0.25 -6.35 0.00 1.85 -1.26 -1.99 114.93 106.08 1c4z h MET 522 Ca -0.08 0.02 -0.55 0.00 -0.61 0.00 0.00 59.70 58.48 1c4z h MET 522 Cb 0.62 0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.68 1c4z h MET 522 CO 0.13 -0.17 0.50 -2.00 -0.40 0.00 0.00 176.91 174.97 1c4z s GLU 523 N -5.84 4.48 -0.02 0.39 2.12 -0.91 -4.60 118.70 114.32 1c4z s GLU 523 Ca -0.14 1.47 -0.01 0.00 0.36 0.00 0.00 54.97 56.64 1c4z s GLU 523 Cb 0.13 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 31.03 1c4z s GLU 523 CO 0.66 -0.21 0.02 -1.71 -0.54 0.00 0.00 175.26 173.48 1c4z n ASN 524 N 4.45 -1.68 0.03 -1.70 5.15 -1.25 -4.70 115.26 115.55 1c4z n ASN 524 Ca 0.08 0.09 0.04 0.00 -0.60 0.00 0.00 54.58 54.18 1c4z n ASN 524 Cb 0.49 -0.41 0.18 0.00 -0.53 0.00 0.00 39.78 39.51 1c4z n ASN 524 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1c4z n PRO 525 N 0.61 0.03 0.21 1.20 -0.04 -0.75 -2.58 135.00 133.69 1c4z n PRO 525 Ca -0.00 0.47 0.05 0.00 -0.04 0.00 0.00 63.50 63.98 1c4z n PRO 525 Cb 0.14 -1.60 0.46 0.00 -0.04 0.00 0.00 33.50 32.46 1c4z n PRO 525 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1c4z h ALA 526 N 2.11 1.44 0.00 0.55 0.00 -1.87 -2.62 119.26 118.87 1c4z h ALA 526 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1c4z h ALA 526 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1c4z h ALA 526 CO 0.00 0.34 0.09 -0.44 0.00 0.00 0.00 179.25 179.24 1c4z h ASP 527 N 0.00 0.00 0.37 0.00 5.19 -1.83 -0.88 116.42 119.27 1c4z h ASP 527 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1c4z h ASP 527 Cb 0.52 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.03 1c4z h ASP 527 CO 0.04 0.00 0.00 0.18 -3.12 0.00 0.00 179.24 176.34 1c4z n LEU 528 N -2.92 0.00 -0.78 1.55 4.77 -0.99 -2.44 117.00 116.18 1c4z n LEU 528 Ca -0.03 0.24 0.10 0.00 -0.03 0.00 0.00 56.01 56.29 1c4z n LEU 528 Cb 0.15 -0.24 0.09 0.00 -2.33 0.00 0.00 43.42 41.09 1c4z n LEU 528 CO 0.17 -0.06 0.56 0.29 -1.33 0.00 0.00 177.39 177.02 1c4z n LYS 529 N -1.24 1.72 -2.25 3.23 5.02 -0.33 -4.85 118.16 119.46 1c4z n LYS 529 Ca 0.12 -1.68 -0.27 0.00 -2.02 0.00 0.00 58.31 54.46 1c4z n LYS 529 Cb 0.17 -1.37 0.14 0.00 -0.02 0.00 0.00 35.03 33.94 1c4z n LYS 529 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1c4z s LYS 530 N -1.59 1.28 -0.18 1.97 1.02 -1.02 -4.97 119.74 116.25 1c4z s LYS 530 Ca 0.23 -0.70 -0.29 0.00 0.02 0.00 0.00 55.97 55.23 1c4z s LYS 530 Cb 0.16 -2.10 -0.04 0.00 -0.52 0.00 0.00 37.83 35.34 1c4z s LYS 530 CO 0.24 -1.85 1.75 -1.14 -0.92 0.00 0.00 175.35 173.43 1c4z s GLN 531 N -5.49 3.75 -0.02 1.68 0.74 -1.14 -4.71 119.66 114.48 1c4z s GLN 531 Ca 0.69 1.85 -0.30 0.00 0.05 0.00 0.00 55.36 57.65 1c4z s GLN 531 Cb -0.05 -4.10 -0.03 0.00 1.10 0.00 0.00 33.01 29.93 1c4z s GLN 531 CO 0.48 -1.36 1.04 -1.17 -0.55 0.00 0.00 175.29 173.73 1c4z s LEU 532 N 5.53 4.34 -0.23 3.68 2.96 -1.26 -1.87 118.68 131.83 1c4z s LEU 532 Ca 0.78 1.70 0.02 0.00 -0.22 0.00 0.00 54.13 56.41 1c4z s LEU 532 Cb -0.29 -3.57 0.05 0.00 0.50 0.00 0.00 46.19 42.89 1c4z s LEU 532 CO 0.32 -0.36 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.59 1c4z s TYR 533 N 1.32 2.73 -0.02 5.38 1.51 -1.26 -4.88 117.35 122.14 1c4z s TYR 533 Ca 0.53 -1.92 -0.09 0.00 -1.01 0.00 0.00 57.07 54.57 1c4z s TYR 533 Cb -0.22 -1.73 -0.05 0.00 -0.11 0.00 0.00 41.96 39.85 1c4z s TYR 533 CO 0.26 -0.81 0.28 0.08 -1.11 0.00 0.00 175.55 174.25 1c4z s VAL 534 N 1.28 5.27 -0.09 0.71 1.01 -1.26 -0.94 120.40 126.38 1c4z s VAL 534 Ca -0.06 0.35 -0.01 0.00 0.00 0.00 0.00 61.98 62.27 1c4z s VAL 534 Cb -0.18 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1c4z s VAL 534 CO -0.06 0.47 -0.05 -0.70 0.00 0.00 0.00 175.10 174.76 1c4z s GLU 535 N -1.45 1.16 -0.07 2.72 2.12 0.23 -4.66 118.70 118.75 1c4z s GLU 535 Ca 0.24 -0.11 -0.25 0.00 0.36 0.00 0.00 54.97 55.21 1c4z s GLU 535 Cb -0.14 -1.33 -0.03 0.00 0.26 0.00 0.00 34.13 32.89 1c4z s GLU 535 CO 0.13 -0.27 0.77 -0.06 -0.54 0.00 0.00 175.26 175.28 1c4z s PHE 536 N 1.78 3.57 -0.04 5.30 0.40 -1.26 -0.34 117.98 127.39 1c4z s PHE 536 Ca 0.04 1.33 -0.34 0.00 -0.60 0.00 0.00 56.93 57.37 1c4z s PHE 536 Cb -0.12 -2.89 -0.12 0.00 0.51 0.00 0.00 43.02 40.39 1c4z s PHE 536 CO -0.07 0.03 1.83 -1.91 0.70 0.00 0.00 175.22 175.80 1c4z n GLU 537 N 3.98 2.18 -0.63 0.44 2.13 0.27 -1.96 120.64 127.05 1c4z n GLU 537 Ca 0.01 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1c4z n GLU 537 Cb 0.51 -2.63 0.00 0.00 0.27 0.00 0.00 31.44 29.59 1c4z n GLU 537 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1c4z n GLY 538 N 4.23 0.69 3.09 8.31 0.00 -1.26 -4.89 105.19 115.36 1c4z n GLY 538 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 1c4z n GLY 538 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c4z s GLU 539 N -0.37 2.24 0.97 1.61 2.02 -0.83 -5.11 118.70 119.23 1c4z s GLU 539 Ca 0.00 -1.36 -0.12 0.00 0.02 0.00 0.00 54.97 53.51 1c4z s GLU 539 Cb 0.00 -2.99 0.17 0.00 0.10 0.00 0.00 34.13 31.41 1c4z s GLU 539 CO 0.00 -0.61 1.08 -0.65 0.02 0.00 0.00 175.26 175.10 1c4z s GLN 540 N 1.13 0.64 0.00 1.61 -0.21 -1.26 -4.71 119.66 116.86 1c4z s GLN 540 Ca -0.07 0.92 0.00 0.00 0.02 0.00 0.00 55.36 56.23 1c4z s GLN 540 Cb -0.20 -1.73 0.00 0.00 1.00 0.00 0.00 33.01 32.08 1c4z s GLN 540 CO -0.04 -2.69 0.00 0.41 -2.12 0.00 0.00 175.29 170.85 1c4z n GLY 541 N -0.47 0.87 3.11 3.09 0.00 -1.26 -5.10 105.19 105.44 1c4z n GLY 541 Ca 0.07 -2.06 -0.15 0.00 0.00 0.00 0.00 46.02 43.87 1c4z n GLY 541 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c4z s VAL 542 N -1.16 0.80 -0.30 1.61 1.01 -1.26 -5.11 120.40 115.99 1c4z s VAL 542 Ca 0.00 -1.18 -0.11 0.00 0.00 0.00 0.00 61.98 60.68 1c4z s VAL 542 Cb 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1c4z s VAL 542 CO 0.00 -0.31 0.20 -0.62 0.00 0.00 0.00 175.10 174.37 1c4z s ASP 543 N -1.66 5.97 0.00 3.32 2.15 -1.26 -4.84 116.67 120.35 1c4z s ASP 543 Ca -0.06 -0.19 0.18 0.00 0.43 0.00 0.00 52.55 52.90 1c4z s ASP 543 Cb -0.10 -2.11 0.20 0.00 -0.30 0.00 0.00 42.92 40.61 1c4z s ASP 543 CO 0.01 -0.12 1.12 -0.62 -0.17 0.00 0.00 175.17 175.39 1c4z n GLU 544 N 5.07 1.67 0.00 4.34 1.02 -1.26 -4.90 120.64 126.57 1c4z n GLU 544 Ca -0.14 -1.69 0.00 0.00 -0.02 0.00 0.00 57.16 55.32 1c4z n GLU 544 Cb 0.51 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 1c4z n GLU 544 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c4z n GLY 545 N 1.01 1.26 0.20 0.62 0.00 -1.26 -4.99 105.19 102.03 1c4z n GLY 545 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1c4z n GLY 545 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1c4z h GLY 546 N 0.00 0.78 1.42 -0.02 0.00 -1.91 -0.26 103.07 103.07 1c4z h GLY 546 Ca 0.00 -1.34 -0.05 0.00 0.00 0.00 0.00 47.33 45.94 1c4z h GLY 546 CO 0.00 1.19 0.09 -2.08 0.00 0.00 0.00 176.54 175.74 1c4z h VAL 547 N 0.38 1.21 -0.59 4.60 2.07 -1.88 0.18 116.25 122.22 1c4z h VAL 547 Ca -0.12 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1c4z h VAL 547 Cb 1.66 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 1c4z h VAL 547 CO 0.20 0.29 0.28 0.28 0.02 0.00 0.00 177.57 178.63 1c4z h SER 548 N 0.71 0.78 -0.27 0.57 0.02 -1.83 -0.85 113.55 112.68 1c4z h SER 548 Ca 0.16 -0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 1c4z h SER 548 Cb 0.30 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1c4z h SER 548 CO 0.00 0.70 -0.20 0.50 -1.14 0.00 0.00 176.83 176.69 1c4z h LYS 549 N 0.81 0.74 0.17 3.45 3.64 -0.38 -1.89 116.57 123.11 1c4z h LYS 549 Ca 0.20 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1c4z h LYS 549 Cb 0.13 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1c4z h LYS 549 CO -0.02 0.88 -0.08 1.49 -2.27 0.00 0.00 179.45 179.44 1c4z h GLU 550 N 0.65 -0.23 -0.39 1.90 4.81 -0.10 0.54 114.58 121.76 1c4z h GLU 550 Ca 0.09 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1c4z h GLU 550 Cb 0.70 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.05 1c4z h GLU 550 CO 0.05 -0.15 -0.14 0.35 -0.73 0.00 0.00 179.01 178.39 1c4z h PHE 551 N -0.23 -0.33 -0.19 0.92 3.57 -1.06 -0.17 116.94 119.45 1c4z h PHE 551 Ca -0.02 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.56 1c4z h PHE 551 Cb 0.18 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 1c4z h PHE 551 CO -0.07 -0.22 -0.07 0.74 -2.23 0.00 0.00 178.31 176.46 1c4z h PHE 552 N -0.06 -0.17 -0.29 0.41 0.04 -0.75 -1.69 116.94 114.43 1c4z h PHE 552 Ca 0.19 0.02 0.03 0.00 2.80 0.00 0.00 57.97 61.02 1c4z h PHE 552 Cb 0.35 0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.57 1c4z h PHE 552 CO -0.39 -0.12 0.09 1.96 -0.60 0.00 0.00 178.31 179.26 1c4z h GLN 553 N -0.04 0.21 -0.64 1.51 4.20 0.00 -0.90 115.11 119.46 1c4z h GLN 553 Ca 0.10 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1c4z h GLN 553 Cb 0.19 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 1c4z h GLN 553 CO -0.22 0.14 0.34 -0.07 -0.67 0.00 0.00 178.83 178.35 1c4z h LEU 554 N 0.22 0.81 -0.89 1.46 3.38 -0.91 0.36 115.31 119.75 1c4z h LEU 554 Ca 0.13 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1c4z h LEU 554 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1c4z h LEU 554 CO -0.14 0.68 0.01 0.58 0.09 0.00 0.00 178.44 179.66 1c4z h VAL 555 N 0.88 1.25 -0.07 1.22 2.07 -1.06 -1.83 116.25 118.70 1c4z h VAL 555 Ca 0.22 -1.01 -0.14 0.00 0.82 0.00 0.00 66.70 66.59 1c4z h VAL 555 Cb 0.06 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1c4z h VAL 555 CO -0.03 0.36 -0.58 0.58 0.02 0.00 0.00 177.57 177.92 1c4z h VAL 556 N 0.78 1.38 -0.19 2.57 2.07 -0.50 -2.43 116.25 119.92 1c4z h VAL 556 Ca 0.15 -1.92 -0.09 0.00 0.82 0.00 0.00 66.70 65.67 1c4z h VAL 556 Cb 0.45 1.96 -0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1c4z h VAL 556 CO 0.02 0.57 -0.23 -0.08 0.02 0.00 0.00 177.57 177.87 1c4z h GLU 557 N 0.18 0.49 -0.30 1.57 4.22 0.03 -2.84 114.58 117.93 1c4z h GLU 557 Ca -0.00 -0.27 -0.17 0.00 0.08 0.00 0.00 59.36 58.99 1c4z h GLU 557 Cb 1.06 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 1c4z h GLU 557 CO 0.09 0.86 -0.49 1.49 -2.18 0.00 0.00 179.01 178.77 1c4z h GLU 558 N 0.15 0.85 -0.34 1.92 4.81 -1.35 -2.95 114.58 117.66 1c4z h GLU 558 Ca 0.02 -0.50 -0.10 0.00 -0.13 0.00 0.00 59.36 58.65 1c4z h GLU 558 Cb 0.79 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 1c4z h GLU 558 CO 0.06 1.14 -0.19 0.82 -0.73 0.00 0.00 179.01 180.11 1c4z h ILE 559 N 0.66 1.26 -0.02 2.32 1.08 -1.50 -3.00 117.51 118.31 1c4z h ILE 559 Ca 0.03 -1.23 0.00 0.00 -0.39 0.00 0.00 64.86 63.27 1c4z h ILE 559 Cb 1.09 1.20 0.00 0.00 -3.07 0.00 0.00 36.82 36.04 1c4z h ILE 559 CO 0.11 0.40 0.00 0.49 -0.69 0.00 0.00 178.15 178.46 1c4z n PHE 560 N -4.14 0.00 -2.40 1.37 3.01 -1.07 -4.46 117.46 109.76 1c4z n PHE 560 Ca 0.00 -0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.05 1c4z n PHE 560 Cb 0.39 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.82 1c4z n PHE 560 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1c4z s ASN 561 N -2.00 7.13 0.28 4.37 3.84 -1.12 -4.85 114.94 122.60 1c4z s ASN 561 Ca 0.38 2.22 0.00 0.00 0.21 0.00 0.00 52.86 55.68 1c4z s ASN 561 Cb 0.21 -2.61 0.53 0.00 -0.55 0.00 0.00 41.25 38.83 1c4z s ASN 561 CO 0.33 -0.32 1.83 -0.65 -2.79 0.00 0.00 177.10 175.50 1c4z h PRO 562 N 5.00 0.92 -0.98 0.43 0.11 -1.89 -2.89 132.00 132.69 1c4z h PRO 562 Ca -0.45 -0.06 0.19 0.00 0.11 0.00 0.00 66.00 65.79 1c4z h PRO 562 Cb 1.21 -0.21 -0.18 0.00 0.11 0.00 0.00 31.00 31.94 1c4z h PRO 562 CO 0.73 0.61 -0.27 -0.25 -0.21 0.00 0.00 178.00 178.61 1c4z n ASP 563 N -4.65 -0.41 0.08 -2.05 10.43 -1.26 0.62 116.55 119.31 1c4z n ASP 563 Ca 0.18 1.69 0.12 0.00 2.57 0.00 0.00 54.79 59.35 1c4z n ASP 563 Cb 0.35 -0.48 0.46 0.00 1.84 0.00 0.00 41.12 43.29 1c4z n ASP 563 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1c4z n ILE 564 N -5.56 0.57 -3.67 0.53 3.06 -1.09 -4.94 119.36 108.25 1c4z n ILE 564 Ca 0.14 -0.05 -0.25 0.00 -2.50 0.00 0.00 62.75 60.10 1c4z n ILE 564 Cb 0.47 -0.74 0.06 0.00 0.54 0.00 0.00 39.64 39.97 1c4z n ILE 564 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1c4z n GLY 565 N 0.91 -0.49 0.12 4.50 0.00 0.20 -4.93 105.19 105.50 1c4z n GLY 565 Ca 0.05 0.21 -0.16 0.00 0.00 0.00 0.00 46.02 46.12 1c4z n GLY 565 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1c4z n MET 566 N -4.76 0.67 -4.66 1.61 2.81 -1.26 -4.26 117.12 107.28 1c4z n MET 566 Ca -0.05 0.13 -0.24 0.00 -1.81 0.00 0.00 57.70 55.73 1c4z n MET 566 Cb 0.57 -1.57 -0.14 0.00 -0.71 0.00 0.00 33.22 31.38 1c4z n MET 566 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1c4z s PHE 567 N -2.52 1.61 0.08 2.03 0.40 -1.26 -1.12 117.98 117.20 1c4z s PHE 567 Ca -0.24 -0.34 0.02 0.00 -0.60 0.00 0.00 56.93 55.77 1c4z s PHE 567 Cb 0.08 -0.99 -0.04 0.00 0.51 0.00 0.00 43.02 42.58 1c4z s PHE 567 CO 0.70 0.04 0.13 0.95 0.70 0.00 0.00 175.22 177.74 1c4z s THR 568 N -0.67 4.78 0.04 0.64 -4.23 -0.69 -4.75 115.64 110.77 1c4z s THR 568 Ca 0.06 -0.69 0.03 0.00 -1.18 0.00 0.00 61.69 59.91 1c4z s THR 568 Cb -0.08 -3.33 -0.04 0.00 1.34 0.00 0.00 72.50 70.39 1c4z s THR 568 CO 0.01 0.10 0.00 -0.47 -0.54 0.00 0.00 174.62 173.72 1c4z s TYR 569 N -1.47 3.04 -0.34 3.99 5.04 -1.26 -2.36 117.35 124.00 1c4z s TYR 569 Ca 0.31 0.03 -0.05 0.00 -2.44 0.00 0.00 57.07 54.92 1c4z s TYR 569 Cb -0.12 -1.61 0.05 0.00 0.35 0.00 0.00 41.96 40.63 1c4z s TYR 569 CO 0.24 0.47 0.10 0.34 -1.34 0.00 0.00 175.55 175.36 1c4z s ASP 570 N -1.93 5.24 0.45 4.32 3.68 -0.79 -4.96 116.67 122.68 1c4z s ASP 570 Ca 0.23 -1.28 0.20 0.00 2.13 0.00 0.00 52.55 53.83 1c4z s ASP 570 Cb -0.12 -1.84 1.17 0.00 -1.45 0.00 0.00 42.92 40.68 1c4z s ASP 570 CO 0.14 -0.35 1.88 -0.33 0.13 0.00 0.00 175.17 176.65 1c4z h GLU 571 N 8.17 0.30 -0.10 4.34 4.39 -1.98 0.35 114.58 130.04 1c4z h GLU 571 Ca -0.22 -0.02 -0.23 0.00 0.34 0.00 0.00 59.36 59.23 1c4z h GLU 571 Cb 1.07 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.67 1c4z h GLU 571 CO 0.61 0.20 -0.85 1.03 -1.16 0.00 0.00 179.01 178.83 1c4z h SER 572 N 0.31 0.89 0.00 1.42 0.87 -1.97 -3.37 113.55 111.70 1c4z h SER 572 Ca 0.43 -0.62 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1c4z h SER 572 Cb 1.21 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 62.90 1c4z h SER 572 CO -0.13 1.42 -0.88 0.35 -0.53 0.00 0.00 176.83 177.06 1c4z n THR 573 N -3.90 0.00 -2.48 2.23 -2.24 -0.93 -5.00 114.28 101.96 1c4z n THR 573 Ca -0.08 -0.24 -0.14 0.00 -2.27 0.00 0.00 64.05 61.32 1c4z n THR 573 Cb 0.78 0.74 0.01 0.00 -2.10 0.00 0.00 70.33 69.76 1c4z n THR 573 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1c4z n LYS 574 N -1.49 -2.03 -4.45 -0.78 5.02 0.12 -5.01 118.16 109.53 1c4z n LYS 574 Ca 0.01 0.64 -0.29 0.00 -2.02 0.00 0.00 58.31 56.64 1c4z n LYS 574 Cb 0.22 -4.88 -0.13 0.00 -0.02 0.00 0.00 35.03 30.23 1c4z n LYS 574 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1c4z s LEU 575 N -4.20 2.31 0.10 -0.35 1.43 -1.25 -4.79 118.68 111.93 1c4z s LEU 575 Ca 0.09 -0.73 0.04 0.00 -1.03 0.00 0.00 54.13 52.50 1c4z s LEU 575 Cb -0.04 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 1c4z s LEU 575 CO 0.11 0.19 0.05 -0.36 0.23 0.00 0.00 176.35 176.57 1c4z s PHE 576 N -1.03 3.10 0.07 0.29 0.40 0.41 -1.89 117.98 119.33 1c4z s PHE 576 Ca 0.14 0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.49 1c4z s PHE 576 Cb -0.10 -1.57 -0.04 0.00 0.51 0.00 0.00 43.02 41.82 1c4z s PHE 576 CO 0.06 0.51 -0.05 -0.46 0.70 0.00 0.00 175.22 175.98 1c4z s TRP 577 N -1.42 0.69 0.46 0.36 -0.11 -0.99 -3.99 118.94 113.94 1c4z s TRP 577 Ca 0.28 -0.99 -0.24 0.00 1.22 0.00 0.00 56.10 56.37 1c4z s TRP 577 Cb -0.12 -0.45 -0.07 0.00 -1.50 0.00 0.00 33.47 31.33 1c4z s TRP 577 CO 0.21 -0.27 1.27 -0.06 -4.62 0.00 0.00 176.95 173.48 1c4z s PHE 578 N -3.77 2.70 -0.32 5.86 0.40 -1.26 -1.70 117.98 119.88 1c4z s PHE 578 Ca 0.09 1.44 -0.14 0.00 -0.60 0.00 0.00 56.93 57.72 1c4z s PHE 578 Cb 0.07 -3.61 -0.02 0.00 0.51 0.00 0.00 43.02 39.96 1c4z s PHE 578 CO -0.07 -2.12 0.32 1.21 0.70 0.00 0.00 175.22 175.26 1c4z s ASN 579 N -0.99 6.15 0.32 1.36 3.84 -0.28 -4.72 114.94 120.62 1c4z s ASN 579 Ca 0.63 -0.17 0.22 0.00 0.21 0.00 0.00 52.86 53.76 1c4z s ASN 579 Cb -0.36 -2.18 1.16 0.00 -0.55 0.00 0.00 41.25 39.32 1c4z s ASN 579 CO 0.44 -0.26 1.69 -2.65 -2.79 0.00 0.00 177.10 173.52 1c4z n PRO 580 N 5.29 0.16 0.00 0.43 -0.02 -1.26 -2.31 135.00 137.28 1c4z n PRO 580 Ca -0.10 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.09 1c4z n PRO 580 Cb 0.50 -1.95 0.05 0.00 -0.02 0.00 0.00 33.50 32.07 1c4z n PRO 580 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1c4z n SER 581 N -2.28 1.20 -4.63 2.55 7.64 -1.26 -4.92 113.62 111.92 1c4z n SER 581 Ca -0.01 -0.99 -0.42 0.00 1.01 0.00 0.00 58.87 58.46 1c4z n SER 581 Cb 0.08 0.60 -0.03 0.00 -1.01 0.00 0.00 64.21 63.85 1c4z n SER 581 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1c4z s SER 582 N -2.79 6.03 -0.15 6.43 0.15 -0.98 -4.93 113.70 117.46 1c4z s SER 582 Ca 0.14 2.31 -0.06 0.00 0.70 0.00 0.00 55.95 59.04 1c4z s SER 582 Cb 0.17 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.92 1c4z s SER 582 CO 0.71 -1.44 0.05 0.12 1.20 0.00 0.00 173.24 173.87 1c4z s PHE 583 N 6.09 3.24 -1.11 3.44 5.36 -1.26 -4.64 117.98 129.10 1c4z s PHE 583 Ca 0.93 0.11 -0.12 0.00 -0.96 0.00 0.00 56.93 56.89 1c4z s PHE 583 Cb -0.38 -1.98 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 1c4z s PHE 583 CO 0.38 0.28 0.85 0.39 -1.46 0.00 0.00 175.22 175.66 1c4z n GLU 584 N 3.02 -2.18 -1.03 10.12 -0.58 -1.26 -4.95 120.64 123.79 1c4z n GLU 584 Ca -0.18 0.67 0.03 0.00 -0.42 0.00 0.00 57.16 57.27 1c4z n GLU 584 Cb 0.53 -5.05 0.03 0.00 -0.57 0.00 0.00 31.44 26.38 1c4z n GLU 584 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1c4z n THR 585 N -3.76 0.25 -0.17 2.62 -2.24 -1.26 -4.86 114.28 104.86 1c4z n THR 585 Ca -0.11 -0.88 -0.05 0.00 -2.27 0.00 0.00 64.05 60.74 1c4z n THR 585 Cb 0.61 0.68 0.04 0.00 -2.10 0.00 0.00 70.33 69.57 1c4z n THR 585 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1c4z h GLU 586 N 0.62 0.54 -0.22 -0.78 3.07 -1.93 -2.18 114.58 113.69 1c4z h GLU 586 Ca -0.13 -0.03 0.06 0.00 -0.50 0.00 0.00 59.36 58.76 1c4z h GLU 586 Cb 1.62 -0.12 -0.06 0.00 -0.84 0.00 0.00 28.75 29.35 1c4z h GLU 586 CO 0.05 0.36 -0.19 0.78 -1.40 0.00 0.00 179.01 178.61 1c4z h GLY 587 N 0.56 -0.08 1.03 -3.84 0.00 -1.96 -0.12 103.07 98.66 1c4z h GLY 587 Ca 0.21 0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.77 1c4z h GLY 587 CO -0.12 -0.18 0.52 1.46 0.00 0.00 0.00 176.54 178.23 1c4z h GLN 588 N -0.20 1.27 -0.24 4.80 7.50 -1.84 -1.31 115.11 125.08 1c4z h GLN 588 Ca 0.13 -0.13 -0.09 0.00 0.50 0.00 0.00 58.65 59.06 1c4z h GLN 588 Cb 0.40 -0.26 -0.00 0.00 0.05 0.00 0.00 27.48 27.67 1c4z h GLN 588 CO -0.34 0.91 -0.19 0.74 -1.50 0.00 0.00 178.83 178.45 1c4z h PHE 589 N 1.28 0.65 -0.99 2.96 0.04 -1.06 -2.94 116.94 116.88 1c4z h PHE 589 Ca 0.33 -0.18 0.15 0.00 2.80 0.00 0.00 57.97 61.07 1c4z h PHE 589 Cb -0.01 -0.14 -0.09 0.00 2.20 0.00 0.00 35.95 37.91 1c4z h PHE 589 CO 0.01 0.86 0.62 1.15 -0.60 0.00 0.00 178.31 180.34 1c4z h THR 590 N 0.26 0.82 -0.34 -1.55 2.02 -0.73 -2.43 112.91 110.97 1c4z h THR 590 Ca 0.04 -0.29 -0.07 0.00 0.77 0.00 0.00 66.41 66.86 1c4z h THR 590 Cb 0.72 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1c4z h THR 590 CO 0.05 0.16 -0.07 0.25 0.37 0.00 0.00 175.52 176.28 1c4z h LEU 591 N 0.86 0.64 -0.90 2.58 5.85 -1.09 -1.50 115.31 121.75 1c4z h LEU 591 Ca 0.52 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1c4z h LEU 591 Cb 0.70 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1c4z h LEU 591 CO -0.30 0.85 0.44 0.40 -0.34 0.00 0.00 178.44 179.49 1c4z h ILE 592 N 0.43 1.26 0.46 4.05 2.04 -1.32 0.43 117.51 124.85 1c4z h ILE 592 Ca 0.09 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 1c4z h ILE 592 Cb 0.56 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1c4z h ILE 592 CO 0.03 0.30 -0.45 1.23 0.00 0.00 0.00 178.15 179.26 1c4z h GLY 593 N 1.22 -1.21 -0.27 5.37 0.00 -1.28 0.49 103.07 107.39 1c4z h GLY 593 Ca 0.30 0.56 0.10 0.00 0.00 0.00 0.00 47.33 48.28 1c4z h GLY 593 CO -0.04 -0.37 -0.30 -2.22 0.00 0.00 0.00 176.54 173.61 1c4z h ILE 594 N -0.90 0.23 -0.39 2.60 2.04 -0.94 -0.79 117.51 119.36 1c4z h ILE 594 Ca -0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.87 1c4z h ILE 594 Cb 0.78 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1c4z h ILE 594 CO -0.05 0.00 0.04 0.58 0.00 0.00 0.00 178.15 178.72 1c4z h VAL 595 N -0.18 0.75 -0.66 1.67 2.07 -0.48 0.50 116.25 119.91 1c4z h VAL 595 Ca 0.22 -0.05 0.11 0.00 0.82 0.00 0.00 66.70 67.79 1c4z h VAL 595 Cb 0.53 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 30.80 1c4z h VAL 595 CO -0.61 0.03 0.25 -0.07 0.02 0.00 0.00 177.57 177.19 1c4z h LEU 596 N 0.15 0.24 -0.62 2.57 4.07 0.13 0.32 115.31 122.18 1c4z h LEU 596 Ca 0.19 0.09 -0.09 0.00 0.08 0.00 0.00 57.88 58.15 1c4z h LEU 596 Cb 0.25 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 1c4z h LEU 596 CO -0.29 0.13 0.04 1.23 -1.08 0.00 0.00 178.44 178.47 1c4z h GLY 597 N 0.43 1.15 1.51 0.83 0.00 0.18 -2.71 103.07 104.46 1c4z h GLY 597 Ca 0.34 -0.82 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 1c4z h GLY 597 CO -0.34 0.75 0.03 1.41 0.00 0.00 0.00 176.54 178.40 1c4z h LEU 598 N 0.97 0.57 -0.06 3.11 3.38 0.20 -2.83 115.31 120.65 1c4z h LEU 598 Ca 0.18 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1c4z h LEU 598 Cb 0.52 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1c4z h LEU 598 CO 0.02 0.62 -0.02 0.00 0.09 0.00 0.00 178.44 179.15 1c4z h ALA 599 N 1.45 0.04 -0.49 1.53 0.00 -0.16 -1.85 119.26 119.78 1c4z h ALA 599 Ca 0.13 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.13 1c4z h ALA 599 Cb 0.32 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1c4z h ALA 599 CO 0.01 -0.50 0.16 0.82 0.00 0.00 0.00 179.25 179.73 1c4z h ILE 600 N -0.01 0.81 0.00 0.00 2.04 -1.27 -1.57 117.51 117.50 1c4z h ILE 600 Ca 0.03 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1c4z h ILE 600 Cb 0.06 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1c4z h ILE 600 CO -0.07 0.06 0.00 -1.22 0.00 0.00 0.00 178.15 176.92 1c4z n TYR 601 N -5.03 0.00 -0.96 1.37 4.02 -0.93 -2.26 117.16 113.37 1c4z n TYR 601 Ca 0.05 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.03 1c4z n TYR 601 Cb 0.21 -0.36 0.14 0.00 -0.02 0.00 0.00 39.34 39.31 1c4z n TYR 601 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1c4z n ASN 602 N -1.36 2.49 -4.16 7.72 4.13 -0.74 -4.87 115.26 118.48 1c4z n ASN 602 Ca 0.08 -2.98 -0.30 0.00 1.68 0.00 0.00 54.58 53.07 1c4z n ASN 602 Cb 0.19 -0.40 -0.06 0.00 -1.54 0.00 0.00 39.78 37.98 1c4z n ASN 602 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1c4z n ASN 603 N -1.24 -0.24 -4.13 6.41 5.15 -0.80 -4.93 115.26 115.49 1c4z n ASN 603 Ca 0.15 -1.13 -0.34 0.00 -0.60 0.00 0.00 54.58 52.66 1c4z n ASN 603 Cb 0.63 -2.37 -0.14 0.00 -0.53 0.00 0.00 39.78 37.37 1c4z n ASN 603 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1c4z s ILE 605 N 1.17 3.74 0.19 0.00 -4.36 -1.26 -4.55 121.20 116.12 1c4z s ILE 605 Ca -0.03 1.33 0.08 0.00 -0.26 0.00 0.00 60.65 61.77 1c4z s ILE 605 Cb -0.20 -3.69 -0.04 0.00 1.25 0.00 0.00 42.46 39.78 1c4z s ILE 605 CO -0.03 0.01 -0.02 -0.76 0.24 0.00 0.00 174.94 174.38 1c4z s LEU 606 N -2.62 3.22 -1.16 0.37 1.43 -0.66 -4.97 118.68 114.29 1c4z s LEU 606 Ca 0.57 -0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 53.15 1c4z s LEU 606 Cb -0.22 -1.86 0.25 0.00 0.03 0.00 0.00 46.19 44.39 1c4z s LEU 606 CO 0.27 0.08 1.76 -0.67 0.23 0.00 0.00 176.35 178.02 1c4z n ASP 607 N -0.20 6.38 -4.46 2.29 -0.08 -1.26 -4.51 116.55 114.70 1c4z n ASP 607 Ca -0.09 -3.34 -0.33 0.00 -1.51 0.00 0.00 54.79 49.52 1c4z n ASP 607 Cb 0.56 -1.33 -0.13 0.00 2.34 0.00 0.00 41.12 42.56 1c4z n ASP 607 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1c4z s VAL 608 N -1.93 3.01 -0.32 5.18 -7.23 -1.26 -5.10 120.40 112.76 1c4z s VAL 608 Ca 0.37 -0.74 0.02 0.00 -1.81 0.00 0.00 61.98 59.82 1c4z s VAL 608 Cb 0.10 -2.17 0.10 0.00 0.56 0.00 0.00 36.38 34.96 1c4z s VAL 608 CO 0.02 0.59 0.06 -1.00 -0.31 0.00 0.00 175.10 174.46 1c4z s HIS 609 N -0.69 2.73 0.01 2.82 3.76 -1.26 -4.98 115.29 117.68 1c4z s HIS 609 Ca 0.11 -2.34 0.04 0.00 -0.15 0.00 0.00 55.06 52.72 1c4z s HIS 609 Cb -0.11 -2.28 -0.03 0.00 1.11 0.00 0.00 32.58 31.27 1c4z s HIS 609 CO 0.01 -0.90 -0.07 -0.06 -0.85 0.00 0.00 174.74 172.86 1c4z s PHE 610 N 1.26 2.86 0.81 1.40 2.99 -1.26 -0.44 117.98 125.60 1c4z s PHE 610 Ca 0.09 -0.06 -0.10 0.00 0.00 0.00 0.00 56.93 56.86 1c4z s PHE 610 Cb -0.18 -1.59 0.08 0.00 0.00 0.00 0.00 43.02 41.33 1c4z s PHE 610 CO -0.16 0.37 1.10 -1.25 -0.00 0.00 0.00 175.22 175.29 1c4z s PRO 611 N -1.49 1.94 0.39 0.24 0.04 -1.26 -4.86 135.00 130.01 1c4z s PRO 611 Ca 0.17 1.23 0.25 0.00 0.04 0.00 0.00 61.00 62.69 1c4z s PRO 611 Cb -0.11 -1.86 1.34 0.00 0.04 0.00 0.00 34.50 33.91 1c4z s PRO 611 CO 0.08 -1.89 1.74 1.98 0.04 0.00 0.00 177.00 178.95 1c4z h MET 612 N -1.31 0.00 0.00 4.56 4.05 -1.94 -2.58 114.93 117.71 1c4z h MET 612 Ca -0.44 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 58.92 1c4z h MET 612 Cb 1.24 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.03 1c4z h MET 612 CO 0.49 0.00 -0.32 0.28 0.23 0.00 0.00 176.91 177.59 1c4z h VAL 613 N 0.00 0.73 -0.49 -5.77 2.07 -1.90 -2.89 116.25 108.00 1c4z h VAL 613 Ca 0.00 -1.42 -0.09 0.00 0.82 0.00 0.00 66.70 66.01 1c4z h VAL 613 Cb 0.11 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1c4z h VAL 613 CO 0.00 0.31 -0.07 0.58 0.02 0.00 0.00 177.57 178.41 1c4z h VAL 614 N 0.00 1.26 0.00 2.57 2.07 -1.81 0.22 116.25 120.56 1c4z h VAL 614 Ca -0.00 -1.16 -0.09 0.00 0.82 0.00 0.00 66.70 66.26 1c4z h VAL 614 Cb 0.88 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1c4z h VAL 614 CO 0.04 0.41 -0.43 1.88 0.02 0.00 0.00 177.57 179.49 1c4z h TYR 615 N 0.80 0.00 -0.03 1.57 -1.99 -1.71 -0.29 116.97 115.32 1c4z h TYR 615 Ca 0.14 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.69 1c4z h TYR 615 Cb 0.58 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.32 1c4z h TYR 615 CO 0.03 0.43 -0.69 0.00 -0.00 0.00 0.00 178.16 177.93 1c4z h ARG 616 N 0.00 0.52 -0.47 4.88 3.08 -1.23 -2.54 114.38 118.61 1c4z h ARG 616 Ca -0.00 -0.52 -0.08 0.00 0.07 0.00 0.00 59.98 59.45 1c4z h ARG 616 Cb 1.06 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 31.23 1c4z h ARG 616 CO 0.06 1.15 -0.04 0.87 -1.07 0.00 0.00 179.97 180.94 1c4z h LYS 617 N 0.08 0.81 0.00 0.04 1.57 -0.86 -1.07 116.57 117.13 1c4z h LYS 617 Ca -0.08 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1c4z h LYS 617 Cb 1.37 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.60 1c4z h LYS 617 CO 0.14 0.83 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.76 1c4z h LEU 618 N 0.74 0.00 -2.19 2.94 3.38 -0.96 -1.23 115.31 118.00 1c4z h LEU 618 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1c4z h LEU 618 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1c4z h LEU 618 CO 0.03 0.02 0.00 0.23 0.09 0.00 0.00 178.44 178.81 1c4z n MET 619 N -3.25 2.46 -0.20 1.13 2.81 -0.47 -4.93 117.12 114.67 1c4z n MET 619 Ca -0.02 -2.11 0.00 0.00 -1.81 0.00 0.00 57.70 53.76 1c4z n MET 619 Cb 0.15 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 1c4z n MET 619 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1c4z n GLY 620 N 1.36 0.72 3.84 3.03 0.00 -0.46 -5.02 105.19 108.64 1c4z n GLY 620 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1c4z n GLY 620 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c4z s LYS 621 N -0.71 3.95 0.50 1.61 1.02 -0.83 -4.99 119.74 120.28 1c4z s LYS 621 Ca 0.00 0.44 -0.21 0.00 0.02 0.00 0.00 55.97 56.22 1c4z s LYS 621 Cb 0.00 -3.13 -0.07 0.00 -0.52 0.00 0.00 37.83 34.11 1c4z s LYS 621 CO 0.00 0.62 1.08 0.15 -0.92 0.00 0.00 175.35 176.28 1c4z s LYS 622 N -1.40 3.67 0.26 1.68 -0.14 -1.26 -3.53 119.74 119.02 1c4z s LYS 622 Ca 0.29 1.50 -0.30 0.00 -1.36 0.00 0.00 55.97 56.11 1c4z s LYS 622 Cb -0.16 -2.13 -0.09 0.00 -1.68 0.00 0.00 37.83 33.76 1c4z s LYS 622 CO 0.16 -0.56 1.04 0.20 -0.76 0.00 0.00 175.35 175.43 1c4z s GLY 623 N -1.81 3.09 0.40 -3.33 0.00 -1.26 -4.90 107.32 99.50 1c4z s GLY 623 Ca 0.68 0.80 0.03 0.00 0.00 0.00 0.00 44.72 46.23 1c4z s GLY 623 CO 0.24 1.39 0.09 -0.51 0.00 0.00 0.00 173.10 174.31 1c4z s THR 624 N -1.16 0.88 0.20 0.90 -4.23 -1.26 -4.51 115.64 106.46 1c4z s THR 624 Ca 0.43 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.80 1c4z s THR 624 Cb -0.30 -2.47 0.20 0.00 1.34 0.00 0.00 72.50 71.27 1c4z s THR 624 CO 0.38 0.00 1.64 0.15 -0.54 0.00 0.00 174.62 176.25 1c4z h PHE 625 N 1.83 -0.27 -0.30 3.99 3.57 -1.90 0.40 116.94 124.27 1c4z h PHE 625 Ca -0.38 0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.25 1c4z h PHE 625 Cb 1.27 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 40.21 1c4z h PHE 625 CO 1.21 -0.24 0.21 0.00 -2.23 0.00 0.00 178.31 177.26 1c4z h ARG 626 N 0.02 0.03 0.00 1.11 3.08 -2.00 -0.70 114.38 115.91 1c4z h ARG 626 Ca 0.29 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.22 1c4z h ARG 626 Cb 0.44 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1c4z h ARG 626 CO -0.59 0.02 -0.55 -0.44 -1.07 0.00 0.00 179.97 177.34 1c4z h ASP 627 N 0.03 0.00 -0.29 7.04 3.32 -0.60 -3.04 116.42 122.87 1c4z h ASP 627 Ca 0.14 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.28 1c4z h ASP 627 Cb 0.53 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1c4z h ASP 627 CO -0.01 0.55 0.27 -0.07 -1.72 0.00 0.00 179.24 178.26 1c4z h LEU 628 N 0.00 0.00 -0.76 1.55 3.38 -0.72 -2.76 115.31 116.00 1c4z h LEU 628 Ca -0.01 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.12 1c4z h LEU 628 Cb 1.07 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.68 1c4z h LEU 628 CO 0.07 0.00 -0.13 1.23 0.09 0.00 0.00 178.44 179.70 1c4z h GLY 629 N 0.00 0.65 1.18 0.83 0.00 -1.63 0.47 103.07 104.56 1c4z h GLY 629 Ca 0.14 0.21 -0.29 0.00 0.00 0.00 0.00 47.33 47.39 1c4z h GLY 629 CO -0.00 -0.29 -1.57 -0.55 0.00 0.00 0.00 176.54 174.12 1c4z h ASP 630 N 0.03 0.11 1.09 0.19 3.45 -1.73 -3.24 116.42 116.33 1c4z h ASP 630 Ca 0.38 -0.19 -0.09 0.00 0.43 0.00 0.00 57.03 57.55 1c4z h ASP 630 Cb 0.62 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.34 1c4z h ASP 630 CO -0.75 1.17 -0.95 0.77 -1.57 0.00 0.00 179.24 177.91 1c4z h SER 631 N 0.02 0.00 -1.19 6.45 4.64 -1.46 -3.41 113.55 118.60 1c4z h SER 631 Ca -0.24 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.66 1c4z h SER 631 Cb 1.97 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.78 1c4z h SER 631 CO 0.10 0.35 -0.84 1.41 -0.87 0.00 0.00 176.83 176.98 1c4z n HIS 632 N -2.94 -1.66 -0.16 4.77 8.25 0.16 -5.03 115.22 118.62 1c4z n HIS 632 Ca -0.03 -2.78 -0.06 0.00 -0.26 0.00 0.00 57.72 54.59 1c4z n HIS 632 Cb 0.71 0.48 0.00 0.00 1.12 0.00 0.00 29.99 32.30 1c4z n HIS 632 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1c4z h PRO 633 N 4.07 -0.18 -0.20 -0.41 0.11 -1.61 -1.04 132.00 132.74 1c4z h PRO 633 Ca -0.01 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1c4z h PRO 633 Cb 0.95 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1c4z h PRO 633 CO 0.40 -0.12 0.12 -0.24 -0.21 0.00 0.00 178.00 177.95 1c4z h VAL 634 N -0.19 1.08 -0.85 3.15 3.04 -1.91 -2.08 116.25 118.49 1c4z h VAL 634 Ca 0.21 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.70 1c4z h VAL 634 Cb 0.53 0.86 -0.04 0.00 -2.01 0.00 0.00 31.29 30.63 1c4z h VAL 634 CO -0.61 0.08 0.54 0.25 -1.01 0.00 0.00 177.57 176.82 1c4z h LEU 635 N 0.24 1.00 -0.83 3.16 6.46 -1.87 -2.15 115.31 121.33 1c4z h LEU 635 Ca 0.07 -0.05 -0.04 0.00 -0.12 0.00 0.00 57.88 57.75 1c4z h LEU 635 Cb 0.03 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 39.67 1c4z h LEU 635 CO -0.01 0.75 0.37 0.22 -0.62 0.00 0.00 178.44 179.14 1c4z h TYR 636 N 1.16 1.22 -0.24 1.25 5.03 -1.04 -1.18 116.97 123.18 1c4z h TYR 636 Ca 0.31 -0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.53 1c4z h TYR 636 Cb -0.09 -0.37 -0.01 0.00 1.55 0.00 0.00 36.73 37.81 1c4z h TYR 636 CO -0.01 0.90 0.10 1.96 -1.32 0.00 0.00 178.16 179.80 1c4z h GLN 637 N 1.19 0.35 -0.04 1.82 1.08 -0.99 -0.22 115.11 118.31 1c4z h GLN 637 Ca 0.28 -0.06 0.04 0.00 -1.45 0.00 0.00 58.65 57.46 1c4z h GLN 637 Cb 0.17 -0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.48 1c4z h GLN 637 CO -0.03 0.38 -0.33 0.77 -0.95 0.00 0.00 178.83 178.67 1c4z h SER 638 N 0.24 -1.00 -0.51 1.46 0.02 -1.03 0.14 113.55 112.88 1c4z h SER 638 Ca 0.08 0.13 0.05 0.00 -0.84 0.00 0.00 61.79 61.22 1c4z h SER 638 Cb 0.15 0.41 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 1c4z h SER 638 CO -0.01 -0.38 0.34 -0.07 -1.14 0.00 0.00 176.83 175.57 1c4z h LEU 639 N -0.46 0.41 0.25 5.07 3.38 -0.98 -0.53 115.31 122.46 1c4z h LEU 639 Ca 0.07 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1c4z h LEU 639 Cb 0.56 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1c4z h LEU 639 CO -0.29 0.27 -0.12 0.50 0.09 0.00 0.00 178.44 178.89 1c4z h LYS 640 N 0.47 -0.33 -0.49 1.13 3.64 -0.09 -1.88 116.57 119.02 1c4z h LYS 640 Ca 0.22 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.72 1c4z h LYS 640 Cb 0.26 0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 32.05 1c4z h LYS 640 CO -0.06 -0.01 -0.25 -0.44 -2.27 0.00 0.00 179.45 176.43 1c4z h ASP 641 N -0.68 -0.85 -0.07 4.20 3.45 -0.36 0.32 116.42 122.43 1c4z h ASP 641 Ca -0.03 0.19 0.04 0.00 0.43 0.00 0.00 57.03 57.65 1c4z h ASP 641 Cb 0.47 0.45 -0.06 0.00 -0.56 0.00 0.00 39.33 39.63 1c4z h ASP 641 CO 0.06 -0.26 -0.36 0.25 -1.57 0.00 0.00 179.24 177.35 1c4z h LEU 642 N -0.14 -1.11 -1.09 1.55 6.46 -1.02 0.62 115.31 120.58 1c4z h LEU 642 Ca 0.22 0.15 0.09 0.00 -0.12 0.00 0.00 57.88 58.23 1c4z h LEU 642 Cb 0.49 0.45 -0.07 0.00 -0.73 0.00 0.00 40.66 40.80 1c4z h LEU 642 CO -0.58 -0.40 0.61 -0.07 -0.62 0.00 0.00 178.44 177.39 1c4z h LEU 643 N -0.47 0.91 -0.24 2.25 3.38 -0.30 -1.27 115.31 119.57 1c4z h LEU 643 Ca 0.07 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1c4z h LEU 643 Cb 0.59 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1c4z h LEU 643 CO -0.34 0.54 -0.08 -0.62 0.09 0.00 0.00 178.44 178.03 1c4z n GLU 644 N -4.54 0.79 -1.67 1.13 1.02 0.98 -4.89 120.64 113.44 1c4z n GLU 644 Ca 0.16 -0.24 -0.48 0.00 -0.02 0.00 0.00 57.16 56.57 1c4z n GLU 644 Cb 0.28 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.16 1c4z n GLU 644 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1c4z n TYR 645 N -0.89 2.24 0.02 -0.32 9.36 0.20 -4.85 117.16 122.92 1c4z n TYR 645 Ca 0.16 0.17 -0.12 0.00 3.32 0.00 0.00 57.90 61.43 1c4z n TYR 645 Cb 0.26 -2.59 -0.14 0.00 -0.63 0.00 0.00 39.34 36.25 1c4z n TYR 645 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1c4z h GLU 646 N 7.65 0.10 0.00 2.98 5.08 -1.89 -3.46 114.58 125.04 1c4z h GLU 646 Ca -0.47 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 57.71 1c4z h GLU 646 Cb 1.27 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1c4z h GLU 646 CO 0.92 0.86 0.00 0.41 -1.00 0.00 0.00 179.01 180.20 1c4z n GLY 647 N 1.59 -3.61 2.85 -3.84 0.00 -1.26 -4.99 105.19 95.94 1c4z n GLY 647 Ca -0.15 -0.84 -0.29 0.00 0.00 0.00 0.00 46.02 44.74 1c4z n GLY 647 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1c4z s ASN 648 N -2.00 3.50 1.37 1.61 3.84 -1.26 -5.07 114.94 116.92 1c4z s ASN 648 Ca 0.00 -1.07 -0.19 0.00 0.21 0.00 0.00 52.86 51.81 1c4z s ASN 648 Cb 0.00 -0.94 0.30 0.00 -0.55 0.00 0.00 41.25 40.06 1c4z s ASN 648 CO 0.00 -0.27 0.74 0.52 -2.79 0.00 0.00 177.10 175.29 1c4z n VAL 649 N 4.82 0.00 0.00 -5.21 0.31 -1.26 -1.93 118.33 115.06 1c4z n VAL 649 Ca -0.10 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1c4z n VAL 649 Cb 0.45 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 1c4z n VAL 649 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1c4z n GLU 650 N -4.97 0.00 0.06 5.55 2.13 -0.98 -3.87 120.64 118.57 1c4z n GLU 650 Ca 0.11 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.87 1c4z n GLU 650 Cb 0.49 0.00 0.12 0.00 0.27 0.00 0.00 31.44 32.31 1c4z n GLU 650 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1c4z h ASP 651 N 0.00 0.37 0.60 4.31 3.32 -1.89 -3.26 116.42 119.87 1c4z h ASP 651 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1c4z h ASP 651 Cb 0.00 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1c4z h ASP 651 CO 0.00 0.85 -1.21 0.47 -1.72 0.00 0.00 179.24 177.64 1c4z n ASP 652 N -3.92 0.59 -4.11 6.45 8.00 -0.81 -4.93 116.55 117.81 1c4z n ASP 652 Ca -0.02 0.08 -0.20 0.00 0.71 0.00 0.00 54.79 55.35 1c4z n ASP 652 Cb 0.59 0.87 -0.14 0.00 -0.02 0.00 0.00 41.12 42.43 1c4z n ASP 652 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1c4z s MET 653 N -3.34 0.93 -1.02 -1.24 -1.94 -1.23 -5.05 119.30 106.41 1c4z s MET 653 Ca -0.00 -0.61 -0.02 0.00 -1.71 0.00 0.00 55.69 53.34 1c4z s MET 653 Cb 0.12 -0.92 0.31 0.00 2.01 0.00 0.00 34.83 36.35 1c4z s MET 653 CO 0.82 0.24 1.47 -0.12 -0.01 0.00 0.00 175.02 177.42 1c4z n MET 654 N 2.28 4.47 -4.07 2.03 1.56 -1.26 -3.91 117.12 118.22 1c4z n MET 654 Ca -0.16 -4.60 -0.12 0.00 -0.27 0.00 0.00 57.70 52.55 1c4z n MET 654 Cb 0.55 -2.47 -0.11 0.00 2.15 0.00 0.00 33.22 33.34 1c4z n MET 654 CO 0.00 0.00 0.00 0.96 -0.73 0.00 0.00 175.97 176.20 1c4z s ILE 655 N -3.10 0.50 0.00 1.12 -4.36 -1.26 -5.11 121.20 108.99 1c4z s ILE 655 Ca 0.34 -1.19 0.00 0.00 -0.26 0.00 0.00 60.65 59.53 1c4z s ILE 655 Cb 0.09 -0.74 0.00 0.00 1.25 0.00 0.00 42.46 43.06 1c4z s ILE 655 CO 0.05 -0.48 0.00 0.35 0.24 0.00 0.00 174.94 175.10 1c4z n THR 656 N 1.24 0.00 1.19 8.37 -2.24 -1.26 -1.47 114.28 120.12 1c4z n THR 656 Ca -0.21 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.58 1c4z n THR 656 Cb 0.56 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.84 1c4z n THR 656 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1c4z n PHE 657 N 0.00 0.22 -3.66 4.78 3.01 -1.21 -4.65 117.46 115.95 1c4z n PHE 657 Ca 0.00 -0.09 -0.38 0.00 1.01 0.00 0.00 57.45 58.00 1c4z n PHE 657 Cb 0.00 -0.08 -0.12 0.00 -0.01 0.00 0.00 39.48 39.27 1c4z n PHE 657 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 1c4z s GLN 658 N -1.55 3.71 0.40 -1.08 0.74 -1.26 -0.26 119.66 120.36 1c4z s GLN 658 Ca 0.07 -0.46 0.08 0.00 0.05 0.00 0.00 55.36 55.10 1c4z s GLN 658 Cb 0.05 -3.52 -0.07 0.00 1.10 0.00 0.00 33.01 30.56 1c4z s GLN 658 CO 0.04 -0.23 0.02 0.96 -0.55 0.00 0.00 175.29 175.52 1c4z s ILE 659 N 1.68 2.11 0.18 -2.34 -4.36 -0.22 -4.94 121.20 113.32 1c4z s ILE 659 Ca 0.06 -1.99 0.08 0.00 -0.26 0.00 0.00 60.65 58.55 1c4z s ILE 659 Cb -0.16 -2.94 -0.04 0.00 1.25 0.00 0.00 42.46 40.57 1c4z s ILE 659 CO 0.07 -0.04 -0.04 -0.94 0.24 0.00 0.00 174.94 174.23 1c4z s SER 660 N -3.72 4.54 -0.21 4.36 1.04 -1.26 -0.90 113.70 117.54 1c4z s SER 660 Ca 0.35 -0.49 -0.05 0.00 0.48 0.00 0.00 55.95 56.25 1c4z s SER 660 Cb 0.07 -0.88 0.08 0.00 0.10 0.00 0.00 66.02 65.39 1c4z s SER 660 CO 0.18 0.09 0.11 -1.10 0.98 0.00 0.00 173.24 173.51 1c4z s GLN 661 N -2.94 0.11 0.21 4.02 -1.52 -0.61 -4.97 119.66 113.97 1c4z s GLN 661 Ca 0.27 -0.20 -0.03 0.00 -1.95 0.00 0.00 55.36 53.44 1c4z s GLN 661 Cb -0.09 -1.57 -0.05 0.00 -0.22 0.00 0.00 33.01 31.09 1c4z s GLN 661 CO 0.17 -0.78 0.43 0.95 -0.25 0.00 0.00 175.29 175.81 1c4z s THR 662 N 2.14 5.15 0.70 -0.19 -4.23 -1.26 -1.71 115.64 116.24 1c4z s THR 662 Ca 0.05 -0.17 0.02 0.00 -1.18 0.00 0.00 61.69 60.41 1c4z s THR 662 Cb -0.16 -3.71 0.13 0.00 1.34 0.00 0.00 72.50 70.10 1c4z s THR 662 CO -0.18 -0.17 0.97 -1.81 -0.54 0.00 0.00 174.62 172.88 1c4z s ASP 663 N -3.02 4.42 0.00 3.99 1.11 -1.21 -4.95 116.67 117.01 1c4z s ASP 663 Ca 0.40 -0.56 0.06 0.00 0.18 0.00 0.00 52.55 52.64 1c4z s ASP 663 Cb -0.11 0.20 0.38 0.00 1.07 0.00 0.00 42.92 44.46 1c4z s ASP 663 CO 0.28 -1.82 0.79 0.18 1.18 0.00 0.00 175.17 175.78 1c4z n LEU 664 N -2.74 0.00 -0.03 1.23 4.32 -1.26 -2.44 117.00 116.08 1c4z n LEU 664 Ca 0.16 0.00 0.02 0.00 -0.02 0.00 0.00 56.01 56.17 1c4z n LEU 664 Cb 0.61 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.44 1c4z n LEU 664 CO 0.41 0.00 0.48 0.49 -1.22 0.00 0.00 177.39 177.55 1c4z n PHE 665 N -0.90 0.00 -1.70 -1.77 0.99 -1.26 -4.99 117.46 107.83 1c4z n PHE 665 Ca 0.05 -0.53 -0.03 0.00 -0.00 0.00 0.00 57.45 56.94 1c4z n PHE 665 Cb 0.02 -0.07 -0.01 0.00 -1.00 0.00 0.00 39.48 38.43 1c4z n PHE 665 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1c4z n GLY 666 N -0.63 0.38 3.34 1.37 0.00 -1.02 -5.00 105.19 103.63 1c4z n GLY 666 Ca 0.03 -0.84 -0.46 0.00 0.00 0.00 0.00 46.02 44.75 1c4z n GLY 666 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1c4z s ASN 667 N -2.91 6.70 0.38 1.61 -0.87 -1.26 -4.92 114.94 113.66 1c4z s ASN 667 Ca 0.00 -2.52 -0.27 0.00 -1.57 0.00 0.00 52.86 48.50 1c4z s ASN 667 Cb 0.00 -2.24 -0.09 0.00 -0.02 0.00 0.00 41.25 38.90 1c4z s ASN 667 CO 0.00 -0.67 1.25 -2.16 -2.57 0.00 0.00 177.10 172.95 1c4z s PRO 668 N 0.64 4.12 -0.06 -0.60 0.04 -1.26 -3.35 135.00 134.53 1c4z s PRO 668 Ca 0.19 2.04 0.06 0.00 0.04 0.00 0.00 61.00 63.33 1c4z s PRO 668 Cb -0.11 -2.83 -0.01 0.00 0.04 0.00 0.00 34.50 31.59 1c4z s PRO 668 CO -0.08 -0.32 -0.23 1.41 0.04 0.00 0.00 177.00 177.81 1c4z s MET 669 N -2.11 2.41 0.27 4.56 1.75 -0.69 -4.95 119.30 120.54 1c4z s MET 669 Ca 0.54 -0.85 -0.18 0.00 -1.25 0.00 0.00 55.69 53.96 1c4z s MET 669 Cb -0.36 -2.04 -0.09 0.00 2.84 0.00 0.00 34.83 35.18 1c4z s MET 669 CO 0.46 0.35 0.74 -1.64 -0.65 0.00 0.00 175.02 174.28 1c4z s MET 670 N -0.11 4.16 -0.03 4.11 -1.94 -1.26 -1.57 119.30 122.66 1c4z s MET 670 Ca -0.04 0.82 -0.01 0.00 -1.71 0.00 0.00 55.69 54.75 1c4z s MET 670 Cb -0.13 -2.67 0.03 0.00 2.01 0.00 0.00 34.83 34.06 1c4z s MET 670 CO 0.03 0.28 0.04 -0.47 -0.01 0.00 0.00 175.02 174.89 1c4z s TYR 671 N -1.73 0.10 -0.17 -0.03 5.04 -0.08 -4.96 117.35 115.52 1c4z s TYR 671 Ca 0.48 0.14 -0.20 0.00 -2.44 0.00 0.00 57.07 55.05 1c4z s TYR 671 Cb -0.14 -0.37 -0.03 0.00 0.35 0.00 0.00 41.96 41.77 1c4z s TYR 671 CO 0.19 -0.14 0.60 -0.51 -1.34 0.00 0.00 175.55 174.36 1c4z s ASP 672 N 1.48 6.71 0.00 4.32 -0.00 -1.26 -1.06 116.67 126.86 1c4z s ASP 672 Ca -0.04 0.86 0.27 0.00 -0.00 0.00 0.00 52.55 53.64 1c4z s ASP 672 Cb -0.13 -2.34 1.38 0.00 -0.00 0.00 0.00 42.92 41.83 1c4z s ASP 672 CO -0.03 -0.20 1.93 0.18 -0.00 0.00 0.00 175.17 177.05 1c4z n LEU 673 N 4.67 0.00 -3.54 1.23 4.77 0.64 -4.85 117.00 119.91 1c4z n LEU 673 Ca -0.03 0.28 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 1c4z n LEU 673 Cb 0.50 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 1c4z n LEU 673 CO 0.44 -0.03 0.74 -0.75 -1.33 0.00 0.00 177.39 176.46 1c4z s LYS 674 N -2.56 0.69 0.00 3.23 2.20 -1.26 -5.00 119.74 117.04 1c4z s LYS 674 Ca 0.26 -0.08 0.00 0.00 -0.36 0.00 0.00 55.97 55.79 1c4z s LYS 674 Cb 0.18 0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.82 1c4z s LYS 674 CO 0.41 -0.27 0.00 -1.91 -0.36 0.00 0.00 175.35 173.23 1c4z n GLU 675 N 0.21 0.00 -3.08 4.03 4.07 -1.26 -1.78 120.64 122.83 1c4z n GLU 675 Ca -0.09 0.00 -0.36 0.00 -0.06 0.00 0.00 57.16 56.65 1c4z n GLU 675 Cb 0.60 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.95 1c4z n GLU 675 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1c4z n ASN 676 N 0.00 5.48 -0.28 4.31 4.13 -1.26 -4.86 115.26 122.78 1c4z n ASN 676 Ca 0.00 -3.50 0.07 0.00 1.68 0.00 0.00 54.58 52.83 1c4z n ASN 676 Cb 0.00 -0.98 0.17 0.00 -1.54 0.00 0.00 39.78 37.44 1c4z n ASN 676 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 1c4z h GLY 677 N 4.55 0.88 -0.73 7.41 0.00 -1.62 -1.23 103.07 112.33 1c4z h GLY 677 Ca 0.24 0.15 0.08 0.00 0.00 0.00 0.00 47.33 47.80 1c4z h GLY 677 CO 1.09 -0.34 -0.40 1.22 0.00 0.00 0.00 176.54 178.12 1c4z n ASP 678 N -5.41 -0.71 0.00 0.19 9.92 -1.26 -3.32 116.55 115.96 1c4z n ASP 678 Ca 0.15 1.29 0.00 0.00 -0.53 0.00 0.00 54.79 55.70 1c4z n ASP 678 Cb 0.52 -0.19 0.00 0.00 -0.64 0.00 0.00 41.12 40.81 1c4z n ASP 678 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1c4z n LYS 679 N -4.94 0.00 -1.32 -1.24 0.00 -0.47 -4.75 118.16 105.43 1c4z n LYS 679 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 58.31 58.01 1c4z n LYS 679 Cb 0.21 -0.64 -0.15 0.00 0.00 0.00 0.00 35.03 34.45 1c4z n LYS 679 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 1c4z n ILE 680 N -0.46 0.00 -1.68 3.15 3.06 -1.16 -4.90 119.36 117.36 1c4z n ILE 680 Ca 0.00 -0.09 -0.32 0.00 -2.50 0.00 0.00 62.75 59.84 1c4z n ILE 680 Cb 0.00 -0.35 0.04 0.00 0.54 0.00 0.00 39.64 39.87 1c4z n ILE 680 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 1c4z s PRO 681 N 7.56 2.99 -0.31 9.51 0.02 -1.26 -3.37 135.00 150.13 1c4z s PRO 681 Ca 1.19 1.05 -0.26 0.00 0.02 0.00 0.00 61.00 63.00 1c4z s PRO 681 Cb -1.03 -1.99 0.01 0.00 0.02 0.00 0.00 34.50 31.50 1c4z s PRO 681 CO 0.45 -1.06 0.91 0.42 -0.33 0.00 0.00 177.00 177.39 1c4z s ILE 682 N -2.85 4.67 0.43 2.83 1.01 -0.54 -4.91 121.20 121.84 1c4z s ILE 682 Ca 0.60 1.41 0.07 0.00 0.00 0.00 0.00 60.65 62.73 1c4z s ILE 682 Cb -0.15 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 38.03 1c4z s ILE 682 CO 0.50 -0.35 0.31 0.42 0.00 0.00 0.00 174.94 175.81 1c4z s THR 683 N 3.25 2.42 0.37 2.92 -4.23 -1.26 -2.31 115.64 116.79 1c4z s THR 683 Ca 0.38 -1.49 0.29 0.00 -1.18 0.00 0.00 61.69 59.69 1c4z s THR 683 Cb -0.13 -2.90 0.31 0.00 1.34 0.00 0.00 72.50 71.11 1c4z s THR 683 CO 0.14 0.00 2.05 0.78 -0.54 0.00 0.00 174.62 177.05 1c4z h ASN 684 N 1.14 0.00 0.41 3.99 -0.26 -1.96 -2.11 115.58 116.78 1c4z h ASN 684 Ca -0.41 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.33 1c4z h ASN 684 Cb 1.27 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.53 1c4z h ASN 684 CO 0.62 0.11 -0.15 -0.62 -1.06 0.00 0.00 177.43 176.33 1c4z n GLU 685 N -3.51 0.59 0.00 0.81 4.71 -1.26 -4.13 120.64 117.85 1c4z n GLU 685 Ca -0.01 -0.23 0.00 0.00 -0.01 0.00 0.00 57.16 56.91 1c4z n GLU 685 Cb 0.26 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.19 1c4z n GLU 685 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1c4z n ASN 686 N -1.01 0.58 -0.32 1.62 6.94 -0.95 -4.84 115.26 117.28 1c4z n ASN 686 Ca 0.13 -1.16 -0.04 0.00 -0.02 0.00 0.00 54.58 53.48 1c4z n ASN 686 Cb 0.30 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 37.80 1c4z n ASN 686 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 1c4z h ARG 687 N 0.00 1.19 -0.98 -3.83 0.11 -1.55 -2.11 114.38 107.21 1c4z h ARG 687 Ca 0.00 -0.13 0.05 0.00 0.10 0.00 0.00 59.98 60.00 1c4z h ARG 687 Cb 0.50 -0.24 -0.06 0.00 1.11 0.00 0.00 29.97 31.28 1c4z h ARG 687 CO 0.00 0.87 0.64 0.87 0.10 0.00 0.00 179.97 182.45 1c4z h LYS 688 N 1.20 1.16 -0.52 0.08 1.57 -1.88 0.54 116.57 118.71 1c4z h LYS 688 Ca 0.30 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.92 1c4z h LYS 688 Cb 0.01 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1c4z h LYS 688 CO -0.05 0.77 -0.04 1.49 -0.57 0.00 0.00 179.45 181.05 1c4z h GLU 689 N 1.19 0.95 -0.29 3.15 4.81 -1.86 -0.96 114.58 121.57 1c4z h GLU 689 Ca 0.40 -0.32 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1c4z h GLU 689 Cb 0.08 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 1c4z h GLU 689 CO -0.14 0.98 -0.05 0.35 -0.73 0.00 0.00 179.01 179.42 1c4z h PHE 690 N 0.82 -0.12 -0.64 0.92 3.57 -0.14 0.20 116.94 121.55 1c4z h PHE 690 Ca 0.14 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.61 1c4z h PHE 690 Cb 0.58 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.39 1c4z h PHE 690 CO 0.04 -0.11 0.18 0.28 -2.23 0.00 0.00 178.31 176.48 1c4z h VAL 691 N 0.02 1.25 -0.43 1.41 2.07 0.17 -0.15 116.25 120.59 1c4z h VAL 691 Ca 0.14 -0.88 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 1c4z h VAL 691 Cb 0.21 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1c4z h VAL 691 CO -0.28 0.34 -0.15 0.78 0.02 0.00 0.00 177.57 178.27 1c4z h ASN 692 N 0.93 0.88 -0.43 0.57 2.35 -0.55 -1.54 115.58 117.80 1c4z h ASN 692 Ca 0.20 -0.38 -0.03 0.00 -0.55 0.00 0.00 56.30 55.54 1c4z h ASN 692 Cb 0.32 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1c4z h ASN 692 CO -0.00 1.06 0.15 -0.07 -1.65 0.00 0.00 177.43 176.92 1c4z h LEU 693 N 0.70 0.60 -1.89 1.61 3.38 -0.80 0.10 115.31 119.02 1c4z h LEU 693 Ca 0.10 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1c4z h LEU 693 Cb 0.70 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1c4z h LEU 693 CO 0.05 0.63 -0.13 0.22 0.09 0.00 0.00 178.44 179.30 1c4z h TYR 694 N 0.55 0.00 0.14 1.13 -0.00 -0.95 -0.27 116.97 117.57 1c4z h TYR 694 Ca 0.14 0.00 -0.19 0.00 -0.00 0.00 0.00 58.73 58.68 1c4z h TYR 694 Cb 0.23 0.00 0.02 0.00 -0.00 0.00 0.00 36.73 36.98 1c4z h TYR 694 CO 0.01 0.13 -0.84 0.77 -0.00 0.00 0.00 178.16 178.23 1c4z h SER 695 N 0.00 0.50 0.00 -2.11 0.02 -0.52 -3.30 113.55 108.15 1c4z h SER 695 Ca -0.00 -0.94 0.03 0.00 -0.84 0.00 0.00 61.79 60.04 1c4z h SER 695 Cb 0.33 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 1c4z h SER 695 CO 0.02 1.40 -0.26 -0.78 -1.14 0.00 0.00 176.83 176.06 1c4z h ASP 696 N -0.31 -0.78 -4.03 3.07 3.58 -0.28 -2.52 116.42 115.15 1c4z h ASP 696 Ca -0.14 0.11 -0.52 0.00 0.42 0.00 0.00 57.03 56.90 1c4z h ASP 696 Cb 1.65 0.32 0.08 0.00 1.72 0.00 0.00 39.33 43.10 1c4z h ASP 696 CO 0.16 -0.33 0.50 -0.47 -2.88 0.00 0.00 179.24 176.22 1c4z s TYR 697 N -6.06 2.70 0.00 0.28 5.04 -0.16 -0.66 117.35 118.49 1c4z s TYR 697 Ca -0.15 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 55.98 1c4z s TYR 697 Cb 0.09 -3.47 0.00 0.00 0.35 0.00 0.00 41.96 38.93 1c4z s TYR 697 CO 0.66 -1.85 0.00 -0.89 -1.34 0.00 0.00 175.55 172.12 1c4z n ILE 698 N -0.76 0.00 0.05 3.14 2.08 -1.26 -4.61 119.36 118.01 1c4z n ILE 698 Ca 0.09 0.00 -0.05 0.00 0.56 0.00 0.00 62.75 63.35 1c4z n ILE 698 Cb 0.48 0.00 -0.10 0.00 -0.75 0.00 0.00 39.64 39.27 1c4z n ILE 698 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1c4z h LEU 699 N 0.00 0.00 0.00 1.39 4.07 -1.35 -3.40 115.31 116.02 1c4z h LEU 699 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1c4z h LEU 699 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1c4z h LEU 699 CO 0.00 0.86 0.00 0.59 -1.08 0.00 0.00 178.44 178.81 1c4z n ASN 700 N -3.20 0.27 0.19 -0.43 3.02 0.16 -4.67 115.26 110.60 1c4z n ASN 700 Ca -0.05 0.11 -0.14 0.00 -0.03 0.00 0.00 54.58 54.47 1c4z n ASN 700 Cb 0.92 -0.03 -0.07 0.00 -0.61 0.00 0.00 39.78 39.99 1c4z n ASN 700 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1c4z h LYS 701 N 0.00 -0.51 -1.10 3.52 1.57 -1.86 -0.45 116.57 117.74 1c4z h LYS 701 Ca 0.00 0.04 0.38 0.00 -1.87 0.00 0.00 60.65 59.19 1c4z h LYS 701 Cb 0.00 0.12 -0.15 0.00 0.08 0.00 0.00 32.23 32.28 1c4z h LYS 701 CO 0.00 -0.34 0.65 1.03 -0.57 0.00 0.00 179.45 180.22 1c4z h SER 702 N -0.53 0.38 -0.27 0.86 0.87 -1.82 -1.18 113.55 111.86 1c4z h SER 702 Ca -0.02 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1c4z h SER 702 Cb 0.47 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1c4z h SER 702 CO -0.02 -0.22 0.00 1.33 -0.53 0.00 0.00 176.83 177.39 1c4z n VAL 703 N -4.99 1.19 -0.22 2.23 0.24 -1.05 -4.65 118.33 111.09 1c4z n VAL 703 Ca 0.35 -1.15 0.02 0.00 -2.04 0.00 0.00 64.34 61.52 1c4z n VAL 703 Cb 1.19 0.38 0.11 0.00 -1.47 0.00 0.00 33.84 34.05 1c4z n VAL 703 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1c4z h GLU 704 N 1.64 0.07 0.04 7.34 4.81 0.22 -0.34 114.58 128.37 1c4z h GLU 704 Ca 0.00 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1c4z h GLU 704 Cb 0.80 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.11 1c4z h GLU 704 CO 0.03 0.05 -0.51 0.87 -0.73 0.00 0.00 179.01 178.72 1c4z h LYS 705 N 0.07 -0.64 0.00 1.92 1.79 -1.86 -0.33 116.57 117.53 1c4z h LYS 705 Ca 0.35 0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 58.73 1c4z h LYS 705 Cb 0.57 0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.34 1c4z h LYS 705 CO -0.61 -0.42 -0.67 -0.56 -1.08 0.00 0.00 179.45 176.11 1c4z h GLN 706 N -0.66 0.00 -0.04 3.15 -0.00 -1.86 -3.23 115.11 112.47 1c4z h GLN 706 Ca 0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 58.65 58.49 1c4z h GLN 706 Cb 0.69 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.16 1c4z h GLN 706 CO -0.32 0.57 -0.71 0.35 -0.00 0.00 0.00 178.83 178.72 1c4z h PHE 707 N 0.00 0.33 -0.16 0.06 3.57 -1.04 -2.63 116.94 117.06 1c4z h PHE 707 Ca -0.02 -0.14 0.04 0.00 3.53 0.00 0.00 57.97 61.38 1c4z h PHE 707 Cb 1.47 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 40.11 1c4z h PHE 707 CO 0.00 0.87 -0.13 -0.22 -2.23 0.00 0.00 178.31 176.60 1c4z h LYS 708 N 0.16 -0.13 -0.75 1.11 1.63 -1.07 -1.39 116.57 116.13 1c4z h LYS 708 Ca -0.02 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 1c4z h LYS 708 Cb 1.27 0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.89 1c4z h LYS 708 CO 0.11 -0.09 0.40 0.00 -3.45 0.00 0.00 179.45 176.42 1c4z h ALA 709 N 0.97 1.29 -0.27 5.00 0.00 -1.56 -1.94 119.26 122.75 1c4z h ALA 709 Ca 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1c4z h ALA 709 Cb 0.29 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1c4z h ALA 709 CO -0.25 0.57 0.15 0.35 0.00 0.00 0.00 179.25 180.07 1c4z h PHE 710 N 1.05 0.38 -0.38 0.00 3.04 -1.04 -2.46 116.94 117.52 1c4z h PHE 710 Ca 0.26 -0.01 -0.14 0.00 3.98 0.00 0.00 57.97 62.06 1c4z h PHE 710 Cb 0.05 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.43 1c4z h PHE 710 CO 0.01 0.32 -0.31 -0.09 -2.02 0.00 0.00 178.31 176.22 1c4z h ARG 711 N 0.32 0.88 -0.71 1.11 2.43 -1.10 -1.76 114.38 115.56 1c4z h ARG 711 Ca 0.10 -0.44 0.06 0.00 -0.81 0.00 0.00 59.98 58.89 1c4z h ARG 711 Cb 0.07 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 1c4z h ARG 711 CO -0.01 1.09 0.40 -0.09 -1.51 0.00 0.00 179.97 179.85 1c4z h ARG 712 N 0.69 0.72 0.35 0.20 2.43 -1.26 0.87 114.38 118.39 1c4z h ARG 712 Ca 0.07 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1c4z h ARG 712 Cb 0.89 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 1c4z h ARG 712 CO 0.08 0.48 -0.17 0.78 -1.51 0.00 0.00 179.97 179.63 1c4z h GLY 713 N 0.74 -0.49 0.85 2.80 0.00 -1.21 -1.63 103.07 104.13 1c4z h GLY 713 Ca 0.31 0.18 0.05 0.00 0.00 0.00 0.00 47.33 47.88 1c4z h GLY 713 CO -0.18 -0.18 0.63 -2.75 0.00 0.00 0.00 176.54 174.06 1c4z h PHE 714 N -0.52 1.17 0.00 5.60 3.57 -0.88 -2.38 116.94 123.51 1c4z h PHE 714 Ca -0.05 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.41 1c4z h PHE 714 Cb 0.39 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1c4z h PHE 714 CO -0.04 0.64 -0.32 1.25 -2.23 0.00 0.00 178.31 177.61 1c4z h HIS 715 N 1.17 0.00 -0.39 0.41 2.76 -0.70 -0.16 115.15 118.25 1c4z h HIS 715 Ca 0.40 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.57 1c4z h HIS 715 Cb 0.09 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.03 1c4z h HIS 715 CO -0.00 0.32 0.23 0.52 -1.30 0.00 0.00 177.93 177.70 1c4z h MET 716 N 0.00 0.52 0.00 5.26 2.86 -0.76 0.13 114.93 122.94 1c4z h MET 716 Ca -0.00 -0.04 -0.17 0.00 -2.06 0.00 0.00 59.70 57.43 1c4z h MET 716 Cb 0.90 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.42 1c4z h MET 716 CO 0.04 0.37 -1.00 0.28 1.06 0.00 0.00 176.91 177.66 1c4z h VAL 717 N 0.53 0.87 0.00 -2.22 2.07 -1.58 -3.41 116.25 112.51 1c4z h VAL 717 Ca 0.14 -2.02 -0.00 0.00 0.82 0.00 0.00 66.70 65.64 1c4z h VAL 717 Cb -0.01 2.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1c4z h VAL 717 CO -0.03 0.29 -0.02 0.74 0.02 0.00 0.00 177.57 178.58 1c4z h THR 718 N -1.00 0.42 -3.40 2.57 2.02 -0.86 -3.46 112.91 109.20 1c4z h THR 718 Ca -0.26 -0.08 -0.57 0.00 0.77 0.00 0.00 66.41 66.27 1c4z h THR 718 Cb 1.14 1.06 0.12 0.00 -1.74 0.00 0.00 68.15 68.73 1c4z h THR 718 CO -0.16 0.02 0.43 -3.20 0.37 0.00 0.00 175.52 172.98 1c4z n ASN 719 N -3.66 2.32 -3.13 4.18 5.15 0.02 -4.01 115.26 116.13 1c4z n ASN 719 Ca -0.03 1.11 -0.07 0.00 -0.60 0.00 0.00 54.58 54.99 1c4z n ASN 719 Cb 0.10 -1.47 0.00 0.00 -0.53 0.00 0.00 39.78 37.89 1c4z n ASN 719 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1c4z n GLU 720 N 0.13 -1.60 0.00 1.20 1.02 -1.26 -4.81 120.64 115.32 1c4z n GLU 720 Ca 0.07 1.53 0.00 0.00 -0.02 0.00 0.00 57.16 58.74 1c4z n GLU 720 Cb 0.39 -5.13 0.00 0.00 -0.02 0.00 0.00 31.44 26.68 1c4z n GLU 720 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1c4z n SER 721 N -1.50 0.00 -4.33 1.62 3.41 -1.26 -5.16 113.62 106.40 1c4z n SER 721 Ca -0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.29 1c4z n SER 721 Cb 0.53 0.00 0.23 0.00 -0.26 0.00 0.00 64.21 64.70 1c4z n SER 721 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1c4z n PRO 722 N 0.00 -2.27 0.10 4.33 -0.04 -1.26 -4.89 135.00 130.97 1c4z n PRO 722 Ca 0.00 -0.64 0.12 0.00 -0.04 0.00 0.00 63.50 62.94 1c4z n PRO 722 Cb 0.00 -1.93 0.45 0.00 -0.04 0.00 0.00 33.50 31.98 1c4z n PRO 722 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1c4z n LEU 723 N -3.50 0.64 -4.72 1.53 7.99 -1.26 -4.60 117.00 113.08 1c4z n LEU 723 Ca 0.02 0.59 -0.31 0.00 -0.01 0.00 0.00 56.01 56.30 1c4z n LEU 723 Cb 0.58 -0.43 0.13 0.00 -0.11 0.00 0.00 43.42 43.59 1c4z n LEU 723 CO 0.55 -0.28 0.68 -0.75 -1.51 0.00 0.00 177.39 176.08 1c4z s LYS 724 N -3.15 1.66 0.00 3.23 2.20 -1.26 -1.38 119.74 121.04 1c4z s LYS 724 Ca 0.09 1.24 0.00 0.00 -0.36 0.00 0.00 55.97 56.94 1c4z s LYS 724 Cb 0.12 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.62 1c4z s LYS 724 CO 0.51 -2.08 0.00 0.66 -0.36 0.00 0.00 175.35 174.07 1c4z n TYR 725 N -3.83 0.00 -3.84 4.03 0.53 -1.26 -4.97 117.16 107.81 1c4z n TYR 725 Ca 0.10 0.00 -0.26 0.00 -1.02 0.00 0.00 57.90 56.71 1c4z n TYR 725 Cb 0.53 0.00 -0.17 0.00 -1.03 0.00 0.00 39.34 38.67 1c4z n TYR 725 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 1c4z s LEU 726 N 0.00 1.16 0.00 7.72 1.43 -0.48 -5.08 118.68 123.43 1c4z s LEU 726 Ca 0.00 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 1c4z s LEU 726 Cb 0.00 -0.72 0.00 0.00 0.03 0.00 0.00 46.19 45.50 1c4z s LEU 726 CO 0.00 -0.18 0.28 0.49 0.23 0.00 0.00 176.35 177.17 1c4z n PHE 727 N 4.99 0.00 -2.65 0.29 3.72 -1.26 -4.89 117.46 117.65 1c4z n PHE 727 Ca -0.10 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.00 1c4z n PHE 727 Cb 0.49 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.01 1c4z n PHE 727 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1c4z s ARG 728 N -0.56 3.70 0.49 -1.08 3.03 -1.26 -4.99 118.95 118.27 1c4z s ARG 728 Ca 0.00 0.44 0.25 0.00 2.03 0.00 0.00 55.73 58.45 1c4z s ARG 728 Cb 0.00 -2.34 1.28 0.00 -1.03 0.00 0.00 34.95 32.86 1c4z s ARG 728 CO 0.00 -0.16 2.01 -1.35 -1.13 0.00 0.00 175.30 174.67 1c4z h PRO 729 N 0.75 0.00 0.00 3.89 0.11 -1.90 -2.71 132.00 132.13 1c4z h PRO 729 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1c4z h PRO 729 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1c4z h PRO 729 CO 0.63 0.16 0.05 0.93 -0.21 0.00 0.00 178.00 179.56 1c4z h GLU 730 N 0.00 0.00 -0.22 1.05 3.07 -1.94 -0.96 114.58 115.58 1c4z h GLU 730 Ca -0.00 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.71 1c4z h GLU 730 Cb 0.41 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 1c4z h GLU 730 CO 0.02 0.00 -0.49 0.93 -1.40 0.00 0.00 179.01 178.07 1c4z h GLU 731 N 0.00 0.59 -0.08 2.33 5.08 -1.89 -0.61 114.58 120.00 1c4z h GLU 731 Ca 0.00 -0.34 -0.22 0.00 -1.00 0.00 0.00 59.36 57.80 1c4z h GLU 731 Cb 0.11 0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.39 1c4z h GLU 731 CO 0.00 0.95 -0.83 0.82 -1.00 0.00 0.00 179.01 178.95 1c4z h ILE 732 N 0.47 1.33 -0.72 3.13 2.04 -1.39 -2.35 117.51 120.02 1c4z h ILE 732 Ca 0.02 -2.14 -0.06 0.00 1.00 0.00 0.00 64.86 63.69 1c4z h ILE 732 Cb 1.02 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 39.22 1c4z h ILE 732 CO 0.10 0.66 0.23 -0.08 0.00 0.00 0.00 178.15 179.05 1c4z h GLU 733 N 0.39 1.11 -0.37 2.37 4.81 -1.37 -1.93 114.58 119.59 1c4z h GLU 733 Ca -0.06 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1c4z h GLU 733 Cb 1.44 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.64 1c4z h GLU 733 CO 0.16 0.95 0.23 -0.07 -0.73 0.00 0.00 179.01 179.54 1c4z h LEU 734 N 1.07 0.39 -1.87 1.64 3.38 -0.92 0.45 115.31 119.45 1c4z h LEU 734 Ca 0.23 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1c4z h LEU 734 Cb 0.30 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1c4z h LEU 734 CO -0.01 0.28 0.05 -0.07 0.09 0.00 0.00 178.44 178.79 1c4z h LEU 735 N 0.47 0.12 0.12 1.67 3.38 -1.04 0.43 115.31 120.45 1c4z h LEU 735 Ca 0.14 -0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.74 1c4z h LEU 735 Cb -0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1c4z h LEU 735 CO -0.05 0.10 -2.02 -0.38 0.09 0.00 0.00 178.44 176.19 1c4z n ILE 736 N -4.51 1.77 0.85 1.22 5.41 -0.76 -4.52 119.36 118.83 1c4z n ILE 736 Ca -0.01 -0.66 0.11 0.00 1.00 0.00 0.00 62.75 63.18 1c4z n ILE 736 Cb 0.09 -1.71 -0.06 0.00 -0.71 0.00 0.00 39.64 37.26 1c4z n ILE 736 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1c4z n GLY 738 N 1.46 -0.55 3.98 0.00 0.00 0.15 -4.67 105.19 105.56 1c4z n GLY 738 Ca 0.03 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 44.18 1c4z n GLY 738 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1c4z s SER 739 N -2.35 4.90 -0.35 1.61 1.04 -0.73 -4.73 113.70 113.09 1c4z s SER 739 Ca 0.00 -0.13 0.04 0.00 0.48 0.00 0.00 55.95 56.34 1c4z s SER 739 Cb 0.00 -0.54 0.56 0.00 0.10 0.00 0.00 66.02 66.13 1c4z s SER 739 CO 0.00 -1.44 1.73 0.54 0.98 0.00 0.00 173.24 175.05 1c4z n ARG 740 N -2.56 2.21 -1.73 4.02 1.74 -1.26 -1.56 116.66 117.53 1c4z n ARG 740 Ca 0.11 -2.47 -0.42 0.00 -0.77 0.00 0.00 57.85 54.30 1c4z n ARG 740 Cb 0.60 -1.98 -0.02 0.00 -1.02 0.00 0.00 32.46 30.04 1c4z n ARG 740 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1c4z n ASN 741 N -0.73 3.77 -2.86 0.55 2.85 -1.26 -4.96 115.26 112.62 1c4z n ASN 741 Ca 0.47 1.11 -0.22 0.00 -0.11 0.00 0.00 54.58 55.83 1c4z n ASN 741 Cb 1.42 -1.56 -0.02 0.00 1.24 0.00 0.00 39.78 40.86 1c4z n ASN 741 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1c4z n LEU 742 N 2.86 3.22 0.25 1.20 4.77 -1.26 -4.59 117.00 123.45 1c4z n LEU 742 Ca 0.12 -5.15 -0.12 0.00 -0.03 0.00 0.00 56.01 50.83 1c4z n LEU 742 Cb 0.35 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.29 1c4z n LEU 742 CO 0.64 2.21 0.52 -0.78 -1.33 0.00 0.00 177.39 178.64 1c4z h ASP 743 N 2.90 -0.80 0.00 -1.43 1.82 -1.99 -3.45 116.42 113.48 1c4z h ASP 743 Ca 0.13 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.82 1c4z h ASP 743 Cb 0.80 0.24 0.00 0.00 0.68 0.00 0.00 39.33 41.05 1c4z h ASP 743 CO 0.70 -0.46 0.00 0.49 -1.61 0.00 0.00 179.24 178.37 1c4z n PHE 744 N -4.27 0.00 -1.52 0.28 3.01 -1.26 -4.80 117.46 108.90 1c4z n PHE 744 Ca -0.09 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.07 1c4z n PHE 744 Cb 0.31 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.85 1c4z n PHE 744 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1c4z s GLN 745 N 0.00 2.49 0.00 -1.08 -1.52 -1.26 -0.14 119.66 118.15 1c4z s GLN 745 Ca 0.00 0.85 0.00 0.00 -1.95 0.00 0.00 55.36 54.26 1c4z s GLN 745 Cb 0.00 -1.95 0.00 0.00 -0.22 0.00 0.00 33.01 30.84 1c4z s GLN 745 CO 0.00 -1.39 0.00 0.00 -0.25 0.00 0.00 175.29 173.65 1c4z n ALA 746 N -3.31 0.00 0.01 6.09 0.00 -1.26 -4.30 120.51 117.73 1c4z n ALA 746 Ca 0.07 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.35 1c4z n ALA 746 Cb 0.55 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.93 1c4z n ALA 746 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1c4z h LEU 747 N 0.00 0.85 0.97 0.00 7.12 -1.54 -3.26 115.31 119.45 1c4z h LEU 747 Ca 0.00 -0.59 -0.05 0.00 0.13 0.00 0.00 57.88 57.37 1c4z h LEU 747 Cb 0.00 -0.25 0.01 0.00 -0.53 0.00 0.00 40.66 39.88 1c4z h LEU 747 CO 0.00 1.39 -0.47 -0.08 -0.13 0.00 0.00 178.44 179.15 1c4z h GLU 748 N 0.46 -1.25 -6.93 1.25 4.81 -0.72 -3.32 114.58 108.88 1c4z h GLU 748 Ca -0.07 0.09 -0.37 0.00 -0.13 0.00 0.00 59.36 58.88 1c4z h GLU 748 Cb 1.47 0.28 0.22 0.00 0.63 0.00 0.00 28.75 31.35 1c4z h GLU 748 CO 0.17 -0.84 -0.17 0.39 -0.73 0.00 0.00 179.01 177.83 1c4z n GLU 749 N -5.52 -4.81 -0.20 1.92 1.02 -1.23 -1.70 120.64 110.11 1c4z n GLU 749 Ca -0.16 -1.43 0.00 0.00 -0.02 0.00 0.00 57.16 55.55 1c4z n GLU 749 Cb 0.51 -1.93 0.00 0.00 -0.02 0.00 0.00 31.44 30.01 1c4z n GLU 749 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1c4z n THR 750 N -5.82 0.00 -2.97 2.62 -2.24 -1.26 -4.76 114.28 99.83 1c4z n THR 750 Ca 0.13 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.57 1c4z n THR 750 Cb 0.60 -0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.57 1c4z n THR 750 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1c4z s THR 751 N -0.59 4.48 0.26 4.28 2.01 -0.69 -4.22 115.64 121.16 1c4z s THR 751 Ca 0.00 1.35 0.09 0.00 0.31 0.00 0.00 61.69 63.44 1c4z s THR 751 Cb 0.00 -3.75 -0.05 0.00 0.01 0.00 0.00 72.50 68.71 1c4z s THR 751 CO 0.00 -0.06 -0.15 -1.61 -0.69 0.00 0.00 174.62 172.12 1c4z s GLU 752 N -2.59 1.54 0.12 4.92 0.41 -0.25 -4.98 118.70 117.87 1c4z s GLU 752 Ca 0.53 -1.72 0.09 0.00 -0.41 0.00 0.00 54.97 53.45 1c4z s GLU 752 Cb -0.13 -1.42 -0.04 0.00 -1.78 0.00 0.00 34.13 30.76 1c4z s GLU 752 CO 0.18 0.21 -0.21 0.71 -0.49 0.00 0.00 175.26 175.67 1c4z s TYR 753 N -2.77 1.86 0.07 1.61 1.51 -1.26 -1.93 117.35 116.44 1c4z s TYR 753 Ca 0.27 -0.42 -0.00 0.00 -1.01 0.00 0.00 57.07 55.91 1c4z s TYR 753 Cb -0.01 -1.00 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 1c4z s TYR 753 CO 0.11 0.25 -0.03 0.34 -1.11 0.00 0.00 175.55 175.11 1c4z s ASP 754 N -2.09 0.65 0.00 2.29 2.15 -0.59 -4.79 116.67 114.29 1c4z s ASP 754 Ca 0.09 -1.02 0.00 0.00 0.43 0.00 0.00 52.55 52.06 1c4z s ASP 754 Cb -0.09 0.18 0.00 0.00 -0.30 0.00 0.00 42.92 42.71 1c4z s ASP 754 CO 0.05 -0.57 0.00 0.61 -0.17 0.00 0.00 175.17 175.09 1c4z n GLY 755 N 0.06 1.49 0.00 2.66 0.00 -1.26 -1.45 105.19 106.69 1c4z n GLY 755 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1c4z n GLY 755 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c4z n GLY 756 N -2.00 1.62 0.11 -0.02 0.00 -1.26 -4.72 105.19 98.91 1c4z n GLY 756 Ca 0.00 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1c4z n GLY 756 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1c4z h TYR 757 N 0.00 0.09 -2.70 1.61 0.05 -1.88 -3.51 116.97 110.64 1c4z h TYR 757 Ca 0.00 -0.07 0.00 0.00 0.05 0.00 0.00 58.73 58.71 1c4z h TYR 757 Cb 0.00 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1c4z h TYR 757 CO 0.00 1.49 -0.37 0.25 -1.05 0.00 0.00 178.16 178.48 1c4z n THR 758 N -4.30 -1.23 -0.18 -2.88 -2.24 -1.26 -4.40 114.28 97.80 1c4z n THR 758 Ca -0.30 0.60 0.01 0.00 -2.27 0.00 0.00 64.05 62.10 1c4z n THR 758 Cb 0.73 -0.98 0.04 0.00 -2.10 0.00 0.00 70.33 68.02 1c4z n THR 758 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1c4z n ARG 759 N -2.11 -0.08 -3.19 -0.78 0.63 -1.26 -3.77 116.66 106.10 1c4z n ARG 759 Ca 0.00 0.74 -0.40 0.00 -0.92 0.00 0.00 57.85 57.27 1c4z n ARG 759 Cb 0.17 -1.10 -0.07 0.00 0.45 0.00 0.00 32.46 31.90 1c4z n ARG 759 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1c4z s ASP 760 N -5.15 6.53 0.00 6.15 1.11 -1.26 -4.66 116.67 119.39 1c4z s ASP 760 Ca -0.07 0.64 0.00 0.00 0.18 0.00 0.00 52.55 53.31 1c4z s ASP 760 Cb 0.11 -2.31 0.00 0.00 1.07 0.00 0.00 42.92 41.79 1c4z s ASP 760 CO 0.36 -0.29 0.00 -0.24 1.18 0.00 0.00 175.17 176.18 1c4z n SER 761 N 5.38 0.00 -0.33 0.27 2.88 -1.25 -5.01 113.62 115.57 1c4z n SER 761 Ca -0.03 0.00 0.20 0.00 -1.33 0.00 0.00 58.87 57.71 1c4z n SER 761 Cb 0.50 0.00 0.41 0.00 -0.75 0.00 0.00 64.21 64.36 1c4z n SER 761 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1c4z h VAL 762 N 0.00 0.36 -0.40 2.46 2.07 -1.94 0.06 116.25 118.86 1c4z h VAL 762 Ca 0.00 -0.12 -0.14 0.00 0.82 0.00 0.00 66.70 67.26 1c4z h VAL 762 Cb 0.00 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.73 1c4z h VAL 762 CO 0.00 0.06 -0.28 0.25 0.02 0.00 0.00 177.57 177.62 1c4z h LEU 763 N 0.36 0.94 -0.13 2.57 7.12 -1.96 -2.30 115.31 121.90 1c4z h LEU 763 Ca 0.67 -0.44 -0.04 0.00 0.13 0.00 0.00 57.88 58.21 1c4z h LEU 763 Cb 1.43 -0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 41.30 1c4z h LEU 763 CO -0.59 1.18 -0.07 0.40 -0.13 0.00 0.00 178.44 179.23 1c4z h ILE 764 N 0.71 1.32 -0.51 4.05 1.08 -1.40 -1.27 117.51 121.49 1c4z h ILE 764 Ca 0.08 -1.10 -0.03 0.00 -0.39 0.00 0.00 64.86 63.42 1c4z h ILE 764 Cb 0.87 1.77 -0.02 0.00 -3.07 0.00 0.00 36.82 36.36 1c4z h ILE 764 CO 0.08 0.32 0.20 0.03 -0.69 0.00 0.00 178.15 178.08 1c4z h ARG 765 N -0.07 0.77 -0.59 2.37 3.08 -1.25 -0.89 114.38 117.81 1c4z h ARG 765 Ca 0.03 -0.14 0.06 0.00 0.07 0.00 0.00 59.98 59.99 1c4z h ARG 765 Cb 0.53 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.41 1c4z h ARG 765 CO 0.02 0.69 0.31 0.93 -1.07 0.00 0.00 179.97 180.84 1c4z h GLU 766 N 0.69 0.56 0.08 0.04 5.08 -1.43 -1.30 114.58 118.30 1c4z h GLU 766 Ca 0.17 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1c4z h GLU 766 Cb 0.21 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 1c4z h GLU 766 CO -0.01 0.37 -0.24 0.35 -1.00 0.00 0.00 179.01 178.48 1c4z h PHE 767 N 0.58 -0.64 -0.63 4.33 3.04 -0.45 -1.20 116.94 121.96 1c4z h PHE 767 Ca 0.26 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.23 1c4z h PHE 767 Cb 0.18 0.27 -0.03 0.00 2.56 0.00 0.00 35.95 38.93 1c4z h PHE 767 CO -0.10 -0.34 0.39 -1.49 -2.02 0.00 0.00 178.31 174.76 1c4z h TRP 768 N -0.42 0.83 -0.07 0.41 4.06 -0.89 0.41 115.95 120.28 1c4z h TRP 768 Ca 0.04 0.00 0.02 0.00 2.06 0.00 0.00 58.89 61.01 1c4z h TRP 768 Cb 0.46 -0.27 -0.00 0.00 -1.00 0.00 0.00 29.16 28.35 1c4z h TRP 768 CO -0.24 0.55 0.12 0.93 -3.56 0.00 0.00 178.44 176.24 1c4z h GLU 769 N 0.86 0.00 0.06 0.49 5.08 -0.88 0.11 114.58 120.29 1c4z h GLU 769 Ca 0.23 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.43 1c4z h GLU 769 Cb -0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 1c4z h GLU 769 CO -0.04 0.00 -0.78 0.82 -1.00 0.00 0.00 179.01 178.00 1c4z h ILE 770 N 0.00 1.37 0.14 3.13 2.04 0.23 -3.30 117.51 121.12 1c4z h ILE 770 Ca 0.03 -2.37 0.01 0.00 1.00 0.00 0.00 64.86 63.53 1c4z h ILE 770 Cb 0.28 2.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.29 1c4z h ILE 770 CO -0.00 0.60 -0.16 0.58 0.00 0.00 0.00 178.15 179.17 1c4z h VAL 771 N -0.69 0.65 -0.87 1.67 2.07 0.21 -2.77 116.25 116.51 1c4z h VAL 771 Ca -0.18 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.44 1c4z h VAL 771 Cb 1.39 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 31.75 1c4z h VAL 771 CO 0.01 0.00 0.57 0.45 0.02 0.00 0.00 177.57 178.61 1c4z h HIS 772 N -0.33 0.94 -0.19 1.57 3.86 -1.03 0.42 115.15 120.39 1c4z h HIS 772 Ca 0.01 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1c4z h HIS 772 Cb 0.32 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1c4z h HIS 772 CO -0.14 0.44 0.00 -1.13 0.86 0.00 0.00 177.93 177.96 1c4z n SER 773 N -4.52 2.11 -4.84 2.45 3.41 -1.07 -4.88 113.62 106.28 1c4z n SER 773 Ca 0.15 -2.21 -0.30 0.00 -0.26 0.00 0.00 58.87 56.25 1c4z n SER 773 Cb 0.29 -0.45 0.05 0.00 -0.26 0.00 0.00 64.21 63.85 1c4z n SER 773 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1c4z s PHE 774 N -1.58 3.19 -0.07 7.33 0.08 0.13 -5.04 117.98 122.02 1c4z s PHE 774 Ca 0.16 1.20 -0.14 0.00 0.12 0.00 0.00 56.93 58.27 1c4z s PHE 774 Cb 0.11 -2.98 -0.05 0.00 -0.57 0.00 0.00 43.02 39.53 1c4z s PHE 774 CO 0.06 -1.28 0.35 0.95 -0.10 0.00 0.00 175.22 175.20 1c4z s THR 775 N -3.20 5.19 0.19 0.64 -4.23 -1.26 -4.84 115.64 108.12 1c4z s THR 775 Ca 0.58 0.68 -0.03 0.00 -1.18 0.00 0.00 61.69 61.75 1c4z s THR 775 Cb -0.13 -3.65 0.29 0.00 1.34 0.00 0.00 72.50 70.35 1c4z s THR 775 CO 0.54 0.51 1.02 0.47 -0.54 0.00 0.00 174.62 176.62 1c4z n ASP 776 N 2.46 -0.17 -0.27 3.99 8.00 -1.26 0.18 116.55 129.48 1c4z n ASP 776 Ca -0.14 1.12 0.06 0.00 0.71 0.00 0.00 54.79 56.54 1c4z n ASP 776 Cb 0.53 -0.37 0.20 0.00 -0.02 0.00 0.00 41.12 41.46 1c4z n ASP 776 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1c4z h GLU 777 N 0.00 0.52 -0.08 -1.24 4.81 -1.99 0.44 114.58 117.04 1c4z h GLU 777 Ca 0.35 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.53 1c4z h GLU 777 Cb 0.62 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 1c4z h GLU 777 CO -0.65 0.34 -0.02 1.96 -0.73 0.00 0.00 179.01 179.91 1c4z h GLN 778 N 0.53 0.15 -0.99 1.92 4.20 0.16 0.11 115.11 121.18 1c4z h GLN 778 Ca 0.43 -0.06 0.21 0.00 0.06 0.00 0.00 58.65 59.29 1c4z h GLN 778 Cb 0.63 -0.01 -0.10 0.00 0.30 0.00 0.00 27.48 28.30 1c4z h GLN 778 CO -0.38 0.48 0.62 0.87 -0.67 0.00 0.00 178.83 179.75 1c4z h LYS 779 N -0.18 0.64 -0.14 1.46 1.57 0.33 0.29 116.57 120.53 1c4z h LYS 779 Ca 0.02 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.56 1c4z h LYS 779 Cb 0.42 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1c4z h LYS 779 CO 0.01 0.42 -0.72 0.00 -0.57 0.00 0.00 179.45 178.58 1c4z h ARG 780 N 0.65 0.64 -0.72 3.15 3.08 0.02 -2.70 114.38 118.51 1c4z h ARG 780 Ca 0.57 -0.50 0.04 0.00 0.07 0.00 0.00 59.98 60.16 1c4z h ARG 780 Cb 1.04 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 31.14 1c4z h ARG 780 CO -0.35 1.12 0.44 -0.07 -1.07 0.00 0.00 179.97 180.05 1c4z h LEU 781 N 0.45 0.71 -0.84 3.04 3.38 0.15 0.22 115.31 122.41 1c4z h LEU 781 Ca -0.03 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1c4z h LEU 781 Cb 1.33 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 1c4z h LEU 781 CO 0.14 0.48 0.43 0.15 0.09 0.00 0.00 178.44 179.73 1c4z h PHE 782 N 0.84 1.19 -0.03 1.13 3.04 -0.76 -1.25 116.94 121.11 1c4z h PHE 782 Ca 0.30 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 62.19 1c4z h PHE 782 Cb 0.07 -0.37 -0.00 0.00 2.56 0.00 0.00 35.95 38.21 1c4z h PHE 782 CO -0.05 0.85 -0.01 -0.07 -2.02 0.00 0.00 178.31 177.01 1c4z h LEU 783 N 1.19 0.07 -1.01 0.59 3.38 -1.05 -0.53 115.31 117.95 1c4z h LEU 783 Ca 0.29 -0.41 0.16 0.00 0.09 0.00 0.00 57.88 58.02 1c4z h LEU 783 Cb 0.08 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.71 1c4z h LEU 783 CO -0.04 0.46 0.62 -0.61 0.09 0.00 0.00 178.44 178.96 1c4z h GLN 784 N -0.33 0.83 -0.06 1.13 5.75 -0.54 0.23 115.11 122.12 1c4z h GLN 784 Ca 0.01 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1c4z h GLN 784 Cb 0.43 -0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.80 1c4z h GLN 784 CO 0.00 0.55 -0.09 0.35 -2.65 0.00 0.00 178.83 176.99 1c4z h PHE 785 N 0.85 0.20 0.00 3.99 3.57 -1.09 -3.37 116.94 121.09 1c4z h PHE 785 Ca 0.55 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.98 1c4z h PHE 785 Cb 0.75 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.45 1c4z h PHE 785 CO -0.00 0.66 -0.01 1.15 -2.23 0.00 0.00 178.31 177.88 1c4z h THR 786 N -0.32 1.65 -1.31 4.41 2.02 -0.60 -3.44 112.91 115.31 1c4z h THR 786 Ca 0.00 -1.93 -0.47 0.00 0.77 0.00 0.00 66.41 64.79 1c4z h THR 786 Cb 0.65 2.96 -0.00 0.00 -1.74 0.00 0.00 68.15 70.01 1c4z h THR 786 CO 0.02 0.50 -0.29 0.42 0.37 0.00 0.00 175.52 176.55 1c4z s THR 787 N -2.95 2.65 -1.48 3.16 -4.23 0.78 -3.26 115.64 110.31 1c4z s THR 787 Ca -0.18 -1.17 0.21 0.00 -1.18 0.00 0.00 61.69 59.37 1c4z s THR 787 Cb -0.01 -2.82 0.38 0.00 1.34 0.00 0.00 72.50 71.39 1c4z s THR 787 CO 0.69 0.00 1.65 0.61 -0.54 0.00 0.00 174.62 177.03 1c4z n GLY 788 N -1.78 -0.94 3.38 3.99 0.00 -1.26 -4.27 105.19 104.30 1c4z n GLY 788 Ca 0.07 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 1c4z n GLY 788 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1c4z s THR 789 N -2.52 0.00 -1.16 2.61 -1.32 -1.26 -4.82 115.64 107.18 1c4z s THR 789 Ca 0.20 -1.76 0.17 0.00 -1.21 0.00 0.00 61.69 59.09 1c4z s THR 789 Cb 0.14 -2.46 0.56 0.00 -1.51 0.00 0.00 72.50 69.22 1c4z s THR 789 CO 0.31 0.00 1.47 -0.90 -2.21 0.00 0.00 174.62 173.29 1c4z n ASP 790 N -0.76 3.93 -2.71 8.08 5.75 -1.26 -2.29 116.55 127.28 1c4z n ASP 790 Ca 0.02 -2.27 -0.06 0.00 -0.01 0.00 0.00 54.79 52.46 1c4z n ASP 790 Cb 0.63 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1c4z n ASP 790 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1c4z n ARG 791 N 0.88 1.23 -4.20 0.11 1.74 -1.26 -4.89 116.66 110.27 1c4z n ARG 791 Ca 0.21 -0.84 -0.19 0.00 -0.77 0.00 0.00 57.85 56.25 1c4z n ARG 791 Cb 0.69 0.07 -0.12 0.00 -1.02 0.00 0.00 32.46 32.08 1c4z n ARG 791 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1c4z s ALA 792 N -2.19 1.34 0.70 7.54 0.00 -0.60 -4.95 121.76 123.60 1c4z s ALA 792 Ca 0.09 -1.08 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 1c4z s ALA 792 Cb -0.01 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.00 1c4z s ALA 792 CO 0.06 0.20 1.08 -2.14 0.00 0.00 0.00 175.76 174.96 1c4z s PRO 793 N -1.87 2.84 0.06 0.00 0.02 -1.26 -1.78 135.00 133.00 1c4z s PRO 793 Ca 0.01 0.40 -0.33 0.00 0.02 0.00 0.00 61.00 61.10 1c4z s PRO 793 Cb -0.09 -2.05 -0.12 0.00 0.02 0.00 0.00 34.50 32.26 1c4z s PRO 793 CO 0.03 -1.02 1.79 0.28 -0.33 0.00 0.00 177.00 177.75 1c4z n VAL 794 N -2.97 0.36 0.00 3.83 0.31 -1.26 -0.57 118.33 118.02 1c4z n VAL 794 Ca 0.07 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1c4z n VAL 794 Cb 0.57 -1.90 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 1c4z n VAL 794 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1c4z n GLY 795 N 4.09 1.01 0.00 2.92 0.00 -1.26 -4.91 105.19 107.05 1c4z n GLY 795 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1c4z n GLY 795 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c4z n GLY 796 N -0.91 -2.21 0.58 -0.02 0.00 0.26 -4.45 105.19 98.44 1c4z n GLY 796 Ca 0.00 -1.49 0.42 0.00 0.00 0.00 0.00 46.02 44.95 1c4z n GLY 796 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1c4z n LEU 797 N -1.99 0.00 -0.09 0.99 4.77 -1.26 0.07 117.00 119.49 1c4z n LEU 797 Ca 0.00 0.81 0.08 0.00 -0.03 0.00 0.00 56.01 56.86 1c4z n LEU 797 Cb 0.00 -0.39 0.43 0.00 -2.33 0.00 0.00 43.42 41.13 1c4z n LEU 797 CO 0.00 -0.81 1.19 1.23 -1.33 0.00 0.00 177.39 177.67 1c4z h GLY 798 N 0.00 0.71 -0.06 -0.72 0.00 -1.78 -0.33 103.07 100.90 1c4z h GLY 798 Ca 0.74 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1c4z h GLY 798 CO -0.01 0.18 0.00 0.28 0.00 0.00 0.00 176.54 176.99 1c4z n LYS 799 N -4.47 0.73 0.06 4.80 4.76 0.11 -3.31 118.16 120.84 1c4z n LYS 799 Ca 0.08 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.64 1c4z n LYS 799 Cb 0.23 -1.02 0.19 0.00 -1.84 0.00 0.00 35.03 32.58 1c4z n LYS 799 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1c4z n LEU 800 N -0.46 0.69 -3.99 -0.35 4.77 -0.13 -4.97 117.00 112.55 1c4z n LEU 800 Ca 0.00 0.23 -0.39 0.00 -0.03 0.00 0.00 56.01 55.82 1c4z n LEU 800 Cb 0.01 -0.19 0.01 0.00 -2.33 0.00 0.00 43.42 40.92 1c4z n LEU 800 CO 0.00 -0.05 -0.16 0.29 -1.33 0.00 0.00 177.39 176.14 1c4z n LYS 801 N -2.08 -0.46 -2.47 3.23 5.02 -1.21 -4.85 118.16 115.34 1c4z n LYS 801 Ca 0.03 0.09 -0.39 0.00 -2.02 0.00 0.00 58.31 56.02 1c4z n LYS 801 Cb 0.43 -2.01 -0.04 0.00 -0.02 0.00 0.00 35.03 33.40 1c4z n LYS 801 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1c4z s MET 802 N -6.82 4.39 -0.02 1.97 1.75 -1.26 -4.82 119.30 114.49 1c4z s MET 802 Ca 0.37 1.71 0.07 0.00 -1.25 0.00 0.00 55.69 56.59 1c4z s MET 802 Cb -0.21 -2.89 -0.02 0.00 2.84 0.00 0.00 34.83 34.55 1c4z s MET 802 CO 0.85 0.01 -0.23 0.42 -0.65 0.00 0.00 175.02 175.42 1c4z s ILE 803 N -1.37 1.82 -0.18 10.11 1.01 -0.17 -1.09 121.20 131.33 1c4z s ILE 803 Ca 0.51 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 60.18 1c4z s ILE 803 Cb -0.28 -1.51 0.01 0.00 0.01 0.00 0.00 42.46 40.69 1c4z s ILE 803 CO 0.36 0.52 -0.17 -0.63 0.00 0.00 0.00 174.94 175.01 1c4z s ILE 804 N -0.53 2.29 0.00 2.92 1.01 -0.81 -0.08 121.20 125.99 1c4z s ILE 804 Ca 0.09 -0.87 0.08 0.00 0.00 0.00 0.00 60.65 59.95 1c4z s ILE 804 Cb -0.09 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.38 1c4z s ILE 804 CO -0.01 0.52 -0.23 0.00 0.00 0.00 0.00 174.94 175.22 1c4z s ALA 805 N 1.27 2.32 0.17 9.38 0.00 0.15 -1.54 121.76 133.51 1c4z s ALA 805 Ca 0.04 -1.15 -0.31 0.00 0.00 0.00 0.00 51.96 50.54 1c4z s ALA 805 Cb -0.13 -0.62 -0.10 0.00 0.00 0.00 0.00 23.12 22.27 1c4z s ALA 805 CO -0.10 0.54 1.50 0.21 0.00 0.00 0.00 175.76 177.91 1c4z s LYS 806 N -0.90 4.25 -0.52 0.00 2.20 -0.53 -0.28 119.74 123.97 1c4z s LYS 806 Ca 0.11 2.29 0.07 0.00 -0.36 0.00 0.00 55.97 58.07 1c4z s LYS 806 Cb -0.10 -3.16 0.35 0.00 -1.51 0.00 0.00 37.83 33.41 1c4z s LYS 806 CO 0.01 -0.53 0.93 -1.71 -0.36 0.00 0.00 175.35 173.69 1c4z n ASN 807 N 3.60 3.80 0.00 1.43 5.15 -0.56 -4.79 115.26 123.89 1c4z n ASN 807 Ca 0.12 -3.55 0.00 0.00 -0.60 0.00 0.00 54.58 50.55 1c4z n ASN 807 Cb 0.40 -0.56 0.00 0.00 -0.53 0.00 0.00 39.78 39.09 1c4z n ASN 807 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1c4z n GLY 808 N -0.17 0.52 3.96 8.20 0.00 -1.26 -4.16 105.19 112.28 1c4z n GLY 808 Ca 0.30 -2.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.03 1c4z n GLY 808 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1c4z s PRO 809 N -1.36 1.27 0.34 1.61 0.04 -1.26 -1.68 135.00 133.95 1c4z s PRO 809 Ca 0.00 -0.67 -0.26 0.00 0.04 0.00 0.00 61.00 60.11 1c4z s PRO 809 Cb 0.00 -2.09 -0.13 0.00 0.04 0.00 0.00 34.50 32.32 1c4z s PRO 809 CO 0.00 -1.87 0.83 -3.47 0.04 0.00 0.00 177.00 172.54 1c4z n ASP 810 N -3.28 0.43 -0.56 6.66 2.03 -0.83 -4.25 116.55 116.76 1c4z n ASP 810 Ca 0.14 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.53 1c4z n ASP 810 Cb 0.60 -1.22 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 1c4z n ASP 810 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1c4z n THR 811 N -0.22 0.00 0.26 5.18 -2.24 -1.26 -4.99 114.28 111.00 1c4z n THR 811 Ca 0.11 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.93 1c4z n THR 811 Cb 0.34 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.62 1c4z n THR 811 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1c4z n GLU 812 N 0.00 0.62 -1.82 -0.78 4.71 -1.26 -4.97 120.64 117.14 1c4z n GLU 812 Ca 0.00 -1.15 -0.32 0.00 -0.01 0.00 0.00 57.16 55.68 1c4z n GLU 812 Cb 0.00 -1.16 0.03 0.00 -1.01 0.00 0.00 31.44 29.30 1c4z n GLU 812 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1c4z s ARG 813 N -0.73 3.07 0.20 3.49 0.52 -1.26 -5.04 118.95 119.20 1c4z s ARG 813 Ca 0.11 1.15 -0.07 0.00 -0.52 0.00 0.00 55.73 56.40 1c4z s ARG 813 Cb 0.07 -2.00 -0.06 0.00 0.52 0.00 0.00 34.95 33.48 1c4z s ARG 813 CO 0.10 -1.00 0.47 -0.51 0.02 0.00 0.00 175.30 174.38 1c4z s LEU 814 N -4.94 4.20 1.02 2.53 1.43 -1.26 -4.97 118.68 116.70 1c4z s LEU 814 Ca 0.62 0.76 -0.12 0.00 -1.03 0.00 0.00 54.13 54.36 1c4z s LEU 814 Cb -0.16 -3.51 0.20 0.00 0.03 0.00 0.00 46.19 42.76 1c4z s LEU 814 CO 0.44 -0.03 1.08 -2.16 0.23 0.00 0.00 176.35 175.91 1c4z s PRO 815 N -2.81 0.20 0.00 1.29 0.04 -1.26 -4.96 135.00 127.50 1c4z s PRO 815 Ca 0.44 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.54 1c4z s PRO 815 Cb -0.12 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.76 1c4z s PRO 815 CO 0.23 -3.03 0.00 0.25 0.04 0.00 0.00 177.00 174.49 1c4z n THR 816 N -4.46 0.00 -3.72 1.26 -2.24 -1.06 -4.96 114.28 99.10 1c4z n THR 816 Ca 0.07 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 1c4z n THR 816 Cb 0.54 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 1c4z n THR 816 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1c4z s SER 817 N -0.82 -0.31 -0.51 3.42 1.04 -1.26 -1.27 113.70 113.99 1c4z s SER 817 Ca 0.00 -0.40 0.03 0.00 0.48 0.00 0.00 55.95 56.06 1c4z s SER 817 Cb 0.00 0.62 0.15 0.00 0.10 0.00 0.00 66.02 66.89 1c4z s SER 817 CO 0.00 -1.12 0.33 -1.00 0.98 0.00 0.00 173.24 172.43 1c4z s HIS 818 N -3.68 2.28 0.31 5.02 3.76 -0.45 -4.99 115.29 117.54 1c4z s HIS 818 Ca 0.09 -2.69 0.08 0.00 -0.15 0.00 0.00 55.06 52.39 1c4z s HIS 818 Cb -0.04 -1.95 0.82 0.00 1.11 0.00 0.00 32.58 32.53 1c4z s HIS 818 CO 0.01 -0.73 1.74 1.79 -0.85 0.00 0.00 174.74 176.70 1c4z h THR 819 N 4.90 0.58 0.00 1.30 1.35 -1.78 0.65 112.91 119.91 1c4z h THR 819 Ca 0.09 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1c4z h THR 819 Cb 0.88 -0.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 1c4z h THR 819 CO 0.53 0.11 0.08 0.00 -0.25 0.00 0.00 175.52 175.99 1c4z n PHE 821 N -2.90 0.08 -3.82 0.00 3.01 0.14 -4.36 117.46 109.61 1c4z n PHE 821 Ca -0.03 -0.43 -0.26 0.00 1.01 0.00 0.00 57.45 57.75 1c4z n PHE 821 Cb 0.14 -0.04 0.03 0.00 -0.01 0.00 0.00 39.48 39.59 1c4z n PHE 821 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1c4z n ASN 822 N -0.24 -2.78 -4.58 4.37 3.02 0.47 -4.61 115.26 110.90 1c4z n ASN 822 Ca 0.02 -0.82 -0.34 0.00 -0.03 0.00 0.00 54.58 53.41 1c4z n ASN 822 Cb 0.25 -3.90 -0.11 0.00 -0.61 0.00 0.00 39.78 35.41 1c4z n ASN 822 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1c4z s VAL 823 N -3.52 4.50 -0.28 2.41 1.01 -0.92 -1.00 120.40 122.60 1c4z s VAL 823 Ca 0.31 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.10 1c4z s VAL 823 Cb -0.16 -3.02 0.01 0.00 0.00 0.00 0.00 36.38 33.21 1c4z s VAL 823 CO 0.83 0.46 0.05 -0.22 0.00 0.00 0.00 175.10 176.21 1c4z s LEU 824 N 0.46 3.68 -0.48 3.92 1.98 0.88 -1.34 118.68 127.79 1c4z s LEU 824 Ca 0.01 -0.74 -0.21 0.00 -2.89 0.00 0.00 54.13 50.31 1c4z s LEU 824 Cb -0.13 -1.83 0.04 0.00 0.66 0.00 0.00 46.19 44.93 1c4z s LEU 824 CO 0.01 -0.17 0.68 -0.76 -1.89 0.00 0.00 176.35 174.22 1c4z s LEU 825 N 1.46 4.59 -0.31 -0.68 1.43 -0.40 -0.67 118.68 124.10 1c4z s LEU 825 Ca 0.02 -0.53 -0.06 0.00 -1.03 0.00 0.00 54.13 52.53 1c4z s LEU 825 Cb -0.17 -2.65 0.03 0.00 0.03 0.00 0.00 46.19 43.42 1c4z s LEU 825 CO 0.01 -0.88 0.07 -0.22 0.23 0.00 0.00 176.35 175.56 1c4z s LEU 826 N 2.93 4.00 0.43 1.79 0.20 0.62 -2.55 118.68 126.10 1c4z s LEU 826 Ca 0.21 -0.96 -0.25 0.00 0.69 0.00 0.00 54.13 53.83 1c4z s LEU 826 Cb -0.16 -1.84 -0.08 0.00 -0.43 0.00 0.00 46.19 43.68 1c4z s LEU 826 CO 0.17 -0.25 1.30 -2.84 -0.29 0.00 0.00 176.35 174.43 1c4z s PRO 827 N 1.42 3.81 -1.31 0.98 0.02 -1.26 -1.50 135.00 137.16 1c4z s PRO 827 Ca -0.00 2.12 -0.18 0.00 0.02 0.00 0.00 61.00 62.96 1c4z s PRO 827 Cb -0.18 -2.63 0.06 0.00 0.02 0.00 0.00 34.50 31.77 1c4z s PRO 827 CO 0.02 -0.61 1.79 -1.91 -0.33 0.00 0.00 177.00 175.96 1c4z n GLU 828 N -0.14 3.13 -0.79 5.54 2.13 -0.68 -4.86 120.64 124.98 1c4z n GLU 828 Ca 0.05 -3.19 -0.32 0.00 0.66 0.00 0.00 57.16 54.36 1c4z n GLU 828 Cb 0.44 -3.48 0.15 0.00 0.27 0.00 0.00 31.44 28.82 1c4z n GLU 828 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1c4z n TYR 829 N 8.27 0.35 1.70 4.31 4.02 -1.26 -1.96 117.16 132.58 1c4z n TYR 829 Ca 0.49 0.36 0.15 0.00 -0.01 0.00 0.00 57.90 58.89 1c4z n TYR 829 Cb 0.45 -1.97 0.70 0.00 -0.02 0.00 0.00 39.34 38.50 1c4z n TYR 829 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1c4z n SER 830 N -3.30 0.88 -3.62 7.72 3.41 -1.26 -4.85 113.62 112.61 1c4z n SER 830 Ca 0.11 -1.28 -0.11 0.00 -0.26 0.00 0.00 58.87 57.33 1c4z n SER 830 Cb 0.52 -0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 1c4z n SER 830 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1c4z s SER 831 N -2.01 -0.52 0.21 4.04 0.15 -1.26 -5.04 113.70 109.27 1c4z s SER 831 Ca 0.42 0.91 -0.12 0.00 0.70 0.00 0.00 55.95 57.86 1c4z s SER 831 Cb 0.21 0.88 0.27 0.00 -1.71 0.00 0.00 66.02 65.68 1c4z s SER 831 CO 0.35 -0.24 1.65 0.50 1.20 0.00 0.00 173.24 176.70 1c4z h LYS 832 N 4.00 0.07 -0.64 5.44 3.64 -1.95 0.42 116.57 127.54 1c4z h LYS 832 Ca -0.27 -0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.23 1c4z h LYS 832 Cb 1.17 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.89 1c4z h LYS 832 CO 0.15 0.04 0.19 0.93 -2.27 0.00 0.00 179.45 178.50 1c4z h GLU 833 N 0.07 0.32 -0.20 1.90 3.07 -2.00 -1.08 114.58 116.67 1c4z h GLU 833 Ca 0.31 -0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 59.00 1c4z h GLU 833 Cb 0.50 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 1c4z h GLU 833 CO -0.57 0.21 -0.52 -0.22 -1.40 0.00 0.00 179.01 176.51 1c4z h LYS 834 N 0.33 0.56 0.84 2.33 3.64 -1.06 -1.66 116.57 121.55 1c4z h LYS 834 Ca 0.34 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1c4z h LYS 834 Cb 0.50 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1c4z h LYS 834 CO -0.39 0.95 -0.45 1.25 -2.27 0.00 0.00 179.45 178.54 1c4z h LEU 835 N 0.44 -1.10 -0.89 5.20 6.46 0.42 -1.19 115.31 124.63 1c4z h LEU 835 Ca 0.01 0.05 0.11 0.00 -0.12 0.00 0.00 57.88 57.93 1c4z h LEU 835 Cb 1.06 0.30 -0.08 0.00 -0.73 0.00 0.00 40.66 41.21 1c4z h LEU 835 CO 0.10 -0.73 0.53 0.50 -0.62 0.00 0.00 178.44 178.22 1c4z h LYS 836 N -1.19 0.82 -0.52 1.25 3.64 -1.22 0.47 116.57 119.83 1c4z h LYS 836 Ca -0.11 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.12 1c4z h LYS 836 Cb 0.93 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 1c4z h LYS 836 CO 0.16 0.55 -0.08 1.49 -2.27 0.00 0.00 179.45 179.29 1c4z h GLU 837 N 0.85 0.94 0.08 1.90 4.22 -1.07 -0.86 114.58 120.64 1c4z h GLU 837 Ca 0.44 -0.32 -0.26 0.00 0.08 0.00 0.00 59.36 59.30 1c4z h GLU 837 Cb 0.44 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.63 1c4z h GLU 837 CO -0.27 0.97 -1.13 0.00 -2.18 0.00 0.00 179.01 176.41 1c4z h ARG 838 N 0.84 0.41 0.09 1.92 2.47 -0.81 -2.53 114.38 116.77 1c4z h ARG 838 Ca 0.14 -0.54 -0.00 0.00 -1.26 0.00 0.00 59.98 58.31 1c4z h ARG 838 Cb 0.61 0.18 0.00 0.00 -1.65 0.00 0.00 29.97 29.11 1c4z h ARG 838 CO 0.04 1.21 -0.04 1.25 0.56 0.00 0.00 179.97 182.99 1c4z h LEU 839 N 0.18 -0.10 -0.22 3.04 6.46 -0.83 -1.99 115.31 121.85 1c4z h LEU 839 Ca -0.13 -0.14 0.04 0.00 -0.12 0.00 0.00 57.88 57.53 1c4z h LEU 839 Cb 1.81 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 41.73 1c4z h LEU 839 CO 0.20 0.07 0.00 -0.07 -0.62 0.00 0.00 178.44 178.02 1c4z h LEU 840 N -0.28 -0.08 -2.10 2.25 3.38 -1.23 -1.31 115.31 115.94 1c4z h LEU 840 Ca -0.01 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1c4z h LEU 840 Cb 0.23 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1c4z h LEU 840 CO 0.02 -0.01 -0.07 0.50 0.09 0.00 0.00 178.44 178.96 1c4z h LYS 841 N 0.07 0.00 0.06 1.13 3.64 -1.37 -1.80 116.57 118.29 1c4z h LYS 841 Ca 0.10 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1c4z h LYS 841 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1c4z h LYS 841 CO -0.17 0.07 -0.03 0.00 -2.27 0.00 0.00 179.45 177.05 1c4z h ALA 842 N 1.93 -0.08 0.00 5.00 0.00 -0.49 -2.45 119.26 123.16 1c4z h ALA 842 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1c4z h ALA 842 Cb 0.26 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1c4z h ALA 842 CO 0.01 -0.15 0.00 -0.84 0.00 0.00 0.00 179.25 178.27 1c4z h ILE 843 N -0.87 0.00 0.01 0.00 3.07 -1.17 -3.10 117.51 115.46 1c4z h ILE 843 Ca -0.01 -0.51 -0.31 0.00 1.55 0.00 0.00 64.86 65.58 1c4z h ILE 843 Cb 0.64 1.44 -0.05 0.00 -0.27 0.00 0.00 36.82 38.58 1c4z h ILE 843 CO 0.01 0.00 -1.85 1.07 -1.05 0.00 0.00 178.15 176.33 1c4z n THR 844 N -2.78 1.60 -0.06 0.16 5.66 -0.69 -4.36 114.28 113.81 1c4z n THR 844 Ca 0.02 -0.79 -0.13 0.00 -3.05 0.00 0.00 64.05 60.11 1c4z n THR 844 Cb 0.33 -1.04 -0.07 0.00 -1.55 0.00 0.00 70.33 68.01 1c4z n THR 844 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 175.07 172.24 1c4z h TYR 845 N 0.01 0.41 0.00 1.09 3.20 -1.40 -3.51 116.97 116.77 1c4z h TYR 845 Ca -0.34 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.42 1c4z h TYR 845 Cb 2.05 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 40.23 1c4z h TYR 845 CO 0.01 0.70 0.00 0.00 -1.64 0.00 0.00 178.16 177.23