#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fhq h ASN 574 N 0.00 0.00 0.00 1.61 -1.24 -2.03 -3.47 115.58 110.45 1fhq h ASN 574 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1fhq h ASN 574 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1fhq h ASN 574 CO 0.00 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.75 1fhq n GLY 575 N 0.36 3.09 3.49 1.57 0.00 -1.26 -5.06 105.19 107.38 1fhq n GLY 575 Ca 0.03 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 1fhq n GLY 575 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1fhq s ARG 576 N 0.00 2.97 0.00 1.61 3.00 -1.26 -2.82 118.95 122.44 1fhq s ARG 576 Ca 0.00 -0.62 0.00 0.00 -1.00 0.00 0.00 55.73 54.11 1fhq s ARG 576 Cb 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 34.95 32.36 1fhq s ARG 576 CO 0.00 0.48 0.00 0.34 0.00 0.00 0.00 175.30 176.12 1fhq n PHE 577 N 2.75 0.00 -4.86 5.12 7.35 -0.93 -4.17 117.46 122.72 1fhq n PHE 577 Ca -0.18 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.20 1fhq n PHE 577 Cb 0.53 0.08 -0.13 0.00 0.35 0.00 0.00 39.48 40.30 1fhq n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1fhq s LEU 578 N -5.11 2.54 -0.22 -2.13 0.20 -0.93 -1.64 118.68 111.39 1fhq s LEU 578 Ca 0.00 -0.36 0.02 0.00 0.69 0.00 0.00 54.13 54.48 1fhq s LEU 578 Cb 0.00 -1.49 0.04 0.00 -0.43 0.00 0.00 46.19 44.31 1fhq s LEU 578 CO 0.00 0.30 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.33 1fhq s THR 579 N -0.80 1.99 -0.35 3.68 2.01 0.29 0.78 115.64 123.24 1fhq s THR 579 Ca 0.13 -1.26 -0.07 0.00 0.31 0.00 0.00 61.69 60.79 1fhq s THR 579 Cb -0.10 -2.00 0.04 0.00 0.01 0.00 0.00 72.50 70.45 1fhq s THR 579 CO 0.02 0.19 0.13 -0.76 -0.69 0.00 0.00 174.62 173.51 1fhq s LEU 580 N 1.24 4.43 -0.15 4.42 1.43 0.87 0.20 118.68 131.12 1fhq s LEU 580 Ca -0.03 -1.16 0.00 0.00 -1.03 0.00 0.00 54.13 51.92 1fhq s LEU 580 Cb -0.17 -1.89 0.03 0.00 0.03 0.00 0.00 46.19 44.19 1fhq s LEU 580 CO -0.08 -0.35 -0.11 -1.59 0.23 0.00 0.00 176.35 174.45 1fhq s LYS 581 N 1.42 1.98 0.18 1.70 -2.85 -0.86 0.24 119.74 121.54 1fhq s LYS 581 Ca -0.01 -0.54 -0.31 0.00 -1.00 0.00 0.00 55.97 54.11 1fhq s LYS 581 Cb -0.20 -2.04 -0.10 0.00 -2.06 0.00 0.00 37.83 33.44 1fhq s LYS 581 CO 0.03 -0.30 1.54 -2.14 0.10 0.00 0.00 175.35 174.58 1fhq s PRO 582 N 1.54 4.22 0.43 1.78 0.02 0.17 -0.56 135.00 142.60 1fhq s PRO 582 Ca 0.03 2.35 -0.08 0.00 0.02 0.00 0.00 61.00 63.32 1fhq s PRO 582 Cb -0.14 -3.15 -0.05 0.00 0.02 0.00 0.00 34.50 31.19 1fhq s PRO 582 CO -0.09 -0.57 0.75 -0.51 -0.33 0.00 0.00 177.00 176.25 1fhq s LEU 583 N 0.85 3.77 0.55 -5.54 1.43 -0.10 -1.32 118.68 118.32 1fhq s LEU 583 Ca 0.68 1.00 0.30 0.00 -1.03 0.00 0.00 54.13 55.07 1fhq s LEU 583 Cb -0.43 -3.90 1.46 0.00 0.03 0.00 0.00 46.19 43.35 1fhq s LEU 583 CO 0.34 -0.45 1.90 -0.65 0.23 0.00 0.00 176.35 177.71 1fhq h PRO 584 N 0.85 0.00 0.00 1.29 0.11 -1.88 0.28 132.00 132.66 1fhq h PRO 584 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1fhq h PRO 584 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1fhq h PRO 584 CO 0.63 0.00 -0.05 -0.44 -0.21 0.00 0.00 178.00 177.93 1fhq h ASP 585 N 0.00 0.00 -3.06 -2.05 3.32 -1.91 -3.42 116.42 109.30 1fhq h ASP 585 Ca 0.33 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.79 1fhq h ASP 585 Cb 1.45 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.96 1fhq h ASP 585 CO -0.00 0.05 -0.34 -0.94 -1.72 0.00 0.00 179.24 176.28 1fhq s SER 586 N -5.82 6.50 0.54 6.45 1.04 0.99 -4.49 113.70 118.91 1fhq s SER 586 Ca -0.03 0.58 0.41 0.00 0.48 0.00 0.00 55.95 57.39 1fhq s SER 586 Cb 0.13 -2.09 1.60 0.00 0.10 0.00 0.00 66.02 65.76 1fhq s SER 586 CO 0.52 0.14 1.71 0.16 0.98 0.00 0.00 173.24 176.75 1fhq h ILE 587 N 2.44 0.26 -3.28 -1.02 3.07 -1.82 -3.32 117.51 113.84 1fhq h ILE 587 Ca -0.47 -0.01 -0.66 0.00 1.55 0.00 0.00 64.86 65.27 1fhq h ILE 587 Cb 1.18 0.24 -0.30 0.00 -0.27 0.00 0.00 36.82 37.66 1fhq h ILE 587 CO 0.70 0.00 -0.77 -0.51 -1.05 0.00 0.00 178.15 176.52 1fhq s ILE 588 N -4.96 2.90 -0.52 0.16 2.07 -1.26 -5.06 121.20 114.54 1fhq s ILE 588 Ca -0.05 -0.66 0.03 0.00 -1.41 0.00 0.00 60.65 58.56 1fhq s ILE 588 Cb 0.25 -2.28 0.15 0.00 0.13 0.00 0.00 42.46 40.70 1fhq s ILE 588 CO 0.84 0.47 0.32 0.00 -1.91 0.00 0.00 174.94 174.66 1fhq s GLN 589 N 1.31 1.65 0.44 3.50 0.00 -1.25 -3.90 119.66 121.41 1fhq s GLN 589 Ca 0.04 -2.46 0.03 0.00 -0.00 0.00 0.00 55.36 52.97 1fhq s GLN 589 Cb -0.14 -2.65 -0.02 0.00 0.00 0.00 0.00 33.01 30.20 1fhq s GLN 589 CO -0.06 -1.21 0.08 -1.21 0.00 0.00 0.00 175.29 172.89 1fhq s GLU 590 N -0.25 2.02 -0.11 9.60 2.02 -0.43 -4.82 118.70 126.73 1fhq s GLU 590 Ca 0.21 -2.25 -0.00 0.00 0.02 0.00 0.00 54.97 52.94 1fhq s GLU 590 Cb -0.16 -0.95 0.02 0.00 0.10 0.00 0.00 34.13 33.14 1fhq s GLU 590 CO -0.07 -0.43 -0.07 -1.54 0.02 0.00 0.00 175.26 173.17 1fhq s SER 591 N -3.70 2.17 -0.07 -0.19 1.04 -1.26 0.45 113.70 112.13 1fhq s SER 591 Ca 0.18 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.33 1fhq s SER 591 Cb 0.02 -0.83 -0.03 0.00 0.10 0.00 0.00 66.02 65.29 1fhq s SER 591 CO 0.11 -0.12 -0.10 -0.76 0.98 0.00 0.00 173.24 173.34 1fhq s LEU 592 N 1.72 2.96 -0.15 2.42 1.02 0.65 -4.92 118.68 122.38 1fhq s LEU 592 Ca 0.05 -0.12 0.00 0.00 0.02 0.00 0.00 54.13 54.08 1fhq s LEU 592 Cb -0.13 -1.63 0.02 0.00 0.02 0.00 0.00 46.19 44.47 1fhq s LEU 592 CO -0.08 0.33 -0.15 -1.61 0.02 0.00 0.00 176.35 174.86 1fhq s GLU 593 N -0.62 2.39 0.14 1.70 8.01 -1.26 0.30 118.70 129.37 1fhq s GLU 593 Ca 0.09 -0.59 -0.30 0.00 0.01 0.00 0.00 54.97 54.18 1fhq s GLU 593 Cb -0.11 -2.17 -0.07 0.00 -4.31 0.00 0.00 34.13 27.47 1fhq s GLU 593 CO 0.01 -0.23 0.99 0.42 0.01 0.00 0.00 175.26 176.46 1fhq s ILE 594 N 1.46 4.30 0.18 -1.63 1.01 0.23 -4.94 121.20 121.81 1fhq s ILE 594 Ca 0.05 1.98 -0.28 0.00 0.00 0.00 0.00 60.65 62.40 1fhq s ILE 594 Cb -0.13 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 38.00 1fhq s ILE 594 CO -0.11 0.34 0.88 -1.10 0.00 0.00 0.00 174.94 174.95 1fhq s GLN 595 N -0.26 4.71 0.63 2.79 1.11 -1.25 -2.18 119.66 125.20 1fhq s GLN 595 Ca 0.46 1.35 0.24 0.00 0.01 0.00 0.00 55.36 57.42 1fhq s GLN 595 Cb -0.25 -3.30 1.14 0.00 -1.01 0.00 0.00 33.01 29.59 1fhq s GLN 595 CO 0.31 0.46 1.61 -0.56 0.01 0.00 0.00 175.29 177.12 1fhq h GLN 596 N 4.61 0.00 0.00 2.91 -0.00 -1.79 1.12 115.11 121.96 1fhq h GLN 596 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.20 1fhq h GLN 596 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.68 1fhq h GLN 596 CO 0.68 0.00 -1.05 0.41 -0.00 0.00 0.00 178.83 178.87 1fhq n GLY 597 N -1.48 -1.31 3.59 0.06 0.00 -1.26 -4.83 105.19 99.96 1fhq n GLY 597 Ca 0.08 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 1fhq n GLY 597 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fhq s VAL 598 N -3.28 4.58 -0.13 1.61 1.01 0.39 -4.99 120.40 119.58 1fhq s VAL 598 Ca 0.01 1.07 -0.05 0.00 0.00 0.00 0.00 61.98 63.01 1fhq s VAL 598 Cb 0.12 -4.34 0.06 0.00 0.00 0.00 0.00 36.38 32.23 1fhq s VAL 598 CO 0.80 -0.58 0.28 0.21 0.00 0.00 0.00 175.10 175.80 1fhq s ASN 599 N 1.95 0.13 0.41 3.32 3.84 -1.26 -4.31 114.94 119.02 1fhq s ASN 599 Ca 0.37 0.62 -0.02 0.00 0.21 0.00 0.00 52.86 54.04 1fhq s ASN 599 Cb -0.12 0.68 -0.03 0.00 -0.55 0.00 0.00 41.25 41.23 1fhq s ASN 599 CO 0.20 -0.22 0.65 -2.16 -2.79 0.00 0.00 177.10 172.78 1fhq s PRO 600 N 2.12 3.47 -0.31 0.43 0.04 -1.26 -4.95 135.00 134.54 1fhq s PRO 600 Ca -0.02 -0.14 -0.21 0.00 0.04 0.00 0.00 61.00 60.67 1fhq s PRO 600 Cb -0.11 -2.54 -0.00 0.00 0.04 0.00 0.00 34.50 31.88 1fhq s PRO 600 CO -0.09 -0.02 0.68 0.12 0.04 0.00 0.00 177.00 177.73 1fhq s PHE 601 N -2.50 3.20 0.04 0.56 5.36 0.51 -4.85 117.98 120.30 1fhq s PHE 601 Ca 0.43 0.63 -0.19 0.00 -0.96 0.00 0.00 56.93 56.84 1fhq s PHE 601 Cb -0.10 -3.08 -0.06 0.00 -0.34 0.00 0.00 43.02 39.44 1fhq s PHE 601 CO 0.40 -0.52 0.55 -0.06 -1.46 0.00 0.00 175.22 174.12 1fhq s PHE 602 N 2.74 3.76 0.00 10.12 0.08 -1.26 0.10 117.98 133.52 1fhq s PHE 602 Ca 0.27 1.21 0.03 0.00 0.12 0.00 0.00 56.93 58.57 1fhq s PHE 602 Cb -0.15 -2.50 -0.01 0.00 -0.57 0.00 0.00 43.02 39.80 1fhq s PHE 602 CO 0.12 0.53 -0.10 0.42 -0.10 0.00 0.00 175.22 176.09 1fhq s ILE 603 N -0.85 0.80 -2.89 0.64 1.01 0.72 0.24 121.20 120.87 1fhq s ILE 603 Ca 0.29 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.42 1fhq s ILE 603 Cb -0.19 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.60 1fhq s ILE 603 CO 0.18 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.89 1fhq n GLY 604 N 2.66 -1.20 0.10 6.18 0.00 -1.25 0.51 105.19 112.19 1fhq n GLY 604 Ca -0.14 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 1fhq n GLY 604 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1fhq h ARG 605 N 0.00 0.17 -6.25 1.61 9.65 0.10 -2.85 114.38 116.81 1fhq h ARG 605 Ca 0.00 -0.15 -0.56 0.00 -1.10 0.00 0.00 59.98 58.17 1fhq h ARG 605 Cb 0.00 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.59 1fhq h ARG 605 CO 0.00 0.84 1.04 -1.12 2.80 0.00 0.00 179.97 183.53 1fhq s SER 606 N -6.20 6.63 0.64 -3.80 0.01 -1.25 -4.67 113.70 105.06 1fhq s SER 606 Ca -0.16 1.77 0.15 0.00 1.31 0.00 0.00 55.95 59.02 1fhq s SER 606 Cb 0.01 -2.53 0.64 0.00 0.21 0.00 0.00 66.02 64.34 1fhq s SER 606 CO 0.73 -1.02 1.29 -0.08 0.41 0.00 0.00 173.24 174.57 1fhq h GLU 607 N 9.61 0.00 -1.58 12.44 4.81 -1.88 0.41 114.58 138.39 1fhq h GLU 607 Ca -0.33 0.00 0.50 0.00 -0.13 0.00 0.00 59.36 59.41 1fhq h GLU 607 Cb 1.14 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.41 1fhq h GLU 607 CO 0.98 0.00 1.07 -0.44 -0.73 0.00 0.00 179.01 179.89 1fhq h ASP 608 N 0.00 0.13 -2.67 1.04 3.32 -1.88 -3.35 116.42 113.01 1fhq h ASP 608 Ca 0.19 0.10 -0.55 0.00 0.02 0.00 0.00 57.03 56.79 1fhq h ASP 608 Cb 2.12 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 41.75 1fhq h ASP 608 CO -0.00 -0.15 1.05 0.00 -1.72 0.00 0.00 179.24 178.42 1fhq n ASN 610 N 7.09 0.18 -4.85 0.00 2.85 0.20 -4.01 115.26 116.73 1fhq n ASN 610 Ca 0.17 1.31 -0.36 0.00 -0.11 0.00 0.00 54.58 55.59 1fhq n ASN 610 Cb 0.43 -0.65 -0.06 0.00 1.24 0.00 0.00 39.78 40.75 1fhq n ASN 610 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1fhq s LYS 612 N -1.75 2.49 -0.15 0.00 1.02 -1.26 -3.97 119.74 116.13 1fhq s LYS 612 Ca 0.33 -1.20 -0.04 0.00 0.02 0.00 0.00 55.97 55.08 1fhq s LYS 612 Cb -0.15 -2.97 0.05 0.00 -0.52 0.00 0.00 37.83 34.24 1fhq s LYS 612 CO 0.18 -0.52 0.07 0.42 -0.92 0.00 0.00 175.35 174.57 1fhq s ILE 613 N 1.21 0.09 -0.57 2.17 -1.09 -1.08 -5.02 121.20 116.92 1fhq s ILE 613 Ca -0.05 -0.14 -0.14 0.00 -2.23 0.00 0.00 60.65 58.09 1fhq s ILE 613 Cb -0.19 -0.61 0.14 0.00 -1.58 0.00 0.00 42.46 40.23 1fhq s ILE 613 CO -0.04 -0.15 0.51 -1.61 -1.23 0.00 0.00 174.94 172.42 1fhq s GLU 614 N 2.06 2.98 -0.20 2.79 2.02 -1.26 -3.20 118.70 123.89 1fhq s GLU 614 Ca 0.02 -1.84 -0.02 0.00 0.02 0.00 0.00 54.97 53.15 1fhq s GLU 614 Cb -0.15 -4.25 0.06 0.00 0.10 0.00 0.00 34.13 29.89 1fhq s GLU 614 CO -0.07 -1.30 0.03 0.34 0.02 0.00 0.00 175.26 174.27 1fhq s ASP 615 N 3.20 3.08 0.23 -0.19 -1.08 -1.26 -5.01 116.67 115.63 1fhq s ASP 615 Ca 0.06 -0.90 0.18 0.00 -0.52 0.00 0.00 52.55 51.36 1fhq s ASP 615 Cb -0.26 -0.68 0.76 0.00 -1.46 0.00 0.00 42.92 41.27 1fhq s ASP 615 CO 0.01 -0.30 0.76 0.59 0.52 0.00 0.00 175.17 176.74 1fhq n ASN 616 N 5.00 0.08 0.03 -0.34 3.02 -1.26 0.20 115.26 121.98 1fhq n ASN 616 Ca -0.09 0.63 -0.17 0.00 -0.03 0.00 0.00 54.58 54.92 1fhq n ASN 616 Cb 0.46 -0.31 -0.07 0.00 -0.61 0.00 0.00 39.78 39.26 1fhq n ASN 616 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1fhq h ARG 617 N 0.00 0.65 -7.22 3.52 2.47 -1.99 -3.46 114.38 108.36 1fhq h ARG 617 Ca 0.44 -0.62 -0.52 0.00 -1.26 0.00 0.00 59.98 58.01 1fhq h ARG 617 Cb 1.50 0.16 0.20 0.00 -1.65 0.00 0.00 29.97 30.18 1fhq h ARG 617 CO -0.17 1.23 0.19 1.28 0.56 0.00 0.00 179.97 183.05 1fhq n LEU 618 N -3.86 3.32 0.00 3.04 4.77 0.53 -4.82 117.00 119.97 1fhq n LEU 618 Ca -0.08 0.45 -0.18 0.00 -0.03 0.00 0.00 56.01 56.17 1fhq n LEU 618 Cb 0.81 -1.47 -0.02 0.00 -2.33 0.00 0.00 43.42 40.42 1fhq n LEU 618 CO 0.53 -2.17 -0.04 -1.54 -1.33 0.00 0.00 177.39 172.85 1fhq n SER 619 N -3.81 2.40 -0.19 -1.43 3.41 -1.26 -4.52 113.62 108.22 1fhq n SER 619 Ca 0.12 -2.25 -0.03 0.00 -0.26 0.00 0.00 58.87 56.45 1fhq n SER 619 Cb 0.52 0.07 0.08 0.00 -0.26 0.00 0.00 64.21 64.62 1fhq n SER 619 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1fhq h ARG 620 N 0.00 0.51 -1.29 4.33 -0.00 -1.91 0.98 114.38 117.00 1fhq h ARG 620 Ca -0.23 -0.03 -0.56 0.00 -0.50 0.00 0.00 59.98 58.66 1fhq h ARG 620 Cb 0.79 -0.11 -0.42 0.00 0.00 0.00 0.00 29.97 30.22 1fhq h ARG 620 CO 0.38 0.33 -0.79 0.28 0.00 0.00 0.00 179.97 180.17 1fhq n VAL 621 N -4.89 2.29 -0.41 2.04 0.31 -1.26 -4.13 118.33 112.28 1fhq n VAL 621 Ca 0.06 -4.61 0.34 0.00 -0.01 0.00 0.00 64.34 60.13 1fhq n VAL 621 Cb 0.18 -1.05 0.57 0.00 -0.91 0.00 0.00 33.84 32.63 1fhq n VAL 621 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1fhq n HIS 622 N -0.51 0.54 0.00 3.52 -0.00 0.42 -4.14 115.22 115.05 1fhq n HIS 622 Ca 0.37 0.55 0.00 0.00 0.46 0.00 0.00 57.72 59.10 1fhq n HIS 622 Cb 0.74 -0.96 0.00 0.00 -0.12 0.00 0.00 29.99 29.65 1fhq n HIS 622 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1fhq s PHE 624 N -2.00 0.09 -0.25 0.00 -0.12 0.14 0.26 117.98 116.09 1fhq s PHE 624 Ca 0.00 -0.25 -0.10 0.00 -0.05 0.00 0.00 56.93 56.54 1fhq s PHE 624 Cb 0.00 -0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.27 1fhq s PHE 624 CO 0.00 -0.32 0.14 0.42 -0.05 0.00 0.00 175.22 175.41 1fhq s ILE 625 N -1.79 5.06 0.14 -4.49 1.09 0.28 0.18 121.20 121.67 1fhq s ILE 625 Ca -0.12 0.08 0.06 0.00 -1.10 0.00 0.00 60.65 59.58 1fhq s ILE 625 Cb -0.06 -3.37 -0.04 0.00 -1.06 0.00 0.00 42.46 37.94 1fhq s ILE 625 CO -0.00 0.32 -0.01 0.12 -0.10 0.00 0.00 174.94 175.27 1fhq s PHE 626 N 1.34 2.89 -0.07 3.97 5.36 0.59 0.19 117.98 132.26 1fhq s PHE 626 Ca 0.07 -0.10 0.04 0.00 -0.96 0.00 0.00 56.93 55.98 1fhq s PHE 626 Cb -0.15 -1.44 -0.02 0.00 -0.34 0.00 0.00 43.02 41.08 1fhq s PHE 626 CO 0.06 0.49 -0.20 0.21 -1.46 0.00 0.00 175.22 174.32 1fhq s LYS 627 N -2.66 2.66 0.10 10.12 2.47 -1.26 0.26 119.74 131.43 1fhq s LYS 627 Ca 0.26 -0.81 0.02 0.00 -1.56 0.00 0.00 55.97 53.88 1fhq s LYS 627 Cb -0.10 -2.30 -0.04 0.00 -1.46 0.00 0.00 37.83 33.93 1fhq s LYS 627 CO 0.18 0.43 -0.07 0.21 0.16 0.00 0.00 175.35 176.26 1fhq s LYS 628 N -0.25 0.83 -0.36 4.03 2.36 0.12 -4.95 119.74 121.51 1fhq s LYS 628 Ca 0.00 -1.29 -0.29 0.00 -2.55 0.00 0.00 55.97 51.84 1fhq s LYS 628 Cb -0.13 -0.26 0.01 0.00 -1.05 0.00 0.00 37.83 36.40 1fhq s LYS 628 CO 0.03 -0.00 1.29 0.50 1.55 0.00 0.00 175.35 178.71 1fhq s ARG 629 N -3.59 3.82 0.07 4.03 6.06 -1.26 0.20 118.95 128.28 1fhq s ARG 629 Ca 0.10 1.06 -0.30 0.00 -2.50 0.00 0.00 55.73 54.08 1fhq s ARG 629 Cb 0.03 -3.91 -0.09 0.00 0.06 0.00 0.00 34.95 31.04 1fhq s ARG 629 CO -0.04 -1.25 1.87 -1.58 -2.50 0.00 0.00 175.30 171.80 1fhq s HIS 630 N 4.59 1.76 -0.20 5.12 5.65 0.60 -4.82 115.29 127.98 1fhq s HIS 630 Ca 0.55 -0.19 -0.13 0.00 0.25 0.00 0.00 55.06 55.54 1fhq s HIS 630 Cb -0.14 -4.18 -0.05 0.00 -1.18 0.00 0.00 32.58 27.03 1fhq s HIS 630 CO 0.26 -5.06 0.27 0.00 -0.65 0.00 0.00 174.74 169.55 1fhq s ALA 631 N 3.60 3.60 0.36 1.58 0.00 -1.26 -3.00 121.76 126.63 1fhq s ALA 631 Ca 0.83 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.15 1fhq s ALA 631 Cb -0.43 -2.43 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 1fhq s ALA 631 CO 0.38 -0.13 0.57 0.54 0.00 0.00 0.00 175.76 177.13 1fhq s VAL 632 N 0.93 5.05 0.00 0.00 0.11 -1.25 -5.06 120.40 120.18 1fhq s VAL 632 Ca 0.14 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.77 1fhq s VAL 632 Cb -0.14 -3.85 0.00 0.00 -1.53 0.00 0.00 36.38 30.87 1fhq s VAL 632 CO 0.05 -0.57 0.00 0.61 -3.33 0.00 0.00 175.10 171.85 1fhq n GLY 633 N -1.83 0.34 3.55 6.54 0.00 -1.26 -4.98 105.19 107.55 1fhq n GLY 633 Ca -0.04 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.72 1fhq n GLY 633 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fhq s LYS 634 N -0.95 3.05 -0.31 1.61 2.20 -1.26 -4.97 119.74 119.10 1fhq s LYS 634 Ca 0.00 -0.03 -0.25 0.00 -0.36 0.00 0.00 55.97 55.33 1fhq s LYS 634 Cb 0.00 -4.24 0.01 0.00 -1.51 0.00 0.00 37.83 32.08 1fhq s LYS 634 CO 0.00 -2.31 0.89 -1.54 -0.36 0.00 0.00 175.35 172.04 1fhq s SER 635 N 4.89 6.77 -0.49 1.43 1.04 -1.26 -4.93 113.70 121.16 1fhq s SER 635 Ca 0.43 0.82 -0.02 0.00 0.48 0.00 0.00 55.95 57.67 1fhq s SER 635 Cb -0.09 -2.46 0.31 0.00 0.10 0.00 0.00 66.02 63.88 1fhq s SER 635 CO 0.16 -0.70 2.05 0.80 0.98 0.00 0.00 173.24 176.53 1fhq n MET 636 N 6.42 2.22 -1.69 4.02 1.56 -1.26 -4.90 117.12 123.50 1fhq n MET 636 Ca 0.07 -2.37 0.00 0.00 -0.27 0.00 0.00 57.70 55.12 1fhq n MET 636 Cb 0.48 -1.94 0.00 0.00 2.15 0.00 0.00 33.22 33.91 1fhq n MET 636 CO 0.00 0.00 0.00 0.98 -0.73 0.00 0.00 175.97 176.22 1fhq n TYR 637 N -0.20 0.00 -3.84 1.12 9.36 -1.26 -5.10 117.16 117.25 1fhq n TYR 637 Ca 0.45 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 61.32 1fhq n TYR 637 Cb 0.60 0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 39.19 1fhq n TYR 637 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1fhq s GLU 638 N -0.21 1.88 0.05 2.98 2.02 -1.26 -5.07 118.70 119.09 1fhq s GLU 638 Ca 0.00 -1.85 0.00 0.00 0.02 0.00 0.00 54.97 53.14 1fhq s GLU 638 Cb 0.00 -3.49 -0.03 0.00 0.10 0.00 0.00 34.13 30.70 1fhq s GLU 638 CO 0.00 -1.04 -0.04 -1.54 0.02 0.00 0.00 175.26 172.65 1fhq s SER 639 N 1.57 0.58 0.00 -0.19 1.04 -1.26 -5.16 113.70 110.28 1fhq s SER 639 Ca 0.09 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.73 1fhq s SER 639 Cb -0.22 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.03 1fhq s SER 639 CO -0.05 -0.43 0.00 -2.65 0.98 0.00 0.00 173.24 171.08 1fhq n PRO 640 N 0.70 2.73 0.00 4.02 -0.02 -1.26 -4.45 135.00 136.72 1fhq n PRO 640 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1fhq n PRO 640 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.06 1fhq n PRO 640 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fhq n ALA 641 N -3.00 0.00 0.00 3.55 0.00 -1.26 -4.94 120.51 114.86 1fhq n ALA 641 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1fhq n ALA 641 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1fhq n ALA 641 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1fhq n GLN 642 N 0.00 0.00 -4.06 0.00 -0.06 -1.26 -4.48 117.38 107.52 1fhq n GLN 642 Ca 0.00 0.00 -0.34 0.00 -2.00 0.00 0.00 57.00 54.66 1fhq n GLN 642 Cb 0.00 0.00 -0.15 0.00 -4.06 0.00 0.00 30.24 26.03 1fhq n GLN 642 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 1fhq s GLY 643 N 0.00 1.53 0.00 1.69 0.00 -1.26 -3.89 107.32 105.39 1fhq s GLY 643 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 44.72 43.56 1fhq s GLY 643 CO 0.00 0.32 0.00 1.04 0.00 0.00 0.00 173.10 174.46 1fhq n LEU 644 N 4.62 0.00 -4.10 0.66 4.32 -1.16 -4.95 117.00 116.39 1fhq n LEU 644 Ca -0.19 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.50 1fhq n LEU 644 Cb 0.51 0.00 -0.17 0.00 -1.62 0.00 0.00 43.42 42.14 1fhq n LEU 644 CO 0.28 0.00 -0.52 -1.81 -1.22 0.00 0.00 177.39 174.13 1fhq s ASP 645 N 1.27 2.75 0.04 -1.43 1.01 -1.26 0.22 116.67 119.26 1fhq s ASP 645 Ca 0.00 -0.51 0.01 0.00 0.71 0.00 0.00 52.55 52.76 1fhq s ASP 645 Cb 0.00 -1.25 -0.04 0.00 1.01 0.00 0.00 42.92 42.64 1fhq s ASP 645 CO 0.00 0.04 0.07 -0.62 0.21 0.00 0.00 175.17 174.87 1fhq s ASP 646 N 0.94 5.53 -0.27 0.27 -1.08 0.53 -4.42 116.67 118.17 1fhq s ASP 646 Ca -0.06 0.05 -0.10 0.00 -0.52 0.00 0.00 52.55 51.92 1fhq s ASP 646 Cb -0.15 -1.52 -0.04 0.00 -1.46 0.00 0.00 42.92 39.75 1fhq s ASP 646 CO -0.02 0.23 0.15 0.27 0.52 0.00 0.00 175.17 176.31 1fhq s ILE 647 N -1.27 4.98 -0.13 4.11 -4.36 -1.26 0.15 121.20 123.41 1fhq s ILE 647 Ca 0.25 0.05 -0.04 0.00 -0.26 0.00 0.00 60.65 60.65 1fhq s ILE 647 Cb -0.12 -3.37 -0.03 0.00 1.25 0.00 0.00 42.46 40.19 1fhq s ILE 647 CO 0.17 0.27 0.02 0.26 0.24 0.00 0.00 174.94 175.91 1fhq s TRP 648 N 1.71 3.20 -0.29 1.37 0.52 0.72 -2.12 118.94 124.04 1fhq s TRP 648 Ca 0.07 0.09 -0.20 0.00 0.02 0.00 0.00 56.10 56.07 1fhq s TRP 648 Cb -0.16 -1.93 -0.01 0.00 -1.15 0.00 0.00 33.47 30.22 1fhq s TRP 648 CO 0.09 0.29 0.63 -0.47 0.02 0.00 0.00 176.95 177.51 1fhq s TYR 649 N -0.25 3.23 -0.36 -1.98 5.04 0.78 0.22 117.35 124.02 1fhq s TYR 649 Ca 0.07 0.63 -0.04 0.00 -2.44 0.00 0.00 57.07 55.28 1fhq s TYR 649 Cb -0.12 -2.96 0.07 0.00 0.35 0.00 0.00 41.96 39.30 1fhq s TYR 649 CO 0.02 -0.44 0.13 0.00 -1.34 0.00 0.00 175.55 173.92 1fhq s HIS 651 N 1.27 3.52 0.00 0.00 2.46 -0.81 0.23 115.29 121.96 1fhq s HIS 651 Ca 0.01 1.47 0.00 0.00 0.47 0.00 0.00 55.06 57.01 1fhq s HIS 651 Cb -0.21 -3.29 0.00 0.00 -0.13 0.00 0.00 32.58 28.95 1fhq s HIS 651 CO -0.01 -0.73 0.60 0.25 -2.47 0.00 0.00 174.74 172.38 1fhq n THR 652 N 3.97 0.31 -3.29 0.89 -2.24 -0.82 0.41 114.28 113.51 1fhq n THR 652 Ca 0.08 -0.56 -0.35 0.00 -2.27 0.00 0.00 64.05 60.95 1fhq n THR 652 Cb 0.48 0.97 -0.06 0.00 -2.10 0.00 0.00 70.33 69.62 1fhq n THR 652 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1fhq s GLY 653 N -0.31 2.46 0.43 3.38 0.00 0.51 -4.66 107.32 109.12 1fhq s GLY 653 Ca 0.00 -0.07 0.23 0.00 0.00 0.00 0.00 44.72 44.88 1fhq s GLY 653 CO 0.00 0.20 1.80 -0.84 0.00 0.00 0.00 173.10 174.26 1fhq h THR 654 N 2.63 0.59 0.00 0.90 2.02 -1.92 -2.90 112.91 114.22 1fhq h THR 654 Ca -0.48 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 65.50 1fhq h THR 654 Cb 1.19 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.41 1fhq h THR 654 CO 0.66 0.24 0.00 0.59 0.37 0.00 0.00 175.52 177.38 1fhq n ASN 655 N -3.39 0.00 -1.18 4.18 3.02 -1.26 -4.82 115.26 111.81 1fhq n ASN 655 Ca 0.00 -1.12 0.04 0.00 -0.03 0.00 0.00 54.58 53.48 1fhq n ASN 655 Cb 0.45 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.60 1fhq n ASN 655 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1fhq n VAL 656 N -0.74 -1.09 -4.46 2.41 3.14 -1.11 -4.79 118.33 111.69 1fhq n VAL 656 Ca 0.09 0.66 -0.23 0.00 -2.96 0.00 0.00 64.34 61.90 1fhq n VAL 656 Cb 0.04 -1.06 -0.10 0.00 -1.06 0.00 0.00 33.84 31.65 1fhq n VAL 656 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1fhq s SER 657 N -5.44 2.98 -0.13 6.55 0.15 -0.70 -4.38 113.70 112.74 1fhq s SER 657 Ca 0.00 -1.22 0.01 0.00 0.70 0.00 0.00 55.95 55.44 1fhq s SER 657 Cb 0.00 -0.21 0.02 0.00 -1.71 0.00 0.00 66.02 64.12 1fhq s SER 657 CO 0.00 -0.34 -0.13 -0.31 1.20 0.00 0.00 173.24 173.66 1fhq s TYR 658 N -2.94 1.92 -0.36 3.44 2.02 0.54 -2.25 117.35 119.73 1fhq s TYR 658 Ca 0.31 -1.00 0.00 0.00 -0.37 0.00 0.00 57.07 56.01 1fhq s TYR 658 Cb 0.04 -1.44 0.09 0.00 -0.40 0.00 0.00 41.96 40.25 1fhq s TYR 658 CO 0.13 -0.57 0.09 -1.17 -1.57 0.00 0.00 175.55 172.47 1fhq s LEU 659 N 1.38 4.73 0.00 -1.29 2.96 -0.78 0.05 118.68 125.73 1fhq s LEU 659 Ca 0.01 -1.90 0.00 0.00 -0.22 0.00 0.00 54.13 52.02 1fhq s LEU 659 Cb -0.13 -1.72 0.00 0.00 0.50 0.00 0.00 46.19 44.84 1fhq s LEU 659 CO -0.07 -0.41 0.00 -3.20 -1.32 0.00 0.00 176.35 171.34 1fhq n ASN 660 N 4.47 0.00 -0.36 3.68 2.85 -1.24 -1.03 115.26 123.63 1fhq n ASN 660 Ca -0.03 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.44 1fhq n ASN 660 Cb 0.42 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.44 1fhq n ASN 660 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1fhq n ASN 661 N 1.65 0.00 -4.39 1.20 5.15 -1.26 -5.10 115.26 112.51 1fhq n ASN 661 Ca 0.00 -1.44 -0.32 0.00 -0.60 0.00 0.00 54.58 52.22 1fhq n ASN 661 Cb 0.00 -0.09 -0.15 0.00 -0.53 0.00 0.00 39.78 39.02 1fhq n ASN 661 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1fhq s ASN 662 N -0.44 3.53 0.04 1.20 -0.87 -0.20 -5.12 114.94 113.07 1fhq s ASN 662 Ca 0.00 -0.34 -0.19 0.00 -1.57 0.00 0.00 52.86 50.76 1fhq s ASN 662 Cb 0.00 -0.58 -0.06 0.00 -0.02 0.00 0.00 41.25 40.59 1fhq s ASN 662 CO 0.00 0.33 0.55 -0.60 -2.57 0.00 0.00 177.10 174.80 1fhq s ARG 663 N -0.70 4.18 -0.21 -0.60 3.52 -1.26 -1.86 118.95 122.01 1fhq s ARG 663 Ca 0.11 0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 56.36 1fhq s ARG 663 Cb -0.10 -3.26 0.07 0.00 -1.56 0.00 0.00 34.95 30.09 1fhq s ARG 663 CO -0.00 0.58 0.03 -1.64 -0.81 0.00 0.00 175.30 173.46 1fhq s MET 664 N -0.88 0.79 0.32 5.12 -1.94 -0.95 -4.80 119.30 116.96 1fhq s MET 664 Ca 0.28 -0.58 -0.13 0.00 -1.71 0.00 0.00 55.69 53.56 1fhq s MET 664 Cb -0.19 -2.15 -0.08 0.00 2.01 0.00 0.00 34.83 34.42 1fhq s MET 664 CO 0.17 -0.68 0.70 0.96 -0.01 0.00 0.00 175.02 176.16 1fhq s ILE 665 N 1.77 4.76 -0.59 2.53 -4.36 -1.26 -1.71 121.20 122.33 1fhq s ILE 665 Ca -0.00 0.77 -0.34 0.00 -0.26 0.00 0.00 60.65 60.81 1fhq s ILE 665 Cb -0.17 -3.64 -0.15 0.00 1.25 0.00 0.00 42.46 39.75 1fhq s ILE 665 CO -0.10 -0.23 2.37 1.67 0.24 0.00 0.00 174.94 178.88 1fhq n GLN 666 N -0.52 0.53 0.00 0.37 7.27 -1.14 -1.29 117.38 122.61 1fhq n GLN 666 Ca 0.03 0.10 0.00 0.00 0.07 0.00 0.00 57.00 57.19 1fhq n GLN 666 Cb 0.53 -2.14 0.00 0.00 2.41 0.00 0.00 30.24 31.04 1fhq n GLN 666 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1fhq n GLY 667 N 6.65 2.00 3.49 1.69 0.00 0.16 -4.90 105.19 114.28 1fhq n GLY 667 Ca 0.51 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.28 1fhq n GLY 667 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fhq s THR 668 N -2.00 2.60 0.05 2.61 -4.23 -0.41 -1.34 115.64 112.92 1fhq s THR 668 Ca 0.00 -2.25 0.08 0.00 -1.18 0.00 0.00 61.69 58.34 1fhq s THR 668 Cb 0.00 -2.34 -0.03 0.00 1.34 0.00 0.00 72.50 71.47 1fhq s THR 668 CO 0.00 -0.33 -0.23 -0.75 -0.54 0.00 0.00 174.62 172.77 1fhq s LYS 669 N -3.34 1.51 -0.06 3.99 2.20 0.24 -1.93 119.74 122.34 1fhq s LYS 669 Ca 0.28 -1.02 -0.10 0.00 -0.36 0.00 0.00 55.97 54.78 1fhq s LYS 669 Cb -0.06 -1.66 0.02 0.00 -1.51 0.00 0.00 37.83 34.62 1fhq s LYS 669 CO 0.15 0.42 0.25 0.12 -0.36 0.00 0.00 175.35 175.93 1fhq s PHE 670 N -0.82 -0.20 0.24 4.03 5.36 0.16 -0.71 117.98 126.03 1fhq s PHE 670 Ca 0.09 0.45 -0.30 0.00 -0.96 0.00 0.00 56.93 56.21 1fhq s PHE 670 Cb -0.09 0.07 -0.09 0.00 -0.34 0.00 0.00 43.02 42.57 1fhq s PHE 670 CO 0.02 -0.22 1.14 -1.17 -1.46 0.00 0.00 175.22 173.53 1fhq s LEU 671 N -0.45 4.51 -0.19 6.12 1.98 -1.26 0.27 118.68 129.65 1fhq s LEU 671 Ca -0.06 2.24 -0.03 0.00 -2.89 0.00 0.00 54.13 53.39 1fhq s LEU 671 Cb -0.04 -3.62 -0.02 0.00 0.66 0.00 0.00 46.19 43.18 1fhq s LEU 671 CO 0.01 -0.24 -0.05 -0.76 -1.89 0.00 0.00 176.35 173.43 1fhq s LEU 672 N -0.91 2.99 -0.17 -0.68 1.43 -0.90 -4.79 118.68 115.65 1fhq s LEU 672 Ca 0.48 -0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 53.22 1fhq s LEU 672 Cb -0.32 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1fhq s LEU 672 CO 0.39 0.06 0.03 -1.10 0.23 0.00 0.00 176.35 175.95 1fhq s GLN 673 N 1.03 3.81 -0.43 1.70 -0.21 -1.18 -4.29 119.66 120.09 1fhq s GLN 673 Ca 0.01 -0.40 -0.42 0.00 0.02 0.00 0.00 55.36 54.56 1fhq s GLN 673 Cb -0.15 -3.09 -0.18 0.00 1.00 0.00 0.00 33.01 30.59 1fhq s GLN 673 CO 0.00 0.30 1.42 -0.40 -2.12 0.00 0.00 175.29 174.50 1fhq n ASP 674 N 3.41 1.04 -0.16 5.90 5.75 0.44 -1.52 116.55 131.40 1fhq n ASP 674 Ca -0.17 1.08 0.00 0.00 -0.01 0.00 0.00 54.79 55.69 1fhq n ASP 674 Cb 0.52 -0.80 0.00 0.00 -1.03 0.00 0.00 41.12 39.82 1fhq n ASP 674 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fhq n GLY 675 N 3.50 1.06 3.57 6.12 0.00 0.50 -4.90 105.19 115.04 1fhq n GLY 675 Ca 0.28 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1fhq n GLY 675 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1fhq s ASP 676 N -2.48 6.03 -0.40 1.61 1.11 -0.58 -4.82 116.67 117.14 1fhq s ASP 676 Ca 0.00 -0.14 -0.17 0.00 0.18 0.00 0.00 52.55 52.42 1fhq s ASP 676 Cb 0.00 -2.13 0.01 0.00 1.07 0.00 0.00 42.92 41.88 1fhq s ASP 676 CO 0.00 -0.11 0.44 -0.70 1.18 0.00 0.00 175.17 175.98 1fhq s GLU 677 N 1.75 3.27 -0.21 8.23 -6.30 -1.26 -0.48 118.70 123.70 1fhq s GLU 677 Ca 0.07 -0.59 -0.07 0.00 -2.50 0.00 0.00 54.97 51.88 1fhq s GLU 677 Cb -0.16 -3.91 -0.03 0.00 0.00 0.00 0.00 34.13 30.02 1fhq s GLU 677 CO 0.11 -0.77 0.05 0.42 0.02 0.00 0.00 175.26 175.09 1fhq s ILE 678 N 2.19 4.46 -0.32 -3.70 1.01 -0.34 -3.69 121.20 120.81 1fhq s ILE 678 Ca 0.13 -0.14 -0.11 0.00 0.00 0.00 0.00 60.65 60.53 1fhq s ILE 678 Cb -0.17 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 1fhq s ILE 678 CO 0.14 0.41 0.19 -0.54 0.00 0.00 0.00 174.94 175.14 1fhq s LYS 679 N 0.89 3.52 0.14 2.79 1.02 0.11 -1.86 119.74 126.35 1fhq s LYS 679 Ca 0.03 -0.61 0.24 0.00 0.02 0.00 0.00 55.97 55.64 1fhq s LYS 679 Cb -0.14 -3.68 0.23 0.00 -0.52 0.00 0.00 37.83 33.72 1fhq s LYS 679 CO 0.02 -0.38 1.23 0.82 -0.92 0.00 0.00 175.35 176.12 1fhq h ILE 680 N 5.53 0.00 -2.43 2.17 2.04 -1.66 1.58 117.51 124.75 1fhq h ILE 680 Ca -0.32 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 64.83 1fhq h ILE 680 Cb 1.16 1.18 -0.24 0.00 -0.74 0.00 0.00 36.82 38.17 1fhq h ILE 680 CO 0.61 0.00 -0.18 -0.51 0.00 0.00 0.00 178.15 178.08 1fhq s ILE 681 N -3.22 -0.01 -0.14 -0.67 1.10 -1.25 -4.33 121.20 112.67 1fhq s ILE 681 Ca 0.04 0.05 -0.03 0.00 -0.51 0.00 0.00 60.65 60.21 1fhq s ILE 681 Cb 0.12 -0.74 0.05 0.00 0.15 0.00 0.00 42.46 42.04 1fhq s ILE 681 CO 0.75 0.02 0.03 0.86 -2.11 0.00 0.00 174.94 174.49 1fhq s TRP 682 N 1.27 0.78 -0.21 3.50 -0.00 -1.26 -1.75 118.94 121.27 1fhq s TRP 682 Ca -0.08 -0.52 -0.00 0.00 -0.00 0.00 0.00 56.10 55.50 1fhq s TRP 682 Cb -0.07 -0.90 0.02 0.00 -0.00 0.00 0.00 33.47 32.53 1fhq s TRP 682 CO -0.12 -0.49 -0.13 -0.51 -0.00 0.00 0.00 176.95 175.69 1fhq s ASP 683 N 1.94 3.75 0.07 5.86 1.11 -1.04 -5.01 116.67 123.35 1fhq s ASP 683 Ca 0.02 -0.76 -0.19 0.00 0.18 0.00 0.00 52.55 51.80 1fhq s ASP 683 Cb -0.15 -1.57 -0.10 0.00 1.07 0.00 0.00 42.92 42.17 1fhq s ASP 683 CO -0.07 -0.06 1.48 0.11 1.18 0.00 0.00 175.17 177.81 1fhq h LYS 684 N 7.96 0.39 -0.96 8.23 1.57 -1.95 0.87 116.57 132.68 1fhq h LYS 684 Ca -0.39 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 58.27 1fhq h LYS 684 Cb 1.12 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.35 1fhq h LYS 684 CO 0.60 0.61 0.63 -2.95 -0.57 0.00 0.00 179.45 177.77 1fhq h ASN 685 N 0.13 1.08 0.48 0.86 -1.07 -1.99 -2.67 115.58 112.40 1fhq h ASN 685 Ca 0.06 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.41 1fhq h ASN 685 Cb 0.46 -0.26 0.00 0.00 -2.07 0.00 0.00 38.32 36.45 1fhq h ASN 685 CO 0.02 0.76 -1.15 -3.20 0.07 0.00 0.00 177.43 173.93 1fhq n ASN 686 N -4.44 0.58 -1.49 6.14 5.15 -1.21 -4.95 115.26 115.05 1fhq n ASN 686 Ca 0.12 -0.08 -0.19 0.00 -0.60 0.00 0.00 54.58 53.82 1fhq n ASN 686 Cb 0.05 0.89 -0.08 0.00 -0.53 0.00 0.00 39.78 40.10 1fhq n ASN 686 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1fhq n LYS 687 N -2.14 -1.41 -3.58 1.20 5.02 0.30 -4.95 118.16 112.61 1fhq n LYS 687 Ca 0.01 1.18 -0.38 0.00 -2.02 0.00 0.00 58.31 57.10 1fhq n LYS 687 Cb 0.48 -5.53 -0.11 0.00 -0.02 0.00 0.00 35.03 29.84 1fhq n LYS 687 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1fhq s PHE 688 N -2.69 3.23 -0.13 2.13 -0.71 -1.12 -4.94 117.98 113.75 1fhq s PHE 688 Ca 0.00 0.14 0.00 0.00 -1.04 0.00 0.00 56.93 56.04 1fhq s PHE 688 Cb 0.00 -2.39 0.02 0.00 -1.21 0.00 0.00 43.02 39.44 1fhq s PHE 688 CO 0.00 -0.15 -0.12 0.14 -1.34 0.00 0.00 175.22 173.75 1fhq s VAL 689 N 1.74 1.37 -0.21 -2.49 -7.23 -1.26 -2.51 120.40 109.81 1fhq s VAL 689 Ca 0.08 -0.52 -0.19 0.00 -1.81 0.00 0.00 61.98 59.53 1fhq s VAL 689 Cb -0.16 -1.30 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 1fhq s VAL 689 CO 0.11 0.42 0.57 -0.51 -0.31 0.00 0.00 175.10 175.38 1fhq s ILE 690 N 1.41 5.06 -0.11 -0.62 1.10 -0.71 -3.52 121.20 123.81 1fhq s ILE 690 Ca 0.02 1.06 -0.07 0.00 -0.51 0.00 0.00 60.65 61.14 1fhq s ILE 690 Cb -0.13 -3.89 0.04 0.00 0.15 0.00 0.00 42.46 38.63 1fhq s ILE 690 CO -0.07 0.13 0.28 -0.83 -2.11 0.00 0.00 174.94 172.34 1fhq s GLY 691 N 1.22 -0.19 -0.01 1.50 0.00 -1.26 -1.89 107.32 106.68 1fhq s GLY 691 Ca 0.26 0.99 0.05 0.00 0.00 0.00 0.00 44.72 46.01 1fhq s GLY 691 CO 0.10 1.09 -0.15 -1.36 0.00 0.00 0.00 173.10 172.77 1fhq s PHE 692 N 0.85 2.65 -0.30 1.90 0.08 -0.78 -0.92 117.98 121.46 1fhq s PHE 692 Ca -0.06 -0.19 -0.11 0.00 0.12 0.00 0.00 56.93 56.69 1fhq s PHE 692 Cb -0.07 -1.57 -0.03 0.00 -0.57 0.00 0.00 43.02 40.79 1fhq s PHE 692 CO -0.06 0.21 0.18 0.21 -0.10 0.00 0.00 175.22 175.67 1fhq s LYS 693 N -1.01 3.60 -0.21 0.44 2.47 0.28 -1.20 119.74 124.10 1fhq s LYS 693 Ca 0.13 -0.55 -0.29 0.00 -1.56 0.00 0.00 55.97 53.69 1fhq s LYS 693 Cb -0.11 -3.64 0.01 0.00 -1.46 0.00 0.00 37.83 32.63 1fhq s LYS 693 CO 0.03 -0.33 1.07 0.08 0.16 0.00 0.00 175.35 176.35 1fhq s VAL 694 N 1.69 4.63 -0.19 4.02 1.01 0.37 -2.02 120.40 129.91 1fhq s VAL 694 Ca 0.06 1.97 -0.02 0.00 0.00 0.00 0.00 61.98 63.98 1fhq s VAL 694 Cb -0.17 -4.27 0.06 0.00 0.00 0.00 0.00 36.38 32.00 1fhq s VAL 694 CO 0.09 -0.16 0.02 -1.61 0.00 0.00 0.00 175.10 173.43 1fhq s GLU 695 N 3.16 0.81 -0.47 2.72 0.41 0.53 0.19 118.70 126.06 1fhq s GLU 695 Ca 0.46 -0.46 -0.25 0.00 -0.41 0.00 0.00 54.97 54.30 1fhq s GLU 695 Cb -0.16 -2.09 0.03 0.00 -1.78 0.00 0.00 34.13 30.13 1fhq s GLU 695 CO 0.08 -0.60 0.91 0.42 -0.49 0.00 0.00 175.26 175.57 1fhq s ILE 696 N 1.80 4.48 -0.06 -1.63 1.01 -1.26 0.10 121.20 125.64 1fhq s ILE 696 Ca -0.01 0.62 -0.18 0.00 0.00 0.00 0.00 60.65 61.07 1fhq s ILE 696 Cb -0.17 -4.44 -0.30 0.00 0.01 0.00 0.00 42.46 37.56 1fhq s ILE 696 CO -0.08 -0.86 0.77 0.78 0.00 0.00 0.00 174.94 175.55 1fhq h ASN 697 N 9.11 0.49 -3.62 3.58 -0.26 -1.64 -3.46 115.58 119.78 1fhq h ASN 697 Ca -0.24 -0.91 -0.68 0.00 -0.56 0.00 0.00 56.30 53.90 1fhq h ASN 697 Cb 1.08 -0.16 -0.18 0.00 -1.06 0.00 0.00 38.32 38.00 1fhq h ASN 697 CO 1.03 1.53 -0.69 -1.81 -1.06 0.00 0.00 177.43 176.43 1fhq s ASP 698 N -7.08 4.69 -0.49 5.81 1.11 -1.13 -5.05 116.67 114.52 1fhq s ASP 698 Ca -0.15 -0.05 -0.02 0.00 0.18 0.00 0.00 52.55 52.50 1fhq s ASP 698 Cb 0.03 -1.16 0.13 0.00 1.07 0.00 0.00 42.92 42.98 1fhq s ASP 698 CO 0.82 0.34 0.29 0.42 1.18 0.00 0.00 175.17 178.22 1fhq s THR 699 N -0.88 3.40 -1.12 -1.27 -4.23 -1.26 -4.58 115.64 105.69 1fhq s THR 699 Ca 0.14 -2.45 -0.17 0.00 -1.18 0.00 0.00 61.69 58.03 1fhq s THR 699 Cb -0.11 -3.29 -0.06 0.00 1.34 0.00 0.00 72.50 70.38 1fhq s THR 699 CO 0.04 -0.76 2.10 0.35 -0.54 0.00 0.00 174.62 175.81 1fhq n THR 700 N 4.12 2.67 -3.36 3.99 -2.24 -1.26 -4.18 114.28 114.03 1fhq n THR 700 Ca 0.02 -2.27 -0.18 0.00 -2.27 0.00 0.00 64.05 59.35 1fhq n THR 700 Cb 0.40 -2.46 0.08 0.00 -2.10 0.00 0.00 70.33 66.24 1fhq n THR 700 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fhq n GLY 701 N 4.28 -0.31 3.71 3.38 0.00 -1.26 -4.86 105.19 110.13 1fhq n GLY 701 Ca 0.51 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 46.20 1fhq n GLY 701 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fhq s LEU 702 N -6.18 4.37 0.32 0.99 2.01 -1.26 -4.19 118.68 114.74 1fhq s LEU 702 Ca 0.23 1.91 0.08 0.00 0.01 0.00 0.00 54.13 56.35 1fhq s LEU 702 Cb -0.10 -3.58 0.92 0.00 0.01 0.00 0.00 46.19 43.44 1fhq s LEU 702 CO 0.65 -0.42 1.61 2.19 1.01 0.00 0.00 176.35 181.38 1fhq h PHE 703 N 6.83 0.38 0.00 0.29 -0.00 -1.86 -3.22 116.94 119.36 1fhq h PHE 703 Ca -0.41 0.05 0.00 0.00 -0.00 0.00 0.00 57.97 57.61 1fhq h PHE 703 Cb 1.21 -0.01 0.00 0.00 -0.00 0.00 0.00 35.95 37.15 1fhq h PHE 703 CO 0.67 -0.35 -0.94 -1.71 -0.00 0.00 0.00 178.31 175.98 1fhq n ASN 704 N -5.31 3.04 0.00 -0.68 5.15 -1.26 -4.40 115.26 111.79 1fhq n ASN 704 Ca 0.27 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.25 1fhq n ASN 704 Cb 0.89 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.14 1fhq n ASN 704 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1fhq n GLU 705 N -2.54 0.00 0.00 1.20 0.28 -1.22 -4.82 120.64 113.54 1fhq n GLU 705 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1fhq n GLU 705 Cb 0.47 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.34 1fhq n GLU 705 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1fhq n GLY 706 N 0.00 1.53 1.10 -1.84 0.00 -1.26 -4.87 105.19 99.85 1fhq n GLY 706 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1fhq n GLY 706 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fhq n LEU 707 N 0.00 3.56 0.00 0.99 7.94 -1.26 0.17 117.00 128.40 1fhq n LEU 707 Ca 0.00 -1.93 0.00 0.00 -1.11 0.00 0.00 56.01 52.97 1fhq n LEU 707 Cb 0.00 -0.38 0.00 0.00 0.53 0.00 0.00 43.42 43.57 1fhq n LEU 707 CO 0.00 0.88 0.00 0.61 -1.11 0.00 0.00 177.39 177.77 1fhq n GLY 708 N 1.28 0.22 3.64 -3.96 0.00 -1.26 -4.60 105.19 100.51 1fhq n GLY 708 Ca 0.20 -2.21 -0.05 0.00 0.00 0.00 0.00 46.02 43.97 1fhq n GLY 708 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1fhq s MET 709 N 0.00 0.65 2.07 1.61 0.23 -1.26 -4.76 119.30 117.84 1fhq s MET 709 Ca 0.00 1.32 0.00 0.00 -1.03 0.00 0.00 55.69 55.98 1fhq s MET 709 Cb 0.00 0.45 0.00 0.00 -1.53 0.00 0.00 34.83 33.75 1fhq s MET 709 CO 0.00 -0.17 0.00 -0.11 -2.03 0.00 0.00 175.02 172.71 1fhq n LEU 710 N 4.79 0.00 0.00 0.18 7.94 -1.26 -4.22 117.00 124.43 1fhq n LEU 710 Ca -0.17 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.73 1fhq n LEU 710 Cb 0.55 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.50 1fhq n LEU 710 CO -0.03 -0.36 0.00 1.67 -1.11 0.00 0.00 177.39 177.56 1fhq n GLN 711 N -0.30 0.00 -3.86 1.96 7.27 -1.26 -4.70 117.38 116.49 1fhq n GLN 711 Ca 0.00 0.00 -0.35 0.00 0.07 0.00 0.00 57.00 56.72 1fhq n GLN 711 Cb 0.00 -0.08 -0.13 0.00 2.41 0.00 0.00 30.24 32.45 1fhq n GLN 711 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 1fhq s GLU 712 N 0.00 2.05 -0.42 3.69 2.02 -1.26 -5.04 118.70 119.74 1fhq s GLU 712 Ca 0.00 -1.65 0.01 0.00 0.02 0.00 0.00 54.97 53.35 1fhq s GLU 712 Cb 0.00 -3.39 0.11 0.00 0.10 0.00 0.00 34.13 30.95 1fhq s GLU 712 CO 0.00 -0.90 0.17 -1.14 0.02 0.00 0.00 175.26 173.41 1fhq s GLN 713 N 1.14 1.84 -0.46 1.61 0.74 -1.26 -4.97 119.66 118.29 1fhq s GLN 713 Ca 0.04 -2.02 0.06 0.00 0.05 0.00 0.00 55.36 53.49 1fhq s GLN 713 Cb -0.21 -3.41 0.20 0.00 1.10 0.00 0.00 33.01 30.69 1fhq s GLN 713 CO -0.04 -1.03 0.59 0.54 -0.55 0.00 0.00 175.29 174.80 1fhq n ARG 714 N 4.15 0.49 -5.01 1.67 5.12 -1.26 -4.80 116.66 117.02 1fhq n ARG 714 Ca 0.02 -2.55 -0.28 0.00 -1.93 0.00 0.00 57.85 53.11 1fhq n ARG 714 Cb 0.40 -1.49 -0.15 0.00 -1.16 0.00 0.00 32.46 30.05 1fhq n ARG 714 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1fhq s VAL 715 N 0.24 1.71 0.00 1.55 -7.23 -1.26 -4.91 120.40 110.50 1fhq s VAL 715 Ca 0.32 -0.97 -0.30 0.00 -1.81 0.00 0.00 61.98 59.23 1fhq s VAL 715 Cb 0.08 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.56 1fhq s VAL 715 CO -0.14 0.45 0.98 -0.69 -0.31 0.00 0.00 175.10 175.38 1fhq s VAL 716 N -0.55 4.87 0.37 1.32 1.01 -1.26 -4.65 120.40 121.51 1fhq s VAL 716 Ca 0.08 2.06 0.08 0.00 0.00 0.00 0.00 61.98 64.20 1fhq s VAL 716 Cb -0.08 -4.32 -0.05 0.00 0.00 0.00 0.00 36.38 31.93 1fhq s VAL 716 CO -0.00 0.16 0.14 -0.76 0.00 0.00 0.00 175.10 174.64 1fhq s LEU 717 N 1.00 3.16 -0.03 3.92 1.02 0.11 -4.95 118.68 122.91 1fhq s LEU 717 Ca 0.52 -0.93 -0.04 0.00 0.02 0.00 0.00 54.13 53.71 1fhq s LEU 717 Cb -0.21 -1.57 -0.04 0.00 0.02 0.00 0.00 46.19 44.39 1fhq s LEU 717 CO 0.28 -0.40 0.17 -0.54 0.02 0.00 0.00 176.35 175.88 1fhq s LYS 718 N -3.86 3.42 0.63 1.70 3.01 -1.26 0.79 119.74 124.18 1fhq s LYS 718 Ca 0.39 -0.29 -0.11 0.00 -1.01 0.00 0.00 55.97 54.95 1fhq s LYS 718 Cb 0.00 -3.11 -0.03 0.00 -1.01 0.00 0.00 37.83 33.69 1fhq s LYS 718 CO 0.22 0.70 1.04 1.14 0.51 0.00 0.00 175.35 178.96 1fhq s GLN 719 N -1.73 3.48 0.19 1.68 -2.07 -0.45 -4.65 119.66 116.11 1fhq s GLN 719 Ca 0.24 0.77 0.01 0.00 -1.82 0.00 0.00 55.36 54.56 1fhq s GLN 719 Cb -0.12 -2.07 -0.00 0.00 -1.09 0.00 0.00 33.01 29.73 1fhq s GLN 719 CO 0.15 -0.66 0.02 0.25 -1.32 0.00 0.00 175.29 173.74 1fhq n THR 720 N -2.81 0.00 -0.10 3.63 -2.24 -1.26 -4.98 114.28 106.52 1fhq n THR 720 Ca 0.06 -0.98 0.20 0.00 -2.27 0.00 0.00 64.05 61.06 1fhq n THR 720 Cb 0.54 0.26 0.62 0.00 -2.10 0.00 0.00 70.33 69.65 1fhq n THR 720 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fhq h ALA 721 N 1.17 2.40 -0.05 6.98 0.00 -1.98 -1.07 119.26 126.71 1fhq h ALA 721 Ca -0.16 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1fhq h ALA 721 Cb 0.51 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1fhq h ALA 721 CO 0.25 -0.59 0.03 1.49 0.00 0.00 0.00 179.25 180.44 1fhq h GLU 722 N 0.17 0.07 -0.20 0.00 4.81 -1.99 -0.76 114.58 116.67 1fhq h GLU 722 Ca 0.33 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.53 1fhq h GLU 722 Cb 1.06 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1fhq h GLU 722 CO -0.05 0.08 0.02 0.93 -0.73 0.00 0.00 179.01 179.26 1fhq h GLU 723 N 0.03 0.34 -0.54 1.92 4.39 -1.62 -2.78 114.58 116.32 1fhq h GLU 723 Ca 0.02 -0.10 0.10 0.00 0.34 0.00 0.00 59.36 59.71 1fhq h GLU 723 Cb 0.03 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1fhq h GLU 723 CO -0.00 0.51 0.37 -0.22 -1.16 0.00 0.00 179.01 178.50 1fhq h LYS 724 N 0.13 0.32 -0.34 2.33 3.64 -1.20 -0.68 116.57 120.77 1fhq h LYS 724 Ca 0.06 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1fhq h LYS 724 Cb 0.34 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1fhq h LYS 724 CO 0.01 0.21 -0.26 -0.44 -2.27 0.00 0.00 179.45 176.70 1fhq h ASP 725 N 0.33 0.71 -0.41 4.20 3.32 -0.87 -1.78 116.42 121.92 1fhq h ASP 725 Ca 0.25 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1fhq h ASP 725 Cb 0.54 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1fhq h ASP 725 CO -0.06 0.94 0.13 -0.07 -1.72 0.00 0.00 179.24 178.46 1fhq h LEU 726 N 0.60 0.60 -1.02 1.55 3.38 -0.92 -2.70 115.31 116.79 1fhq h LEU 726 Ca 0.08 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1fhq h LEU 726 Cb 0.75 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1fhq h LEU 726 CO 0.06 0.64 -0.48 1.62 0.09 0.00 0.00 178.44 180.37 1fhq h VAL 727 N 0.52 1.35 0.00 1.22 3.04 -1.40 -0.68 116.25 120.29 1fhq h VAL 727 Ca 0.13 -1.66 -0.03 0.00 -1.01 0.00 0.00 66.70 64.13 1fhq h VAL 727 Cb 0.25 1.88 -0.00 0.00 -2.01 0.00 0.00 31.29 31.42 1fhq h VAL 727 CO -0.00 0.47 -0.15 0.11 -1.01 0.00 0.00 177.57 176.99 1fhq h LYS 728 N 0.01 0.00 0.07 4.17 1.79 -1.01 -3.05 116.57 118.55 1fhq h LYS 728 Ca -0.00 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 58.10 1fhq h LYS 728 Cb 0.86 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.47 1fhq h LYS 728 CO 0.06 0.15 -2.12 1.17 -1.08 0.00 0.00 179.45 177.64 1fhq n LYS 729 N -3.87 0.70 -0.45 3.15 4.81 -1.01 -5.10 118.16 116.40 1fhq n LYS 729 Ca -0.02 0.26 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1fhq n LYS 729 Cb 0.25 -1.64 0.00 0.00 0.02 0.00 0.00 35.03 33.66 1fhq n LYS 729 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85