#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 0.75 -0.71 1.20 -0.04 -1.26 -4.90 135.00 130.05 1c4z n PRO 498 Ca 0.00 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 1c4z n PRO 498 Cb 0.00 -2.04 -0.00 0.00 -0.04 0.00 0.00 33.50 31.42 1c4z n PRO 498 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1c4z n TYR 499 N -1.79 -1.94 0.02 0.54 0.53 -1.26 -4.75 117.16 108.51 1c4z n TYR 499 Ca 0.13 1.05 -0.17 0.00 -1.02 0.00 0.00 57.90 57.89 1c4z n TYR 499 Cb 0.48 -1.90 -0.07 0.00 -1.03 0.00 0.00 39.34 36.81 1c4z n TYR 499 CO 0.00 0.00 0.00 1.25 -1.02 0.00 0.00 176.86 177.09 1c4z h LEU 500 N 0.05 0.83 -2.16 7.72 6.46 -1.39 -3.46 115.31 123.37 1c4z h LEU 500 Ca -0.00 -0.61 0.01 0.00 -0.12 0.00 0.00 57.88 57.15 1c4z h LEU 500 Cb 0.45 -0.25 -0.10 0.00 -0.73 0.00 0.00 40.66 40.02 1c4z h LEU 500 CO 0.00 1.41 -1.32 0.54 -0.62 0.00 0.00 178.44 178.44 1c4z n ARG 501 N -3.86 -3.89 -4.69 1.25 1.74 -1.25 -4.91 116.66 101.05 1c4z n ARG 501 Ca -0.09 3.01 -0.25 0.00 -0.77 0.00 0.00 57.85 59.76 1c4z n ARG 501 Cb 0.81 -4.61 -0.16 0.00 -1.02 0.00 0.00 32.46 27.48 1c4z n ARG 501 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1c4z s LEU 502 N -0.72 1.83 -0.04 0.55 0.20 -0.49 -4.96 118.68 115.05 1c4z s LEU 502 Ca -0.22 -0.31 0.03 0.00 0.69 0.00 0.00 54.13 54.33 1c4z s LEU 502 Cb 0.01 -0.85 0.00 0.00 -0.43 0.00 0.00 46.19 44.92 1c4z s LEU 502 CO 0.70 0.11 -0.14 -0.75 -0.29 0.00 0.00 176.35 175.98 1c4z s LYS 503 N 0.21 1.45 0.14 1.98 2.20 -1.26 -1.39 119.74 123.07 1c4z s LYS 503 Ca -0.06 -0.47 -0.02 0.00 -0.36 0.00 0.00 55.97 55.05 1c4z s LYS 503 Cb -0.12 -1.28 0.01 0.00 -1.51 0.00 0.00 37.83 34.93 1c4z s LYS 503 CO 0.02 0.18 0.22 1.33 -0.36 0.00 0.00 175.35 176.74 1c4z n VAL 504 N 3.26 0.00 -3.99 4.02 0.24 -0.97 -4.81 118.33 116.07 1c4z n VAL 504 Ca -0.19 -0.57 -0.17 0.00 -2.04 0.00 0.00 64.34 61.38 1c4z n VAL 504 Cb 0.53 0.40 -0.16 0.00 -1.47 0.00 0.00 33.84 33.14 1c4z n VAL 504 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1c4z s ARG 505 N -2.21 0.38 0.62 7.34 1.70 -1.26 0.55 118.95 126.07 1c4z s ARG 505 Ca 0.09 0.01 -0.17 0.00 -0.47 0.00 0.00 55.73 55.19 1c4z s ARG 505 Cb -0.01 -0.50 -0.09 0.00 -0.57 0.00 0.00 34.95 33.78 1c4z s ARG 505 CO 0.07 -0.09 0.28 0.54 -1.08 0.00 0.00 175.30 175.02 1c4z n ARG 506 N 3.92 0.29 -2.34 3.89 1.74 -1.26 -2.77 116.66 120.13 1c4z n ARG 506 Ca -0.24 0.12 -0.04 0.00 -0.77 0.00 0.00 57.85 56.92 1c4z n ARG 506 Cb 0.52 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 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 0.97 -5.83 0.00 0.55 10.43 -1.26 -4.69 116.55 116.71 1c4z n ASP 507 Ca 0.09 0.50 0.00 0.00 2.57 0.00 0.00 54.79 57.96 1c4z n ASP 507 Cb 0.49 -3.81 0.00 0.00 1.84 0.00 0.00 41.12 39.64 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 -0.15 0.00 0.14 1.24 8.25 -1.20 -5.06 115.22 118.44 1c4z n HIS 508 Ca 0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.37 1c4z n HIS 508 Cb 0.21 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.25 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 0.21 -0.37 1.59 2.04 -1.79 -1.63 117.51 117.55 1c4z h ILE 509 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 1c4z h ILE 509 Cb 0.00 0.21 -0.08 0.00 -0.74 0.00 0.00 36.82 36.21 1c4z h ILE 509 CO 0.00 0.00 -0.14 0.40 0.00 0.00 0.00 178.15 178.41 1c4z h ILE 510 N -0.65 0.53 0.58 -0.67 2.04 -1.97 0.11 117.51 117.47 1c4z h ILE 510 Ca 0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1c4z h ILE 510 Cb 0.66 0.53 0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1c4z h ILE 510 CO -0.19 0.00 -0.28 0.44 0.00 0.00 0.00 178.15 178.12 1c4z h ASP 511 N -0.07 -0.66 -0.94 1.72 5.19 -1.96 0.55 116.42 120.25 1c4z h ASP 511 Ca 0.18 0.02 0.21 0.00 -0.62 0.00 0.00 57.03 56.83 1c4z h ASP 511 Cb 0.35 0.17 -0.08 0.00 0.18 0.00 0.00 39.33 39.96 1c4z h ASP 511 CO -0.42 -0.47 0.61 0.44 -3.12 0.00 0.00 179.24 176.28 1c4z h ASP 512 N -0.78 0.47 0.06 6.45 3.45 -1.25 -0.70 116.42 124.13 1c4z h ASP 512 Ca -0.08 0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.43 1c4z h ASP 512 Cb 0.60 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.34 1c4z h ASP 512 CO 0.13 0.17 -0.03 0.00 -1.57 0.00 0.00 179.24 177.94 1c4z h ALA 513 N 1.61 -0.08 0.14 3.45 0.00 -0.53 -2.97 119.26 120.89 1c4z h ALA 513 Ca 0.51 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.30 1c4z h ALA 513 Cb 1.18 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1c4z h ALA 513 CO -0.22 -0.42 -0.29 1.25 0.00 0.00 0.00 179.25 179.56 1c4z h LEU 514 N -0.34 -0.83 0.07 0.00 7.12 0.61 -1.23 115.31 120.71 1c4z h LEU 514 Ca -0.01 0.09 0.03 0.00 0.13 0.00 0.00 57.88 58.12 1c4z h LEU 514 Cb 0.30 0.31 -0.05 0.00 -0.53 0.00 0.00 40.66 40.69 1c4z h LEU 514 CO 0.01 -0.39 -0.38 0.58 -0.13 0.00 0.00 178.44 178.14 1c4z h VAL 515 N -0.52 0.22 0.21 1.05 2.07 -1.44 0.15 116.25 117.99 1c4z h VAL 515 Ca 0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 1c4z h VAL 515 Cb 0.54 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1c4z h VAL 515 CO -0.16 0.00 -0.11 -0.09 0.02 0.00 0.00 177.57 177.23 1c4z h ARG 516 N -0.57 -0.29 -0.99 1.57 9.65 -1.47 -0.49 114.38 121.78 1c4z h ARG 516 Ca 0.04 0.02 0.08 0.00 -1.10 0.00 0.00 59.98 59.01 1c4z h ARG 516 Cb 0.63 0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 29.20 1c4z h ARG 516 CO -0.25 -0.19 0.64 -0.07 2.80 0.00 0.00 179.97 182.90 1c4z h LEU 517 N -0.30 1.01 0.84 3.80 3.38 -1.07 0.13 115.31 123.09 1c4z h LEU 517 Ca -0.03 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1c4z h LEU 517 Cb 0.23 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.79 1c4z h LEU 517 CO 0.04 0.62 -0.43 -0.08 0.09 0.00 0.00 178.44 178.69 1c4z h GLU 518 N 1.13 -1.12 -0.25 1.13 4.57 -0.31 -1.47 114.58 118.26 1c4z h GLU 518 Ca 0.44 0.08 0.06 0.00 -1.18 0.00 0.00 59.36 58.75 1c4z h GLU 518 Cb 0.23 0.25 -0.08 0.00 -0.16 0.00 0.00 28.75 29.00 1c4z h GLU 518 CO -0.19 -0.75 -0.38 0.52 -1.18 0.00 0.00 179.01 177.04 1c4z h MET 519 N -1.16 -0.37 -1.11 1.92 2.86 -0.32 0.11 114.93 116.86 1c4z h MET 519 Ca -0.11 0.03 0.30 0.00 -2.06 0.00 0.00 59.70 57.86 1c4z h MET 519 Cb 0.90 0.08 -0.09 0.00 0.06 0.00 0.00 31.60 32.56 1c4z h MET 519 CO 0.17 -0.25 0.73 0.82 1.06 0.00 0.00 176.91 179.45 1c4z h ILE 520 N -0.38 0.45 0.65 -1.22 2.04 -0.59 -1.66 117.51 116.80 1c4z h ILE 520 Ca 0.11 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1c4z h ILE 520 Cb 0.58 0.16 0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1c4z h ILE 520 CO -0.46 0.05 -0.31 0.00 0.00 0.00 0.00 178.15 177.43 1c4z h ALA 521 N 1.57 -0.92 -1.14 1.87 0.00 0.12 -3.13 119.26 117.63 1c4z h ALA 521 Ca 0.61 -0.19 0.33 0.00 0.00 0.00 0.00 54.91 55.66 1c4z h ALA 521 Cb 1.81 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 19.89 1c4z h ALA 521 CO -0.25 -0.86 0.89 1.98 0.00 0.00 0.00 179.25 181.01 1c4z h MET 522 N -1.18 0.00 -3.70 0.00 1.85 -0.95 -2.32 114.93 108.64 1c4z h MET 522 Ca -0.09 0.00 -0.68 0.00 -0.61 0.00 0.00 59.70 58.32 1c4z h MET 522 Cb 0.67 0.00 -0.37 0.00 0.43 0.00 0.00 31.60 32.34 1c4z h MET 522 CO 0.15 0.00 -0.46 -2.00 -0.40 0.00 0.00 176.91 174.20 1c4z s GLU 523 N -4.85 2.33 -0.32 0.39 2.12 -0.82 -4.84 118.70 112.72 1c4z s GLU 523 Ca -0.05 -2.44 -0.05 0.00 0.36 0.00 0.00 54.97 52.79 1c4z s GLU 523 Cb 0.21 -3.60 0.01 0.00 0.26 0.00 0.00 34.13 31.01 1c4z s GLU 523 CO 0.75 -1.14 0.36 -1.71 -0.54 0.00 0.00 175.26 172.98 1c4z n ASN 524 N 3.56 -5.32 -0.20 -1.70 2.85 -1.20 -4.74 115.26 108.51 1c4z n ASN 524 Ca 0.06 0.15 0.12 0.00 -0.11 0.00 0.00 54.58 54.81 1c4z n ASN 524 Cb 0.37 -3.46 0.43 0.00 1.24 0.00 0.00 39.78 38.36 1c4z n ASN 524 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1c4z h PRO 525 N 0.75 0.57 0.00 1.20 0.11 -1.56 -2.21 132.00 130.86 1c4z h PRO 525 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1c4z h PRO 525 Cb 0.75 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1c4z h PRO 525 CO 0.14 0.37 0.30 0.00 -0.21 0.00 0.00 178.00 178.60 1c4z n ALA 526 N -2.47 0.60 0.23 -0.75 0.00 -1.26 -0.15 120.51 116.71 1c4z n ALA 526 Ca 0.15 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.80 1c4z n ALA 526 Cb 0.44 -0.75 0.43 0.00 0.00 0.00 0.00 19.45 19.58 1c4z n ALA 526 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1c4z h ASP 527 N 0.00 0.00 0.22 0.00 3.32 -1.72 -2.02 116.42 116.23 1c4z h ASP 527 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1c4z h ASP 527 Cb 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1c4z h ASP 527 CO 0.00 0.18 0.00 0.18 -1.72 0.00 0.00 179.24 177.88 1c4z n LEU 528 N -3.28 0.00 0.02 1.55 4.77 0.79 -2.20 117.00 118.65 1c4z n LEU 528 Ca 0.01 0.37 0.11 0.00 -0.03 0.00 0.00 56.01 56.47 1c4z n LEU 528 Cb 0.44 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1c4z n LEU 528 CO 0.33 -0.26 -0.07 1.17 -1.33 0.00 0.00 177.39 177.23 1c4z n LYS 529 N -1.37 0.26 -0.96 3.23 4.81 -0.76 -4.88 118.16 118.49 1c4z n LYS 529 Ca 0.03 -0.02 -0.21 0.00 -0.87 0.00 0.00 58.31 57.24 1c4z n LYS 529 Cb 0.08 -1.56 0.17 0.00 0.02 0.00 0.00 35.03 33.74 1c4z n LYS 529 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1c4z n LYS 530 N -1.89 -2.00 -2.39 1.64 5.02 -0.93 -4.98 118.16 112.63 1c4z n LYS 530 Ca 0.02 -1.34 -0.43 0.00 -2.02 0.00 0.00 58.31 54.54 1c4z n LYS 530 Cb 0.43 -1.11 -0.02 0.00 -0.02 0.00 0.00 35.03 34.30 1c4z n LYS 530 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1c4z s GLN 531 N -4.89 4.09 -0.21 1.97 -0.21 -1.26 -4.66 119.66 114.48 1c4z s GLN 531 Ca 0.52 1.54 -0.29 0.00 0.02 0.00 0.00 55.36 57.15 1c4z s GLN 531 Cb -0.04 -3.83 -0.03 0.00 1.00 0.00 0.00 33.01 30.11 1c4z s GLN 531 CO 0.39 -0.89 1.66 -1.17 -2.12 0.00 0.00 175.29 173.16 1c4z s LEU 532 N 3.94 3.88 -0.32 2.90 2.96 -1.26 -1.12 118.68 129.66 1c4z s LEU 532 Ca 0.57 1.66 -0.05 0.00 -0.22 0.00 0.00 54.13 56.09 1c4z s LEU 532 Cb -0.21 -3.53 0.04 0.00 0.50 0.00 0.00 46.19 42.99 1c4z s LEU 532 CO 0.19 -1.30 0.06 -0.47 -1.32 0.00 0.00 176.35 173.51 1c4z s TYR 533 N 5.38 3.25 -0.02 5.38 5.04 -1.26 -4.81 117.35 130.30 1c4z s TYR 533 Ca 0.74 -1.54 -0.08 0.00 -2.44 0.00 0.00 57.07 53.74 1c4z s TYR 533 Cb -0.26 -2.21 -0.05 0.00 0.35 0.00 0.00 41.96 39.79 1c4z s TYR 533 CO 0.30 -0.74 0.26 0.08 -1.34 0.00 0.00 175.55 174.11 1c4z s VAL 534 N 1.36 5.31 -0.10 3.14 1.01 -1.26 -1.40 120.40 128.45 1c4z s VAL 534 Ca -0.03 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 1c4z s VAL 534 Cb -0.19 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.68 1c4z s VAL 534 CO 0.01 0.46 0.06 -1.61 0.00 0.00 0.00 175.10 174.02 1c4z s GLU 535 N -1.47 0.13 -0.06 2.72 2.02 -0.49 -4.59 118.70 116.95 1c4z s GLU 535 Ca 0.24 0.12 -0.28 0.00 0.02 0.00 0.00 54.97 55.07 1c4z s GLU 535 Cb -0.13 -1.14 -0.02 0.00 0.10 0.00 0.00 34.13 32.93 1c4z s GLU 535 CO 0.13 -0.46 0.94 -0.06 0.02 0.00 0.00 175.26 175.82 1c4z s PHE 536 N 2.11 3.57 -0.07 1.61 0.40 -1.26 -2.29 117.98 122.05 1c4z s PHE 536 Ca 0.04 1.56 -0.34 0.00 -0.60 0.00 0.00 56.93 57.58 1c4z s PHE 536 Cb -0.14 -3.09 -0.12 0.00 0.51 0.00 0.00 43.02 40.18 1c4z s PHE 536 CO -0.06 -0.10 1.87 -1.91 0.70 0.00 0.00 175.22 175.72 1c4z n GLU 537 N 4.42 2.22 -0.17 0.44 2.13 0.19 -1.71 120.64 128.16 1c4z n GLU 537 Ca 0.06 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.69 1c4z n GLU 537 Cb 0.50 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.55 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 4.36 0.85 2.92 8.31 0.00 -1.26 -4.92 105.19 115.45 1c4z n GLY 538 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.83 1.24 1.08 1.61 2.02 -0.69 -5.11 118.70 118.02 1c4z s GLU 539 Ca 0.00 -1.57 -0.12 0.00 0.02 0.00 0.00 54.97 53.30 1c4z s GLU 539 Cb 0.00 -2.77 0.23 0.00 0.10 0.00 0.00 34.13 31.69 1c4z s GLU 539 CO 0.00 -0.94 1.00 1.04 0.02 0.00 0.00 175.26 176.38 1c4z n GLN 540 N 4.47 -1.70 0.00 1.61 6.02 -1.26 -4.66 117.38 121.86 1c4z n GLN 540 Ca 0.01 -0.45 0.00 0.00 -0.01 0.00 0.00 57.00 56.55 1c4z n GLN 540 Cb 0.42 -2.21 0.00 0.00 1.02 0.00 0.00 30.24 29.47 1c4z n GLN 540 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1c4z n GLY 541 N 0.82 2.69 3.17 1.08 0.00 -1.26 -5.07 105.19 106.63 1c4z n GLY 541 Ca 0.06 -1.80 -0.28 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.77 1.61 -0.34 1.61 1.01 -1.26 -5.09 120.40 116.17 1c4z s VAL 542 Ca 0.00 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 60.97 1c4z s VAL 542 Cb 0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 1c4z s VAL 542 CO 0.00 0.46 0.57 -0.62 0.00 0.00 0.00 175.10 175.51 1c4z s ASP 543 N -0.04 6.38 0.00 3.32 2.15 -1.26 -4.85 116.67 122.38 1c4z s ASP 543 Ca -0.03 0.12 0.19 0.00 0.43 0.00 0.00 52.55 53.26 1c4z s ASP 543 Cb -0.12 -2.30 0.33 0.00 -0.30 0.00 0.00 42.92 40.53 1c4z s ASP 543 CO 0.03 -0.51 1.27 -0.62 -0.17 0.00 0.00 175.17 175.17 1c4z n GLU 544 N 5.86 2.21 0.00 4.34 1.02 -1.26 -4.90 120.64 127.92 1c4z n GLU 544 Ca -0.03 -2.04 0.00 0.00 -0.02 0.00 0.00 57.16 55.07 1c4z n GLU 544 Cb 0.49 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 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 1.20 1.30 0.08 0.62 0.00 -1.26 -4.98 105.19 102.16 1c4z n GLY 545 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.10 2.00 -0.02 0.00 -1.91 0.41 103.07 103.44 1c4z h GLY 546 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 1c4z h GLY 546 CO 0.00 -0.04 -0.13 -2.08 0.00 0.00 0.00 176.54 174.29 1c4z h VAL 547 N -0.41 1.09 -0.19 4.60 2.07 -1.90 0.30 116.25 121.81 1c4z h VAL 547 Ca -0.01 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 1c4z h VAL 547 Cb 0.35 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1c4z h VAL 547 CO 0.02 0.13 -0.12 0.28 0.02 0.00 0.00 177.57 177.90 1c4z h SER 548 N 0.00 0.44 -0.61 0.57 0.02 -1.79 -1.51 113.55 110.67 1c4z h SER 548 Ca -0.00 -0.43 -0.06 0.00 -0.84 0.00 0.00 61.79 60.46 1c4z h SER 548 Cb 0.23 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1c4z h SER 548 CO 0.02 0.77 0.17 0.50 -1.14 0.00 0.00 176.83 177.15 1c4z h LYS 549 N 0.11 0.99 -0.15 3.45 3.64 0.19 -1.22 116.57 123.57 1c4z h LYS 549 Ca 0.04 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1c4z h LYS 549 Cb 0.62 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1c4z h LYS 549 CO 0.03 0.87 0.05 1.49 -2.27 0.00 0.00 179.45 179.62 1c4z h GLU 550 N 0.95 0.24 -0.58 1.90 4.81 -0.44 -1.65 114.58 119.81 1c4z h GLU 550 Ca 0.21 -0.05 0.11 0.00 -0.13 0.00 0.00 59.36 59.50 1c4z h GLU 550 Cb 0.31 -0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.54 1c4z h GLU 550 CO -0.00 0.36 -0.27 0.35 -0.73 0.00 0.00 179.01 178.72 1c4z h PHE 551 N 0.06 -0.71 -0.43 0.92 3.57 -0.81 0.13 116.94 119.68 1c4z h PHE 551 Ca 0.05 0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.64 1c4z h PHE 551 Cb 0.22 0.40 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 1c4z h PHE 551 CO -0.00 -0.35 0.24 0.74 -2.23 0.00 0.00 178.31 176.71 1c4z h PHE 552 N -0.12 0.45 -0.79 0.41 0.04 -1.00 -1.69 116.94 114.24 1c4z h PHE 552 Ca 0.25 0.02 0.02 0.00 2.80 0.00 0.00 57.97 61.05 1c4z h PHE 552 Cb 0.52 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.49 1c4z h PHE 552 CO -0.58 0.25 0.52 1.96 -0.60 0.00 0.00 178.31 179.86 1c4z h GLN 553 N 0.48 1.00 -0.24 1.51 4.20 -0.23 -1.14 115.11 120.70 1c4z h GLN 553 Ca 0.17 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 1c4z h GLN 553 Cb 0.03 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1c4z h GLN 553 CO -0.09 0.66 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.50 1c4z h LEU 554 N 1.04 0.56 -0.44 1.46 3.38 -0.77 -0.57 115.31 119.97 1c4z h LEU 554 Ca 0.30 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1c4z h LEU 554 Cb -0.07 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1c4z h LEU 554 CO -0.08 0.88 0.16 0.58 0.09 0.00 0.00 178.44 180.07 1c4z h VAL 555 N 0.25 1.21 -0.44 1.22 2.07 -1.21 -1.75 116.25 117.61 1c4z h VAL 555 Ca 0.05 -0.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.83 1c4z h VAL 555 Cb 0.68 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1c4z h VAL 555 CO 0.04 0.24 -0.04 0.58 0.02 0.00 0.00 177.57 178.41 1c4z h VAL 556 N 0.57 1.24 -0.39 2.57 2.07 -1.20 -2.23 116.25 118.88 1c4z h VAL 556 Ca 0.15 -1.04 -0.10 0.00 0.82 0.00 0.00 66.70 66.53 1c4z h VAL 556 Cb 0.22 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1c4z h VAL 556 CO -0.01 0.36 -0.14 -0.08 0.02 0.00 0.00 177.57 177.72 1c4z h GLU 557 N 0.68 0.79 0.00 1.57 4.22 -0.86 -3.01 114.58 117.98 1c4z h GLU 557 Ca 0.13 -0.33 -0.17 0.00 0.08 0.00 0.00 59.36 59.07 1c4z h GLU 557 Cb 0.49 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1c4z h GLU 557 CO 0.03 0.95 -0.80 1.49 -2.18 0.00 0.00 179.01 178.49 1c4z h GLU 558 N 0.60 0.00 -0.05 1.92 4.81 -1.22 -3.14 114.58 117.51 1c4z h GLU 558 Ca 0.09 -0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.14 1c4z h GLU 558 Cb 0.68 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1c4z h GLU 558 CO 0.05 0.81 -0.74 0.82 -0.73 0.00 0.00 179.01 179.22 1c4z h ILE 559 N 0.00 1.42 -0.56 2.32 1.08 -1.44 -3.17 117.51 117.16 1c4z h ILE 559 Ca -0.01 -2.24 0.00 0.00 -0.39 0.00 0.00 64.86 62.23 1c4z h ILE 559 Cb 1.42 2.19 0.00 0.00 -3.07 0.00 0.00 36.82 37.36 1c4z h ILE 559 CO 0.10 0.66 0.00 0.49 -0.69 0.00 0.00 178.15 178.72 1c4z n PHE 560 N -3.79 0.82 -2.86 1.37 3.01 -1.14 -4.57 117.46 110.29 1c4z n PHE 560 Ca -0.03 -0.39 -0.41 0.00 1.01 0.00 0.00 57.45 57.63 1c4z n PHE 560 Cb 0.71 -0.03 -0.04 0.00 -0.01 0.00 0.00 39.48 40.10 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 -0.97 7.31 0.39 4.37 3.84 -1.19 -4.94 114.94 123.75 1c4z s ASN 561 Ca 0.38 1.57 0.11 0.00 0.21 0.00 0.00 52.86 55.13 1c4z s ASN 561 Cb 0.21 -2.52 0.90 0.00 -0.55 0.00 0.00 41.25 39.29 1c4z s ASN 561 CO 0.25 -0.06 1.94 -0.65 -2.79 0.00 0.00 177.10 175.78 1c4z h PRO 562 N 5.91 0.56 -0.93 0.43 0.11 -1.90 -2.75 132.00 133.44 1c4z h PRO 562 Ca -0.43 -0.03 0.25 0.00 0.11 0.00 0.00 66.00 65.90 1c4z h PRO 562 Cb 1.21 -0.13 -0.17 0.00 0.11 0.00 0.00 31.00 32.02 1c4z h PRO 562 CO 0.72 0.37 0.06 -0.44 -0.21 0.00 0.00 178.00 178.50 1c4z h ASP 563 N 0.58 -0.38 1.41 -2.05 3.45 -1.93 0.49 116.42 118.00 1c4z h ASP 563 Ca 0.34 0.25 0.00 0.00 0.43 0.00 0.00 57.03 58.06 1c4z h ASP 563 Cb 0.56 0.43 0.00 0.00 -0.56 0.00 0.00 39.33 39.76 1c4z h ASP 563 CO -0.12 -0.30 0.00 -0.29 -1.57 0.00 0.00 179.24 176.96 1c4z h ILE 564 N 0.05 0.00 -3.45 0.35 2.10 -1.77 -3.48 117.51 111.31 1c4z h ILE 564 Ca 0.56 -0.48 -0.38 0.00 1.08 0.00 0.00 64.86 65.64 1c4z h ILE 564 Cb 1.14 1.45 0.02 0.00 -1.09 0.00 0.00 36.82 38.34 1c4z h ILE 564 CO -0.84 0.00 -0.53 0.61 -1.08 0.00 0.00 178.15 176.31 1c4z n GLY 565 N 1.12 -0.43 0.09 8.18 0.00 0.17 -4.93 105.19 109.38 1c4z n GLY 565 Ca 0.05 -0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.32 0.65 -4.15 1.61 2.81 -1.26 -4.29 117.12 109.17 1c4z n MET 566 Ca -0.17 0.17 -0.15 0.00 -1.81 0.00 0.00 57.70 55.74 1c4z n MET 566 Cb 0.64 -1.71 -0.13 0.00 -0.71 0.00 0.00 33.22 31.31 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 -2.71 0.68 0.05 2.03 0.40 -1.26 -1.39 117.98 115.78 1c4z s PHE 567 Ca -0.06 -0.31 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 1c4z s PHE 567 Cb 0.08 -0.41 -0.04 0.00 0.51 0.00 0.00 43.02 43.16 1c4z s PHE 567 CO 0.83 -0.04 0.09 0.95 0.70 0.00 0.00 175.22 177.75 1c4z s THR 568 N -0.79 4.66 0.11 0.64 -4.23 -0.60 -4.76 115.64 110.67 1c4z s THR 568 Ca -0.03 -0.63 0.05 0.00 -1.18 0.00 0.00 61.69 59.90 1c4z s THR 568 Cb -0.06 -3.21 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 1c4z s THR 568 CO 0.00 0.19 0.02 -0.47 -0.54 0.00 0.00 174.62 173.82 1c4z s TYR 569 N -1.34 3.00 -0.24 3.99 5.04 -1.26 -1.42 117.35 125.12 1c4z s TYR 569 Ca 0.28 -0.03 0.01 0.00 -2.44 0.00 0.00 57.07 54.89 1c4z s TYR 569 Cb -0.12 -1.52 0.04 0.00 0.35 0.00 0.00 41.96 40.71 1c4z s TYR 569 CO 0.20 0.49 -0.12 0.34 -1.34 0.00 0.00 175.55 175.12 1c4z s ASP 570 N -2.48 4.09 0.32 4.32 3.68 -0.90 -4.99 116.67 120.71 1c4z s ASP 570 Ca 0.27 -1.09 0.01 0.00 2.13 0.00 0.00 52.55 53.87 1c4z s ASP 570 Cb -0.11 -1.56 0.55 0.00 -1.45 0.00 0.00 42.92 40.35 1c4z s ASP 570 CO 0.19 -0.13 1.97 -0.33 0.13 0.00 0.00 175.17 177.00 1c4z h GLU 571 N 7.88 0.96 0.53 4.34 4.39 -1.98 0.50 114.58 131.19 1c4z h GLU 571 Ca -0.29 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.33 1c4z h GLU 571 Cb 1.08 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1c4z h GLU 571 CO 0.53 0.63 -0.32 1.03 -1.16 0.00 0.00 179.01 179.72 1c4z h SER 572 N 0.98 -0.81 0.21 1.42 0.87 -1.98 -3.32 113.55 110.92 1c4z h SER 572 Ca 0.30 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 1c4z h SER 572 Cb -0.01 0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1c4z h SER 572 CO -0.08 -0.51 -1.14 0.35 -0.53 0.00 0.00 176.83 174.92 1c4z n THR 573 N -5.46 0.07 -3.21 2.23 -2.24 -1.15 -5.00 114.28 99.51 1c4z n THR 573 Ca -0.12 -0.18 -0.16 0.00 -2.27 0.00 0.00 64.05 61.32 1c4z n THR 573 Cb 0.35 0.47 0.05 0.00 -2.10 0.00 0.00 70.33 69.10 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 -1.81 -5.23 -4.24 -0.78 5.02 0.17 -5.04 118.16 106.26 1c4z n LYS 574 Ca 0.02 0.55 -0.20 0.00 -2.02 0.00 0.00 58.31 56.66 1c4z n LYS 574 Cb 0.41 -4.75 -0.12 0.00 -0.02 0.00 0.00 35.03 30.56 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 -5.16 2.34 0.05 -0.35 1.43 -1.24 -4.80 118.68 110.95 1c4z s LEU 575 Ca 0.38 -0.72 0.02 0.00 -1.03 0.00 0.00 54.13 52.78 1c4z s LEU 575 Cb -0.17 -0.65 -0.04 0.00 0.03 0.00 0.00 46.19 45.37 1c4z s LEU 575 CO 0.48 -0.06 0.07 -0.36 0.23 0.00 0.00 176.35 176.70 1c4z s PHE 576 N -1.62 3.19 0.12 0.29 0.40 0.13 -2.12 117.98 118.38 1c4z s PHE 576 Ca 0.05 0.11 0.04 0.00 -0.60 0.00 0.00 56.93 56.53 1c4z s PHE 576 Cb -0.08 -1.65 -0.04 0.00 0.51 0.00 0.00 43.02 41.76 1c4z s PHE 576 CO 0.03 0.52 -0.10 -0.46 0.70 0.00 0.00 175.22 175.92 1c4z s TRP 577 N -1.30 1.14 0.46 0.36 -0.00 -0.51 -4.26 118.94 114.83 1c4z s TRP 577 Ca 0.26 -0.75 -0.24 0.00 -0.00 0.00 0.00 56.10 55.37 1c4z s TRP 577 Cb -0.12 -0.60 -0.07 0.00 -0.00 0.00 0.00 33.47 32.67 1c4z s TRP 577 CO 0.18 0.02 1.35 -0.06 -0.00 0.00 0.00 176.95 178.45 1c4z s PHE 578 N -3.07 2.54 -0.38 5.86 0.40 -1.26 -1.55 117.98 120.52 1c4z s PHE 578 Ca 0.12 1.35 -0.13 0.00 -0.60 0.00 0.00 56.93 57.68 1c4z s PHE 578 Cb 0.01 -3.78 0.01 0.00 0.51 0.00 0.00 43.02 39.78 1c4z s PHE 578 CO -0.00 -2.59 0.24 1.21 0.70 0.00 0.00 175.22 174.78 1c4z s ASN 579 N -0.75 5.90 0.55 1.36 3.84 -0.48 -4.68 114.94 120.68 1c4z s ASN 579 Ca 0.63 -0.82 0.26 0.00 0.21 0.00 0.00 52.86 53.14 1c4z s ASN 579 Cb -0.40 -2.09 1.47 0.00 -0.55 0.00 0.00 41.25 39.68 1c4z s ASN 579 CO 0.50 -0.37 2.01 -0.65 -2.79 0.00 0.00 177.10 175.81 1c4z h PRO 580 N 8.51 0.00 0.00 0.43 0.11 -1.90 -1.02 132.00 138.13 1c4z h PRO 580 Ca -0.28 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 1c4z h PRO 580 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1c4z h PRO 580 CO 0.68 0.00 -0.08 1.03 -0.21 0.00 0.00 178.00 179.41 1c4z h SER 581 N 0.00 0.00 -1.62 -2.05 0.87 -1.92 -3.46 113.55 105.38 1c4z h SER 581 Ca 0.20 0.00 -0.65 0.00 -1.23 0.00 0.00 61.79 60.11 1c4z h SER 581 Cb 0.87 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1c4z h SER 581 CO -0.00 0.08 1.24 -0.24 -0.53 0.00 0.00 176.83 177.39 1c4z n SER 582 N -3.13 2.82 -4.76 6.23 2.88 -0.39 -4.94 113.62 112.33 1c4z n SER 582 Ca 0.03 0.68 -0.34 0.00 -1.33 0.00 0.00 58.87 57.91 1c4z n SER 582 Cb 0.55 -1.33 -0.08 0.00 -0.75 0.00 0.00 64.21 62.60 1c4z n SER 582 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1c4z s PHE 583 N 5.75 3.30 -1.17 0.66 5.36 -1.26 -4.66 117.98 125.96 1c4z s PHE 583 Ca 1.01 0.27 -0.16 0.00 -0.96 0.00 0.00 56.93 57.09 1c4z s PHE 583 Cb -0.75 -1.80 -0.01 0.00 -0.34 0.00 0.00 43.02 40.12 1c4z s PHE 583 CO 0.50 0.56 0.77 0.39 -1.46 0.00 0.00 175.22 175.98 1c4z n GLU 584 N 1.70 -1.84 -0.37 10.12 -0.58 -1.26 -4.92 120.64 123.49 1c4z n GLU 584 Ca -0.17 0.51 0.01 0.00 -0.42 0.00 0.00 57.16 57.09 1c4z n GLU 584 Cb 0.54 -4.42 0.01 0.00 -0.57 0.00 0.00 31.44 26.99 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 -4.12 0.11 -0.26 2.62 -2.24 -1.26 -4.88 114.28 104.25 1c4z n THR 585 Ca -0.13 -0.13 0.06 0.00 -2.27 0.00 0.00 64.05 61.58 1c4z n THR 585 Cb 0.61 0.56 0.17 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 0.00 0.11 0.43 -0.78 3.07 -1.92 -1.83 114.58 113.65 1c4z h GLU 586 Ca 0.00 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 1c4z h GLU 586 Cb 1.28 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.14 1c4z h GLU 586 CO 0.00 0.07 -0.52 0.78 -1.40 0.00 0.00 179.01 177.95 1c4z h GLY 587 N 0.11 -1.25 0.67 -3.84 0.00 -1.98 -0.74 103.07 96.04 1c4z h GLY 587 Ca 0.43 0.61 0.10 0.00 0.00 0.00 0.00 47.33 48.46 1c4z h GLY 587 CO -0.67 -0.35 0.60 1.46 0.00 0.00 0.00 176.54 177.58 1c4z h GLN 588 N -0.96 0.94 -0.12 4.80 7.50 -1.78 0.88 115.11 126.37 1c4z h GLN 588 Ca -0.05 -0.06 -0.10 0.00 0.50 0.00 0.00 58.65 58.94 1c4z h GLN 588 Cb 0.86 -0.21 -0.01 0.00 0.05 0.00 0.00 27.48 28.16 1c4z h GLN 588 CO -0.11 0.62 -0.38 0.74 -1.50 0.00 0.00 178.83 178.20 1c4z h PHE 589 N 0.97 0.29 0.00 2.96 0.04 -1.20 -2.15 116.94 117.84 1c4z h PHE 589 Ca 0.43 -0.07 -0.06 0.00 2.80 0.00 0.00 57.97 61.07 1c4z h PHE 589 Cb 0.38 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 1c4z h PHE 589 CO -0.00 0.60 -0.27 1.15 -0.60 0.00 0.00 178.31 179.19 1c4z h THR 590 N 0.21 0.70 0.04 -1.55 2.02 0.64 -3.10 112.91 111.88 1c4z h THR 590 Ca 0.02 -1.19 -0.00 0.00 0.77 0.00 0.00 66.41 66.01 1c4z h THR 590 Cb 0.77 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 1c4z h THR 590 CO 0.06 0.27 -0.02 0.25 0.37 0.00 0.00 175.52 176.44 1c4z h LEU 591 N 0.00 -0.05 -1.21 2.58 5.85 -0.39 -2.79 115.31 119.30 1c4z h LEU 591 Ca -0.00 -0.62 0.03 0.00 0.84 0.00 0.00 57.88 58.13 1c4z h LEU 591 Cb 0.74 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.74 1c4z h LEU 591 CO 0.04 0.69 0.54 0.16 -0.34 0.00 0.00 178.44 179.53 1c4z h ILE 592 N -0.90 1.15 -0.29 4.05 3.07 -1.59 0.25 117.51 123.26 1c4z h ILE 592 Ca -0.01 -0.36 0.06 0.00 1.55 0.00 0.00 64.86 66.11 1c4z h ILE 592 Cb 0.66 0.02 -0.06 0.00 -0.27 0.00 0.00 36.82 37.17 1c4z h ILE 592 CO 0.01 0.19 -0.10 1.23 -1.05 0.00 0.00 178.15 178.43 1c4z h GLY 593 N 1.04 0.17 1.01 0.16 0.00 -1.62 0.65 103.07 104.47 1c4z h GLY 593 Ca 0.32 0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.79 1c4z h GLY 593 CO -0.09 -0.13 0.42 -2.22 0.00 0.00 0.00 176.54 174.52 1c4z h ILE 594 N -0.04 1.16 0.15 2.60 2.04 -0.84 -2.39 117.51 120.19 1c4z h ILE 594 Ca 0.14 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1c4z h ILE 594 Cb 0.26 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1c4z h ILE 594 CO -0.32 0.16 -0.15 0.58 0.00 0.00 0.00 178.15 178.42 1c4z h VAL 595 N 0.86 0.67 -0.97 1.67 2.07 0.12 0.48 116.25 121.15 1c4z h VAL 595 Ca 0.23 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.90 1c4z h VAL 595 Cb -0.10 0.67 -0.09 0.00 -1.52 0.00 0.00 31.29 30.25 1c4z h VAL 595 CO -0.05 0.00 0.59 -0.07 0.02 0.00 0.00 177.57 178.06 1c4z h LEU 596 N -0.32 0.81 0.05 2.57 4.07 0.34 0.11 115.31 122.94 1c4z h LEU 596 Ca 0.00 0.07 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 1c4z h LEU 596 Cb 0.31 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1c4z h LEU 596 CO -0.04 0.37 -0.02 1.23 -1.08 0.00 0.00 178.44 178.90 1c4z h GLY 597 N 0.85 -0.06 1.42 0.83 0.00 -0.82 -2.68 103.07 102.61 1c4z h GLY 597 Ca 0.52 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1c4z h GLY 597 CO -0.32 -0.02 0.36 1.41 0.00 0.00 0.00 176.54 177.96 1c4z h LEU 598 N -0.11 0.67 -0.43 3.11 3.38 0.62 -2.78 115.31 119.78 1c4z h LEU 598 Ca -0.01 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1c4z h LEU 598 Cb 0.09 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1c4z h LEU 598 CO 0.01 0.51 0.23 0.00 0.09 0.00 0.00 178.44 179.28 1c4z h ALA 599 N 1.61 0.53 -0.45 1.53 0.00 -0.53 -2.02 119.26 119.94 1c4z h ALA 599 Ca 0.21 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1c4z h ALA 599 Cb -0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1c4z h ALA 599 CO -0.04 -0.12 0.20 0.82 0.00 0.00 0.00 179.25 180.11 1c4z h ILE 600 N 0.46 0.92 0.00 0.00 2.04 -1.25 -2.40 117.51 117.28 1c4z h ILE 600 Ca 0.18 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1c4z h ILE 600 Cb 0.06 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1c4z h ILE 600 CO -0.11 0.07 0.00 1.88 0.00 0.00 0.00 178.15 179.99 1c4z h TYR 601 N 0.40 0.00 -0.12 1.37 -1.99 -1.37 -3.09 116.97 112.18 1c4z h TYR 601 Ca 0.20 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.93 1c4z h TYR 601 Cb 0.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.88 1c4z h TYR 601 CO -0.12 0.00 0.00 0.09 -0.00 0.00 0.00 178.16 178.13 1c4z n ASN 602 N -2.76 2.94 -3.38 3.88 4.13 -0.79 -4.93 115.26 114.35 1c4z n ASN 602 Ca 0.00 -2.93 -0.23 0.00 1.68 0.00 0.00 54.58 53.10 1c4z n ASN 602 Cb 0.23 -0.43 -0.01 0.00 -1.54 0.00 0.00 39.78 38.03 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 -0.92 -3.52 -4.24 6.41 5.15 -0.96 -4.94 115.26 112.24 1c4z n ASN 603 Ca 0.17 -0.39 -0.36 0.00 -0.60 0.00 0.00 54.58 53.39 1c4z n ASN 603 Cb 0.70 -2.93 -0.13 0.00 -0.53 0.00 0.00 39.78 36.89 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 1.35 3.60 0.22 0.00 -4.36 -1.26 -4.59 121.20 116.17 1c4z s ILE 605 Ca -0.02 1.60 0.06 0.00 -0.26 0.00 0.00 60.65 62.03 1c4z s ILE 605 Cb -0.19 -4.01 -0.03 0.00 1.25 0.00 0.00 42.46 39.48 1c4z s ILE 605 CO 0.00 0.37 0.24 -0.76 0.24 0.00 0.00 174.94 175.03 1c4z s LEU 606 N -1.45 4.00 -1.17 0.37 1.43 -0.27 -4.97 118.68 116.63 1c4z s LEU 606 Ca 0.44 -0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 53.41 1c4z s LEU 606 Cb -0.30 -2.56 0.23 0.00 0.03 0.00 0.00 46.19 43.59 1c4z s LEU 606 CO 0.39 -0.01 1.99 -0.67 0.23 0.00 0.00 176.35 178.28 1c4z n ASP 607 N -1.00 7.28 -4.40 2.29 4.64 -1.26 -4.50 116.55 119.59 1c4z n ASP 607 Ca -0.08 -3.40 -0.33 0.00 -1.38 0.00 0.00 54.79 49.60 1c4z n ASP 607 Cb 0.57 -1.28 -0.14 0.00 -1.04 0.00 0.00 41.12 39.22 1c4z n ASP 607 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1c4z s VAL 608 N -2.53 3.07 -0.39 5.18 -7.23 -1.26 -5.05 120.40 112.20 1c4z s VAL 608 Ca 0.44 -0.67 0.04 0.00 -1.81 0.00 0.00 61.98 59.97 1c4z s VAL 608 Cb 0.16 -2.27 0.11 0.00 0.56 0.00 0.00 36.38 34.94 1c4z s VAL 608 CO -0.07 0.54 0.11 -1.00 -0.31 0.00 0.00 175.10 174.37 1c4z s HIS 609 N 0.07 3.41 0.11 2.82 3.76 -1.26 -4.98 115.29 119.22 1c4z s HIS 609 Ca -0.05 -2.95 0.06 0.00 -0.15 0.00 0.00 55.06 51.97 1c4z s HIS 609 Cb -0.15 -2.78 -0.04 0.00 1.11 0.00 0.00 32.58 30.72 1c4z s HIS 609 CO 0.04 -0.88 -0.05 -0.06 -0.85 0.00 0.00 174.74 172.94 1c4z s PHE 610 N 0.62 2.85 0.37 1.40 2.99 -1.26 0.19 117.98 125.14 1c4z s PHE 610 Ca 0.13 -0.10 -0.24 0.00 0.00 0.00 0.00 56.93 56.71 1c4z s PHE 610 Cb -0.21 -1.46 -0.10 0.00 0.00 0.00 0.00 43.02 41.25 1c4z s PHE 610 CO -0.07 0.46 0.99 -1.25 -0.00 0.00 0.00 175.22 175.36 1c4z s PRO 611 N -2.37 4.34 0.57 0.24 0.04 -1.26 -4.90 135.00 131.66 1c4z s PRO 611 Ca 0.24 1.37 0.41 0.00 0.04 0.00 0.00 61.00 63.07 1c4z s PRO 611 Cb -0.11 -2.58 1.52 0.00 0.04 0.00 0.00 34.50 33.37 1c4z s PRO 611 CO 0.16 0.04 1.60 1.98 0.04 0.00 0.00 177.00 180.83 1c4z h MET 612 N 2.67 0.00 -0.54 4.56 4.05 -1.94 -1.62 114.93 122.10 1c4z h MET 612 Ca -0.48 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.00 1c4z h MET 612 Cb 1.20 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.97 1c4z h MET 612 CO 0.63 0.00 0.36 0.28 0.23 0.00 0.00 176.91 178.41 1c4z h VAL 613 N 0.00 1.00 -0.84 -5.77 2.07 -1.90 -2.07 116.25 108.74 1c4z h VAL 613 Ca 0.71 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 68.11 1c4z h VAL 613 Cb 3.06 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 33.21 1c4z h VAL 613 CO -0.01 0.09 0.52 0.58 0.02 0.00 0.00 177.57 178.78 1c4z h VAL 614 N 0.52 1.07 -0.17 2.57 2.07 -1.66 -0.09 116.25 120.55 1c4z h VAL 614 Ca 0.23 -0.33 -0.21 0.00 0.82 0.00 0.00 66.70 67.21 1c4z h VAL 614 Cb 0.26 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1c4z h VAL 614 CO -0.06 0.18 -0.74 1.88 0.02 0.00 0.00 177.57 178.84 1c4z h TYR 615 N 0.97 1.02 -0.61 1.57 0.99 -1.59 -1.79 116.97 117.54 1c4z h TYR 615 Ca 0.36 -0.44 0.01 0.00 2.00 0.00 0.00 58.73 60.66 1c4z h TYR 615 Cb 0.12 -0.16 -0.03 0.00 1.00 0.00 0.00 36.73 37.66 1c4z h TYR 615 CO -0.03 1.26 0.40 0.00 -0.00 0.00 0.00 178.16 179.79 1c4z h ARG 616 N 0.53 0.81 -0.03 4.88 3.08 -1.08 -1.57 114.38 120.99 1c4z h ARG 616 Ca -0.04 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 1c4z h ARG 616 Cb 1.36 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.22 1c4z h ARG 616 CO 0.15 0.54 -0.28 0.87 -1.07 0.00 0.00 179.97 180.18 1c4z h LYS 617 N 0.83 0.06 0.00 0.04 1.57 -1.01 -0.90 116.57 117.15 1c4z h LYS 617 Ca 0.22 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 1c4z h LYS 617 Cb -0.09 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1c4z h LYS 617 CO -0.05 0.33 -0.13 -0.07 -0.57 0.00 0.00 179.45 178.96 1c4z h LEU 618 N 0.05 0.00 -1.95 2.94 3.38 -0.39 -1.51 115.31 117.83 1c4z h LEU 618 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1c4z h LEU 618 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1c4z h LEU 618 CO 0.04 0.13 0.00 0.23 0.09 0.00 0.00 178.44 178.93 1c4z n MET 619 N -3.38 2.24 -0.29 1.13 2.81 -0.42 -4.94 117.12 114.28 1c4z n MET 619 Ca -0.00 -1.92 0.00 0.00 -1.81 0.00 0.00 57.70 53.97 1c4z n MET 619 Cb 0.33 -1.43 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 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 0.68 3.78 3.03 0.00 -0.57 -5.04 105.19 108.44 1c4z n GLY 620 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 4.33 0.49 1.61 1.02 -0.74 -4.97 119.74 120.77 1c4z s LYS 621 Ca 0.00 0.85 -0.22 0.00 0.02 0.00 0.00 55.97 56.62 1c4z s LYS 621 Cb 0.00 -3.28 -0.07 0.00 -0.52 0.00 0.00 37.83 33.96 1c4z s LYS 621 CO 0.00 0.52 1.20 0.15 -0.92 0.00 0.00 175.35 176.30 1c4z s LYS 622 N -0.76 3.59 0.45 1.68 -0.14 -1.26 -3.78 119.74 119.52 1c4z s LYS 622 Ca 0.32 1.86 -0.19 0.00 -1.36 0.00 0.00 55.97 56.60 1c4z s LYS 622 Cb -0.20 -2.34 -0.10 0.00 -1.68 0.00 0.00 37.83 33.51 1c4z s LYS 622 CO 0.20 -0.72 0.94 0.20 -0.76 0.00 0.00 175.35 175.21 1c4z s GLY 623 N -1.31 2.26 0.35 -3.33 0.00 -1.26 -4.94 107.32 99.09 1c4z s GLY 623 Ca 0.66 0.27 0.05 0.00 0.00 0.00 0.00 44.72 45.71 1c4z s GLY 623 CO 0.37 0.54 0.21 -0.51 0.00 0.00 0.00 173.10 173.71 1c4z s THR 624 N -2.32 0.22 0.27 0.90 -4.23 -1.26 -4.60 115.64 104.62 1c4z s THR 624 Ca 0.60 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.10 1c4z s THR 624 Cb -0.09 -2.44 0.30 0.00 1.34 0.00 0.00 72.50 71.61 1c4z s THR 624 CO 0.20 0.00 1.64 0.15 -0.54 0.00 0.00 174.62 176.07 1c4z h PHE 625 N 2.04 0.20 -0.12 3.99 3.57 -1.89 -0.10 116.94 124.63 1c4z h PHE 625 Ca -0.30 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.20 1c4z h PHE 625 Cb 1.25 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 1c4z h PHE 625 CO 1.54 -0.22 -0.19 0.00 -2.23 0.00 0.00 178.31 177.20 1c4z h ARG 626 N 0.17 0.19 -0.14 1.11 3.08 -2.00 -2.56 114.38 114.23 1c4z h ARG 626 Ca 0.50 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.47 1c4z h ARG 626 Cb 0.97 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1c4z h ARG 626 CO -0.67 0.39 -0.08 -0.44 -1.07 0.00 0.00 179.97 178.10 1c4z h ASP 627 N 0.18 0.19 -0.04 7.04 3.32 -1.42 -1.98 116.42 123.70 1c4z h ASP 627 Ca 0.03 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.07 1c4z h ASP 627 Cb 0.45 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1c4z h ASP 627 CO 0.03 0.30 0.13 -0.07 -1.72 0.00 0.00 179.24 177.90 1c4z h LEU 628 N 0.20 0.00 -2.03 1.55 3.38 -1.40 -2.59 115.31 114.42 1c4z h LEU 628 Ca 0.04 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.14 1c4z h LEU 628 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1c4z h LEU 628 CO 0.01 0.00 0.36 1.23 0.09 0.00 0.00 178.44 180.14 1c4z h GLY 629 N 0.00 0.00 0.00 0.83 0.00 -1.51 0.38 103.07 102.77 1c4z h GLY 629 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.13 1c4z h GLY 629 CO -0.00 0.00 -1.84 1.22 0.00 0.00 0.00 176.54 175.92 1c4z n ASP 630 N -4.13 2.31 0.06 0.19 10.43 -0.98 -4.28 116.55 120.14 1c4z n ASP 630 Ca 0.08 -0.03 -0.13 0.00 2.57 0.00 0.00 54.79 57.28 1c4z n ASP 630 Cb 0.56 0.43 -0.14 0.00 1.84 0.00 0.00 41.12 43.81 1c4z n ASP 630 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 1c4z h SER 631 N 0.00 0.25 -1.98 -2.24 4.64 -1.45 -3.41 113.55 109.35 1c4z h SER 631 Ca -0.33 -0.32 -0.55 0.00 -0.47 0.00 0.00 61.79 60.12 1c4z h SER 631 Cb 1.67 -0.08 -0.39 0.00 -0.31 0.00 0.00 62.40 63.29 1c4z h SER 631 CO -0.01 1.26 -1.11 1.41 -0.87 0.00 0.00 176.83 177.51 1c4z n HIS 632 N -3.39 -0.35 -0.23 4.77 8.25 0.13 -5.02 115.22 119.39 1c4z n HIS 632 Ca -0.11 -3.56 -0.12 0.00 -0.26 0.00 0.00 57.72 53.67 1c4z n HIS 632 Cb 1.01 -0.33 -0.09 0.00 1.12 0.00 0.00 29.99 31.70 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 3.90 -0.25 -0.35 -0.41 0.11 -1.73 0.13 132.00 133.40 1c4z h PRO 633 Ca 0.07 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.18 1c4z h PRO 633 Cb 0.89 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 1c4z h PRO 633 CO 0.46 -0.17 0.15 -0.39 -0.21 0.00 0.00 178.00 177.84 1c4z h VAL 634 N -0.26 1.14 -0.34 3.15 -1.51 -1.94 0.13 116.25 116.62 1c4z h VAL 634 Ca 0.12 -0.41 -0.05 0.00 -1.23 0.00 0.00 66.70 65.13 1c4z h VAL 634 Cb 0.54 0.71 -0.01 0.00 -2.13 0.00 0.00 31.29 30.40 1c4z h VAL 634 CO -0.71 0.16 0.03 0.25 -1.23 0.00 0.00 177.57 176.07 1c4z h LEU 635 N 0.49 0.57 -1.35 4.19 6.46 -1.70 -0.74 115.31 123.23 1c4z h LEU 635 Ca 0.12 -0.29 -0.00 0.00 -0.12 0.00 0.00 57.88 57.59 1c4z h LEU 635 Cb 0.09 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 39.84 1c4z h LEU 635 CO -0.01 0.71 0.35 0.22 -0.62 0.00 0.00 178.44 179.09 1c4z h TYR 636 N 0.40 0.77 -0.47 1.25 5.03 0.41 -1.64 116.97 122.71 1c4z h TYR 636 Ca 0.10 0.00 -0.12 0.00 2.58 0.00 0.00 58.73 61.29 1c4z h TYR 636 Cb 0.40 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.42 1c4z h TYR 636 CO 0.03 0.51 -0.20 1.96 -1.32 0.00 0.00 178.16 179.14 1c4z h GLN 637 N 0.81 0.95 0.32 1.82 1.08 -0.16 -2.35 115.11 117.58 1c4z h GLN 637 Ca 0.21 -0.39 -0.02 0.00 -1.45 0.00 0.00 58.65 57.01 1c4z h GLN 637 Cb -0.03 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 1c4z h GLN 637 CO -0.04 1.05 -0.15 0.77 -0.95 0.00 0.00 178.83 179.51 1c4z h SER 638 N 0.82 -0.36 0.22 1.46 0.02 -0.48 -1.90 113.55 113.34 1c4z h SER 638 Ca 0.11 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1c4z h SER 638 Cb 0.76 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 1c4z h SER 638 CO 0.06 -0.13 -0.20 -0.07 -1.14 0.00 0.00 176.83 175.35 1c4z h LEU 639 N -0.59 0.00 0.13 5.07 3.38 -1.37 -0.31 115.31 121.62 1c4z h LEU 639 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1c4z h LEU 639 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1c4z h LEU 639 CO 0.07 0.20 -0.06 0.50 0.09 0.00 0.00 178.44 179.24 1c4z h LYS 640 N 0.00 -0.17 -0.59 1.13 3.64 -1.36 -1.04 116.57 118.19 1c4z h LYS 640 Ca -0.00 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.52 1c4z h LYS 640 Cb 0.37 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.19 1c4z h LYS 640 CO 0.03 0.20 0.40 -0.44 -2.27 0.00 0.00 179.45 177.37 1c4z h ASP 641 N -0.56 0.20 0.09 4.20 3.45 -0.89 0.55 116.42 123.45 1c4z h ASP 641 Ca -0.02 0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.45 1c4z h ASP 641 Cb 0.44 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.18 1c4z h ASP 641 CO 0.03 0.11 -0.04 0.25 -1.57 0.00 0.00 179.24 178.02 1c4z h LEU 642 N 0.22 -0.10 -1.34 1.55 6.46 -0.81 -1.90 115.31 119.38 1c4z h LEU 642 Ca 0.28 -0.46 0.04 0.00 -0.12 0.00 0.00 57.88 57.61 1c4z h LEU 642 Cb 0.80 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.72 1c4z h LEU 642 CO -0.05 0.46 0.47 -0.07 -0.62 0.00 0.00 178.44 178.62 1c4z h LEU 643 N -0.70 0.74 -0.21 2.25 3.38 0.19 -2.09 115.31 118.87 1c4z h LEU 643 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1c4z h LEU 643 Cb 0.55 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1c4z h LEU 643 CO 0.02 0.51 -0.13 -0.62 0.09 0.00 0.00 178.44 178.31 1c4z n GLU 644 N -4.46 0.60 -1.66 1.13 1.02 0.18 -4.90 120.64 112.56 1c4z n GLU 644 Ca 0.09 -0.21 -0.48 0.00 -0.02 0.00 0.00 57.16 56.54 1c4z n GLU 644 Cb 0.13 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.01 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 -1.02 2.13 -0.01 -0.32 9.36 -0.72 -4.87 117.16 121.72 1c4z n TYR 645 Ca 0.13 0.32 -0.04 0.00 3.32 0.00 0.00 57.90 61.63 1c4z n TYR 645 Cb 0.29 -2.51 -0.12 0.00 -0.63 0.00 0.00 39.34 36.36 1c4z n TYR 645 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1c4z n GLU 646 N 3.65 0.64 0.00 2.98 1.02 -1.26 -4.91 120.64 122.76 1c4z n GLU 646 Ca 0.18 0.20 0.00 0.00 -0.02 0.00 0.00 57.16 57.52 1c4z n GLU 646 Cb 0.27 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 1c4z n GLU 646 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c4z n GLY 647 N 1.50 -1.10 3.10 0.62 0.00 -1.26 -5.01 105.19 103.04 1c4z n GLY 647 Ca -0.16 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.47 4.14 1.31 1.61 3.84 -1.26 -5.04 114.94 118.07 1c4z s ASN 648 Ca 0.00 -1.16 -0.16 0.00 0.21 0.00 0.00 52.86 51.75 1c4z s ASN 648 Cb 0.00 -1.55 0.25 0.00 -0.55 0.00 0.00 41.25 39.39 1c4z s ASN 648 CO 0.00 -0.14 0.56 0.52 -2.79 0.00 0.00 177.10 175.25 1c4z n VAL 649 N 4.51 0.00 0.00 -5.21 0.31 -1.26 -1.85 118.33 114.83 1c4z n VAL 649 Ca -0.16 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1c4z n VAL 649 Cb 0.45 -0.65 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 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 -4.45 0.00 0.07 5.55 2.13 -0.97 -3.91 120.64 119.06 1c4z n GLU 650 Ca 0.09 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.84 1c4z n GLU 650 Cb 0.39 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 32.00 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 0.01 0.31 4.31 3.32 -1.89 -3.35 116.42 119.14 1c4z h ASP 651 Ca 0.00 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1c4z h ASP 651 Cb 0.00 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 1c4z h ASP 651 CO 0.00 0.97 -1.70 0.47 -1.72 0.00 0.00 179.24 177.26 1c4z n ASP 652 N -3.40 0.27 -4.24 6.45 8.00 -0.77 -4.98 116.55 117.88 1c4z n ASP 652 Ca -0.00 0.11 -0.21 0.00 0.71 0.00 0.00 54.79 55.39 1c4z n ASP 652 Cb 0.91 1.47 -0.12 0.00 -0.02 0.00 0.00 41.12 43.36 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 -3.43 1.00 -0.77 -1.24 -1.94 -1.26 -5.06 119.30 106.60 1c4z s MET 653 Ca -0.06 -1.09 0.02 0.00 -1.71 0.00 0.00 55.69 52.86 1c4z s MET 653 Cb 0.12 -1.14 0.32 0.00 2.01 0.00 0.00 34.83 36.15 1c4z s MET 653 CO 0.87 0.26 1.26 -0.12 -0.01 0.00 0.00 175.02 177.28 1c4z n MET 654 N 1.11 4.01 -4.35 2.03 1.56 -1.26 -3.96 117.12 116.26 1c4z n MET 654 Ca -0.20 -4.76 -0.23 0.00 -0.27 0.00 0.00 57.70 52.24 1c4z n MET 654 Cb 0.54 -2.34 -0.11 0.00 2.15 0.00 0.00 33.22 33.46 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 -4.12 1.94 0.00 1.12 -4.36 -1.26 -5.11 121.20 109.41 1c4z s ILE 655 Ca 0.44 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 58.88 1c4z s ILE 655 Cb 0.22 -1.91 0.00 0.00 1.25 0.00 0.00 42.46 42.02 1c4z s ILE 655 CO -0.11 -0.27 0.00 0.35 0.24 0.00 0.00 174.94 175.15 1c4z n THR 656 N 0.28 0.00 1.92 8.37 -2.24 -1.26 -2.49 114.28 118.86 1c4z n THR 656 Ca -0.13 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.78 1c4z n THR 656 Cb 0.57 0.00 0.75 0.00 -2.10 0.00 0.00 70.33 69.55 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 0.01 -3.39 4.78 3.01 -1.19 -4.65 117.46 116.03 1c4z n PHE 657 Ca 0.00 -0.01 -0.39 0.00 1.01 0.00 0.00 57.45 58.06 1c4z n PHE 657 Cb 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.38 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 -1.99 4.02 0.32 -1.08 0.74 -1.26 -1.19 119.66 119.22 1c4z s GLN 658 Ca 0.39 0.04 0.10 0.00 0.05 0.00 0.00 55.36 55.95 1c4z s GLN 658 Cb 0.18 -3.66 -0.06 0.00 1.10 0.00 0.00 33.01 30.58 1c4z s GLN 658 CO 0.31 -0.28 -0.12 0.96 -0.55 0.00 0.00 175.29 175.61 1c4z s ILE 659 N 2.07 2.24 0.20 -2.34 -5.25 0.45 -4.93 121.20 113.63 1c4z s ILE 659 Ca 0.15 -2.26 0.06 0.00 -0.99 0.00 0.00 60.65 57.62 1c4z s ILE 659 Cb -0.16 -2.52 -0.04 0.00 2.95 0.00 0.00 42.46 42.70 1c4z s ILE 659 CO 0.10 -0.28 0.13 -0.94 -1.79 0.00 0.00 174.94 172.16 1c4z s SER 660 N -3.56 5.37 -0.20 4.36 1.04 -1.26 -0.83 113.70 118.62 1c4z s SER 660 Ca 0.31 -0.23 -0.03 0.00 0.48 0.00 0.00 55.95 56.49 1c4z s SER 660 Cb 0.00 -1.34 0.06 0.00 0.10 0.00 0.00 66.02 64.84 1c4z s SER 660 CO 0.15 0.04 0.04 -1.10 0.98 0.00 0.00 173.24 173.35 1c4z s GLN 661 N -3.32 0.64 -0.12 4.02 -1.52 -0.96 -4.98 119.66 113.42 1c4z s GLN 661 Ca 0.31 -0.43 -0.06 0.00 -1.95 0.00 0.00 55.36 53.23 1c4z s GLN 661 Cb -0.09 -2.10 -0.04 0.00 -0.22 0.00 0.00 33.01 30.56 1c4z s GLN 661 CO 0.23 -0.65 0.12 0.99 -0.25 0.00 0.00 175.29 175.72 1c4z s THR 662 N 1.86 5.32 0.95 -0.19 2.01 -1.26 -1.74 115.64 122.59 1c4z s THR 662 Ca -0.01 0.14 -0.16 0.00 0.31 0.00 0.00 61.69 61.98 1c4z s THR 662 Cb -0.17 -3.31 0.19 0.00 0.01 0.00 0.00 72.50 69.22 1c4z s THR 662 CO -0.09 0.61 1.31 1.51 -0.69 0.00 0.00 174.62 177.28 1c4z s ASP 663 N -0.95 3.21 0.00 3.53 -4.77 -0.55 -4.91 116.67 112.23 1c4z s ASP 663 Ca 0.14 0.30 0.00 0.00 -3.30 0.00 0.00 52.55 49.69 1c4z s ASP 663 Cb -0.12 -0.37 0.00 0.00 -1.09 0.00 0.00 42.92 41.34 1c4z s ASP 663 CO 0.04 -2.68 0.43 0.00 0.70 0.00 0.00 175.17 173.66 1c4z n LEU 664 N -3.74 0.37 -0.32 2.11 -0.00 -1.26 -2.05 117.00 112.12 1c4z n LEU 664 Ca 0.15 -0.19 0.03 0.00 -0.00 0.00 0.00 56.01 56.00 1c4z n LEU 664 Cb 0.60 -0.19 0.04 0.00 -0.00 0.00 0.00 43.42 43.87 1c4z n LEU 664 CO 0.47 0.09 0.35 0.49 -0.00 0.00 0.00 177.39 178.78 1c4z n PHE 665 N -0.08 0.00 -1.02 1.47 0.99 -1.26 -5.01 117.46 112.55 1c4z n PHE 665 Ca 0.00 -0.29 -0.01 0.00 -0.00 0.00 0.00 57.45 57.15 1c4z n PHE 665 Cb 0.09 -0.07 -0.00 0.00 -1.00 0.00 0.00 39.48 38.50 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 -0.41 0.49 3.54 1.37 0.00 -0.87 -5.00 105.19 104.30 1c4z n GLY 666 Ca 0.04 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.38 6.38 0.08 1.61 -0.87 -1.26 -4.87 114.94 113.63 1c4z s ASN 667 Ca 0.00 -0.16 -0.22 0.00 -1.57 0.00 0.00 52.86 50.91 1c4z s ASN 667 Cb 0.00 -2.36 -0.07 0.00 -0.02 0.00 0.00 41.25 38.81 1c4z s ASN 667 CO 0.00 -0.83 0.67 -2.16 -2.57 0.00 0.00 177.10 172.21 1c4z s PRO 668 N 3.05 4.38 -0.13 -0.60 0.04 -1.26 -1.49 135.00 139.00 1c4z s PRO 668 Ca 0.27 0.91 -0.00 0.00 0.04 0.00 0.00 61.00 62.22 1c4z s PRO 668 Cb -0.13 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.11 1c4z s PRO 668 CO 0.20 0.50 -0.13 1.41 0.04 0.00 0.00 177.00 179.03 1c4z s MET 669 N -0.74 3.35 0.25 4.56 1.75 -0.71 -4.96 119.30 122.80 1c4z s MET 669 Ca 0.33 -0.68 -0.30 0.00 -1.25 0.00 0.00 55.69 53.79 1c4z s MET 669 Cb -0.20 -2.63 -0.09 0.00 2.84 0.00 0.00 34.83 34.75 1c4z s MET 669 CO 0.21 0.23 0.94 -1.64 -0.65 0.00 0.00 175.02 174.12 1c4z s MET 670 N 0.30 4.83 -0.04 4.11 -1.94 -1.26 -2.27 119.30 123.02 1c4z s MET 670 Ca -0.10 1.48 0.01 0.00 -1.71 0.00 0.00 55.69 55.37 1c4z s MET 670 Cb -0.16 -3.23 0.02 0.00 2.01 0.00 0.00 34.83 33.47 1c4z s MET 670 CO 0.05 0.49 -0.05 -0.47 -0.01 0.00 0.00 175.02 175.04 1c4z s TYR 671 N -1.22 0.74 -0.29 -0.03 5.04 -0.01 -5.00 117.35 116.58 1c4z s TYR 671 Ca 0.42 -0.20 -0.14 0.00 -2.44 0.00 0.00 57.07 54.71 1c4z s TYR 671 Cb -0.25 -0.65 -0.03 0.00 0.35 0.00 0.00 41.96 41.38 1c4z s TYR 671 CO 0.31 -0.18 0.30 -0.51 -1.34 0.00 0.00 175.55 174.14 1c4z s ASP 672 N 0.83 6.15 0.02 4.32 -0.00 -1.26 -0.41 116.67 126.32 1c4z s ASP 672 Ca -0.11 0.03 0.22 0.00 -0.00 0.00 0.00 52.55 52.69 1c4z s ASP 672 Cb -0.14 -2.17 0.93 0.00 -0.00 0.00 0.00 42.92 41.54 1c4z s ASP 672 CO 0.00 -0.18 1.70 0.18 -0.00 0.00 0.00 175.17 176.88 1c4z n LEU 673 N 5.24 0.08 -3.62 1.23 4.77 -0.33 -4.80 117.00 119.56 1c4z n LEU 673 Ca -0.11 0.51 -0.12 0.00 -0.03 0.00 0.00 56.01 56.27 1c4z n LEU 673 Cb 0.51 -0.49 -0.05 0.00 -2.33 0.00 0.00 43.42 41.05 1c4z n LEU 673 CO 0.36 -0.15 0.19 -0.75 -1.33 0.00 0.00 177.39 175.71 1c4z s LYS 674 N -3.02 1.02 0.00 3.23 2.20 -1.26 -5.04 119.74 116.87 1c4z s LYS 674 Ca 0.10 -0.50 0.00 0.00 -0.36 0.00 0.00 55.97 55.21 1c4z s LYS 674 Cb 0.14 0.46 0.00 0.00 -1.51 0.00 0.00 37.83 36.92 1c4z s LYS 674 CO 0.41 -0.38 0.02 -1.91 -0.36 0.00 0.00 175.35 173.12 1c4z n GLU 675 N 0.12 0.00 -2.97 4.03 4.07 -1.26 -2.20 120.64 122.44 1c4z n GLU 675 Ca -0.17 0.02 -0.33 0.00 -0.06 0.00 0.00 57.16 56.61 1c4z n GLU 675 Cb 0.62 -0.05 -0.02 0.00 -0.06 0.00 0.00 31.44 31.93 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 -0.32 5.46 -0.33 4.31 4.13 -1.26 -4.89 115.26 122.36 1c4z n ASN 676 Ca 0.00 -3.60 0.06 0.00 1.68 0.00 0.00 54.58 52.73 1c4z n ASN 676 Cb 0.00 -0.86 0.16 0.00 -1.54 0.00 0.00 39.78 37.53 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 3.96 0.78 -0.75 7.41 0.00 -1.74 -0.75 103.07 111.97 1c4z h GLY 677 Ca 0.27 0.26 0.10 0.00 0.00 0.00 0.00 47.33 47.96 1c4z h GLY 677 CO 1.01 -0.38 -0.35 1.22 0.00 0.00 0.00 176.54 178.04 1c4z n ASP 678 N -5.55 -0.60 0.05 0.19 9.92 -1.26 -2.71 116.55 116.58 1c4z n ASP 678 Ca 0.16 1.32 -0.02 0.00 -0.53 0.00 0.00 54.79 55.72 1c4z n ASP 678 Cb 0.52 -0.25 -0.01 0.00 -0.64 0.00 0.00 41.12 40.73 1c4z n ASP 678 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 1c4z h LYS 679 N 0.00 -0.13 -5.38 -1.24 1.63 -1.56 -3.44 116.57 106.45 1c4z h LYS 679 Ca 0.21 0.01 -0.43 0.00 -0.85 0.00 0.00 60.65 59.59 1c4z h LYS 679 Cb 0.40 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.03 1c4z h LYS 679 CO -0.73 -0.08 1.56 1.51 -3.45 0.00 0.00 179.45 178.25 1c4z n ILE 680 N -2.51 -0.05 -1.75 2.00 3.06 -1.10 -4.95 119.36 114.06 1c4z n ILE 680 Ca -0.02 -0.53 -0.32 0.00 -2.50 0.00 0.00 62.75 59.38 1c4z n ILE 680 Cb 0.05 -1.95 0.04 0.00 0.54 0.00 0.00 39.64 38.32 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 8.50 2.91 -0.11 9.51 0.02 -1.26 -3.15 135.00 151.42 1c4z s PRO 681 Ca 1.10 1.22 -0.25 0.00 0.02 0.00 0.00 61.00 63.10 1c4z s PRO 681 Cb -0.51 -1.98 -0.03 0.00 0.02 0.00 0.00 34.50 32.00 1c4z s PRO 681 CO 0.33 -1.14 0.78 0.42 -0.33 0.00 0.00 177.00 177.05 1c4z s ILE 682 N -2.58 4.96 0.41 2.83 1.01 -1.04 -4.91 121.20 121.88 1c4z s ILE 682 Ca 0.63 1.57 0.04 0.00 0.00 0.00 0.00 60.65 62.90 1c4z s ILE 682 Cb -0.17 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.14 1c4z s ILE 682 CO 0.44 0.14 0.04 0.42 0.00 0.00 0.00 174.94 175.99 1c4z s THR 683 N 1.44 1.36 0.33 2.92 -4.23 -1.26 -2.30 115.64 113.90 1c4z s THR 683 Ca 0.39 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.13 1c4z s THR 683 Cb -0.17 -2.64 0.23 0.00 1.34 0.00 0.00 72.50 71.25 1c4z s THR 683 CO 0.16 0.00 1.95 0.78 -0.54 0.00 0.00 174.62 176.97 1c4z h ASN 684 N 1.77 0.00 0.91 3.99 -0.26 -1.96 -2.14 115.58 117.88 1c4z h ASN 684 Ca -0.42 0.00 -0.20 0.00 -0.56 0.00 0.00 56.30 55.12 1c4z h ASN 684 Cb 1.26 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.50 1c4z h ASN 684 CO 0.72 0.21 -0.94 -0.33 -1.06 0.00 0.00 177.43 176.03 1c4z h GLU 685 N 0.00 0.02 -0.33 0.81 3.07 -2.00 -3.35 114.58 112.81 1c4z h GLU 685 Ca -0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1c4z h GLU 685 Cb 0.52 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 1c4z h GLU 685 CO 0.03 0.94 0.00 0.27 -1.40 0.00 0.00 179.01 178.85 1c4z n ASN 686 N -3.44 2.89 0.05 1.42 2.04 -1.07 -4.70 115.26 112.45 1c4z n ASN 686 Ca -0.01 -2.01 -0.01 0.00 -0.44 0.00 0.00 54.58 52.11 1c4z n ASN 686 Cb 0.89 -0.22 0.28 0.00 -2.53 0.00 0.00 39.78 38.20 1c4z n ASN 686 CO 0.00 0.00 0.00 0.08 -0.44 0.00 0.00 177.26 176.90 1c4z h ARG 687 N 1.91 0.39 -0.37 -3.83 0.11 -1.53 -1.04 114.38 110.02 1c4z h ARG 687 Ca 0.00 -0.12 -0.10 0.00 0.10 0.00 0.00 59.98 59.86 1c4z h ARG 687 Cb 0.73 -0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.75 1c4z h ARG 687 CO 0.00 0.56 -0.19 0.87 0.10 0.00 0.00 179.97 181.31 1c4z h LYS 688 N 0.35 0.69 -0.37 0.08 1.57 -1.85 0.20 116.57 117.25 1c4z h LYS 688 Ca 0.06 -0.26 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1c4z h LYS 688 Cb 0.52 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1c4z h LYS 688 CO 0.03 0.84 0.01 1.49 -0.57 0.00 0.00 179.45 181.25 1c4z h GLU 689 N 0.62 0.64 -0.23 3.15 4.81 -1.77 -1.67 114.58 120.13 1c4z h GLU 689 Ca 0.09 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1c4z h GLU 689 Cb 0.66 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 1c4z h GLU 689 CO 0.05 0.74 0.13 0.35 -0.73 0.00 0.00 179.01 179.54 1c4z h PHE 690 N 0.46 0.24 -0.35 0.92 3.57 -0.82 -2.72 116.94 118.25 1c4z h PHE 690 Ca 0.11 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 1c4z h PHE 690 Cb 0.44 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1c4z h PHE 690 CO 0.03 0.14 0.09 0.28 -2.23 0.00 0.00 178.31 176.62 1c4z h VAL 691 N 0.26 1.16 0.00 1.41 2.07 -0.41 -1.07 116.25 119.68 1c4z h VAL 691 Ca 0.09 -0.56 -0.14 0.00 0.82 0.00 0.00 66.70 66.92 1c4z h VAL 691 Cb 0.01 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1c4z h VAL 691 CO -0.05 0.20 -0.66 0.78 0.02 0.00 0.00 177.57 177.86 1c4z h ASN 692 N 0.49 0.00 0.22 0.57 2.35 -1.10 -1.74 115.58 116.38 1c4z h ASN 692 Ca 0.12 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.55 1c4z h ASN 692 Cb 0.18 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.59 1c4z h ASN 692 CO -0.00 0.66 -1.38 -0.07 -1.65 0.00 0.00 177.43 174.99 1c4z h LEU 693 N 0.00 0.85 -1.58 1.61 3.38 -1.18 0.25 115.31 118.63 1c4z h LEU 693 Ca -0.01 -0.85 -0.04 0.00 0.09 0.00 0.00 57.88 57.07 1c4z h LEU 693 Cb 1.19 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1c4z h LEU 693 CO 0.09 1.66 -0.21 0.22 0.09 0.00 0.00 178.44 180.29 1c4z h TYR 694 N 0.20 0.00 0.15 1.13 -0.00 -1.19 0.17 116.97 117.44 1c4z h TYR 694 Ca -0.22 0.00 -0.21 0.00 -0.00 0.00 0.00 58.73 58.30 1c4z h TYR 694 Cb 2.06 0.00 0.02 0.00 -0.00 0.00 0.00 36.73 38.81 1c4z h TYR 694 CO 0.12 0.21 -0.94 0.77 -0.00 0.00 0.00 178.16 178.32 1c4z h SER 695 N 0.00 0.51 -0.16 -2.11 0.02 -1.24 -3.32 113.55 107.25 1c4z h SER 695 Ca -0.00 -0.94 0.00 0.00 -0.84 0.00 0.00 61.79 60.01 1c4z h SER 695 Cb 0.50 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1c4z h SER 695 CO 0.03 1.45 0.10 -0.78 -1.14 0.00 0.00 176.83 176.49 1c4z h ASP 696 N -0.31 0.18 -3.46 3.07 3.58 -0.63 -2.60 116.42 116.25 1c4z h ASP 696 Ca -0.17 -0.01 -0.52 0.00 0.42 0.00 0.00 57.03 56.75 1c4z h ASP 696 Cb 1.72 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 42.73 1c4z h ASP 696 CO 0.16 0.14 0.54 -0.47 -2.88 0.00 0.00 179.24 176.72 1c4z s TYR 697 N -6.16 3.47 0.00 0.28 5.04 0.58 -1.51 117.35 119.05 1c4z s TYR 697 Ca -0.13 1.45 0.00 0.00 -2.44 0.00 0.00 57.07 55.95 1c4z s TYR 697 Cb 0.08 -3.39 0.00 0.00 0.35 0.00 0.00 41.96 39.00 1c4z s TYR 697 CO 0.69 -1.05 0.00 -0.89 -1.34 0.00 0.00 175.55 172.95 1c4z n ILE 698 N 2.67 0.00 0.37 3.14 2.08 -1.26 -4.61 119.36 121.75 1c4z n ILE 698 Ca 0.05 0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.48 1c4z n ILE 698 Cb 0.45 0.00 0.20 0.00 -0.75 0.00 0.00 39.64 39.54 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 -1.43 -3.41 115.31 115.92 1c4z h LEU 699 Ca 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.92 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 0.02 0.00 0.59 -1.08 0.00 0.00 178.44 177.97 1c4z n ASN 700 N -2.61 0.00 -0.21 -0.43 3.02 -0.57 -4.63 115.26 109.83 1c4z n ASN 700 Ca 0.03 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.75 1c4z n ASN 700 Cb 0.49 0.00 0.50 0.00 -0.61 0.00 0.00 39.78 40.16 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 0.42 0.00 3.52 1.57 -1.86 -0.98 116.57 119.23 1c4z h LYS 701 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1c4z h LYS 701 Cb 0.00 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1c4z h LYS 701 CO 0.00 0.28 -0.37 -1.13 -0.57 0.00 0.00 179.45 177.65 1c4z n SER 702 N -4.50 0.76 -0.04 0.86 3.41 -1.26 -3.63 113.62 109.23 1c4z n SER 702 Ca 0.17 0.31 0.04 0.00 -0.26 0.00 0.00 58.87 59.13 1c4z n SER 702 Cb 0.61 -0.23 0.06 0.00 -0.26 0.00 0.00 64.21 64.38 1c4z n SER 702 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1c4z n VAL 703 N -2.19 1.32 -0.11 -3.33 0.24 -0.99 -4.55 118.33 108.72 1c4z n VAL 703 Ca 0.04 -1.48 -0.14 0.00 -2.04 0.00 0.00 64.34 60.73 1c4z n VAL 703 Cb 0.44 0.21 -0.10 0.00 -1.47 0.00 0.00 33.84 32.92 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 0.00 -0.41 -0.86 7.34 4.81 -1.25 0.48 114.58 124.69 1c4z h GLU 704 Ca 0.00 0.03 0.19 0.00 -0.13 0.00 0.00 59.36 59.45 1c4z h GLU 704 Cb 0.73 0.09 -0.12 0.00 0.63 0.00 0.00 28.75 30.08 1c4z h GLU 704 CO 0.00 -0.27 0.36 0.87 -0.73 0.00 0.00 179.01 179.23 1c4z h LYS 705 N -0.42 0.40 0.04 1.92 1.57 -1.87 -0.59 116.57 117.62 1c4z h LYS 705 Ca 0.06 -0.02 -0.27 0.00 -1.87 0.00 0.00 60.65 58.55 1c4z h LYS 705 Cb 0.60 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 1c4z h LYS 705 CO -0.56 0.26 -1.41 -0.56 -0.57 0.00 0.00 179.45 176.61 1c4z h GLN 706 N 0.41 0.08 0.13 3.15 -0.00 -1.67 -3.34 115.11 113.87 1c4z h GLN 706 Ca 0.51 -0.13 -0.01 0.00 -0.00 0.00 0.00 58.65 59.03 1c4z h GLN 706 Cb 0.92 0.05 0.00 0.00 -0.00 0.00 0.00 27.48 28.45 1c4z h GLN 706 CO -0.50 0.86 -0.06 0.35 -0.00 0.00 0.00 178.83 179.48 1c4z h PHE 707 N 0.02 -0.16 -0.71 0.06 3.57 0.59 -2.12 116.94 118.19 1c4z h PHE 707 Ca -0.18 -0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.52 1c4z h PHE 707 Cb 1.93 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 40.69 1c4z h PHE 707 CO 0.02 0.21 0.57 0.87 -2.23 0.00 0.00 178.31 177.75 1c4z h LYS 708 N -0.57 0.00 0.07 1.11 1.57 -1.30 0.13 116.57 117.58 1c4z h LYS 708 Ca -0.02 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 1c4z h LYS 708 Cb 0.45 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.77 1c4z h LYS 708 CO 0.03 0.00 -0.55 0.00 -0.57 0.00 0.00 179.45 178.36 1c4z h ALA 709 N 1.53 -0.02 -0.72 3.86 0.00 -1.65 -1.24 119.26 121.01 1c4z h ALA 709 Ca 0.34 -0.60 0.16 0.00 0.00 0.00 0.00 54.91 54.81 1c4z h ALA 709 Cb 1.47 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 19.20 1c4z h ALA 709 CO -0.00 0.27 0.10 0.35 0.00 0.00 0.00 179.25 179.96 1c4z h PHE 710 N -0.43 0.13 -0.21 0.00 3.04 -0.14 -1.64 116.94 117.69 1c4z h PHE 710 Ca -0.09 0.05 -0.14 0.00 3.98 0.00 0.00 57.97 61.77 1c4z h PHE 710 Cb 1.37 0.05 0.00 0.00 2.56 0.00 0.00 35.95 39.93 1c4z h PHE 710 CO 0.20 -0.15 -0.40 -0.09 -2.02 0.00 0.00 178.31 175.84 1c4z h ARG 711 N 0.19 0.65 -0.74 1.11 2.43 -0.98 -2.27 114.38 114.77 1c4z h ARG 711 Ca 0.40 -0.41 0.12 0.00 -0.81 0.00 0.00 59.98 59.28 1c4z h ARG 711 Cb 0.69 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 30.21 1c4z h ARG 711 CO -0.56 1.03 0.33 -0.09 -1.51 0.00 0.00 179.97 179.17 1c4z h ARG 712 N 0.34 0.51 -0.31 0.20 2.43 -0.48 0.24 114.38 117.31 1c4z h ARG 712 Ca 0.01 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1c4z h ARG 712 Cb 1.01 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.43 1c4z h ARG 712 CO 0.09 0.34 0.09 0.78 -1.51 0.00 0.00 179.97 179.76 1c4z h GLY 713 N 0.52 0.51 1.00 2.80 0.00 -1.22 -0.56 103.07 106.12 1c4z h GLY 713 Ca 0.39 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 1c4z h GLY 713 CO -0.34 0.29 0.19 -2.75 0.00 0.00 0.00 176.54 173.92 1c4z h PHE 714 N 0.34 0.92 -0.05 5.60 3.57 -0.70 -2.69 116.94 123.92 1c4z h PHE 714 Ca 0.10 -0.09 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 1c4z h PHE 714 Cb 0.25 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 1c4z h PHE 714 CO 0.01 0.77 -0.35 1.25 -2.23 0.00 0.00 178.31 177.76 1c4z h HIS 715 N 0.81 0.10 -0.73 0.41 2.76 -0.38 -0.23 115.15 117.88 1c4z h HIS 715 Ca 0.19 -0.02 0.15 0.00 -2.20 0.00 0.00 60.37 58.48 1c4z h HIS 715 Cb 0.27 -0.02 -0.10 0.00 1.55 0.00 0.00 27.41 29.11 1c4z h HIS 715 CO 0.02 0.43 0.23 0.52 -1.30 0.00 0.00 177.93 177.82 1c4z h MET 716 N 0.08 0.33 0.14 5.26 2.86 -0.75 2.03 114.93 124.88 1c4z h MET 716 Ca 0.01 -0.02 -0.26 0.00 -2.06 0.00 0.00 59.70 57.37 1c4z h MET 716 Cb 0.66 -0.07 0.01 0.00 0.06 0.00 0.00 31.60 32.25 1c4z h MET 716 CO 0.05 0.22 -1.26 0.28 1.06 0.00 0.00 176.91 177.26 1c4z h VAL 717 N 0.34 1.19 0.00 -2.22 2.07 -1.56 -3.35 116.25 112.71 1c4z h VAL 717 Ca 0.41 -2.47 -0.05 0.00 0.82 0.00 0.00 66.70 65.40 1c4z h VAL 717 Cb 0.66 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.31 1c4z h VAL 717 CO -0.45 0.72 -0.25 0.74 0.02 0.00 0.00 177.57 178.35 1c4z h THR 718 N -0.27 1.05 0.00 2.57 2.02 -0.45 -3.44 112.91 114.40 1c4z h THR 718 Ca -0.25 -0.89 -0.41 0.00 0.77 0.00 0.00 66.41 65.63 1c4z h THR 718 Cb 1.78 1.50 -0.09 0.00 -1.74 0.00 0.00 68.15 69.59 1c4z h THR 718 CO 0.11 0.24 1.64 -3.20 0.37 0.00 0.00 175.52 174.68 1c4z n ASN 719 N -4.06 -0.20 0.00 4.18 2.85 0.68 -4.25 115.26 114.46 1c4z n ASN 719 Ca -0.02 -0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.42 1c4z n ASN 719 Cb 0.32 -0.72 0.00 0.00 1.24 0.00 0.00 39.78 40.62 1c4z n ASN 719 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1c4z n GLU 720 N 6.78 0.00 -3.53 1.20 1.02 -1.26 -4.96 120.64 119.88 1c4z n GLU 720 Ca 0.59 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 57.53 1c4z n GLU 720 Cb 0.06 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.53 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 0.00 -2.79 -3.50 1.62 3.41 -1.26 -4.94 113.62 106.15 1c4z n SER 721 Ca 0.00 -0.76 -0.23 0.00 -0.26 0.00 0.00 58.87 57.63 1c4z n SER 721 Cb 0.00 -4.54 0.21 0.00 -0.26 0.00 0.00 64.21 59.62 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 -4.03 -3.27 0.12 4.33 -0.04 -1.26 -4.89 135.00 125.95 1c4z n PRO 722 Ca -0.24 -0.97 0.13 0.00 -0.04 0.00 0.00 63.50 62.38 1c4z n PRO 722 Cb 0.66 -1.67 0.40 0.00 -0.04 0.00 0.00 33.50 32.84 1c4z n PRO 722 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1c4z h LEU 723 N -3.06 0.00-10.29 1.53 -0.00 -1.92 -3.43 115.31 98.14 1c4z h LEU 723 Ca -0.32 0.00 -0.49 0.00 -0.00 0.00 0.00 57.88 57.07 1c4z h LEU 723 Cb 1.00 0.00 0.16 0.00 -0.00 0.00 0.00 40.66 41.82 1c4z h LEU 723 CO 0.20 0.00 0.22 -0.75 -0.00 0.00 0.00 178.44 178.11 1c4z s LYS 724 N -3.14 1.06 0.00 1.13 2.20 -1.26 -1.73 119.74 118.00 1c4z s LYS 724 Ca 0.10 1.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.73 1c4z s LYS 724 Cb 0.11 -1.77 0.00 0.00 -1.51 0.00 0.00 37.83 34.66 1c4z s LYS 724 CO 0.58 -2.43 0.00 0.66 -0.36 0.00 0.00 175.35 173.80 1c4z n TYR 725 N -4.04 0.00 -3.64 4.03 0.53 -1.26 -4.97 117.16 107.80 1c4z n TYR 725 Ca 0.08 0.00 -0.26 0.00 -1.02 0.00 0.00 57.90 56.70 1c4z n TYR 725 Cb 0.54 -0.01 -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 0.48 0.00 7.72 1.43 -0.71 -5.08 118.68 122.52 1c4z s LEU 726 Ca 0.00 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 52.54 1c4z s LEU 726 Cb 0.00 -0.30 0.00 0.00 0.03 0.00 0.00 46.19 45.92 1c4z s LEU 726 CO 0.00 -0.33 0.53 0.49 0.23 0.00 0.00 176.35 177.27 1c4z n PHE 727 N 5.24 0.00 -2.88 0.29 3.72 -1.26 -4.82 117.46 117.74 1c4z n PHE 727 Ca -0.07 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.04 1c4z n PHE 727 Cb 0.49 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 38.98 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 -1.12 3.68 0.54 -1.08 3.03 -1.26 -4.98 118.95 117.76 1c4z s ARG 728 Ca 0.00 0.30 0.28 0.00 2.03 0.00 0.00 55.73 58.34 1c4z s ARG 728 Cb 0.00 -2.43 1.54 0.00 -1.03 0.00 0.00 34.95 33.03 1c4z s ARG 728 CO 0.00 -0.04 2.12 -1.35 -1.13 0.00 0.00 175.30 174.89 1c4z h PRO 729 N 1.02 0.00 0.00 3.89 0.11 -1.88 -2.46 132.00 132.68 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 0.09 0.00 0.39 -0.21 0.00 0.00 178.00 178.91 1c4z n GLU 730 N -3.69 0.06 0.02 1.05 4.71 -1.26 -0.34 120.64 121.18 1c4z n GLU 730 Ca -0.02 0.29 -0.07 0.00 -0.01 0.00 0.00 57.16 57.34 1c4z n GLU 730 Cb 0.20 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.01 1c4z n GLU 730 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 1c4z h GLU 731 N 0.00 0.00 -0.16 3.49 5.08 -1.85 -2.77 114.58 118.37 1c4z h GLU 731 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1c4z h GLU 731 Cb 0.11 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.37 1c4z h GLU 731 CO 0.00 0.70 -0.61 0.82 -1.00 0.00 0.00 179.01 178.92 1c4z h ILE 732 N 0.00 1.31 -0.50 3.13 2.04 -0.85 -2.66 117.51 119.98 1c4z h ILE 732 Ca -0.15 -1.85 -0.00 0.00 1.00 0.00 0.00 64.86 63.86 1c4z h ILE 732 Cb 1.87 1.99 -0.02 0.00 -0.74 0.00 0.00 36.82 39.91 1c4z h ILE 732 CO 0.10 0.58 0.30 -0.08 0.00 0.00 0.00 178.15 179.04 1c4z h GLU 733 N 0.40 0.68 -0.53 2.37 4.81 -1.46 -2.53 114.58 118.33 1c4z h GLU 733 Ca -0.03 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1c4z h GLU 733 Cb 1.24 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 30.43 1c4z h GLU 733 CO 0.13 0.50 0.24 -0.07 -0.73 0.00 0.00 179.01 179.08 1c4z h LEU 734 N 0.67 0.31 -1.53 1.64 3.38 -1.46 0.54 115.31 118.85 1c4z h LEU 734 Ca 0.18 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1c4z h LEU 734 Cb 0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1c4z h LEU 734 CO -0.03 0.21 0.14 -0.07 0.09 0.00 0.00 178.44 178.78 1c4z h LEU 735 N 0.46 0.41 0.04 1.67 3.38 -1.20 -0.49 115.31 119.57 1c4z h LEU 735 Ca 0.25 -0.03 -0.29 0.00 0.09 0.00 0.00 57.88 57.90 1c4z h LEU 735 Cb 0.21 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1c4z h LEU 735 CO -0.21 0.36 -1.58 0.40 0.09 0.00 0.00 178.44 177.51 1c4z h ILE 736 N 0.46 1.04 -0.00 1.22 2.04 -0.84 -3.41 117.51 118.01 1c4z h ILE 736 Ca 0.12 -2.80 0.00 0.00 1.00 0.00 0.00 64.86 63.17 1c4z h ILE 736 Cb 0.07 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1c4z h ILE 736 CO -0.01 0.69 -0.54 0.00 0.00 0.00 0.00 178.15 178.28 1c4z n GLY 738 N 1.25 0.25 1.77 0.00 0.00 -0.20 -4.72 105.19 103.54 1c4z n GLY 738 Ca 0.03 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.32 1c4z n GLY 738 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1c4z n SER 739 N -0.66 0.39 -1.63 1.61 3.41 -0.33 -4.73 113.62 111.69 1c4z n SER 739 Ca 0.00 -1.40 -0.13 0.00 -0.26 0.00 0.00 58.87 57.07 1c4z n SER 739 Cb 0.00 -0.36 0.18 0.00 -0.26 0.00 0.00 64.21 63.77 1c4z n SER 739 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1c4z n ARG 740 N -2.02 2.07 -1.84 4.33 1.74 -1.26 -2.06 116.66 117.62 1c4z n ARG 740 Ca 0.08 -3.17 -0.40 0.00 -0.77 0.00 0.00 57.85 53.59 1c4z n ARG 740 Cb 0.27 -1.98 0.01 0.00 -1.02 0.00 0.00 32.46 29.74 1c4z n ARG 740 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1c4z s ASN 741 N -2.11 5.95 -0.27 0.55 3.84 -1.26 -4.93 114.94 116.70 1c4z s ASN 741 Ca 0.50 2.88 0.20 0.00 0.21 0.00 0.00 52.86 56.65 1c4z s ASN 741 Cb 0.44 -2.65 0.50 0.00 -0.55 0.00 0.00 41.25 38.99 1c4z s ASN 741 CO 0.04 -1.12 1.12 0.18 -2.79 0.00 0.00 177.10 174.52 1c4z n LEU 742 N -0.14 2.18 0.00 3.21 4.77 -1.26 -4.50 117.00 121.27 1c4z n LEU 742 Ca 0.05 -3.36 0.00 0.00 -0.03 0.00 0.00 56.01 52.66 1c4z n LEU 742 Cb 0.42 0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 1c4z n LEU 742 CO 0.58 1.25 0.45 -0.67 -1.33 0.00 0.00 177.39 177.67 1c4z n ASP 743 N -0.60 0.00 0.00 -1.43 -0.08 -1.26 -4.74 116.55 108.44 1c4z n ASP 743 Ca 0.14 0.89 0.00 0.00 -1.51 0.00 0.00 54.79 54.31 1c4z n ASP 743 Cb 0.83 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.90 1c4z n ASP 743 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1c4z n PHE 744 N -2.46 0.00 -1.83 -0.67 3.01 -1.26 -4.85 117.46 109.40 1c4z n PHE 744 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 1c4z n PHE 744 Cb 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 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 3.03 0.00 -1.08 -1.52 -1.26 0.27 119.66 119.10 1c4z s GLN 745 Ca 0.00 1.22 0.00 0.00 -1.95 0.00 0.00 55.36 54.63 1c4z s GLN 745 Cb 0.00 -1.99 0.00 0.00 -0.22 0.00 0.00 33.01 30.80 1c4z s GLN 745 CO 0.00 -1.04 0.00 0.00 -0.25 0.00 0.00 175.29 174.00 1c4z n ALA 746 N -2.41 0.00 0.11 6.09 0.00 -1.26 -4.34 120.51 118.70 1c4z n ALA 746 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 1c4z n ALA 746 Cb 0.53 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.13 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 0.13 0.73 0.00 7.12 -1.38 -3.13 115.31 118.78 1c4z h LEU 747 Ca 0.00 -0.07 -0.04 0.00 0.13 0.00 0.00 57.88 57.90 1c4z h LEU 747 Cb 0.00 -0.04 0.01 0.00 -0.53 0.00 0.00 40.66 40.10 1c4z h LEU 747 CO 0.00 0.70 -0.35 -0.08 -0.13 0.00 0.00 178.44 178.58 1c4z h GLU 748 N 0.09 -0.94 -7.29 1.25 4.81 -0.38 -3.33 114.58 108.78 1c4z h GLU 748 Ca -0.01 0.06 -0.46 0.00 -0.13 0.00 0.00 59.36 58.82 1c4z h GLU 748 Cb 1.08 0.21 0.17 0.00 0.63 0.00 0.00 28.75 30.84 1c4z h GLU 748 CO 0.09 -0.61 0.17 -1.21 -0.73 0.00 0.00 179.01 176.72 1c4z s GLU 749 N -5.04 0.43 0.00 1.92 2.02 -1.18 -2.22 118.70 114.63 1c4z s GLU 749 Ca -0.16 0.77 0.00 0.00 0.02 0.00 0.00 54.97 55.60 1c4z s GLU 749 Cb 0.02 -1.72 0.00 0.00 0.10 0.00 0.00 34.13 32.53 1c4z s GLU 749 CO 0.49 -2.79 0.00 0.25 0.02 0.00 0.00 175.26 173.22 1c4z n THR 750 N -4.26 0.00 -3.07 3.63 -2.24 -1.26 -4.65 114.28 102.43 1c4z n THR 750 Ca 0.06 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.44 1c4z n THR 750 Cb 0.55 -0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.62 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 -2.04 4.60 0.39 4.28 2.01 -0.94 -4.32 115.64 119.61 1c4z s THR 751 Ca 0.00 1.53 0.08 0.00 0.31 0.00 0.00 61.69 63.61 1c4z s THR 751 Cb 0.00 -4.06 -0.06 0.00 0.01 0.00 0.00 72.50 68.39 1c4z s THR 751 CO 0.00 0.48 0.10 -1.61 -0.69 0.00 0.00 174.62 172.90 1c4z s GLU 752 N -0.77 2.14 0.11 4.92 0.41 -0.52 -5.01 118.70 119.99 1c4z s GLU 752 Ca 0.34 -1.86 0.03 0.00 -0.41 0.00 0.00 54.97 53.08 1c4z s GLU 752 Cb -0.21 -1.91 -0.04 0.00 -1.78 0.00 0.00 34.13 30.19 1c4z s GLU 752 CO 0.23 -0.03 -0.09 0.71 -0.49 0.00 0.00 175.26 175.59 1c4z s TYR 753 N -2.59 1.07 0.05 1.61 1.51 -1.26 -0.78 117.35 116.95 1c4z s TYR 753 Ca 0.38 -0.76 -0.10 0.00 -1.01 0.00 0.00 57.07 55.58 1c4z s TYR 753 Cb 0.04 -0.58 0.01 0.00 -0.11 0.00 0.00 41.96 41.32 1c4z s TYR 753 CO 0.21 -0.02 0.22 0.34 -1.11 0.00 0.00 175.55 175.19 1c4z s ASP 754 N -2.83 0.00 0.00 2.29 2.15 -0.85 -4.82 116.67 112.61 1c4z s ASP 754 Ca 0.11 -0.36 0.00 0.00 0.43 0.00 0.00 52.55 52.73 1c4z s ASP 754 Cb 0.01 0.31 0.00 0.00 -0.30 0.00 0.00 42.92 42.94 1c4z s ASP 754 CO -0.01 -0.59 0.00 0.61 -0.17 0.00 0.00 175.17 175.00 1c4z n GLY 755 N 0.56 0.76 0.75 2.66 0.00 -1.26 -0.96 105.19 107.69 1c4z n GLY 755 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.26 1.23 0.04 -0.02 0.00 -1.26 -4.55 105.19 98.37 1c4z n GLY 756 Ca 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 -3.26 1.61 0.05 -1.89 -3.51 116.97 109.97 1c4z h TYR 757 Ca 0.00 0.00 0.20 0.00 0.05 0.00 0.00 58.73 58.98 1c4z h TYR 757 Cb 0.28 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 37.91 1c4z h TYR 757 CO 0.00 0.00 -1.06 0.25 -1.05 0.00 0.00 178.16 176.30 1c4z n THR 758 N -3.61 -1.55 -0.29 -2.88 -2.24 -1.26 -4.46 114.28 97.98 1c4z n THR 758 Ca -0.03 1.05 0.05 0.00 -2.27 0.00 0.00 64.05 62.85 1c4z n THR 758 Cb 0.13 -1.65 0.12 0.00 -2.10 0.00 0.00 70.33 66.83 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 -3.51 -0.07 -3.01 -0.78 0.63 -1.26 -3.80 116.66 104.85 1c4z n ARG 759 Ca -0.05 1.28 -0.43 0.00 -0.92 0.00 0.00 57.85 57.72 1c4z n ARG 759 Cb 0.55 -1.92 -0.06 0.00 0.45 0.00 0.00 32.46 31.49 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 -5.20 6.35 -0.29 6.15 1.11 -1.26 -4.62 116.67 118.91 1c4z s ASP 760 Ca -0.12 -0.31 -0.20 0.00 0.18 0.00 0.00 52.55 52.10 1c4z s ASP 760 Cb 0.22 -2.36 0.16 0.00 1.07 0.00 0.00 42.92 42.01 1c4z s ASP 760 CO 0.64 -0.92 1.15 -0.44 1.18 0.00 0.00 175.17 176.78 1c4z s SER 761 N 2.26 -0.30 0.16 0.27 0.01 -1.25 -5.01 113.70 109.84 1c4z s SER 761 Ca 0.26 0.52 -0.24 0.00 1.31 0.00 0.00 55.95 57.81 1c4z s SER 761 Cb -0.14 0.84 0.05 0.00 0.21 0.00 0.00 66.02 66.99 1c4z s SER 761 CO 0.20 -0.09 1.59 0.58 0.41 0.00 0.00 173.24 175.94 1c4z h VAL 762 N 4.22 0.21 -0.75 3.43 2.07 -1.94 0.16 116.25 123.66 1c4z h VAL 762 Ca -0.28 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1c4z h VAL 762 Cb 1.18 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1c4z h VAL 762 CO 0.18 0.00 0.37 0.25 0.02 0.00 0.00 177.57 178.38 1c4z h LEU 763 N -0.27 0.98 0.82 2.57 7.12 -1.97 -0.31 115.31 124.24 1c4z h LEU 763 Ca 0.16 -0.13 -0.04 0.00 0.13 0.00 0.00 57.88 58.00 1c4z h LEU 763 Cb 0.55 -0.25 0.01 0.00 -0.53 0.00 0.00 40.66 40.43 1c4z h LEU 763 CO -0.54 0.83 -0.39 0.40 -0.13 0.00 0.00 178.44 178.61 1c4z h ILE 764 N 1.05 0.10 -1.00 4.05 1.08 -1.69 0.33 117.51 121.42 1c4z h ILE 764 Ca 0.26 -0.14 0.10 0.00 -0.39 0.00 0.00 64.86 64.69 1c4z h ILE 764 Cb 0.11 0.11 -0.08 0.00 -3.07 0.00 0.00 36.82 33.90 1c4z h ILE 764 CO -0.03 0.01 0.64 0.03 -0.69 0.00 0.00 178.15 178.10 1c4z h ARG 765 N -1.22 1.03 -0.94 2.37 3.08 -0.98 0.49 114.38 118.21 1c4z h ARG 765 Ca -0.11 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 59.89 1c4z h ARG 765 Cb 0.85 -0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.62 1c4z h ARG 765 CO 0.18 0.68 0.63 0.93 -1.07 0.00 0.00 179.97 181.32 1c4z h GLU 766 N 1.06 1.24 0.66 0.04 5.08 -0.84 -0.17 114.58 121.65 1c4z h GLU 766 Ca 0.48 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.74 1c4z h GLU 766 Cb 0.38 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1c4z h GLU 766 CO -0.23 0.82 -0.46 0.35 -1.00 0.00 0.00 179.01 178.49 1c4z h PHE 767 N 1.28 -1.24 -0.59 4.33 3.04 0.39 -0.98 116.94 123.17 1c4z h PHE 767 Ca 0.35 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.34 1c4z h PHE 767 Cb -0.14 0.45 -0.05 0.00 2.56 0.00 0.00 35.95 38.77 1c4z h PHE 767 CO -0.01 -0.67 0.31 -1.49 -2.02 0.00 0.00 178.31 174.44 1c4z h TRP 768 N -1.07 0.57 -0.61 0.41 4.06 -0.68 0.97 115.95 119.59 1c4z h TRP 768 Ca -0.08 0.02 0.09 0.00 2.06 0.00 0.00 58.89 60.98 1c4z h TRP 768 Cb 0.88 -0.17 -0.04 0.00 -1.00 0.00 0.00 29.16 28.83 1c4z h TRP 768 CO -0.14 0.27 0.41 0.93 -3.56 0.00 0.00 178.44 176.35 1c4z h GLU 769 N 0.59 0.47 -0.03 0.49 5.08 -0.88 -1.67 114.58 118.63 1c4z h GLU 769 Ca 0.27 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.56 1c4z h GLU 769 Cb 0.17 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1c4z h GLU 769 CO -0.18 0.31 -0.14 0.82 -1.00 0.00 0.00 179.01 178.83 1c4z h ILE 770 N 0.49 1.48 -0.49 3.13 2.04 0.49 -3.26 117.51 121.40 1c4z h ILE 770 Ca 0.28 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 1c4z h ILE 770 Cb 0.45 2.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.97 1c4z h ILE 770 CO -0.08 0.44 0.26 0.58 0.00 0.00 0.00 178.15 179.35 1c4z h VAL 771 N -0.43 1.18 -0.65 1.67 2.07 -0.39 -3.01 116.25 116.68 1c4z h VAL 771 Ca -0.01 -0.46 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 1c4z h VAL 771 Cb 0.79 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1c4z h VAL 771 CO 0.03 0.19 0.23 0.45 0.02 0.00 0.00 177.57 178.49 1c4z h HIS 772 N 0.64 1.03 0.00 1.57 3.86 -1.46 -1.31 115.15 119.48 1c4z h HIS 772 Ca 0.17 -0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1c4z h HIS 772 Cb 0.07 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.24 1c4z h HIS 772 CO -0.02 0.82 0.00 -1.13 0.86 0.00 0.00 177.93 178.47 1c4z n SER 773 N -4.38 0.00 -4.66 2.45 3.41 -1.18 -4.80 113.62 104.46 1c4z n SER 773 Ca 0.04 -0.66 -0.30 0.00 -0.26 0.00 0.00 58.87 57.70 1c4z n SER 773 Cb 0.20 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.00 1.96 -0.24 7.33 0.08 -0.50 -5.00 117.98 119.61 1c4z s PHE 774 Ca 0.26 1.35 -0.11 0.00 0.12 0.00 0.00 56.93 58.55 1c4z s PHE 774 Cb 0.12 -3.18 -0.05 0.00 -0.57 0.00 0.00 43.02 39.34 1c4z s PHE 774 CO 0.20 -2.81 0.16 0.95 -0.10 0.00 0.00 175.22 173.62 1c4z s THR 775 N -2.77 5.36 0.00 0.64 -4.23 -1.26 -4.83 115.64 108.55 1c4z s THR 775 Ca 0.65 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 61.34 1c4z s THR 775 Cb -0.20 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.13 1c4z s THR 775 CO 0.59 0.34 0.00 0.47 -0.54 0.00 0.00 174.62 175.48 1c4z n ASP 776 N 4.33 0.00 -0.30 3.99 9.92 -1.26 0.43 116.55 133.66 1c4z n ASP 776 Ca -0.15 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.09 1c4z n ASP 776 Cb 0.52 0.00 0.13 0.00 -0.64 0.00 0.00 41.12 41.13 1c4z n ASP 776 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 1c4z h GLU 777 N 0.00 1.18 0.48 -1.24 4.81 -1.99 0.30 114.58 118.12 1c4z h GLU 777 Ca 0.00 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1c4z h GLU 777 Cb 0.00 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.14 1c4z h GLU 777 CO 0.00 0.84 -0.23 1.96 -0.73 0.00 0.00 179.01 180.85 1c4z h GLN 778 N 1.20 -0.62 -1.05 1.92 4.20 0.84 -1.04 115.11 120.55 1c4z h GLN 778 Ca 0.31 0.04 0.32 0.00 0.06 0.00 0.00 58.65 59.38 1c4z h GLN 778 Cb -0.02 0.14 -0.13 0.00 0.30 0.00 0.00 27.48 27.77 1c4z h GLN 778 CO -0.05 -0.32 0.63 0.87 -0.67 0.00 0.00 178.83 179.29 1c4z h LYS 779 N -1.00 0.32 -0.02 1.46 1.57 -1.20 1.37 116.57 119.08 1c4z h LYS 779 Ca -0.07 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 1c4z h LYS 779 Cb 0.59 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 1c4z h LYS 779 CO 0.11 0.21 -0.72 0.00 -0.57 0.00 0.00 179.45 178.48 1c4z h ARG 780 N 0.33 0.10 -0.03 3.15 3.08 -0.79 -2.77 114.38 117.44 1c4z h ARG 780 Ca 0.72 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 60.55 1c4z h ARG 780 Cb 1.73 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.79 1c4z h ARG 780 CO -0.52 0.78 -0.55 -0.07 -1.07 0.00 0.00 179.97 178.54 1c4z h LEU 781 N 0.07 0.10 -1.12 3.04 3.38 0.30 -0.37 115.31 120.71 1c4z h LEU 781 Ca -0.02 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1c4z h LEU 781 Cb 1.28 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1c4z h LEU 781 CO 0.10 0.64 -0.43 0.15 0.09 0.00 0.00 178.44 178.99 1c4z h PHE 782 N 0.07 0.00 0.05 1.13 3.04 -0.29 -2.34 116.94 118.60 1c4z h PHE 782 Ca -0.00 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.94 1c4z h PHE 782 Cb 1.00 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.51 1c4z h PHE 782 CO 0.01 0.43 -0.02 -0.07 -2.02 0.00 0.00 178.31 176.63 1c4z h LEU 783 N 0.00 -0.06 -1.11 0.59 3.38 -1.17 -2.36 115.31 114.58 1c4z h LEU 783 Ca -0.00 -0.61 0.34 0.00 0.09 0.00 0.00 57.88 57.70 1c4z h LEU 783 Cb 0.79 0.01 -0.14 0.00 0.09 0.00 0.00 40.66 41.41 1c4z h LEU 783 CO 0.06 0.66 0.63 -0.61 0.09 0.00 0.00 178.44 179.26 1c4z h GLN 784 N -0.85 0.26 0.17 1.13 5.75 -1.02 0.07 115.11 120.63 1c4z h GLN 784 Ca -0.01 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 1c4z h GLN 784 Cb 0.66 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.15 1c4z h GLN 784 CO 0.01 0.17 -0.08 0.35 -2.65 0.00 0.00 178.83 176.63 1c4z h PHE 785 N 0.27 -0.22 0.65 3.99 3.57 -1.45 -3.37 116.94 120.38 1c4z h PHE 785 Ca 0.74 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 62.21 1c4z h PHE 785 Cb 1.85 0.07 0.01 0.00 2.79 0.00 0.00 35.95 40.67 1c4z h PHE 785 CO -0.01 -0.14 -0.31 1.15 -2.23 0.00 0.00 178.31 176.77 1c4z h THR 786 N -0.84 0.00 -3.51 4.41 2.02 -1.07 -3.44 112.91 110.49 1c4z h THR 786 Ca -0.02 -0.16 -0.47 0.00 0.77 0.00 0.00 66.41 66.53 1c4z h THR 786 Cb 0.18 0.00 0.05 0.00 -1.74 0.00 0.00 68.15 66.64 1c4z h THR 786 CO 0.04 0.00 0.14 0.42 0.37 0.00 0.00 175.52 176.49 1c4z s THR 787 N -4.60 3.53 -0.46 3.16 -4.23 -0.02 -3.56 115.64 109.45 1c4z s THR 787 Ca -0.13 -0.11 0.22 0.00 -1.18 0.00 0.00 61.69 60.49 1c4z s THR 787 Cb 0.01 -3.39 0.22 0.00 1.34 0.00 0.00 72.50 70.68 1c4z s THR 787 CO 0.38 -0.39 1.66 0.61 -0.54 0.00 0.00 174.62 176.35 1c4z n GLY 788 N -2.55 -1.13 3.39 3.99 0.00 -1.26 -4.22 105.19 103.42 1c4z n GLY 788 Ca 0.05 0.10 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.35 0.03 -2.16 2.61 -1.32 -1.26 -4.86 115.64 105.33 1c4z s THR 789 Ca 0.03 -1.55 0.18 0.00 -1.21 0.00 0.00 61.69 59.13 1c4z s THR 789 Cb 0.08 -2.14 0.43 0.00 -1.51 0.00 0.00 72.50 69.37 1c4z s THR 789 CO 0.32 -0.12 1.52 -0.90 -2.21 0.00 0.00 174.62 173.24 1c4z n ASP 790 N -0.29 1.21 -5.00 8.08 5.75 -1.26 -3.24 116.55 121.81 1c4z n ASP 790 Ca -0.03 -1.69 -0.20 0.00 -0.01 0.00 0.00 54.79 52.86 1c4z n ASP 790 Cb 0.63 -0.09 0.04 0.00 -1.03 0.00 0.00 41.12 40.67 1c4z n ASP 790 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1c4z s ARG 791 N -1.82 2.40 -0.04 0.11 0.52 -1.26 -4.86 118.95 113.99 1c4z s ARG 791 Ca 0.28 -1.64 0.06 0.00 -0.52 0.00 0.00 55.73 53.91 1c4z s ARG 791 Cb 0.15 -2.55 -0.02 0.00 0.52 0.00 0.00 34.95 33.04 1c4z s ARG 791 CO 0.22 -0.68 -0.20 0.00 0.02 0.00 0.00 175.30 174.66 1c4z s ALA 792 N -2.62 2.39 1.00 2.13 0.00 -0.88 -4.92 121.76 118.86 1c4z s ALA 792 Ca 0.55 -1.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.32 1c4z s ALA 792 Cb -0.06 -0.77 0.19 0.00 0.00 0.00 0.00 23.12 22.49 1c4z s ALA 792 CO 0.34 0.52 1.16 -2.14 0.00 0.00 0.00 175.76 175.64 1c4z s PRO 793 N -0.57 0.40 0.04 0.00 0.02 -1.26 -1.18 135.00 132.45 1c4z s PRO 793 Ca 0.08 0.07 -0.30 0.00 0.02 0.00 0.00 61.00 60.87 1c4z s PRO 793 Cb -0.11 -1.77 -0.07 0.00 0.02 0.00 0.00 34.50 32.56 1c4z s PRO 793 CO 0.00 -2.66 1.60 0.08 -0.33 0.00 0.00 177.00 175.69 1c4z s VAL 794 N -3.31 3.23 0.00 3.83 1.01 -1.26 -2.00 120.40 121.90 1c4z s VAL 794 Ca 0.68 0.64 0.00 0.00 0.00 0.00 0.00 61.98 63.30 1c4z s VAL 794 Cb -0.12 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1c4z s VAL 794 CO 0.54 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1c4z n GLY 795 N 3.93 0.83 0.00 4.51 0.00 -1.26 -4.92 105.19 108.27 1c4z n GLY 795 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.74 -1.21 0.37 -0.02 0.00 -0.85 -4.29 105.19 98.46 1c4z n GLY 796 Ca 0.00 -1.61 0.08 0.00 0.00 0.00 0.00 46.02 44.49 1c4z n GLY 796 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1c4z h LEU 797 N 0.00 0.87 -1.75 0.99 3.38 -1.88 -1.65 115.31 115.27 1c4z h LEU 797 Ca 0.00 0.04 0.29 0.00 0.09 0.00 0.00 57.88 58.30 1c4z h LEU 797 Cb 0.00 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1c4z h LEU 797 CO 0.00 0.47 0.89 1.23 0.09 0.00 0.00 178.44 181.12 1c4z h GLY 798 N 0.94 0.00 1.49 0.83 0.00 -1.78 1.59 103.07 106.13 1c4z h GLY 798 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1c4z h GLY 798 CO -0.24 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.58 1c4z n LYS 799 N -3.77 0.43 0.02 4.80 4.76 -0.62 -3.46 118.16 120.31 1c4z n LYS 799 Ca 0.22 0.04 0.14 0.00 -2.87 0.00 0.00 58.31 55.83 1c4z n LYS 799 Cb 1.22 -1.50 0.58 0.00 -1.84 0.00 0.00 35.03 33.49 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 -1.25 0.13 -4.05 -0.35 4.77 0.54 -4.95 117.00 111.85 1c4z n LEU 800 Ca 0.13 0.51 -0.40 0.00 -0.03 0.00 0.00 56.01 56.22 1c4z n LEU 800 Cb 0.19 -0.47 0.01 0.00 -2.33 0.00 0.00 43.42 40.82 1c4z n LEU 800 CO 0.19 -0.03 -0.17 0.29 -1.33 0.00 0.00 177.39 176.34 1c4z n LYS 801 N -1.62 -0.35 -1.41 3.23 5.02 -1.22 -4.88 118.16 116.92 1c4z n LYS 801 Ca 0.07 -0.02 -0.34 0.00 -2.02 0.00 0.00 58.31 56.00 1c4z n LYS 801 Cb 0.35 -2.05 0.09 0.00 -0.02 0.00 0.00 35.03 33.41 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 -7.15 2.15 -0.04 1.97 1.75 -1.26 -4.82 119.30 111.90 1c4z s MET 802 Ca 0.40 1.65 0.02 0.00 -1.25 0.00 0.00 55.69 56.51 1c4z s MET 802 Cb -0.22 -1.85 0.01 0.00 2.84 0.00 0.00 34.83 35.61 1c4z s MET 802 CO 0.85 -1.80 -0.08 0.42 -0.65 0.00 0.00 175.02 173.75 1c4z s ILE 803 N -2.15 0.76 -0.28 10.11 1.01 -0.51 -1.44 121.20 128.69 1c4z s ILE 803 Ca 0.72 -0.29 -0.01 0.00 0.00 0.00 0.00 60.65 61.07 1c4z s ILE 803 Cb -0.26 -0.71 0.05 0.00 0.01 0.00 0.00 42.46 41.54 1c4z s ILE 803 CO 0.46 0.26 -0.03 -0.63 0.00 0.00 0.00 174.94 175.00 1c4z s ILE 804 N 0.55 2.81 0.16 2.92 1.01 0.04 -0.02 121.20 128.69 1c4z s ILE 804 Ca -0.09 -1.36 0.08 0.00 0.00 0.00 0.00 60.65 59.28 1c4z s ILE 804 Cb -0.12 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 1c4z s ILE 804 CO 0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 174.94 174.84 1c4z s ALA 805 N 1.24 3.00 0.02 9.38 0.00 -0.40 -2.00 121.76 133.00 1c4z s ALA 805 Ca -0.05 -1.40 -0.30 0.00 0.00 0.00 0.00 51.96 50.20 1c4z s ALA 805 Cb -0.19 -0.82 -0.05 0.00 0.00 0.00 0.00 23.12 22.06 1c4z s ALA 805 CO -0.02 0.51 1.21 0.21 0.00 0.00 0.00 175.76 177.66 1c4z s LYS 806 N -2.73 4.40 -0.60 0.00 2.20 -0.14 -1.09 119.74 121.78 1c4z s LYS 806 Ca 0.25 1.74 0.06 0.00 -0.36 0.00 0.00 55.97 57.65 1c4z s LYS 806 Cb -0.09 -3.43 0.30 0.00 -1.51 0.00 0.00 37.83 33.09 1c4z s LYS 806 CO 0.16 -0.33 0.86 -1.71 -0.36 0.00 0.00 175.35 173.96 1c4z n ASN 807 N 4.42 4.14 0.00 1.43 5.15 -1.07 -4.84 115.26 124.49 1c4z n ASN 807 Ca 0.10 -3.57 0.00 0.00 -0.60 0.00 0.00 54.58 50.50 1c4z n ASN 807 Cb 0.46 -0.61 0.00 0.00 -0.53 0.00 0.00 39.78 39.10 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 0.25 -1.35 2.95 8.20 0.00 -1.26 -4.33 105.19 109.64 1c4z n GLY 808 Ca 0.30 -1.59 -0.24 0.00 0.00 0.00 0.00 46.02 44.50 1c4z n GLY 808 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1c4z n PRO 809 N -1.69 -1.95 -1.56 1.61 -0.04 -1.26 -1.92 135.00 128.19 1c4z n PRO 809 Ca 0.00 -1.52 -0.44 0.00 -0.04 0.00 0.00 63.50 61.49 1c4z n PRO 809 Cb 0.00 -1.22 -0.01 0.00 -0.04 0.00 0.00 33.50 32.23 1c4z n PRO 809 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1c4z n ASP 810 N -4.13 0.86 -1.13 3.54 2.03 -1.11 -4.24 116.55 112.37 1c4z n ASP 810 Ca 0.13 1.15 -0.01 0.00 0.52 0.00 0.00 54.79 56.58 1c4z n ASP 810 Cb 0.47 -1.24 0.00 0.00 -0.72 0.00 0.00 41.12 39.63 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 0.07 0.00 0.22 5.18 -2.24 -1.26 -4.97 114.28 111.28 1c4z n THR 811 Ca 0.11 -0.08 0.06 0.00 -2.27 0.00 0.00 64.05 61.87 1c4z n THR 811 Cb 0.32 0.07 0.10 0.00 -2.10 0.00 0.00 70.33 68.72 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 -0.04 1.58 -2.43 -0.78 4.71 -1.26 -4.98 120.64 117.44 1c4z n GLU 812 Ca -0.00 -1.59 -0.32 0.00 -0.01 0.00 0.00 57.16 55.23 1c4z n GLU 812 Cb 0.04 -1.26 -0.03 0.00 -1.01 0.00 0.00 31.44 29.18 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 -1.01 3.91 0.41 3.49 0.52 -1.26 -5.06 118.95 119.95 1c4z s ARG 813 Ca 0.19 1.03 -0.09 0.00 -0.52 0.00 0.00 55.73 56.34 1c4z s ARG 813 Cb 0.11 -2.13 -0.06 0.00 0.52 0.00 0.00 34.95 33.40 1c4z s ARG 813 CO 0.16 -0.31 0.76 -0.51 0.02 0.00 0.00 175.30 175.43 1c4z s LEU 814 N -3.95 3.81 0.84 2.53 1.43 -1.26 -4.96 118.68 117.11 1c4z s LEU 814 Ca 0.60 1.08 -0.11 0.00 -1.03 0.00 0.00 54.13 54.68 1c4z s LEU 814 Cb -0.11 -3.97 0.10 0.00 0.03 0.00 0.00 46.19 42.23 1c4z s LEU 814 CO 0.28 -0.42 1.10 -2.16 0.23 0.00 0.00 176.35 175.38 1c4z s PRO 815 N -3.97 1.71 0.29 1.29 0.04 -1.26 -4.94 135.00 128.16 1c4z s PRO 815 Ca 0.50 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.68 1c4z s PRO 815 Cb -0.10 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 1c4z s PRO 815 CO 0.33 -2.01 0.18 0.95 0.04 0.00 0.00 177.00 176.49 1c4z s THR 816 N -2.87 0.22 0.16 1.26 -4.23 -0.87 -4.96 115.64 104.36 1c4z s THR 816 Ca 0.63 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 59.04 1c4z s THR 816 Cb -0.18 -2.50 -0.00 0.00 1.34 0.00 0.00 72.50 71.15 1c4z s THR 816 CO 0.57 0.00 0.30 -0.94 -0.54 0.00 0.00 174.62 174.01 1c4z s SER 817 N -3.34 0.01 -0.49 3.99 1.04 -1.26 0.45 113.70 114.10 1c4z s SER 817 Ca 0.37 -0.82 0.03 0.00 0.48 0.00 0.00 55.95 56.01 1c4z s SER 817 Cb 0.05 0.44 0.13 0.00 0.10 0.00 0.00 66.02 66.75 1c4z s SER 817 CO 0.18 -0.90 0.26 -1.00 0.98 0.00 0.00 173.24 172.76 1c4z s HIS 818 N -3.95 2.58 0.46 5.02 3.76 -0.80 -4.99 115.29 117.37 1c4z s HIS 818 Ca 0.16 -2.81 0.18 0.00 -0.15 0.00 0.00 55.06 52.44 1c4z s HIS 818 Cb 0.03 -2.34 1.15 0.00 1.11 0.00 0.00 32.58 32.53 1c4z s HIS 818 CO -0.01 -0.75 1.97 1.79 -0.85 0.00 0.00 174.74 176.89 1c4z h THR 819 N 5.32 0.83 0.00 1.30 1.35 -1.82 0.11 112.91 120.00 1c4z h THR 819 Ca -0.03 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 1c4z h THR 819 Cb 0.90 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 1c4z h THR 819 CO 0.59 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 175.91 1c4z n PHE 821 N -2.16 0.08 -4.11 0.00 3.01 0.29 -4.30 117.46 110.27 1c4z n PHE 821 Ca 0.02 -0.26 -0.28 0.00 1.01 0.00 0.00 57.45 57.94 1c4z n PHE 821 Cb 0.21 -0.02 -0.05 0.00 -0.01 0.00 0.00 39.48 39.61 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 0.00 -0.04 -4.48 4.37 3.02 -0.55 -4.66 115.26 112.92 1c4z n ASN 822 Ca 0.03 -1.11 -0.34 0.00 -0.03 0.00 0.00 54.58 53.13 1c4z n ASN 822 Cb 0.20 -2.48 -0.12 0.00 -0.61 0.00 0.00 39.78 36.77 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 -4.07 3.82 -0.21 2.41 1.01 -1.06 -1.43 120.40 120.87 1c4z s VAL 823 Ca 0.06 -0.38 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 1c4z s VAL 823 Cb -0.03 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1c4z s VAL 823 CO 0.93 0.49 0.01 -0.22 0.00 0.00 0.00 175.10 176.31 1c4z s LEU 824 N 0.40 3.24 -0.50 3.92 1.98 0.98 -1.91 118.68 126.79 1c4z s LEU 824 Ca -0.04 -0.23 -0.18 0.00 -2.89 0.00 0.00 54.13 50.79 1c4z s LEU 824 Cb -0.14 -1.83 0.06 0.00 0.66 0.00 0.00 46.19 44.94 1c4z s LEU 824 CO 0.03 0.04 0.55 -0.76 -1.89 0.00 0.00 176.35 174.32 1c4z s LEU 825 N 1.17 5.21 -0.32 -0.68 1.43 0.17 -1.27 118.68 124.39 1c4z s LEU 825 Ca 0.03 -1.07 -0.08 0.00 -1.03 0.00 0.00 54.13 51.98 1c4z s LEU 825 Cb -0.14 -2.35 0.01 0.00 0.03 0.00 0.00 46.19 43.74 1c4z s LEU 825 CO 0.01 -0.81 0.12 -0.76 0.23 0.00 0.00 176.35 175.14 1c4z s LEU 826 N 2.29 4.12 0.44 1.79 1.43 -0.25 -2.04 118.68 126.46 1c4z s LEU 826 Ca 0.11 -0.78 -0.25 0.00 -1.03 0.00 0.00 54.13 52.19 1c4z s LEU 826 Cb -0.21 -1.93 -0.08 0.00 0.03 0.00 0.00 46.19 44.00 1c4z s LEU 826 CO 0.10 -0.25 1.27 -2.84 0.23 0.00 0.00 176.35 174.86 1c4z s PRO 827 N 1.52 3.79 -1.45 1.29 0.02 -1.26 -2.59 135.00 136.31 1c4z s PRO 827 Ca 0.02 2.06 -0.13 0.00 0.02 0.00 0.00 61.00 62.97 1c4z s PRO 827 Cb -0.18 -2.59 0.04 0.00 0.02 0.00 0.00 34.50 31.80 1c4z s PRO 827 CO 0.04 -0.61 2.26 -1.91 -0.33 0.00 0.00 177.00 176.46 1c4z n GLU 828 N -0.21 3.08 -0.65 5.54 2.13 -0.81 -4.90 120.64 124.82 1c4z n GLU 828 Ca 0.06 -2.70 -0.32 0.00 0.66 0.00 0.00 57.16 54.86 1c4z n GLU 828 Cb 0.45 -3.18 0.18 0.00 0.27 0.00 0.00 31.44 29.17 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 5.45 -1.39 0.29 4.31 4.02 -1.26 -2.75 117.16 125.82 1c4z n TYR 829 Ca 0.53 0.10 0.12 0.00 -0.01 0.00 0.00 57.90 58.64 1c4z n TYR 829 Cb 0.37 -1.60 0.25 0.00 -0.02 0.00 0.00 39.34 38.34 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 -2.17 3.34 -3.71 7.72 3.41 -1.26 -4.80 113.62 116.16 1c4z n SER 830 Ca 0.01 -1.97 -0.12 0.00 -0.26 0.00 0.00 58.87 56.54 1c4z n SER 830 Cb 0.60 -0.29 -0.10 0.00 -0.26 0.00 0.00 64.21 64.17 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 -1.38 -0.51 0.34 4.04 0.15 -1.26 -5.00 113.70 110.08 1c4z s SER 831 Ca 0.40 0.92 0.02 0.00 0.70 0.00 0.00 55.95 57.99 1c4z s SER 831 Cb 0.23 0.87 0.63 0.00 -1.71 0.00 0.00 66.02 66.03 1c4z s SER 831 CO 0.31 -0.18 1.99 0.50 1.20 0.00 0.00 173.24 177.07 1c4z h LYS 832 N 6.28 0.86 -0.14 5.44 3.64 -1.97 0.25 116.57 130.92 1c4z h LYS 832 Ca -0.32 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 58.95 1c4z h LYS 832 Cb 1.18 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1c4z h LYS 832 CO 0.25 0.57 -0.20 0.93 -2.27 0.00 0.00 179.45 178.73 1c4z h GLU 833 N 0.88 0.24 0.07 1.90 3.07 -2.00 -2.00 114.58 116.75 1c4z h GLU 833 Ca 0.26 -0.07 -0.26 0.00 -0.50 0.00 0.00 59.36 58.79 1c4z h GLU 833 Cb -0.03 -0.03 0.01 0.00 -0.84 0.00 0.00 28.75 27.87 1c4z h GLU 833 CO -0.07 0.44 -1.12 -0.22 -1.40 0.00 0.00 179.01 176.65 1c4z h LYS 834 N 0.22 0.46 0.44 2.33 3.64 -1.39 -2.58 116.57 119.68 1c4z h LYS 834 Ca 0.04 -0.59 -0.01 0.00 -1.27 0.00 0.00 60.65 58.82 1c4z h LYS 834 Cb 0.49 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1c4z h LYS 834 CO 0.03 1.23 -0.32 1.25 -2.27 0.00 0.00 179.45 179.37 1c4z h LEU 835 N 0.21 -0.83 -1.34 5.20 6.46 -0.18 0.23 115.31 125.06 1c4z h LEU 835 Ca -0.13 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.68 1c4z h LEU 835 Cb 1.79 0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 41.95 1c4z h LEU 835 CO 0.20 -0.48 0.30 0.50 -0.62 0.00 0.00 178.44 178.34 1c4z h LYS 836 N -0.75 0.75 -0.00 1.25 3.64 -1.46 0.15 116.57 120.15 1c4z h LYS 836 Ca -0.04 -0.07 -0.21 0.00 -1.27 0.00 0.00 60.65 59.06 1c4z h LYS 836 Cb 0.63 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1c4z h LYS 836 CO 0.01 0.55 -0.89 1.49 -2.27 0.00 0.00 179.45 178.34 1c4z h GLU 837 N 0.76 0.30 0.05 1.90 4.22 -1.16 -1.88 114.58 118.77 1c4z h GLU 837 Ca 0.20 -0.32 -0.08 0.00 0.08 0.00 0.00 59.36 59.23 1c4z h GLU 837 Cb 0.02 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.37 1c4z h GLU 837 CO -0.03 1.02 -0.36 0.00 -2.18 0.00 0.00 179.01 177.45 1c4z h ARG 838 N 0.17 0.16 -1.00 1.92 2.47 -0.78 -2.80 114.38 114.52 1c4z h ARG 838 Ca -0.06 -0.24 0.05 0.00 -1.26 0.00 0.00 59.98 58.48 1c4z h ARG 838 Cb 1.51 0.08 -0.06 0.00 -1.65 0.00 0.00 29.97 29.85 1c4z h ARG 838 CO 0.14 1.06 0.65 1.25 0.56 0.00 0.00 179.97 183.64 1c4z h LEU 839 N -0.63 1.06 -0.23 3.04 6.46 -0.78 -0.90 115.31 123.33 1c4z h LEU 839 Ca -0.06 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.66 1c4z h LEU 839 Cb 1.23 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 1c4z h LEU 839 CO 0.07 0.70 -0.01 -0.07 -0.62 0.00 0.00 178.44 178.50 1c4z h LEU 840 N 1.21 0.41 -0.95 2.25 3.38 -1.42 -1.17 115.31 119.04 1c4z h LEU 840 Ca 0.42 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1c4z h LEU 840 Cb 0.10 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1c4z h LEU 840 CO -0.15 0.63 0.00 0.50 0.09 0.00 0.00 178.44 179.51 1c4z h LYS 841 N 0.18 0.00 0.00 1.13 3.64 -1.15 0.44 116.57 120.81 1c4z h LYS 841 Ca 0.06 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 1c4z h LYS 841 Cb 0.43 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1c4z h LYS 841 CO 0.01 0.00 -0.40 0.00 -2.27 0.00 0.00 179.45 176.79 1c4z h ALA 842 N 2.19 0.08 0.00 5.00 0.00 -0.72 -2.56 119.26 123.25 1c4z h ALA 842 Ca 0.00 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.27 1c4z h ALA 842 Cb 0.30 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1c4z h ALA 842 CO 0.00 0.24 -0.01 -0.84 0.00 0.00 0.00 179.25 178.64 1c4z h ILE 843 N -1.00 0.03 0.04 0.00 3.07 -1.03 -3.13 117.51 115.49 1c4z h ILE 843 Ca -0.10 -0.71 -0.30 0.00 1.55 0.00 0.00 64.86 65.30 1c4z h ILE 843 Cb 0.91 1.69 -0.04 0.00 -0.27 0.00 0.00 36.82 39.12 1c4z h ILE 843 CO -0.06 0.01 -1.67 0.00 -1.05 0.00 0.00 178.15 175.39 1c4z h THR 844 N 0.00 0.94 0.53 0.16 1.03 -1.05 -3.36 112.91 111.16 1c4z h THR 844 Ca -0.00 -2.72 -0.03 0.00 -0.01 0.00 0.00 66.41 63.65 1c4z h THR 844 Cb 0.69 2.53 0.01 0.00 -1.07 0.00 0.00 68.15 70.31 1c4z h THR 844 CO 0.00 0.66 -0.25 0.22 -0.01 0.00 0.00 175.52 176.14 1c4z h TYR 845 N 0.02 -0.66 0.00 0.00 3.20 -1.45 -3.50 116.97 114.59 1c4z h TYR 845 Ca -0.28 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.58 1c4z h TYR 845 Cb 2.00 0.22 0.00 0.00 1.54 0.00 0.00 36.73 40.48 1c4z h TYR 845 CO 0.02 -0.40 0.00 0.00 -1.64 0.00 0.00 178.16 176.14