#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z4r n GLY 497 N 0.00 1.31 3.31 5.00 0.00 -1.26 -4.99 105.19 108.55 1z4r n GLY 497 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1z4r n GLY 497 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1z4r s ILE 498 N -3.77 1.00 0.49 -0.61 -4.36 -1.26 -4.89 121.20 107.80 1z4r s ILE 498 Ca 0.00 -2.03 -0.22 0.00 -0.26 0.00 0.00 60.65 58.14 1z4r s ILE 498 Cb 0.00 -2.28 -0.07 0.00 1.25 0.00 0.00 42.46 41.36 1z4r s ILE 498 CO 0.00 -0.37 1.15 0.27 0.24 0.00 0.00 174.94 176.23 1z4r s ILE 499 N -3.45 3.15 0.03 8.37 -4.36 -1.26 -4.30 121.20 119.38 1z4r s ILE 499 Ca 0.27 0.80 0.01 0.00 -0.26 0.00 0.00 60.65 61.48 1z4r s ILE 499 Cb 0.05 -3.38 -0.02 0.00 1.25 0.00 0.00 42.46 40.37 1z4r s ILE 499 CO 0.08 -0.07 -0.05 -1.61 0.24 0.00 0.00 174.94 173.52 1z4r s GLU 500 N -2.92 0.41 -0.16 0.37 2.02 0.76 -4.98 118.70 114.21 1z4r s GLU 500 Ca 0.67 -0.59 -0.04 0.00 0.02 0.00 0.00 54.97 55.03 1z4r s GLU 500 Cb -0.27 -0.17 -0.03 0.00 0.10 0.00 0.00 34.13 33.77 1z4r s GLU 500 CO 0.31 0.02 -0.01 -0.06 0.02 0.00 0.00 175.26 175.55 1z4r s PHE 501 N -1.14 3.08 -0.04 1.61 0.08 -1.26 -1.07 117.98 119.25 1z4r s PHE 501 Ca -0.09 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.77 1z4r s PHE 501 Cb -0.08 -1.98 0.03 0.00 -0.57 0.00 0.00 43.02 40.42 1z4r s PHE 501 CO -0.00 0.04 -0.01 -1.01 -0.10 0.00 0.00 175.22 174.14 1z4r s HIS 502 N 0.30 0.46 -0.37 0.36 3.76 -0.57 -4.98 115.29 114.24 1z4r s HIS 502 Ca -0.02 -0.06 -0.19 0.00 -0.15 0.00 0.00 55.06 54.64 1z4r s HIS 502 Cb -0.14 -0.52 0.00 0.00 1.11 0.00 0.00 32.58 33.04 1z4r s HIS 502 CO 0.02 -0.17 0.55 0.08 -0.85 0.00 0.00 174.74 174.38 1z4r s VAL 503 N 1.14 4.96 0.34 -0.90 1.01 -1.26 0.11 120.40 125.80 1z4r s VAL 503 Ca -0.08 0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.21 1z4r s VAL 503 Cb -0.14 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 1z4r s VAL 503 CO -0.02 -0.32 0.11 2.30 0.00 0.00 0.00 175.10 177.17 1z4r n ILE 504 N 5.54 0.00 -3.52 2.22 -5.35 -0.01 -4.95 119.36 113.29 1z4r n ILE 504 Ca -0.04 -1.92 0.00 0.00 -0.27 0.00 0.00 62.75 60.53 1z4r n ILE 504 Cb 0.48 0.66 0.00 0.00 -1.74 0.00 0.00 39.64 39.05 1z4r n ILE 504 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1z4r n GLY 505 N -0.16 -1.56 3.35 3.28 0.00 -1.26 -0.73 105.19 108.11 1z4r n GLY 505 Ca -0.06 -1.23 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 1z4r n GLY 505 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1z4r s ASN 506 N -3.54 5.33 0.23 1.61 2.47 -1.26 -4.97 114.94 114.81 1z4r s ASN 506 Ca 0.00 -0.81 0.12 0.00 0.42 0.00 0.00 52.86 52.59 1z4r s ASN 506 Cb 0.00 -1.92 0.01 0.00 -1.45 0.00 0.00 41.25 37.88 1z4r s ASN 506 CO 0.00 -0.25 1.40 0.77 -3.72 0.00 0.00 177.10 175.30 1z4r h SER 507 N 8.28 0.00 0.00 -4.21 4.64 -1.93 -3.24 113.55 117.10 1z4r h SER 507 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1z4r h SER 507 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1z4r h SER 507 CO 0.62 0.68 0.00 -0.11 -0.87 0.00 0.00 176.83 177.14 1z4r n LEU 508 N -3.30 -3.31 -3.91 5.97 7.94 -1.26 -4.89 117.00 114.24 1z4r n LEU 508 Ca 0.01 0.75 -0.17 0.00 -1.11 0.00 0.00 56.01 55.50 1z4r n LEU 508 Cb 0.79 3.15 -0.15 0.00 0.53 0.00 0.00 43.42 47.74 1z4r n LEU 508 CO 0.43 0.09 -0.40 0.28 -1.11 0.00 0.00 177.39 176.68 1z4r s THR 509 N -2.00 0.38 -2.00 1.96 -1.32 -1.26 -4.97 115.64 106.42 1z4r s THR 509 Ca 0.00 -0.13 0.30 0.00 -1.21 0.00 0.00 61.69 60.65 1z4r s THR 509 Cb 0.00 -0.37 0.85 0.00 -1.51 0.00 0.00 72.50 71.47 1z4r s THR 509 CO 0.00 0.14 2.12 -0.81 -2.21 0.00 0.00 174.62 173.87 1z4r n PRO 510 N 3.45 0.96 0.18 7.08 -0.04 -1.26 -3.78 135.00 141.58 1z4r n PRO 510 Ca -0.19 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.40 1z4r n PRO 510 Cb 0.55 -1.49 0.24 0.00 -0.04 0.00 0.00 33.50 32.76 1z4r n PRO 510 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1z4r h LYS 511 N 0.00 0.00 -0.51 0.54 2.10 -2.01 -3.36 116.57 113.33 1z4r h LYS 511 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 1z4r h LYS 511 Cb 0.00 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.31 1z4r h LYS 511 CO 0.00 0.00 0.23 0.00 -2.00 0.00 0.00 179.45 177.68 1z4r h ALA 512 N 2.17 0.66 -3.63 0.07 0.00 -2.03 -3.38 119.26 113.11 1z4r h ALA 512 Ca 0.00 -0.13 -0.67 0.00 0.00 0.00 0.00 54.91 54.11 1z4r h ALA 512 Cb 0.92 -0.20 -0.38 0.00 0.00 0.00 0.00 17.79 18.13 1z4r h ALA 512 CO 0.00 0.24 -0.71 1.21 0.00 0.00 0.00 179.25 179.99 1z4r s ASN 513 N -5.93 4.78 0.34 0.00 3.84 -1.26 -4.98 114.94 111.74 1z4r s ASN 513 Ca -0.13 -1.90 0.08 0.00 0.21 0.00 0.00 52.86 51.13 1z4r s ASN 513 Cb 0.12 -1.65 0.63 0.00 -0.55 0.00 0.00 41.25 39.79 1z4r s ASN 513 CO 0.77 -0.35 1.82 0.03 -2.79 0.00 0.00 177.10 176.57 1z4r h ARG 514 N 7.75 0.24 -0.25 0.43 2.47 -1.82 -0.87 114.38 122.32 1z4r h ARG 514 Ca -0.10 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.53 1z4r h ARG 514 Cb 1.03 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.32 1z4r h ARG 514 CO 0.54 0.49 0.12 -0.09 0.56 0.00 0.00 179.97 181.58 1z4r h ARG 515 N 0.22 0.37 -0.49 0.04 9.65 -1.95 0.23 114.38 122.45 1z4r h ARG 515 Ca 0.03 -0.06 -0.10 0.00 -1.10 0.00 0.00 59.98 58.75 1z4r h ARG 515 Cb 0.58 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.08 1z4r h ARG 515 CO 0.04 0.37 -0.11 0.28 2.80 0.00 0.00 179.97 183.36 1z4r h VAL 516 N 0.28 1.26 -0.53 0.20 2.07 -1.89 -2.00 116.25 115.64 1z4r h VAL 516 Ca 0.09 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.39 1z4r h VAL 516 Cb 0.13 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1z4r h VAL 516 CO -0.01 0.42 0.33 0.25 0.02 0.00 0.00 177.57 178.59 1z4r h LEU 517 N 0.81 0.63 -1.09 2.57 5.85 -0.86 0.14 115.31 123.35 1z4r h LEU 517 Ca 0.13 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1z4r h LEU 517 Cb 0.63 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1z4r h LEU 517 CO 0.04 0.48 0.34 -0.07 -0.34 0.00 0.00 178.44 178.89 1z4r h LEU 518 N 0.72 0.88 -0.51 2.25 3.38 -0.70 -0.72 115.31 120.61 1z4r h LEU 518 Ca 0.19 -0.09 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 1z4r h LEU 518 Cb -0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1z4r h LEU 518 CO -0.04 0.74 -0.50 -0.50 0.09 0.00 0.00 178.44 178.23 1z4r h TRP 519 N 0.98 0.78 -0.64 1.13 6.55 -0.75 -1.10 115.95 122.92 1z4r h TRP 519 Ca 0.24 -0.26 -0.08 0.00 0.95 0.00 0.00 58.89 59.74 1z4r h TRP 519 Cb 0.09 -0.15 -0.02 0.00 -0.86 0.00 0.00 29.16 28.21 1z4r h TRP 519 CO 0.01 1.01 0.08 -0.07 -1.05 0.00 0.00 178.44 178.41 1z4r h LEU 520 N 0.50 1.03 -0.70 -4.49 3.38 -0.10 0.17 115.31 115.10 1z4r h LEU 520 Ca 0.02 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.62 1z4r h LEU 520 Cb 1.05 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1z4r h LEU 520 CO 0.10 1.05 -0.07 0.58 0.09 0.00 0.00 178.44 180.19 1z4r h VAL 521 N 0.98 1.26 -0.81 1.22 2.07 -1.07 0.40 116.25 120.31 1z4r h VAL 521 Ca 0.19 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.49 1z4r h VAL 521 Cb 0.47 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1z4r h VAL 521 CO 0.02 0.42 0.37 1.23 0.02 0.00 0.00 177.57 179.62 1z4r h GLY 522 N 0.97 1.26 0.89 2.17 0.00 -0.63 -0.56 103.07 107.17 1z4r h GLY 522 Ca 0.14 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 1z4r h GLY 522 CO 0.04 0.61 -0.02 1.41 0.00 0.00 0.00 176.54 178.58 1z4r h LEU 523 N 1.15 0.54 -0.58 3.11 3.38 -0.31 -0.82 115.31 121.79 1z4r h LEU 523 Ca 0.27 -0.32 0.08 0.00 0.09 0.00 0.00 57.88 58.00 1z4r h LEU 523 Cb 0.15 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 1z4r h LEU 523 CO -0.03 0.74 0.25 -0.61 0.09 0.00 0.00 178.44 178.87 1z4r h GLN 524 N 0.34 0.44 -0.35 1.13 4.15 -0.60 0.29 115.11 120.51 1z4r h GLN 524 Ca 0.08 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 1z4r h GLN 524 Cb 0.47 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 1z4r h GLN 524 CO 0.02 0.29 -0.06 -0.91 -1.93 0.00 0.00 178.83 176.25 1z4r h ASN 525 N 0.46 0.66 -0.33 -0.69 2.35 -0.90 -0.03 115.58 117.10 1z4r h ASN 525 Ca 0.28 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1z4r h ASN 525 Cb 0.29 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 1z4r h ASN 525 CO -0.25 0.85 0.14 0.58 -1.65 0.00 0.00 177.43 177.10 1z4r h VAL 526 N 0.46 1.18 -0.50 2.81 2.07 -0.70 -0.33 116.25 121.25 1z4r h VAL 526 Ca 0.09 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.07 1z4r h VAL 526 Cb 0.55 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1z4r h VAL 526 CO 0.03 0.20 0.32 -0.26 0.02 0.00 0.00 177.57 177.88 1z4r h PHE 527 N 0.39 0.61 -0.62 1.57 0.04 -0.35 -0.78 116.94 117.79 1z4r h PHE 527 Ca 0.11 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 1z4r h PHE 527 Cb 0.18 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 1z4r h PHE 527 CO -0.01 0.37 0.35 1.03 -0.60 0.00 0.00 178.31 179.46 1z4r h SER 528 N 0.65 0.77 -0.55 2.17 0.87 -0.73 0.14 113.55 116.87 1z4r h SER 528 Ca 0.19 -0.08 -0.11 0.00 -1.23 0.00 0.00 61.79 60.56 1z4r h SER 528 Cb -0.05 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.70 1z4r h SER 528 CO -0.06 0.63 -0.09 0.45 -0.53 0.00 0.00 176.83 177.24 1z4r h HIS 529 N 0.85 1.15 -0.00 2.24 3.86 -0.71 -2.94 115.15 119.59 1z4r h HIS 529 Ca 0.22 -0.23 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1z4r h HIS 529 Cb 0.02 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.21 1z4r h HIS 529 CO -0.01 1.05 -0.40 1.04 0.86 0.00 0.00 177.93 180.47 1z4r n GLN 530 N -4.17 0.21 -3.11 2.45 1.13 -0.33 -4.14 117.38 109.42 1z4r n GLN 530 Ca 0.02 -0.11 -0.24 0.00 -1.94 0.00 0.00 57.00 54.72 1z4r n GLN 530 Cb 0.39 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 29.20 1z4r n GLN 530 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1z4r n LEU 531 N -1.30 2.92 0.21 1.08 4.77 0.47 -4.95 117.00 120.20 1z4r n LEU 531 Ca 0.07 -5.36 0.18 0.00 -0.03 0.00 0.00 56.01 50.87 1z4r n LEU 531 Cb 0.34 -0.09 0.84 0.00 -2.33 0.00 0.00 43.42 42.18 1z4r n LEU 531 CO 0.32 2.27 1.15 1.55 -1.33 0.00 0.00 177.39 181.35 1z4r h PRO 532 N 3.25 0.00 -0.01 3.23 0.13 -1.68 -1.36 132.00 135.57 1z4r h PRO 532 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1z4r h PRO 532 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1z4r h PRO 532 CO 0.70 0.00 -0.09 0.54 -0.23 0.00 0.00 178.00 178.92 1z4r n ARG 533 N -3.62 0.96 -3.51 0.86 1.74 -1.26 -4.80 116.66 107.02 1z4r n ARG 533 Ca 0.02 -0.38 -0.37 0.00 -0.77 0.00 0.00 57.85 56.35 1z4r n ARG 533 Cb 0.37 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.24 1z4r n ARG 533 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1z4r s MET 534 N -2.30 4.20 0.21 5.56 -1.94 -0.51 -5.04 119.30 119.47 1z4r s MET 534 Ca 0.33 0.07 -0.32 0.00 -1.71 0.00 0.00 55.69 54.06 1z4r s MET 534 Cb 0.20 -3.48 -0.13 0.00 2.01 0.00 0.00 34.83 33.43 1z4r s MET 534 CO 0.43 0.12 1.49 -2.30 -0.01 0.00 0.00 175.02 174.76 1z4r n PRO 535 N 3.98 2.13 -0.25 2.03 -0.02 -1.26 -4.87 135.00 136.73 1z4r n PRO 535 Ca -0.11 0.76 -0.02 0.00 -2.02 0.00 0.00 63.50 62.11 1z4r n PRO 535 Cb 0.52 -2.48 0.16 0.00 -0.02 0.00 0.00 33.50 31.68 1z4r n PRO 535 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1z4r h LYS 536 N 4.99 1.08 -0.50 -0.52 3.64 -1.94 -1.54 116.57 121.79 1z4r h LYS 536 Ca -0.45 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 58.76 1z4r h LYS 536 Cb 1.26 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.85 1z4r h LYS 536 CO 0.82 0.80 0.13 1.49 -2.27 0.00 0.00 179.45 180.42 1z4r h GLU 537 N 1.08 0.75 -0.29 1.90 4.81 -1.99 -0.85 114.58 119.99 1z4r h GLU 537 Ca 0.27 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 1z4r h GLU 537 Cb 0.05 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1z4r h GLU 537 CO -0.04 0.67 0.05 -0.92 -0.73 0.00 0.00 179.01 178.05 1z4r h TYR 538 N 0.73 0.50 -0.40 0.92 3.20 -1.68 -0.60 116.97 119.64 1z4r h TYR 538 Ca 0.16 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1z4r h TYR 538 Cb 0.26 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 1z4r h TYR 538 CO 0.01 0.56 0.21 0.82 -1.64 0.00 0.00 178.16 178.13 1z4r h ILE 539 N 0.30 1.15 -0.56 1.81 2.04 -0.97 -2.33 117.51 118.96 1z4r h ILE 539 Ca 0.09 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.56 1z4r h ILE 539 Cb 0.32 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1z4r h ILE 539 CO 0.00 0.16 0.35 0.00 0.00 0.00 0.00 178.15 178.67 1z4r h ALA 540 N 1.07 0.71 -0.60 1.87 0.00 -1.03 -0.20 119.26 121.08 1z4r h ALA 540 Ca 0.14 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1z4r h ALA 540 Cb 0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1z4r h ALA 540 CO -0.02 0.10 0.35 -0.09 0.00 0.00 0.00 179.25 179.59 1z4r h ARG 541 N 0.71 0.67 0.00 0.00 2.43 -0.83 -2.01 114.38 115.35 1z4r h ARG 541 Ca 0.22 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 59.15 1z4r h ARG 541 Cb -0.03 -0.15 0.02 0.00 -0.42 0.00 0.00 29.97 29.39 1z4r h ARG 541 CO -0.07 0.44 -0.76 -0.07 -1.51 0.00 0.00 179.97 178.00 1z4r h LEU 542 N 0.69 0.66 -1.63 3.80 3.38 -1.18 -2.53 115.31 118.50 1z4r h LEU 542 Ca 0.25 -0.76 0.01 0.00 0.09 0.00 0.00 57.88 57.48 1z4r h LEU 542 Cb 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1z4r h LEU 542 CO -0.13 1.33 0.26 0.58 0.09 0.00 0.00 178.44 180.58 1z4r h VAL 543 N 0.06 1.08 -0.41 1.22 2.07 -0.96 -1.94 116.25 117.38 1z4r h VAL 543 Ca -0.10 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1z4r h VAL 543 Cb 1.45 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1z4r h VAL 543 CO 0.15 0.09 0.00 0.49 0.02 0.00 0.00 177.57 178.32 1z4r n PHE 544 N -4.48 0.53 -2.63 1.57 3.72 -0.76 -4.53 117.46 110.88 1z4r n PHE 544 Ca 0.03 -0.27 -0.42 0.00 -0.05 0.00 0.00 57.45 56.74 1z4r n PHE 544 Cb 0.08 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.60 1z4r n PHE 544 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1z4r s ASP 545 N -1.38 7.21 0.61 4.37 2.15 -0.73 -4.64 116.67 124.25 1z4r s ASP 545 Ca 0.38 1.63 0.29 0.00 0.43 0.00 0.00 52.55 55.28 1z4r s ASP 545 Cb 0.22 -2.56 1.49 0.00 -0.30 0.00 0.00 42.92 41.76 1z4r s ASP 545 CO 0.30 -0.46 1.89 -0.65 -0.17 0.00 0.00 175.17 176.08 1z4r h PRO 546 N 7.13 0.00 -0.00 4.34 0.11 -1.88 0.52 132.00 142.21 1z4r h PRO 546 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1z4r h PRO 546 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1z4r h PRO 546 CO 0.85 0.00 -0.17 1.63 -0.21 0.00 0.00 178.00 180.10 1z4r n LYS 547 N -3.52 0.66 -4.43 1.05 5.02 -1.26 -4.81 118.16 110.87 1z4r n LYS 547 Ca 0.06 -0.28 -0.32 0.00 -2.02 0.00 0.00 58.31 55.74 1z4r n LYS 547 Cb 0.61 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 34.03 1z4r n LYS 547 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1z4r s HIS 548 N -2.53 2.93 0.29 2.13 3.76 0.17 -4.46 115.29 117.57 1z4r s HIS 548 Ca 0.26 -0.01 0.09 0.00 -0.15 0.00 0.00 55.06 55.25 1z4r s HIS 548 Cb 0.20 -1.63 -0.06 0.00 1.11 0.00 0.00 32.58 32.20 1z4r s HIS 548 CO 0.50 0.39 -0.13 0.15 -0.85 0.00 0.00 174.74 174.80 1z4r s LYS 549 N -1.40 1.63 -0.04 1.40 1.02 -0.14 -4.54 119.74 117.68 1z4r s LYS 549 Ca 0.17 -1.79 0.01 0.00 0.02 0.00 0.00 55.97 54.37 1z4r s LYS 549 Cb -0.11 -1.50 0.02 0.00 -0.52 0.00 0.00 37.83 35.72 1z4r s LYS 549 CO 0.08 0.19 -0.02 0.99 -0.92 0.00 0.00 175.35 175.66 1z4r s THR 550 N -2.73 0.35 -0.43 2.17 2.01 0.10 -0.39 115.64 116.73 1z4r s THR 550 Ca 0.29 -0.00 -0.23 0.00 0.31 0.00 0.00 61.69 62.06 1z4r s THR 550 Cb -0.00 -0.42 0.02 0.00 0.01 0.00 0.00 72.50 72.11 1z4r s THR 550 CO 0.13 0.19 0.80 -0.22 -0.69 0.00 0.00 174.62 174.83 1z4r s LEU 551 N 1.05 4.19 -0.13 4.42 2.96 0.23 -0.83 118.68 130.57 1z4r s LEU 551 Ca -0.09 0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 53.80 1z4r s LEU 551 Cb -0.14 -3.01 -0.04 0.00 0.50 0.00 0.00 46.19 43.50 1z4r s LEU 551 CO -0.01 -0.88 0.14 0.00 -1.32 0.00 0.00 176.35 174.28 1z4r s ALA 552 N 3.29 3.85 -0.34 5.97 0.00 0.12 -1.32 121.76 133.31 1z4r s ALA 552 Ca 0.31 -0.65 -0.10 0.00 0.00 0.00 0.00 51.96 51.53 1z4r s ALA 552 Cb -0.12 -1.98 0.02 0.00 0.00 0.00 0.00 23.12 21.04 1z4r s ALA 552 CO 0.21 0.57 0.16 -1.17 0.00 0.00 0.00 175.76 175.54 1z4r s LEU 553 N -0.89 4.39 -0.08 0.00 2.96 0.15 -1.52 118.68 123.69 1z4r s LEU 553 Ca 0.14 -0.84 0.03 0.00 -0.22 0.00 0.00 54.13 53.24 1z4r s LEU 553 Cb -0.12 -1.98 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 1z4r s LEU 553 CO 0.03 -0.30 -0.17 -0.63 -1.32 0.00 0.00 176.35 173.96 1z4r s ILE 554 N 1.55 2.72 -0.09 6.68 -1.09 -0.23 -0.75 121.20 129.99 1z4r s ILE 554 Ca 0.02 -0.81 -0.01 0.00 -2.23 0.00 0.00 60.65 57.62 1z4r s ILE 554 Cb -0.18 -2.08 0.03 0.00 -1.58 0.00 0.00 42.46 38.65 1z4r s ILE 554 CO 0.06 0.56 -0.03 -1.59 -1.23 0.00 0.00 174.94 172.71 1z4r s LYS 555 N -0.11 0.97 -1.24 2.79 -2.85 -0.08 -0.17 119.74 119.04 1z4r s LYS 555 Ca -0.03 -0.04 -0.02 0.00 -1.00 0.00 0.00 55.97 54.88 1z4r s LYS 555 Cb -0.14 -1.23 0.00 0.00 -2.06 0.00 0.00 37.83 34.40 1z4r s LYS 555 CO 0.04 -0.29 1.04 -0.25 0.10 0.00 0.00 175.35 175.99 1z4r n ASP 556 N 5.07 -3.12 0.00 0.03 8.00 -1.26 -2.16 116.55 123.11 1z4r n ASP 556 Ca -0.09 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.81 1z4r n ASP 556 Cb 0.50 -5.09 0.00 0.00 -0.02 0.00 0.00 41.12 36.51 1z4r n ASP 556 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1z4r n GLY 557 N -1.35 0.73 3.65 0.44 0.00 -1.26 -4.97 105.19 102.43 1z4r n GLY 557 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 1z4r n GLY 557 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1z4r s ARG 558 N -0.37 2.92 -0.06 1.61 3.52 -0.92 -4.99 118.95 120.65 1z4r s ARG 558 Ca 0.00 -0.45 -0.30 0.00 -0.13 0.00 0.00 55.73 54.85 1z4r s ARG 558 Cb 0.00 -2.73 -0.03 0.00 -1.56 0.00 0.00 34.95 30.63 1z4r s ARG 558 CO 0.00 0.68 1.26 0.08 -0.81 0.00 0.00 175.30 176.52 1z4r s VAL 559 N -0.84 4.13 -0.30 7.11 1.01 -1.26 -0.90 120.40 129.35 1z4r s VAL 559 Ca 0.13 1.45 0.02 0.00 0.00 0.00 0.00 61.98 63.59 1z4r s VAL 559 Cb -0.11 -3.94 0.02 0.00 0.00 0.00 0.00 36.38 32.36 1z4r s VAL 559 CO 0.02 -0.03 0.62 2.30 0.00 0.00 0.00 175.10 178.01 1z4r n ILE 560 N 4.78 0.08 0.00 2.22 -5.35 0.07 -4.95 119.36 116.21 1z4r n ILE 560 Ca 0.12 -0.54 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 1z4r n ILE 560 Cb 0.45 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 1z4r n ILE 560 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1z4r n GLY 561 N 0.11 0.92 0.00 3.28 0.00 -1.17 -0.72 105.19 107.60 1z4r n GLY 561 Ca 0.02 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1z4r n GLY 561 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z4r n GLY 562 N -0.35 0.68 2.85 -0.02 0.00 0.00 -0.68 105.19 107.68 1z4r n GLY 562 Ca 0.00 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 44.93 1z4r n GLY 562 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1z4r s ILE 563 N -2.00 0.83 -0.10 -0.61 1.01 -0.44 -1.80 121.20 118.10 1z4r s ILE 563 Ca 0.00 -0.28 -0.18 0.00 0.00 0.00 0.00 60.65 60.19 1z4r s ILE 563 Cb 0.00 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 1z4r s ILE 563 CO 0.00 0.24 0.49 0.00 0.00 0.00 0.00 174.94 175.67 1z4r s PHE 565 N 0.50 0.70 -0.06 0.00 -0.12 0.48 -0.67 117.98 118.81 1z4r s PHE 565 Ca 0.27 -1.02 -0.00 0.00 -0.05 0.00 0.00 56.93 56.12 1z4r s PHE 565 Cb -0.15 -0.23 0.03 0.00 -0.63 0.00 0.00 43.02 42.03 1z4r s PHE 565 CO 0.11 -0.72 -0.02 0.50 -0.05 0.00 0.00 175.22 175.05 1z4r s ARG 566 N -4.05 0.71 0.02 1.99 3.52 -0.24 -0.96 118.95 119.93 1z4r s ARG 566 Ca 0.26 0.02 -0.24 0.00 -0.13 0.00 0.00 55.73 55.64 1z4r s ARG 566 Cb 0.04 -0.93 -0.05 0.00 -1.56 0.00 0.00 34.95 32.45 1z4r s ARG 566 CO 0.06 -0.22 0.73 -1.64 -0.81 0.00 0.00 175.30 173.42 1z4r s MET 567 N 1.57 4.46 -0.57 5.12 -1.94 -1.26 -0.54 119.30 126.15 1z4r s MET 567 Ca -0.01 1.00 0.07 0.00 -1.71 0.00 0.00 55.69 55.03 1z4r s MET 567 Cb -0.13 -3.37 0.25 0.00 2.01 0.00 0.00 34.83 33.59 1z4r s MET 567 CO -0.04 0.27 0.68 1.19 -0.01 0.00 0.00 175.02 177.11 1z4r n PHE 568 N 2.92 2.45 -0.28 -0.03 3.72 0.13 -4.98 117.46 121.38 1z4r n PHE 568 Ca -0.03 -3.98 0.10 0.00 -0.05 0.00 0.00 57.45 53.49 1z4r n PHE 568 Cb 0.50 -0.50 0.25 0.00 -0.94 0.00 0.00 39.48 38.80 1z4r n PHE 568 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1z4r h PRO 569 N 4.13 0.27 -0.32 -1.08 0.13 -1.95 -0.36 132.00 132.82 1z4r h PRO 569 Ca 0.16 -0.02 -0.15 0.00 -0.87 0.00 0.00 66.00 65.12 1z4r h PRO 569 Cb 0.73 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1z4r h PRO 569 CO 0.72 0.18 -0.41 1.79 -0.23 0.00 0.00 178.00 180.05 1z4r h THR 570 N 0.27 1.28 0.00 1.56 1.35 -1.93 -2.78 112.91 112.67 1z4r h THR 570 Ca 0.50 -1.58 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1z4r h THR 570 Cb 0.95 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1z4r h THR 570 CO -0.58 0.52 0.00 1.56 -0.25 0.00 0.00 175.52 176.77 1z4r h GLN 571 N 0.65 0.00 0.00 4.72 1.08 -1.64 -3.47 115.11 116.45 1z4r h GLN 571 Ca 0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1z4r h GLN 571 Cb 0.97 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 1z4r h GLN 571 CO 0.09 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.38 1z4r n GLY 572 N 0.46 0.43 3.66 3.46 0.00 -0.25 -5.03 105.19 107.92 1z4r n GLY 572 Ca 0.03 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.97 1z4r n GLY 572 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1z4r s PHE 573 N -2.00 0.27 -0.01 1.61 -0.12 -1.08 -3.99 117.98 112.66 1z4r s PHE 573 Ca 0.00 -0.67 0.04 0.00 -0.05 0.00 0.00 56.93 56.25 1z4r s PHE 573 Cb 0.00 0.34 -0.01 0.00 -0.63 0.00 0.00 43.02 42.73 1z4r s PHE 573 CO 0.00 -1.11 -0.14 0.99 -0.05 0.00 0.00 175.22 174.91 1z4r s THR 574 N -3.77 1.09 -0.20 -4.49 2.01 0.02 -0.69 115.64 109.62 1z4r s THR 574 Ca 0.20 -0.58 -0.16 0.00 0.31 0.00 0.00 61.69 61.46 1z4r s THR 574 Cb -0.02 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 1z4r s THR 574 CO 0.10 0.31 0.39 -0.70 -0.69 0.00 0.00 174.62 174.03 1z4r s GLU 575 N -0.26 4.19 -0.40 4.92 2.12 0.30 -1.18 118.70 128.39 1z4r s GLU 575 Ca 0.04 0.20 -0.21 0.00 0.36 0.00 0.00 54.97 55.37 1z4r s GLU 575 Cb -0.06 -3.52 0.01 0.00 0.26 0.00 0.00 34.13 30.82 1z4r s GLU 575 CO -0.00 -0.01 0.64 0.42 -0.54 0.00 0.00 175.26 175.77 1z4r s ILE 576 N 1.22 4.86 -0.18 -3.70 -1.09 -0.12 -1.08 121.20 121.10 1z4r s ILE 576 Ca 0.19 0.35 -0.17 0.00 -2.23 0.00 0.00 60.65 58.79 1z4r s ILE 576 Cb -0.15 -4.14 -0.13 0.00 -1.58 0.00 0.00 42.46 36.46 1z4r s ILE 576 CO 0.08 -0.46 0.09 0.58 -1.23 0.00 0.00 174.94 174.00 1z4r h VAL 577 N 5.78 0.60 -4.04 2.92 2.07 -1.21 -3.41 116.25 118.96 1z4r h VAL 577 Ca -0.26 -1.76 -0.40 0.00 0.82 0.00 0.00 66.70 65.10 1z4r h VAL 577 Cb 1.10 1.44 -0.27 0.00 -1.52 0.00 0.00 31.29 32.05 1z4r h VAL 577 CO 0.86 0.20 -0.78 -0.36 0.02 0.00 0.00 177.57 177.52 1z4r s PHE 578 N -2.30 0.93 -0.06 1.57 0.08 -1.02 -4.97 117.98 112.21 1z4r s PHE 578 Ca -0.23 -0.24 -0.02 0.00 0.12 0.00 0.00 56.93 56.55 1z4r s PHE 578 Cb 0.04 -0.58 0.04 0.00 -0.57 0.00 0.00 43.02 41.95 1z4r s PHE 578 CO 0.46 -0.01 0.11 0.00 -0.10 0.00 0.00 175.22 175.68 1z4r s ALA 580 N 1.76 -1.88 -0.02 0.00 0.00 -0.74 -5.01 121.76 115.86 1z4r s ALA 580 Ca -0.02 1.35 0.03 0.00 0.00 0.00 0.00 51.96 53.33 1z4r s ALA 580 Cb -0.12 -0.23 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 1z4r s ALA 580 CO -0.05 -0.45 -0.11 0.08 0.00 0.00 0.00 175.76 175.23 1z4r s VAL 581 N -1.86 0.93 0.43 0.00 1.01 -1.26 -0.82 120.40 118.84 1z4r s VAL 581 Ca -0.00 -0.46 -0.26 0.00 0.00 0.00 0.00 61.98 61.26 1z4r s VAL 581 Cb -0.01 -0.81 -0.09 0.00 0.00 0.00 0.00 36.38 35.47 1z4r s VAL 581 CO -0.01 0.28 1.36 1.07 0.00 0.00 0.00 175.10 177.79 1z4r n THR 582 N 3.12 2.64 -0.26 3.92 5.66 0.10 -4.77 114.28 124.68 1z4r n THR 582 Ca -0.17 -0.50 0.02 0.00 -3.05 0.00 0.00 64.05 60.36 1z4r n THR 582 Cb 0.55 -1.71 0.10 0.00 -1.55 0.00 0.00 70.33 67.72 1z4r n THR 582 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1z4r h SER 583 N 2.23 -0.63 0.46 1.09 0.02 -1.96 -1.23 113.55 113.52 1z4r h SER 583 Ca -0.49 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1z4r h SER 583 Cb 1.28 0.45 0.00 0.00 0.14 0.00 0.00 62.40 64.27 1z4r h SER 583 CO 0.61 -0.24 0.00 -0.46 -1.14 0.00 0.00 176.83 175.60 1z4r n ASN 584 N -5.47 0.11 -0.54 3.07 6.94 -1.26 -2.33 115.26 115.78 1z4r n ASN 584 Ca 0.11 0.53 0.07 0.00 -0.02 0.00 0.00 54.58 55.27 1z4r n ASN 584 Cb 0.41 -0.55 0.06 0.00 -2.36 0.00 0.00 39.78 37.33 1z4r n ASN 584 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1z4r n GLU 585 N -1.63 0.91 -1.55 -3.83 -0.58 -0.49 -5.02 120.64 108.46 1z4r n GLU 585 Ca 0.03 -1.32 -0.29 0.00 -0.42 0.00 0.00 57.16 55.15 1z4r n GLU 585 Cb 0.15 -1.26 0.11 0.00 -0.57 0.00 0.00 31.44 29.88 1z4r n GLU 585 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1z4r s GLN 586 N -1.11 1.70 -1.59 3.49 -0.21 -0.98 -4.08 119.66 116.87 1z4r s GLN 586 Ca 0.16 0.49 -0.04 0.00 0.02 0.00 0.00 55.36 55.99 1z4r s GLN 586 Cb 0.11 -1.89 0.01 0.00 1.00 0.00 0.00 33.01 32.24 1z4r s GLN 586 CO 0.17 -1.86 0.53 0.28 -2.12 0.00 0.00 175.29 172.29 1z4r n VAL 587 N -3.57 -1.87 0.00 1.09 0.31 -1.26 -4.84 118.33 108.19 1z4r n VAL 587 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1z4r n VAL 587 Cb 0.57 -3.41 0.00 0.00 -0.91 0.00 0.00 33.84 30.10 1z4r n VAL 587 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1z4r n LYS 588 N -3.91 4.79 0.00 5.55 5.02 -1.26 -5.02 118.16 123.34 1z4r n LYS 588 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1z4r n LYS 588 Cb 0.63 -0.42 0.00 0.00 -0.02 0.00 0.00 35.03 35.22 1z4r n LYS 588 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1z4r n GLY 589 N 0.85 0.81 0.30 0.72 0.00 -1.26 -5.01 105.19 101.59 1z4r n GLY 589 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1z4r n GLY 589 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1z4r h TYR 590 N 0.00 0.93 -0.84 1.61 0.05 -1.96 -0.57 116.97 116.19 1z4r h TYR 590 Ca 0.00 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.66 1z4r h TYR 590 Cb 0.00 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 37.44 1z4r h TYR 590 CO 0.00 0.82 0.53 0.78 -1.05 0.00 0.00 178.16 179.24 1z4r h GLY 591 N 0.99 1.20 1.36 3.88 0.00 -1.95 0.27 103.07 108.82 1z4r h GLY 591 Ca 0.17 -0.47 -0.19 0.00 0.00 0.00 0.00 47.33 46.83 1z4r h GLY 591 CO 0.01 0.46 -0.68 -0.84 0.00 0.00 0.00 176.54 175.49 1z4r h THR 592 N 1.14 1.31 -0.73 4.70 2.02 -1.95 -2.59 112.91 116.81 1z4r h THR 592 Ca 0.30 -1.95 -0.00 0.00 0.77 0.00 0.00 66.41 65.53 1z4r h THR 592 Cb -0.09 1.92 -0.04 0.00 -1.74 0.00 0.00 68.15 68.20 1z4r h THR 592 CO -0.06 0.61 0.44 -0.74 0.37 0.00 0.00 175.52 176.14 1z4r h HIS 593 N 0.46 0.97 -0.37 3.16 6.17 -0.43 -0.37 115.15 124.73 1z4r h HIS 593 Ca -0.02 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.03 1z4r h HIS 593 Cb 1.28 -0.32 -0.02 0.00 2.52 0.00 0.00 27.41 30.87 1z4r h HIS 593 CO 0.06 0.65 0.15 -0.07 0.71 0.00 0.00 177.93 179.44 1z4r h LEU 594 N 1.00 0.52 -0.63 0.26 3.38 -0.43 -1.70 115.31 117.70 1z4r h LEU 594 Ca 0.26 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1z4r h LEU 594 Cb -0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1z4r h LEU 594 CO -0.05 0.54 -0.06 -0.03 0.09 0.00 0.00 178.44 178.93 1z4r h MET 595 N 0.46 1.01 -0.78 1.13 4.05 -1.09 -1.26 114.93 118.45 1z4r h MET 595 Ca 0.12 -0.34 -0.03 0.00 -0.28 0.00 0.00 59.70 59.17 1z4r h MET 595 Cb 0.19 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 30.87 1z4r h MET 595 CO -0.01 1.02 0.37 -0.91 0.23 0.00 0.00 176.91 177.62 1z4r h ASN 596 N 0.91 1.03 -0.72 1.39 2.35 -0.93 -0.51 115.58 119.09 1z4r h ASN 596 Ca 0.15 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.70 1z4r h ASN 596 Cb 0.61 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 1z4r h ASN 596 CO 0.04 0.88 0.20 -0.74 -1.65 0.00 0.00 177.43 176.15 1z4r h HIS 597 N 1.10 1.20 -0.43 1.19 2.76 -1.02 -1.76 115.15 118.19 1z4r h HIS 597 Ca 0.27 -0.13 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 1z4r h HIS 597 Cb 0.13 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 28.72 1z4r h HIS 597 CO 0.01 0.96 -0.01 1.25 -1.30 0.00 0.00 177.93 178.84 1z4r h LEU 598 N 1.09 0.66 -0.25 0.26 5.85 -0.70 -1.76 115.31 120.47 1z4r h LEU 598 Ca 0.23 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1z4r h LEU 598 Cb 0.35 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1z4r h LEU 598 CO -0.00 0.73 0.03 0.11 -0.34 0.00 0.00 178.44 178.97 1z4r h LYS 599 N 0.65 0.41 -0.88 1.25 1.57 -0.65 -1.86 116.57 117.06 1z4r h LYS 599 Ca 0.13 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1z4r h LYS 599 Cb 0.41 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.63 1z4r h LYS 599 CO 0.02 0.55 0.58 0.93 -0.57 0.00 0.00 179.45 180.95 1z4r h GLU 600 N 0.21 1.11 -0.45 3.15 5.08 -1.05 0.56 114.58 123.19 1z4r h GLU 600 Ca 0.07 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1z4r h GLU 600 Cb 0.34 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1z4r h GLU 600 CO 0.01 0.73 0.26 -0.92 -1.00 0.00 0.00 179.01 178.09 1z4r h TYR 601 N 1.14 0.60 -0.10 4.33 3.20 -1.17 -2.11 116.97 122.87 1z4r h TYR 601 Ca 0.34 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 62.04 1z4r h TYR 601 Cb -0.05 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 1z4r h TYR 601 CO -0.01 0.44 -0.64 0.45 -1.64 0.00 0.00 178.16 176.76 1z4r h HIS 602 N 0.60 0.48 -0.86 -3.82 3.86 -0.86 -2.39 115.15 112.15 1z4r h HIS 602 Ca 0.16 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1z4r h HIS 602 Cb 0.02 -0.08 -0.04 0.00 1.06 0.00 0.00 27.41 28.36 1z4r h HIS 602 CO -0.03 0.90 0.50 0.82 0.86 0.00 0.00 177.93 180.99 1z4r h ILE 603 N 0.27 1.24 -0.08 2.45 2.04 -0.72 0.84 117.51 123.55 1z4r h ILE 603 Ca -0.01 -0.55 -0.07 0.00 1.00 0.00 0.00 64.86 65.24 1z4r h ILE 603 Cb 1.17 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1z4r h ILE 603 CO 0.11 0.26 -0.26 0.50 0.00 0.00 0.00 178.15 178.76 1z4r h LYS 604 N 1.19 0.14 -0.47 2.37 3.64 -1.11 -2.10 116.57 120.23 1z4r h LYS 604 Ca 0.31 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1z4r h LYS 604 Cb -0.03 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1z4r h LYS 604 CO -0.06 0.39 0.00 0.72 -2.27 0.00 0.00 179.45 178.24 1z4r n HIS 605 N -4.19 0.61 -3.69 1.91 8.25 -0.41 -4.95 115.22 112.76 1z4r n HIS 605 Ca -0.01 -0.31 -0.26 0.00 -0.26 0.00 0.00 57.72 56.88 1z4r n HIS 605 Cb 0.34 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.52 1z4r n HIS 605 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1z4r n ASN 606 N 1.08 -5.78 -4.16 0.41 5.15 0.14 -5.00 115.26 107.11 1z4r n ASN 606 Ca 0.18 -0.61 -0.34 0.00 -0.60 0.00 0.00 54.58 53.21 1z4r n ASN 606 Cb 0.48 -4.71 -0.15 0.00 -0.53 0.00 0.00 39.78 34.87 1z4r n ASN 606 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1z4r s ILE 607 N -3.32 2.61 -0.23 -1.44 1.01 -0.34 -5.01 121.20 114.48 1z4r s ILE 607 Ca 0.59 -1.14 0.14 0.00 0.00 0.00 0.00 60.65 60.24 1z4r s ILE 607 Cb -0.27 -2.34 0.59 0.00 0.01 0.00 0.00 42.46 40.45 1z4r s ILE 607 CO 0.76 0.20 1.53 0.18 0.00 0.00 0.00 174.94 177.60 1z4r n LEU 608 N 4.61 4.48 -3.79 2.97 4.77 -1.26 -4.13 117.00 124.65 1z4r n LEU 608 Ca -0.17 -3.16 -0.13 0.00 -0.03 0.00 0.00 56.01 52.52 1z4r n LEU 608 Cb 0.46 -0.61 -0.14 0.00 -2.33 0.00 0.00 43.42 40.80 1z4r n LEU 608 CO 0.26 0.78 -0.27 -0.31 -1.33 0.00 0.00 177.39 176.51 1z4r s TYR 609 N -2.92 -0.09 -0.05 -1.77 2.02 -1.26 -0.97 117.35 112.32 1z4r s TYR 609 Ca 0.46 0.30 0.04 0.00 -0.37 0.00 0.00 57.07 57.50 1z4r s TYR 609 Cb 0.38 -0.08 -0.02 0.00 -0.40 0.00 0.00 41.96 41.83 1z4r s TYR 609 CO 0.09 -0.10 -0.18 -0.06 -1.57 0.00 0.00 175.55 173.73 1z4r s PHE 610 N 0.74 2.61 0.01 2.71 0.08 -0.38 -0.80 117.98 122.94 1z4r s PHE 610 Ca -0.06 -0.33 0.06 0.00 0.12 0.00 0.00 56.93 56.72 1z4r s PHE 610 Cb -0.08 -1.62 -0.02 0.00 -0.57 0.00 0.00 43.02 40.73 1z4r s PHE 610 CO -0.03 0.05 -0.18 -0.51 -0.10 0.00 0.00 175.22 174.45 1z4r s LEU 611 N -0.52 2.08 0.05 -0.37 1.43 -0.32 -0.93 118.68 120.10 1z4r s LEU 611 Ca 0.07 -0.39 -0.27 0.00 -1.03 0.00 0.00 54.13 52.51 1z4r s LEU 611 Cb -0.11 -0.92 0.07 0.00 0.03 0.00 0.00 46.19 45.26 1z4r s LEU 611 CO 0.01 0.19 0.67 0.28 0.23 0.00 0.00 176.35 177.73 1z4r s THR 612 N -0.56 0.00 -0.38 5.49 -1.32 -0.36 -0.95 115.64 117.57 1z4r s THR 612 Ca 0.07 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.45 1z4r s THR 612 Cb -0.08 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.95 1z4r s THR 612 CO 0.00 0.00 0.20 -0.31 -2.21 0.00 0.00 174.62 172.30 1z4r s TYR 613 N -2.56 3.26 -0.07 9.09 2.02 -1.26 0.09 117.35 127.92 1z4r s TYR 613 Ca -0.04 -1.16 -0.13 0.00 -0.37 0.00 0.00 57.07 55.38 1z4r s TYR 613 Cb -0.01 -2.49 -0.05 0.00 -0.40 0.00 0.00 41.96 39.02 1z4r s TYR 613 CO -0.03 -0.70 0.33 0.00 -1.57 0.00 0.00 175.55 173.58 1z4r s ALA 614 N 1.50 3.70 0.63 3.71 0.00 0.13 -4.76 121.76 126.67 1z4r s ALA 614 Ca 0.01 -0.36 -0.17 0.00 0.00 0.00 0.00 51.96 51.44 1z4r s ALA 614 Cb -0.20 -2.31 -0.01 0.00 0.00 0.00 0.00 23.12 20.59 1z4r s ALA 614 CO 0.05 0.39 1.16 -0.51 0.00 0.00 0.00 175.76 176.85 1z4r s ASP 615 N -0.62 5.08 0.27 0.00 1.01 -1.26 -0.55 116.67 120.61 1z4r s ASP 615 Ca 0.20 2.20 -0.01 0.00 0.71 0.00 0.00 52.55 55.65 1z4r s ASP 615 Cb -0.15 -2.58 0.44 0.00 1.01 0.00 0.00 42.92 41.65 1z4r s ASP 615 CO 0.09 -1.66 1.88 -0.08 0.21 0.00 0.00 175.17 175.62 1z4r h GLU 616 N 0.44 1.11 0.00 8.23 4.81 -1.97 -2.25 114.58 124.94 1z4r h GLU 616 Ca -0.49 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1z4r h GLU 616 Cb 1.27 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1z4r h GLU 616 CO 0.54 0.73 0.00 0.66 -0.73 0.00 0.00 179.01 180.21 1z4r n TYR 617 N -4.51 0.00 0.24 0.92 4.01 -1.26 -2.77 117.16 113.79 1z4r n TYR 617 Ca 0.16 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.92 1z4r n TYR 617 Cb 0.20 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.22 1z4r n TYR 617 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1z4r n ALA 618 N -0.79 2.62 -0.29 -0.72 0.00 -0.86 -4.72 120.51 115.76 1z4r n ALA 618 Ca 0.12 -0.23 0.11 0.00 0.00 0.00 0.00 53.44 53.44 1z4r n ALA 618 Cb 0.06 -0.18 0.27 0.00 0.00 0.00 0.00 19.45 19.59 1z4r n ALA 618 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1z4r h ILE 619 N 0.26 0.43 -0.37 0.00 2.04 -1.40 -0.03 117.51 118.44 1z4r h ILE 619 Ca 0.00 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.80 1z4r h ILE 619 Cb 0.15 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1z4r h ILE 619 CO 0.00 0.05 0.25 1.23 0.00 0.00 0.00 178.15 179.68 1z4r h GLY 620 N 0.30 0.40 0.76 5.37 0.00 -1.84 -0.41 103.07 107.65 1z4r h GLY 620 Ca 0.52 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 1z4r h GLY 620 CO -0.57 0.12 0.01 -1.82 0.00 0.00 0.00 176.54 174.27 1z4r h TYR 621 N 0.35 0.18 -0.58 5.60 3.20 -1.34 -1.89 116.97 122.49 1z4r h TYR 621 Ca 0.16 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 1z4r h TYR 621 Cb 0.19 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1z4r h TYR 621 CO -0.00 0.41 0.17 0.74 -1.64 0.00 0.00 178.16 177.83 1z4r h PHE 622 N -0.09 0.90 -0.87 -3.82 0.04 -1.24 -2.22 116.94 109.63 1z4r h PHE 622 Ca 0.03 -0.08 -0.02 0.00 2.80 0.00 0.00 57.97 60.70 1z4r h PHE 622 Cb 0.33 -0.27 -0.04 0.00 2.20 0.00 0.00 35.95 38.17 1z4r h PHE 622 CO 0.03 0.73 0.45 0.87 -0.60 0.00 0.00 178.31 179.79 1z4r h LYS 623 N 0.85 1.23 -0.09 1.51 1.57 -0.97 0.85 116.57 121.52 1z4r h LYS 623 Ca 0.19 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 1z4r h LYS 623 Cb 0.27 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1z4r h LYS 623 CO -0.01 0.92 -0.14 -0.22 -0.57 0.00 0.00 179.45 179.44 1z4r h LYS 624 N 1.23 0.15 -0.16 3.15 3.64 -0.76 -0.89 116.57 122.92 1z4r h LYS 624 Ca 0.30 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1z4r h LYS 624 Cb 0.07 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1z4r h LYS 624 CO -0.04 0.29 0.00 1.04 -2.27 0.00 0.00 179.45 178.47 1z4r n GLN 625 N -4.30 1.36 -0.64 1.90 1.13 -0.51 -4.87 117.38 111.45 1z4r n GLN 625 Ca -0.01 -0.55 0.00 0.00 -1.94 0.00 0.00 57.00 54.50 1z4r n GLN 625 Cb 0.25 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.48 1z4r n GLN 625 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1z4r n GLY 626 N 0.73 0.65 3.88 1.08 0.00 -0.34 -5.02 105.19 106.18 1z4r n GLY 626 Ca 0.05 -0.29 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 1z4r n GLY 626 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1z4r s PHE 627 N -2.00 3.56 0.07 1.61 0.08 0.18 -4.43 117.98 117.05 1z4r s PHE 627 Ca 0.00 1.11 -0.06 0.00 0.12 0.00 0.00 56.93 58.10 1z4r s PHE 627 Cb 0.00 -2.54 -0.01 0.00 -0.57 0.00 0.00 43.02 39.90 1z4r s PHE 627 CO 0.00 -0.41 0.11 0.45 -0.10 0.00 0.00 175.22 175.27 1z4r s SER 628 N -3.84 0.23 0.10 1.36 0.15 0.31 -4.26 113.70 107.76 1z4r s SER 628 Ca 0.52 -0.72 0.27 0.00 0.70 0.00 0.00 55.95 56.72 1z4r s SER 628 Cb -0.10 0.28 0.98 0.00 -1.71 0.00 0.00 66.02 65.47 1z4r s SER 628 CO 0.44 -0.65 1.81 0.29 1.20 0.00 0.00 173.24 176.33 1z4r n LYS 629 N 0.14 0.13 -2.74 5.44 5.02 -1.26 -0.76 118.16 124.12 1z4r n LYS 629 Ca -0.15 0.10 -0.43 0.00 -2.02 0.00 0.00 58.31 55.80 1z4r n LYS 629 Cb 0.61 -1.64 -0.03 0.00 -0.02 0.00 0.00 35.03 33.95 1z4r n LYS 629 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1z4r s ASP 630 N -3.72 6.65 -0.25 4.39 -0.00 -1.26 -4.88 116.67 117.61 1z4r s ASP 630 Ca 0.12 0.48 -0.14 0.00 -0.00 0.00 0.00 52.55 53.01 1z4r s ASP 630 Cb 0.16 -2.49 -0.04 0.00 -0.00 0.00 0.00 42.92 40.54 1z4r s ASP 630 CO 0.58 -1.02 0.34 -0.63 -0.00 0.00 0.00 175.17 174.43 1z4r s ILE 631 N 3.83 5.22 -0.12 0.77 -1.09 -1.26 -4.65 121.20 123.90 1z4r s ILE 631 Ca 0.41 0.52 0.16 0.00 -2.23 0.00 0.00 60.65 59.52 1z4r s ILE 631 Cb -0.10 -3.67 -0.23 0.00 -1.58 0.00 0.00 42.46 36.88 1z4r s ILE 631 CO 0.24 0.22 0.44 0.29 -1.23 0.00 0.00 174.94 174.89 1z4r n LYS 632 N 4.91 0.66 -2.11 2.79 5.02 -1.26 -4.87 118.16 123.30 1z4r n LYS 632 Ca -0.10 0.12 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 1z4r n LYS 632 Cb 0.51 -1.67 -0.03 0.00 -0.02 0.00 0.00 35.03 33.83 1z4r n LYS 632 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1z4r s VAL 633 N -2.68 3.30 0.45 -0.18 1.01 -1.26 -4.94 120.40 116.11 1z4r s VAL 633 Ca -0.07 0.83 -0.25 0.00 0.00 0.00 0.00 61.98 62.49 1z4r s VAL 633 Cb 0.08 -3.53 -0.08 0.00 0.00 0.00 0.00 36.38 32.84 1z4r s VAL 633 CO 0.83 0.03 1.39 -2.65 0.00 0.00 0.00 175.10 174.70 1z4r n PRO 634 N 4.79 2.13 -0.19 2.72 -0.02 -1.26 -4.89 135.00 138.29 1z4r n PRO 634 Ca 0.13 0.76 0.08 0.00 -2.02 0.00 0.00 63.50 62.46 1z4r n PRO 634 Cb 0.42 -2.57 0.38 0.00 -0.02 0.00 0.00 33.50 31.70 1z4r n PRO 634 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1z4r h LYS 635 N 2.17 0.68 0.00 -0.52 3.64 -1.95 0.09 116.57 120.67 1z4r h LYS 635 Ca -0.50 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1z4r h LYS 635 Cb 1.28 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1z4r h LYS 635 CO 0.60 0.45 0.00 0.66 -2.27 0.00 0.00 179.45 178.89 1z4r h SER 636 N 0.70 0.00 1.09 4.20 4.64 -1.93 0.60 113.55 122.85 1z4r h SER 636 Ca 0.34 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.56 1z4r h SER 636 Cb 0.39 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1z4r h SER 636 CO -0.12 0.00 -0.95 0.03 -0.87 0.00 0.00 176.83 174.92 1z4r h ARG 637 N 0.00 0.00 0.00 4.77 2.47 -1.33 -3.39 114.38 116.90 1z4r h ARG 637 Ca 0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1z4r h ARG 637 Cb 0.23 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.55 1z4r h ARG 637 CO 0.00 0.24 -1.25 2.48 0.56 0.00 0.00 179.97 182.00 1z4r n TYR 638 N -2.94 0.00 -1.69 3.04 0.18 -0.92 -4.83 117.16 109.99 1z4r n TYR 638 Ca -0.03 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.33 1z4r n TYR 638 Cb 0.71 -0.13 -0.03 0.00 -0.38 0.00 0.00 39.34 39.52 1z4r n TYR 638 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 1z4r s LEU 639 N -3.39 4.40 0.00 -3.48 2.96 0.16 -0.55 118.68 118.79 1z4r s LEU 639 Ca -0.02 2.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.67 1z4r s LEU 639 Cb 0.04 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.16 1z4r s LEU 639 CO 0.23 -1.02 0.00 0.61 -1.32 0.00 0.00 176.35 174.85 1z4r n GLY 640 N 4.27 1.60 0.16 7.98 0.00 -1.26 -4.83 105.19 113.12 1z4r n GLY 640 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1z4r n GLY 640 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1z4r n TYR 641 N -2.00 0.00 -2.85 1.61 4.01 0.29 -4.98 117.16 113.25 1z4r n TYR 641 Ca 0.00 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.43 1z4r n TYR 641 Cb 0.00 -0.56 -0.04 0.00 -0.31 0.00 0.00 39.34 38.43 1z4r n TYR 641 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 1z4r s ILE 642 N -2.78 4.72 -0.09 -0.72 -4.36 -0.78 -5.05 121.20 112.14 1z4r s ILE 642 Ca -0.29 0.78 -0.20 0.00 -0.26 0.00 0.00 60.65 60.68 1z4r s ILE 642 Cb 0.06 -3.70 -0.04 0.00 1.25 0.00 0.00 42.46 40.03 1z4r s ILE 642 CO 0.41 -0.47 0.58 -0.54 0.24 0.00 0.00 174.94 175.16 1z4r s LYS 643 N -3.69 4.38 0.15 0.37 1.02 -1.26 -4.91 119.74 115.80 1z4r s LYS 643 Ca 0.53 0.64 -0.12 0.00 0.02 0.00 0.00 55.97 57.05 1z4r s LYS 643 Cb -0.10 -3.44 -0.07 0.00 -0.52 0.00 0.00 37.83 33.70 1z4r s LYS 643 CO 0.28 0.12 0.50 0.16 -0.92 0.00 0.00 175.35 175.49 1z4r s ASP 644 N 0.70 6.72 0.28 2.83 1.47 -1.26 -4.86 116.67 122.55 1z4r s ASP 644 Ca 0.31 0.95 0.11 0.00 1.18 0.00 0.00 52.55 55.09 1z4r s ASP 644 Cb -0.16 -2.24 -0.05 0.00 -0.34 0.00 0.00 42.92 40.13 1z4r s ASP 644 CO 0.14 0.08 -0.16 -0.31 0.68 0.00 0.00 175.17 175.59 1z4r s TYR 645 N -1.54 2.22 -0.03 2.11 1.51 -1.26 -5.11 117.35 115.25 1z4r s TYR 645 Ca 0.39 -0.42 -0.30 0.00 -1.01 0.00 0.00 57.07 55.73 1z4r s TYR 645 Cb -0.14 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.62 1z4r s TYR 645 CO 0.20 0.62 1.24 -2.00 -1.11 0.00 0.00 175.55 174.49 1z4r s GLU 646 N -3.56 4.35 -0.78 -0.62 2.56 -1.26 -3.55 118.70 115.83 1z4r s GLU 646 Ca 0.30 1.74 0.00 0.00 0.00 0.00 0.00 54.97 57.00 1z4r s GLU 646 Cb -0.02 -3.53 0.00 0.00 2.00 0.00 0.00 34.13 32.57 1z4r s GLU 646 CO 0.14 -0.45 0.00 0.41 -0.56 0.00 0.00 175.26 174.81 1z4r n GLY 647 N 3.40 0.82 3.96 -1.50 0.00 -1.26 -5.00 105.19 105.61 1z4r n GLY 647 Ca 0.11 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 1z4r n GLY 647 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z4r s ALA 648 N -1.88 3.86 -0.21 4.61 0.00 -1.23 -4.50 121.76 122.40 1z4r s ALA 648 Ca 0.00 -1.10 -0.05 0.00 0.00 0.00 0.00 51.96 50.81 1z4r s ALA 648 Cb 0.00 -1.86 -0.02 0.00 0.00 0.00 0.00 23.12 21.24 1z4r s ALA 648 CO 0.00 0.20 0.00 0.99 0.00 0.00 0.00 175.76 176.95 1z4r s THR 649 N -2.05 3.88 0.12 0.00 2.01 0.29 -4.84 115.64 115.05 1z4r s THR 649 Ca 0.36 -0.33 -0.31 0.00 0.31 0.00 0.00 61.69 61.72 1z4r s THR 649 Cb -0.09 -2.77 -0.08 0.00 0.01 0.00 0.00 72.50 69.56 1z4r s THR 649 CO 0.31 0.41 1.46 -0.22 -0.69 0.00 0.00 174.62 175.88 1z4r s LEU 650 N 1.24 4.37 0.08 4.42 2.96 -1.26 -0.70 118.68 129.79 1z4r s LEU 650 Ca 0.03 2.40 0.03 0.00 -0.22 0.00 0.00 54.13 56.38 1z4r s LEU 650 Cb -0.15 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.93 1z4r s LEU 650 CO 0.01 -0.72 -0.10 -0.04 -1.32 0.00 0.00 176.35 174.19 1z4r s MET 651 N 1.30 0.76 0.02 1.98 -1.94 0.11 -4.63 119.30 116.91 1z4r s MET 651 Ca 0.67 -1.06 0.03 0.00 -1.71 0.00 0.00 55.69 53.62 1z4r s MET 651 Cb -0.39 -0.46 -0.02 0.00 2.01 0.00 0.00 34.83 35.97 1z4r s MET 651 CO 0.30 0.07 -0.10 -2.00 -0.01 0.00 0.00 175.02 173.29 1z4r s GLU 652 N -2.49 0.68 -0.16 2.03 2.12 0.06 -1.23 118.70 119.69 1z4r s GLU 652 Ca 0.01 -0.55 0.01 0.00 0.36 0.00 0.00 54.97 54.81 1z4r s GLU 652 Cb -0.04 -0.61 0.02 0.00 0.26 0.00 0.00 34.13 33.75 1z4r s GLU 652 CO -0.00 0.15 -0.20 0.00 -0.54 0.00 0.00 175.26 174.67 1z4r s GLU 654 N 1.19 3.54 0.12 0.00 2.12 -1.26 -1.25 118.70 123.15 1z4r s GLU 654 Ca 0.02 -0.45 -0.26 0.00 0.36 0.00 0.00 54.97 54.63 1z4r s GLU 654 Cb -0.14 -3.81 -0.07 0.00 0.26 0.00 0.00 34.13 30.38 1z4r s GLU 654 CO -0.10 -0.53 0.81 -0.51 -0.54 0.00 0.00 175.26 174.40 1z4r s LEU 655 N 1.99 4.54 -0.44 2.70 1.02 -0.14 -5.02 118.68 123.32 1z4r s LEU 655 Ca 0.11 1.63 -0.12 0.00 0.02 0.00 0.00 54.13 55.76 1z4r s LEU 655 Cb -0.17 -3.34 0.07 0.00 0.02 0.00 0.00 46.19 42.77 1z4r s LEU 655 CO 0.12 0.10 0.32 0.21 0.02 0.00 0.00 176.35 177.11 1z4r s ASN 656 N -0.60 5.90 0.24 2.29 3.84 -1.26 -4.91 114.94 120.44 1z4r s ASN 656 Ca 0.39 -1.34 0.13 0.00 0.21 0.00 0.00 52.86 52.24 1z4r s ASN 656 Cb -0.22 -2.09 0.70 0.00 -0.55 0.00 0.00 41.25 39.09 1z4r s ASN 656 CO 0.26 -0.57 1.32 -2.65 -2.79 0.00 0.00 177.10 172.68 1z4r n PRO 657 N 5.06 0.08 -0.96 0.43 -0.02 -1.26 -5.14 135.00 133.20 1z4r n PRO 657 Ca -0.11 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1z4r n PRO 657 Cb 0.44 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1z4r n PRO 657 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35