#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 -0.73 -2.05 -3.45 115.58 110.96 1fhq h ASN 574 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1fhq h ASN 574 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.59 1fhq h ASN 574 CO 0.00 0.00 0.00 0.61 -0.37 0.00 0.00 177.43 177.67 1fhq n GLY 575 N -0.01 0.49 3.70 1.57 0.00 -1.26 -5.11 105.19 104.58 1fhq n GLY 575 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 4.25 -0.02 1.61 3.00 -1.26 -1.25 118.95 125.28 1fhq s ARG 576 Ca 0.00 0.25 -0.00 0.00 -1.00 0.00 0.00 55.73 54.98 1fhq s ARG 576 Cb 0.00 -3.48 -0.01 0.00 0.00 0.00 0.00 34.95 31.46 1fhq s ARG 576 CO 0.00 0.09 -0.02 1.97 0.00 0.00 0.00 175.30 177.34 1fhq n PHE 577 N 4.02 0.00 -4.89 5.12 -1.74 -0.73 -4.44 117.46 114.80 1fhq n PHE 577 Ca -0.09 0.00 -0.31 0.00 -0.56 0.00 0.00 57.45 56.49 1fhq n PHE 577 Cb 0.51 -0.06 -0.14 0.00 1.52 0.00 0.00 39.48 41.32 1fhq n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 1fhq s LEU 578 N -5.59 2.51 -0.19 5.98 2.96 -0.53 -1.19 118.68 122.62 1fhq s LEU 578 Ca -0.02 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 1fhq s LEU 578 Cb 0.01 -1.48 0.04 0.00 0.50 0.00 0.00 46.19 45.26 1fhq s LEU 578 CO 0.03 0.30 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.38 1fhq s THR 579 N -0.78 1.54 -0.41 3.68 2.01 0.28 0.10 115.64 122.06 1fhq s THR 579 Ca 0.12 -0.94 -0.14 0.00 0.31 0.00 0.00 61.69 61.04 1fhq s THR 579 Cb -0.10 -1.64 0.02 0.00 0.01 0.00 0.00 72.50 70.79 1fhq s THR 579 CO 0.02 0.16 0.29 -0.76 -0.69 0.00 0.00 174.62 173.65 1fhq s LEU 580 N 1.44 5.09 -0.45 4.42 1.43 0.96 0.15 118.68 131.72 1fhq s LEU 580 Ca -0.01 -0.95 -0.08 0.00 -1.03 0.00 0.00 54.13 52.06 1fhq s LEU 580 Cb -0.16 -2.14 0.11 0.00 0.03 0.00 0.00 46.19 44.03 1fhq s LEU 580 CO -0.08 -0.45 0.30 -1.59 0.23 0.00 0.00 176.35 174.76 1fhq s LYS 581 N 1.66 2.42 -0.62 1.70 -2.85 0.43 0.18 119.74 122.67 1fhq s LYS 581 Ca 0.04 -1.72 -0.26 0.00 -1.00 0.00 0.00 55.97 53.04 1fhq s LYS 581 Cb -0.19 -3.84 -0.11 0.00 -2.06 0.00 0.00 37.83 31.63 1fhq s LYS 581 CO 0.09 -1.13 2.45 -0.35 0.10 0.00 0.00 175.35 176.51 1fhq n PRO 582 N 4.86 0.80 -1.61 1.78 -0.04 -0.09 -1.86 135.00 138.85 1fhq n PRO 582 Ca -0.07 -0.15 -0.31 0.00 -0.04 0.00 0.00 63.50 62.93 1fhq n PRO 582 Cb 0.41 -3.18 0.05 0.00 -0.04 0.00 0.00 33.50 30.75 1fhq n PRO 582 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1fhq s LEU 583 N 11.94 3.04 0.60 1.53 -0.00 -1.02 -2.34 118.68 132.43 1fhq s LEU 583 Ca 1.03 1.53 0.28 0.00 -0.00 0.00 0.00 54.13 56.97 1fhq s LEU 583 Cb -0.32 -4.37 1.32 0.00 -0.00 0.00 0.00 46.19 42.82 1fhq s LEU 583 CO 0.27 -1.48 1.72 -0.65 -0.00 0.00 0.00 176.35 176.21 1fhq h PRO 584 N -0.74 0.00 0.00 1.48 0.11 -1.90 0.87 132.00 131.82 1fhq h PRO 584 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1fhq h PRO 584 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1fhq h PRO 584 CO 0.58 0.00 0.00 0.22 -0.21 0.00 0.00 178.00 178.59 1fhq h ASP 585 N 0.00 0.00 -3.13 -2.05 1.82 -1.89 -3.41 116.42 107.77 1fhq h ASP 585 Ca 0.30 0.00 -0.59 0.00 -0.39 0.00 0.00 57.03 56.35 1fhq h ASP 585 Cb 1.71 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.68 1fhq h ASP 585 CO -0.00 0.00 -0.30 -0.55 -1.61 0.00 0.00 179.24 176.78 1fhq s SER 586 N -5.25 6.53 0.61 2.28 0.15 0.30 -4.53 113.70 113.80 1fhq s SER 586 Ca -0.03 0.65 0.29 0.00 0.70 0.00 0.00 55.95 57.55 1fhq s SER 586 Cb 0.12 -2.12 1.52 0.00 -1.71 0.00 0.00 66.02 63.83 1fhq s SER 586 CO 0.44 0.11 1.90 -0.29 1.20 0.00 0.00 173.24 176.60 1fhq h ILE 587 N 2.39 0.25 -3.78 6.45 6.09 -1.19 -3.40 117.51 124.32 1fhq h ILE 587 Ca -0.47 0.00 -0.68 0.00 -1.37 0.00 0.00 64.86 62.34 1fhq h ILE 587 Cb 1.18 0.64 -0.20 0.00 0.47 0.00 0.00 36.82 38.91 1fhq h ILE 587 CO 0.70 0.00 -0.75 -0.51 -3.07 0.00 0.00 178.15 174.52 1fhq s ILE 588 N -4.45 3.26 -0.62 2.19 2.07 -1.26 -5.08 121.20 117.32 1fhq s ILE 588 Ca -0.04 -0.94 0.05 0.00 -1.41 0.00 0.00 60.65 58.31 1fhq s ILE 588 Cb 0.13 -2.39 0.17 0.00 0.13 0.00 0.00 42.46 40.50 1fhq s ILE 588 CO 0.45 0.38 0.45 -1.10 -1.91 0.00 0.00 174.94 173.21 1fhq s GLN 589 N -1.39 1.99 0.41 3.50 1.11 -1.25 -4.25 119.66 119.78 1fhq s GLN 589 Ca 0.16 -2.97 0.03 0.00 0.01 0.00 0.00 55.36 52.59 1fhq s GLN 589 Cb -0.11 -2.81 -0.04 0.00 -1.01 0.00 0.00 33.01 29.04 1fhq s GLN 589 CO 0.06 -1.32 0.07 -1.21 0.01 0.00 0.00 175.29 172.90 1fhq s GLU 590 N -1.00 1.92 -0.11 2.91 0.41 -0.99 -5.00 118.70 116.85 1fhq s GLU 590 Ca 0.27 -2.15 -0.00 0.00 -0.41 0.00 0.00 54.97 52.68 1fhq s GLU 590 Cb -0.02 -1.00 0.02 0.00 -1.78 0.00 0.00 34.13 31.36 1fhq s GLU 590 CO -0.18 -0.33 -0.07 -1.54 -0.49 0.00 0.00 175.26 172.65 1fhq s SER 591 N -3.65 2.08 -0.12 -0.19 1.04 -1.26 -0.91 113.70 110.68 1fhq s SER 591 Ca 0.24 -0.28 -0.01 0.00 0.48 0.00 0.00 55.95 56.38 1fhq s SER 591 Cb 0.05 -0.80 -0.02 0.00 0.10 0.00 0.00 66.02 65.35 1fhq s SER 591 CO 0.12 -0.11 -0.10 -0.76 0.98 0.00 0.00 173.24 173.37 1fhq s LEU 592 N 1.65 2.93 -0.18 2.42 1.43 0.49 -4.97 118.68 122.45 1fhq s LEU 592 Ca 0.03 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1fhq s LEU 592 Cb -0.13 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.46 1fhq s LEU 592 CO -0.07 0.20 -0.14 -1.61 0.23 0.00 0.00 176.35 174.97 1fhq s GLU 593 N 0.14 2.31 0.15 1.70 8.01 -1.26 0.32 118.70 130.07 1fhq s GLU 593 Ca -0.05 -0.74 -0.30 0.00 0.01 0.00 0.00 54.97 53.90 1fhq s GLU 593 Cb -0.14 -2.32 -0.07 0.00 -4.31 0.00 0.00 34.13 27.28 1fhq s GLU 593 CO 0.04 -0.32 1.00 0.42 0.01 0.00 0.00 175.26 176.41 1fhq s ILE 594 N 1.41 4.25 0.10 -1.63 1.01 0.29 -4.93 121.20 121.69 1fhq s ILE 594 Ca 0.02 1.94 -0.23 0.00 0.00 0.00 0.00 60.65 62.38 1fhq s ILE 594 Cb -0.14 -4.24 -0.07 0.00 0.01 0.00 0.00 42.46 38.02 1fhq s ILE 594 CO -0.10 0.33 0.69 -1.10 0.00 0.00 0.00 174.94 174.77 1fhq s GLN 595 N -0.29 4.42 0.56 2.79 1.11 -1.26 -1.45 119.66 125.55 1fhq s GLN 595 Ca 0.47 0.98 0.36 0.00 0.01 0.00 0.00 55.36 57.17 1fhq s GLN 595 Cb -0.26 -3.28 1.50 0.00 -1.01 0.00 0.00 33.01 29.96 1fhq s GLN 595 CO 0.32 0.53 1.74 -0.56 0.01 0.00 0.00 175.29 177.32 1fhq h GLN 596 N 4.73 0.00 0.00 2.91 -0.00 -1.45 1.05 115.11 122.36 1fhq h GLN 596 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.18 1fhq h GLN 596 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.69 1fhq h GLN 596 CO 0.66 0.00 -0.92 0.41 -0.00 0.00 0.00 178.83 178.98 1fhq n GLY 597 N -1.74 -1.40 3.58 0.06 0.00 -1.26 -4.82 105.19 99.61 1fhq n GLY 597 Ca 0.25 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 4.71 -0.13 1.61 1.01 0.36 -5.00 120.40 119.68 1fhq s VAL 598 Ca 0.02 0.81 -0.05 0.00 0.00 0.00 0.00 61.98 62.76 1fhq s VAL 598 Cb 0.12 -4.24 0.06 0.00 0.00 0.00 0.00 36.38 32.32 1fhq s VAL 598 CO 0.77 -0.50 0.27 0.21 0.00 0.00 0.00 175.10 175.86 1fhq s ASN 599 N 1.91 0.12 0.43 3.32 3.84 -1.26 -4.32 114.94 118.98 1fhq s ASN 599 Ca 0.31 0.61 -0.02 0.00 0.21 0.00 0.00 52.86 53.97 1fhq s ASN 599 Cb -0.13 0.67 -0.03 0.00 -0.55 0.00 0.00 41.25 41.21 1fhq s ASN 599 CO 0.18 -0.22 0.68 -2.16 -2.79 0.00 0.00 177.10 172.79 1fhq s PRO 600 N 2.09 3.45 -0.29 0.43 0.04 -1.26 -4.96 135.00 134.50 1fhq s PRO 600 Ca -0.02 -0.10 -0.21 0.00 0.04 0.00 0.00 61.00 60.71 1fhq s PRO 600 Cb -0.11 -2.51 -0.01 0.00 0.04 0.00 0.00 34.50 31.90 1fhq s PRO 600 CO -0.09 -0.08 0.65 0.12 0.04 0.00 0.00 177.00 177.65 1fhq s PHE 601 N -2.55 3.23 0.02 0.56 5.36 0.58 -4.87 117.98 120.31 1fhq s PHE 601 Ca 0.44 0.69 -0.19 0.00 -0.96 0.00 0.00 56.93 56.92 1fhq s PHE 601 Cb -0.10 -2.98 -0.06 0.00 -0.34 0.00 0.00 43.02 39.54 1fhq s PHE 601 CO 0.40 -0.44 0.54 -0.06 -1.46 0.00 0.00 175.22 174.20 1fhq s PHE 602 N 2.63 3.73 -0.02 10.12 0.08 -1.26 0.14 117.98 133.41 1fhq s PHE 602 Ca 0.27 1.17 0.03 0.00 0.12 0.00 0.00 56.93 58.52 1fhq s PHE 602 Cb -0.15 -2.50 -0.00 0.00 -0.57 0.00 0.00 43.02 39.79 1fhq s PHE 602 CO 0.11 0.49 -0.10 0.42 -0.10 0.00 0.00 175.22 176.04 1fhq s ILE 603 N -0.67 0.79 -1.28 0.64 1.01 0.92 0.20 121.20 122.81 1fhq s ILE 603 Ca 0.28 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.54 1fhq s ILE 603 Cb -0.18 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.60 1fhq s ILE 603 CO 0.17 0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.95 1fhq n GLY 604 N 3.05 -1.34 0.22 6.18 0.00 -1.24 0.11 105.19 112.16 1fhq n GLY 604 Ca -0.16 -0.95 -0.07 0.00 0.00 0.00 0.00 46.02 44.84 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 0.52 -6.13 1.61 9.65 0.12 -3.15 114.38 117.00 1fhq h ARG 605 Ca 0.00 -0.29 -0.58 0.00 -1.10 0.00 0.00 59.98 58.01 1fhq h ARG 605 Cb 0.00 0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 28.54 1fhq h ARG 605 CO 0.00 0.88 0.81 -1.12 2.80 0.00 0.00 179.97 183.34 1fhq s SER 606 N -6.88 7.06 0.63 -3.80 0.01 -1.25 -4.72 113.70 104.75 1fhq s SER 606 Ca -0.07 1.33 0.24 0.00 1.31 0.00 0.00 55.95 58.75 1fhq s SER 606 Cb 0.12 -2.54 1.13 0.00 0.21 0.00 0.00 66.02 64.94 1fhq s SER 606 CO 0.82 -0.72 1.61 1.05 0.41 0.00 0.00 173.24 176.42 1fhq h GLU 607 N 7.61 0.00 -1.53 12.44 -0.00 -1.86 0.17 114.58 131.41 1fhq h GLU 607 Ca -0.20 0.00 0.46 0.00 -0.00 0.00 0.00 59.36 59.62 1fhq h GLU 607 Cb 1.06 0.00 -0.09 0.00 -0.00 0.00 0.00 28.75 29.72 1fhq h GLU 607 CO 0.99 0.00 1.06 -0.44 -0.00 0.00 0.00 179.01 180.62 1fhq h ASP 608 N 0.00 0.11 -2.90 3.06 5.19 -1.90 -3.36 116.42 116.62 1fhq h ASP 608 Ca 0.18 0.05 -0.55 0.00 -0.62 0.00 0.00 57.03 56.09 1fhq h ASP 608 Cb 1.58 0.04 -0.02 0.00 0.18 0.00 0.00 39.33 41.11 1fhq h ASP 608 CO -0.00 -0.06 0.86 0.00 -3.12 0.00 0.00 179.24 176.92 1fhq n ASN 610 N 5.88 0.08 -4.88 0.00 5.15 0.20 -4.04 115.26 117.65 1fhq n ASN 610 Ca 0.13 1.04 -0.35 0.00 -0.60 0.00 0.00 54.58 54.81 1fhq n ASN 610 Cb 0.44 -0.52 -0.05 0.00 -0.53 0.00 0.00 39.78 39.12 1fhq n ASN 610 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fhq s LYS 612 N -1.71 2.76 -0.06 0.00 2.20 -1.26 -3.93 119.74 117.74 1fhq s LYS 612 Ca 0.27 -0.99 -0.02 0.00 -0.36 0.00 0.00 55.97 54.87 1fhq s LYS 612 Cb -0.13 -2.67 0.03 0.00 -1.51 0.00 0.00 37.83 33.55 1fhq s LYS 612 CO 0.15 -0.32 0.04 0.42 -0.36 0.00 0.00 175.35 175.29 1fhq s ILE 613 N 1.23 0.06 -0.65 5.43 -1.09 -1.19 -4.98 121.20 120.02 1fhq s ILE 613 Ca 0.01 0.27 -0.19 0.00 -2.23 0.00 0.00 60.65 58.50 1fhq s ILE 613 Cb -0.15 -0.32 0.10 0.00 -1.58 0.00 0.00 42.46 40.51 1fhq s ILE 613 CO -0.11 0.17 0.80 -1.61 -1.23 0.00 0.00 174.94 172.96 1fhq s GLU 614 N 2.10 3.13 -0.22 2.79 8.01 -1.26 -3.84 118.70 129.40 1fhq s GLU 614 Ca 0.05 -1.31 -0.02 0.00 0.01 0.00 0.00 54.97 53.70 1fhq s GLU 614 Cb -0.12 -4.32 0.07 0.00 -4.31 0.00 0.00 34.13 25.44 1fhq s GLU 614 CO -0.04 -1.61 0.03 -0.51 0.01 0.00 0.00 175.26 173.14 1fhq s ASP 615 N 3.58 3.24 0.37 -0.19 1.11 -1.26 -4.94 116.67 118.58 1fhq s ASP 615 Ca 0.16 -1.01 0.20 0.00 0.18 0.00 0.00 52.55 52.07 1fhq s ASP 615 Cb -0.20 -0.72 1.28 0.00 1.07 0.00 0.00 42.92 44.35 1fhq s ASP 615 CO 0.05 -0.32 1.61 0.78 1.18 0.00 0.00 175.17 178.47 1fhq h ASN 616 N 8.18 0.37 1.41 0.27 2.35 -2.01 1.39 115.58 127.55 1fhq h ASN 616 Ca -0.16 0.23 -0.08 0.00 -0.55 0.00 0.00 56.30 55.74 1fhq h ASN 616 Cb 1.09 0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.67 1fhq h ASN 616 CO 0.37 -0.32 -0.38 0.03 -1.65 0.00 0.00 177.43 175.48 1fhq h ARG 617 N 0.11 0.00 -7.19 0.81 2.47 -2.00 -3.46 114.38 105.11 1fhq h ARG 617 Ca 0.81 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 59.01 1fhq h ARG 617 Cb 2.11 0.00 0.20 0.00 -1.65 0.00 0.00 29.97 30.63 1fhq h ARG 617 CO -0.69 0.38 0.16 1.28 0.56 0.00 0.00 179.97 181.66 1fhq n LEU 618 N -3.26 3.24 -4.69 3.04 4.32 0.48 -4.79 117.00 115.34 1fhq n LEU 618 Ca 0.02 0.46 -0.25 0.00 -0.02 0.00 0.00 56.01 56.22 1fhq n LEU 618 Cb 0.64 -1.46 -0.08 0.00 -1.62 0.00 0.00 43.42 40.90 1fhq n LEU 618 CO 0.38 -2.20 -0.21 -0.55 -1.22 0.00 0.00 177.39 173.59 1fhq s SER 619 N -2.42 4.29 0.13 -1.43 0.15 -1.26 -4.58 113.70 108.58 1fhq s SER 619 Ca 0.68 -1.09 -0.27 0.00 0.70 0.00 0.00 55.95 55.97 1fhq s SER 619 Cb -0.25 -0.49 -0.04 0.00 -1.71 0.00 0.00 66.02 63.53 1fhq s SER 619 CO 0.57 -0.45 1.61 0.03 1.20 0.00 0.00 173.24 176.21 1fhq h ARG 620 N 1.58 -0.42 -1.17 5.44 -0.00 -1.91 1.12 114.38 119.02 1fhq h ARG 620 Ca -0.43 0.03 -0.64 0.00 -0.50 0.00 0.00 59.98 58.44 1fhq h ARG 620 Cb 1.25 0.10 -0.36 0.00 0.00 0.00 0.00 29.97 30.96 1fhq h ARG 620 CO 0.71 -0.28 0.07 0.28 0.00 0.00 0.00 179.97 180.75 1fhq n VAL 621 N -5.41 3.05 -0.47 2.04 0.31 -1.26 -3.64 118.33 112.94 1fhq n VAL 621 Ca -0.04 -3.92 0.38 0.00 -0.01 0.00 0.00 64.34 60.74 1fhq n VAL 621 Cb 0.33 -1.18 0.61 0.00 -0.91 0.00 0.00 33.84 32.69 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 -0.71 0.38 0.00 3.52 -0.00 -0.01 -4.16 115.22 114.23 1fhq n HIS 622 Ca 0.51 0.38 0.00 0.00 0.46 0.00 0.00 57.72 59.07 1fhq n HIS 622 Cb 0.69 -0.80 0.00 0.00 -0.12 0.00 0.00 29.99 29.76 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 0.05 -0.26 0.00 -0.71 0.24 0.31 117.98 115.61 1fhq s PHE 624 Ca 0.00 -0.14 -0.10 0.00 -1.04 0.00 0.00 56.93 55.65 1fhq s PHE 624 Cb 0.00 -0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.71 1fhq s PHE 624 CO 0.00 -0.26 0.16 0.42 -1.34 0.00 0.00 175.22 174.20 1fhq s ILE 625 N -1.29 5.17 0.14 -4.49 1.01 0.38 0.22 121.20 122.33 1fhq s ILE 625 Ca -0.14 0.12 0.06 0.00 0.00 0.00 0.00 60.65 60.69 1fhq s ILE 625 Cb -0.07 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 1fhq s ILE 625 CO 0.01 0.30 0.01 0.12 0.00 0.00 0.00 174.94 175.38 1fhq s PHE 626 N 1.43 2.93 -0.08 3.97 5.36 0.62 0.21 117.98 132.43 1fhq s PHE 626 Ca 0.07 -0.08 0.04 0.00 -0.96 0.00 0.00 56.93 56.00 1fhq s PHE 626 Cb -0.15 -1.46 -0.01 0.00 -0.34 0.00 0.00 43.02 41.06 1fhq s PHE 626 CO 0.07 0.50 -0.21 0.21 -1.46 0.00 0.00 175.22 174.33 1fhq s LYS 627 N -2.66 2.82 0.12 10.12 2.20 -1.26 0.22 119.74 131.30 1fhq s LYS 627 Ca 0.27 -0.83 0.04 0.00 -0.36 0.00 0.00 55.97 55.08 1fhq s LYS 627 Cb -0.10 -2.31 -0.04 0.00 -1.51 0.00 0.00 37.83 33.86 1fhq s LYS 627 CO 0.19 0.33 -0.09 0.21 -0.36 0.00 0.00 175.35 175.63 1fhq s LYS 628 N -0.02 0.96 -0.33 4.03 2.36 0.16 -4.95 119.74 121.94 1fhq s LYS 628 Ca -0.07 -1.37 -0.29 0.00 -2.55 0.00 0.00 55.97 51.70 1fhq s LYS 628 Cb -0.15 -0.50 0.01 0.00 -1.05 0.00 0.00 37.83 36.14 1fhq s LYS 628 CO 0.05 0.05 1.29 0.50 1.55 0.00 0.00 175.35 178.79 1fhq s ARG 629 N -3.59 3.86 0.07 4.03 6.06 -1.26 0.28 118.95 128.39 1fhq s ARG 629 Ca 0.13 1.13 -0.30 0.00 -2.50 0.00 0.00 55.73 54.19 1fhq s ARG 629 Cb 0.02 -3.89 -0.09 0.00 0.06 0.00 0.00 34.95 31.05 1fhq s ARG 629 CO -0.01 -1.20 1.85 -1.58 -2.50 0.00 0.00 175.30 171.86 1fhq s HIS 630 N 4.50 1.82 -0.13 5.12 5.65 0.50 -4.78 115.29 127.98 1fhq s HIS 630 Ca 0.56 -0.14 0.02 0.00 0.25 0.00 0.00 55.06 55.75 1fhq s HIS 630 Cb -0.15 -4.16 0.01 0.00 -1.18 0.00 0.00 32.58 27.11 1fhq s HIS 630 CO 0.25 -4.94 -0.18 0.00 -0.65 0.00 0.00 174.74 169.22 1fhq s ALA 631 N 3.52 1.96 0.41 1.58 0.00 -1.26 -1.45 121.76 126.50 1fhq s ALA 631 Ca 0.82 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.91 1fhq s ALA 631 Cb -0.43 -0.93 0.04 0.00 0.00 0.00 0.00 23.12 21.80 1fhq s ALA 631 CO 0.37 -0.10 0.31 1.55 0.00 0.00 0.00 175.76 177.89 1fhq n VAL 632 N 4.22 0.00 -0.33 0.00 3.14 -1.26 -4.96 118.33 119.14 1fhq n VAL 632 Ca -0.19 -1.61 -0.16 0.00 -2.96 0.00 0.00 64.34 59.43 1fhq n VAL 632 Cb 0.51 -0.16 0.15 0.00 -1.06 0.00 0.00 33.84 33.29 1fhq n VAL 632 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1fhq n GLY 633 N 0.11 -2.49 3.77 7.55 0.00 -1.26 -4.88 105.19 107.98 1fhq n GLY 633 Ca -0.01 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.55 4.43 -0.36 1.61 2.47 -1.26 -4.96 119.74 118.12 1fhq s LYS 634 Ca 0.34 2.11 0.00 0.00 -1.56 0.00 0.00 55.97 56.86 1fhq s LYS 634 Cb -0.06 -3.10 0.13 0.00 -1.46 0.00 0.00 37.83 33.34 1fhq s LYS 634 CO 0.29 -0.09 0.20 -1.54 0.16 0.00 0.00 175.35 174.38 1fhq s SER 635 N -0.57 3.23 -0.93 1.43 1.04 -1.26 -5.03 113.70 111.61 1fhq s SER 635 Ca 0.48 -2.17 -0.11 0.00 0.48 0.00 0.00 55.95 54.62 1fhq s SER 635 Cb -0.38 -0.56 -0.08 0.00 0.10 0.00 0.00 66.02 65.10 1fhq s SER 635 CO 0.50 -0.32 2.09 1.15 0.98 0.00 0.00 173.24 177.64 1fhq n MET 636 N 4.08 2.01 -2.06 4.02 0.00 -1.26 -4.65 117.12 119.26 1fhq n MET 636 Ca 0.09 -1.66 0.00 0.00 0.00 0.00 0.00 57.70 56.13 1fhq n MET 636 Cb 0.37 -2.65 0.00 0.00 0.00 0.00 0.00 33.22 30.94 1fhq n MET 636 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 1fhq n TYR 637 N 5.28 0.00 -3.87 3.17 9.36 -1.26 -5.10 117.16 124.74 1fhq n TYR 637 Ca 0.48 0.00 -0.34 0.00 3.32 0.00 0.00 57.90 61.36 1fhq n TYR 637 Cb 0.23 0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 38.81 1fhq n TYR 637 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1fhq s GLU 638 N -0.17 1.82 0.05 2.98 2.56 -1.26 -5.07 118.70 119.61 1fhq s GLU 638 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 54.97 53.14 1fhq s GLU 638 Cb 0.00 -3.44 -0.03 0.00 2.00 0.00 0.00 34.13 32.66 1fhq s GLU 638 CO 0.00 -1.01 -0.04 -1.54 -0.56 0.00 0.00 175.26 172.10 1fhq s SER 639 N 1.48 0.63 0.00 -1.70 1.04 -1.26 -5.17 113.70 108.72 1fhq s SER 639 Ca 0.09 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.70 1fhq s SER 639 Cb -0.21 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.04 1fhq s SER 639 CO -0.06 -0.44 0.00 -0.81 0.98 0.00 0.00 173.24 172.91 1fhq n PRO 640 N 0.63 1.73 0.00 4.02 -0.04 -1.26 -4.42 135.00 135.65 1fhq n PRO 640 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1fhq n PRO 640 Cb 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.05 1fhq n PRO 640 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fhq n ALA 641 N -3.00 0.00 -2.50 0.55 0.00 -1.26 -4.72 120.51 109.59 1fhq n ALA 641 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 1fhq n ALA 641 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1fhq n ALA 641 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1fhq s GLN 642 N 0.00 3.42 0.00 0.00 0.74 -1.26 -2.96 119.66 119.60 1fhq s GLN 642 Ca 0.00 -0.91 0.00 0.00 0.05 0.00 0.00 55.36 54.50 1fhq s GLN 642 Cb 0.00 -5.18 0.00 0.00 1.10 0.00 0.00 33.01 28.93 1fhq s GLN 642 CO 0.00 -2.34 0.00 0.41 -0.55 0.00 0.00 175.29 172.81 1fhq n GLY 643 N 6.70 -0.59 0.00 2.59 0.00 -0.53 -4.94 105.19 108.42 1fhq n GLY 643 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1fhq n GLY 643 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fhq n LEU 644 N 0.00 0.00 -4.14 0.99 7.99 -1.16 -4.86 117.00 115.82 1fhq n LEU 644 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 56.01 55.72 1fhq n LEU 644 Cb 0.00 0.00 -0.16 0.00 -0.11 0.00 0.00 43.42 43.15 1fhq n LEU 644 CO 0.00 -0.50 -0.52 -1.81 -1.51 0.00 0.00 177.39 173.06 1fhq s ASP 645 N -1.00 2.41 -0.05 -1.43 1.01 -1.25 0.19 116.67 116.55 1fhq s ASP 645 Ca 0.00 -0.41 0.02 0.00 0.71 0.00 0.00 52.55 52.87 1fhq s ASP 645 Cb 0.00 -0.91 -0.03 0.00 1.01 0.00 0.00 42.92 42.99 1fhq s ASP 645 CO 0.00 0.13 -0.09 -0.62 0.21 0.00 0.00 175.17 174.80 1fhq s ASP 646 N 0.26 4.47 -0.33 0.27 -1.08 0.78 -4.38 116.67 116.67 1fhq s ASP 646 Ca -0.11 -0.10 -0.13 0.00 -0.52 0.00 0.00 52.55 51.70 1fhq s ASP 646 Cb -0.15 -1.05 -0.02 0.00 -1.46 0.00 0.00 42.92 40.23 1fhq s ASP 646 CO 0.05 0.34 0.24 0.27 0.52 0.00 0.00 175.17 176.59 1fhq s ILE 647 N -0.83 5.28 -0.16 4.11 -4.36 -1.26 0.36 121.20 124.33 1fhq s ILE 647 Ca 0.13 -0.09 -0.07 0.00 -0.26 0.00 0.00 60.65 60.37 1fhq s ILE 647 Cb -0.11 -3.68 -0.04 0.00 1.25 0.00 0.00 42.46 39.88 1fhq s ILE 647 CO 0.02 0.05 0.06 0.26 0.24 0.00 0.00 174.94 175.57 1fhq s TRP 648 N 1.76 3.29 -0.31 1.37 0.52 0.60 -1.58 118.94 124.59 1fhq s TRP 648 Ca 0.07 0.15 -0.21 0.00 0.02 0.00 0.00 56.10 56.14 1fhq s TRP 648 Cb -0.17 -2.02 -0.01 0.00 -1.15 0.00 0.00 33.47 30.12 1fhq s TRP 648 CO 0.11 0.28 0.65 -0.47 0.02 0.00 0.00 176.95 177.54 1fhq s TYR 649 N 0.01 3.21 -0.37 -1.98 5.04 0.90 0.23 117.35 124.38 1fhq s TYR 649 Ca 0.06 0.60 -0.06 0.00 -2.44 0.00 0.00 57.07 55.23 1fhq s TYR 649 Cb -0.12 -3.04 0.07 0.00 0.35 0.00 0.00 41.96 39.22 1fhq s TYR 649 CO 0.01 -0.50 0.16 0.00 -1.34 0.00 0.00 175.55 173.88 1fhq s HIS 651 N 1.34 3.64 0.00 0.00 2.46 -0.59 0.80 115.29 122.94 1fhq s HIS 651 Ca 0.01 1.63 0.00 0.00 0.47 0.00 0.00 55.06 57.17 1fhq s HIS 651 Cb -0.21 -3.18 0.00 0.00 -0.13 0.00 0.00 32.58 29.06 1fhq s HIS 651 CO 0.01 -0.27 0.64 0.25 -2.47 0.00 0.00 174.74 172.90 1fhq n THR 652 N 3.57 0.40 -3.27 0.89 -2.24 -0.62 -0.24 114.28 112.77 1fhq n THR 652 Ca 0.06 -0.48 -0.38 0.00 -2.27 0.00 0.00 64.05 60.97 1fhq n THR 652 Cb 0.49 0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 69.59 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 -0.40 2.66 0.46 3.38 0.00 0.86 -4.60 107.32 109.68 1fhq s GLY 653 Ca 0.00 0.03 0.24 0.00 0.00 0.00 0.00 44.72 44.99 1fhq s GLY 653 CO 0.00 0.45 1.92 -0.84 0.00 0.00 0.00 173.10 174.63 1fhq h THR 654 N 3.43 0.64 0.00 0.90 2.02 -1.93 -2.60 112.91 115.37 1fhq h THR 654 Ca -0.49 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 65.76 1fhq h THR 654 Cb 1.21 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 1fhq h THR 654 CO 0.64 0.20 0.00 0.59 0.37 0.00 0.00 175.52 177.32 1fhq n ASN 655 N -3.55 0.00 -1.29 4.18 3.02 -1.26 -4.84 115.26 111.51 1fhq n ASN 655 Ca -0.01 -1.25 0.00 0.00 -0.03 0.00 0.00 54.58 53.29 1fhq n ASN 655 Cb 0.35 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 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 -0.78 -1.87 -4.31 2.41 3.14 -0.99 -4.76 118.33 111.17 1fhq n VAL 656 Ca 0.12 0.89 -0.25 0.00 -2.96 0.00 0.00 64.34 62.14 1fhq n VAL 656 Cb 0.05 -1.32 -0.08 0.00 -1.06 0.00 0.00 33.84 31.43 1fhq n VAL 656 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1fhq s SER 657 N -3.95 4.23 -0.10 6.55 1.04 -0.97 -4.46 113.70 116.03 1fhq s SER 657 Ca 0.00 -1.01 -0.00 0.00 0.48 0.00 0.00 55.95 55.42 1fhq s SER 657 Cb 0.00 -0.53 0.02 0.00 0.10 0.00 0.00 66.02 65.61 1fhq s SER 657 CO 0.00 -0.29 -0.07 -0.31 0.98 0.00 0.00 173.24 173.55 1fhq s TYR 658 N -2.53 1.33 -0.32 5.02 1.51 0.34 -2.32 117.35 120.38 1fhq s TYR 658 Ca 0.36 -0.62 -0.06 0.00 -1.01 0.00 0.00 57.07 55.73 1fhq s TYR 658 Cb 0.01 -1.14 0.03 0.00 -0.11 0.00 0.00 41.96 40.75 1fhq s TYR 658 CO 0.20 -0.46 0.09 -1.17 -1.11 0.00 0.00 175.55 173.10 1fhq s LEU 659 N 1.67 4.09 0.00 -1.29 0.20 -0.58 0.17 118.68 122.94 1fhq s LEU 659 Ca 0.03 -0.96 0.00 0.00 0.69 0.00 0.00 54.13 53.89 1fhq s LEU 659 Cb -0.13 -1.87 0.00 0.00 -0.43 0.00 0.00 46.19 43.77 1fhq s LEU 659 CO -0.07 -0.27 0.00 0.59 -0.29 0.00 0.00 176.35 176.31 1fhq n ASN 660 N 4.83 0.00 -0.12 3.68 5.03 -1.19 -0.64 115.26 126.85 1fhq n ASN 660 Ca -0.13 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.32 1fhq n ASN 660 Cb 0.46 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.22 1fhq n ASN 660 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1fhq n ASN 661 N 1.66 0.00 -4.44 6.41 4.13 -1.26 -5.09 115.26 116.67 1fhq n ASN 661 Ca 0.00 -1.18 -0.33 0.00 1.68 0.00 0.00 54.58 54.75 1fhq n ASN 661 Cb 0.00 -0.04 -0.13 0.00 -1.54 0.00 0.00 39.78 38.07 1fhq n ASN 661 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1fhq s ASN 662 N -0.18 4.08 0.06 6.41 0.01 0.19 -5.11 114.94 120.39 1fhq s ASN 662 Ca 0.00 -0.24 -0.16 0.00 -0.71 0.00 0.00 52.86 51.75 1fhq s ASN 662 Cb 0.00 -1.21 -0.06 0.00 0.41 0.00 0.00 41.25 40.39 1fhq s ASN 662 CO 0.00 0.27 0.49 -0.60 -1.51 0.00 0.00 177.10 175.75 1fhq s ARG 663 N -0.26 4.02 -0.10 -0.60 3.52 -1.26 -1.52 118.95 122.75 1fhq s ARG 663 Ca 0.02 0.53 -0.03 0.00 -0.13 0.00 0.00 55.73 56.11 1fhq s ARG 663 Cb -0.13 -3.16 0.04 0.00 -1.56 0.00 0.00 34.95 30.14 1fhq s ARG 663 CO 0.03 0.63 0.06 0.00 -0.81 0.00 0.00 175.30 175.21 1fhq s MET 664 N -1.29 0.11 0.58 5.12 0.23 -0.98 -4.75 119.30 118.31 1fhq s MET 664 Ca 0.28 0.14 -0.05 0.00 -1.03 0.00 0.00 55.69 55.03 1fhq s MET 664 Cb -0.17 -1.12 0.01 0.00 -1.53 0.00 0.00 34.83 32.02 1fhq s MET 664 CO 0.17 -0.46 0.87 0.96 -2.03 0.00 0.00 175.02 174.53 1fhq s ILE 665 N 2.11 3.60 -0.47 3.16 -4.36 -1.26 -2.30 121.20 121.68 1fhq s ILE 665 Ca 0.04 -0.10 -0.29 0.00 -0.26 0.00 0.00 60.65 60.03 1fhq s ILE 665 Cb -0.14 -3.42 -0.10 0.00 1.25 0.00 0.00 42.46 40.06 1fhq s ILE 665 CO -0.06 -0.41 2.37 1.67 0.24 0.00 0.00 174.94 178.75 1fhq n GLN 666 N -2.52 1.08 0.00 0.37 7.27 -1.19 -1.86 117.38 120.53 1fhq n GLN 666 Ca 0.04 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.28 1fhq n GLN 666 Cb 0.58 -2.91 0.00 0.00 2.41 0.00 0.00 30.24 30.32 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 6.16 1.52 3.41 1.69 0.00 0.66 -4.90 105.19 113.74 1fhq n GLY 667 Ca 0.41 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.52 2.25 -0.09 2.61 -4.23 -0.78 0.22 115.64 114.10 1fhq s THR 668 Ca 0.00 -2.10 0.03 0.00 -1.18 0.00 0.00 61.69 58.44 1fhq s THR 668 Cb 0.00 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.74 1fhq s THR 668 CO 0.00 -0.24 -0.20 -0.75 -0.54 0.00 0.00 174.62 172.89 1fhq s LYS 669 N -2.93 2.60 -0.04 3.99 2.20 0.31 -1.55 119.74 124.32 1fhq s LYS 669 Ca 0.22 -0.72 0.02 0.00 -0.36 0.00 0.00 55.97 55.13 1fhq s LYS 669 Cb -0.07 -2.01 0.01 0.00 -1.51 0.00 0.00 37.83 34.26 1fhq s LYS 669 CO 0.10 0.12 -0.08 0.12 -0.36 0.00 0.00 175.35 175.25 1fhq s PHE 670 N 0.48 1.01 0.36 4.03 2.19 0.36 0.35 117.98 126.75 1fhq s PHE 670 Ca -0.17 -0.31 -0.27 0.00 0.33 0.00 0.00 56.93 56.51 1fhq s PHE 670 Cb -0.17 -0.78 -0.09 0.00 -1.31 0.00 0.00 43.02 40.66 1fhq s PHE 670 CO 0.07 -0.18 1.24 -1.17 1.83 0.00 0.00 175.22 177.01 1fhq s LEU 671 N 0.60 4.34 -0.16 6.12 0.20 -1.26 0.31 118.68 128.83 1fhq s LEU 671 Ca -0.10 2.54 -0.03 0.00 0.69 0.00 0.00 54.13 57.24 1fhq s LEU 671 Cb -0.13 -3.79 -0.02 0.00 -0.43 0.00 0.00 46.19 41.82 1fhq s LEU 671 CO 0.01 -0.58 -0.06 -0.76 -0.29 0.00 0.00 176.35 174.67 1fhq s LEU 672 N -2.05 3.08 0.03 -0.68 1.43 -0.62 -4.77 118.68 115.11 1fhq s LEU 672 Ca 0.52 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 53.43 1fhq s LEU 672 Cb -0.36 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1fhq s LEU 672 CO 0.47 0.14 0.05 -1.10 0.23 0.00 0.00 176.35 176.14 1fhq s GLN 673 N 0.53 2.86 -0.31 1.70 -0.21 -1.21 -4.02 119.66 118.99 1fhq s GLN 673 Ca -0.04 -0.63 -0.42 0.00 0.02 0.00 0.00 55.36 54.29 1fhq s GLN 673 Cb -0.15 -2.72 -0.17 0.00 1.00 0.00 0.00 33.01 30.97 1fhq s GLN 673 CO 0.03 0.60 1.67 -0.40 -2.12 0.00 0.00 175.29 175.07 1fhq n ASP 674 N 0.96 1.97 -0.38 5.90 5.68 -1.26 -1.09 116.55 128.33 1fhq n ASP 674 Ca -0.12 1.11 0.00 0.00 -0.50 0.00 0.00 54.79 55.28 1fhq n ASP 674 Cb 0.52 -1.07 0.00 0.00 -1.14 0.00 0.00 41.12 39.43 1fhq n ASP 674 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fhq n GLY 675 N 3.98 0.94 3.60 6.12 0.00 0.27 -4.95 105.19 115.14 1fhq n GLY 675 Ca 0.27 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.83 6.28 -0.44 1.61 1.01 -0.25 -4.77 116.67 117.28 1fhq s ASP 676 Ca 0.00 0.26 -0.18 0.00 0.71 0.00 0.00 52.55 53.35 1fhq s ASP 676 Cb 0.00 -2.22 0.03 0.00 1.01 0.00 0.00 42.92 41.74 1fhq s ASP 676 CO 0.00 -0.23 0.47 -1.61 0.21 0.00 0.00 175.17 174.00 1fhq s GLU 677 N 2.13 3.10 -0.24 8.23 8.01 -1.26 0.75 118.70 139.41 1fhq s GLU 677 Ca 0.16 -0.80 -0.08 0.00 0.01 0.00 0.00 54.97 54.26 1fhq s GLU 677 Cb -0.16 -3.99 -0.04 0.00 -4.31 0.00 0.00 34.13 25.63 1fhq s GLU 677 CO 0.10 -0.92 0.09 0.96 0.01 0.00 0.00 175.26 175.51 1fhq s ILE 678 N 2.20 4.60 -0.33 -1.63 -4.36 0.67 -3.20 121.20 119.15 1fhq s ILE 678 Ca 0.12 -0.08 -0.26 0.00 -0.26 0.00 0.00 60.65 60.17 1fhq s ILE 678 Cb -0.18 -3.15 0.01 0.00 1.25 0.00 0.00 42.46 40.40 1fhq s ILE 678 CO 0.13 0.34 0.94 -0.54 0.24 0.00 0.00 174.94 176.05 1fhq s LYS 679 N 1.43 3.98 0.16 0.37 1.02 0.45 -1.23 119.74 125.92 1fhq s LYS 679 Ca 0.06 0.79 -0.00 0.00 0.02 0.00 0.00 55.97 56.84 1fhq s LYS 679 Cb -0.15 -3.75 -0.01 0.00 -0.52 0.00 0.00 37.83 33.40 1fhq s LYS 679 CO 0.05 -0.83 1.37 0.97 -0.92 0.00 0.00 175.35 175.99 1fhq h ILE 680 N 5.70 1.44 -2.43 2.17 6.09 -1.80 0.97 117.51 129.65 1fhq h ILE 680 Ca -0.22 -2.46 -0.08 0.00 -1.37 0.00 0.00 64.86 60.73 1fhq h ILE 680 Cb 1.08 2.37 -0.24 0.00 0.47 0.00 0.00 36.82 40.50 1fhq h ILE 680 CO 0.97 0.73 -0.15 -0.51 -3.07 0.00 0.00 178.15 176.11 1fhq s ILE 681 N -3.31 -0.01 -0.09 2.19 2.07 -1.26 -4.14 121.20 116.65 1fhq s ILE 681 Ca -0.04 0.04 -0.02 0.00 -1.41 0.00 0.00 60.65 59.22 1fhq s ILE 681 Cb 0.10 -0.75 0.03 0.00 0.13 0.00 0.00 42.46 41.98 1fhq s ILE 681 CO 0.84 0.02 0.01 0.86 -1.91 0.00 0.00 174.94 174.75 1fhq s TRP 682 N 1.04 0.70 -0.17 3.50 -0.00 -1.22 -0.96 118.94 121.82 1fhq s TRP 682 Ca -0.06 -0.25 0.01 0.00 -0.00 0.00 0.00 56.10 55.79 1fhq s TRP 682 Cb -0.06 -0.82 0.03 0.00 -0.00 0.00 0.00 33.47 32.62 1fhq s TRP 682 CO -0.09 -0.37 -0.14 0.34 -0.00 0.00 0.00 176.95 176.69 1fhq s ASP 683 N 1.96 3.05 0.08 5.86 -1.08 -0.00 -4.95 116.67 121.59 1fhq s ASP 683 Ca 0.04 -0.68 -0.19 0.00 -0.52 0.00 0.00 52.55 51.21 1fhq s ASP 683 Cb -0.13 -1.26 -0.09 0.00 -1.46 0.00 0.00 42.92 39.99 1fhq s ASP 683 CO -0.06 -0.08 1.51 0.11 0.52 0.00 0.00 175.17 177.17 1fhq h LYS 684 N 8.00 0.41 0.19 4.34 1.57 -1.95 0.46 116.57 129.58 1fhq h LYS 684 Ca -0.35 -0.13 -0.31 0.00 -1.87 0.00 0.00 60.65 57.98 1fhq h LYS 684 Cb 1.12 -0.04 0.03 0.00 0.08 0.00 0.00 32.23 33.43 1fhq h LYS 684 CO 0.53 0.60 -1.33 -0.91 -0.57 0.00 0.00 179.45 177.76 1fhq h ASN 685 N 0.18 0.84 1.07 0.86 4.21 -1.99 -3.26 115.58 117.48 1fhq h ASN 685 Ca 0.06 -0.88 0.00 0.00 1.21 0.00 0.00 56.30 56.69 1fhq h ASN 685 Cb 0.42 -0.27 0.00 0.00 -1.12 0.00 0.00 38.32 37.35 1fhq h ASN 685 CO 0.01 1.65 -0.03 -3.20 -1.29 0.00 0.00 177.43 174.57 1fhq n ASN 686 N -3.79 0.20 -2.15 5.81 5.15 -1.24 -4.90 115.26 114.35 1fhq n ASN 686 Ca -0.15 0.47 -0.17 0.00 -0.60 0.00 0.00 54.58 54.13 1fhq n ASN 686 Cb 1.03 -0.51 -0.03 0.00 -0.53 0.00 0.00 39.78 39.74 1fhq n ASN 686 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1fhq n LYS 687 N -1.66 -1.78 -2.95 1.20 4.81 0.16 -4.91 118.16 113.02 1fhq n LYS 687 Ca 0.07 0.86 -0.43 0.00 -0.87 0.00 0.00 58.31 57.94 1fhq n LYS 687 Cb 0.36 -5.40 -0.05 0.00 0.02 0.00 0.00 35.03 29.96 1fhq n LYS 687 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1fhq s PHE 688 N -2.71 2.89 -0.17 5.64 2.19 -1.02 -4.88 117.98 119.92 1fhq s PHE 688 Ca 0.00 -0.17 -0.00 0.00 0.33 0.00 0.00 56.93 57.08 1fhq s PHE 688 Cb 0.00 -3.86 0.00 0.00 -1.31 0.00 0.00 43.02 37.85 1fhq s PHE 688 CO 0.00 -1.21 -0.15 0.14 1.83 0.00 0.00 175.22 175.83 1fhq s VAL 689 N 3.45 2.67 0.16 3.12 -7.23 -1.26 -0.82 120.40 120.49 1fhq s VAL 689 Ca 0.25 -0.76 0.07 0.00 -1.81 0.00 0.00 61.98 59.73 1fhq s VAL 689 Cb -0.15 -2.14 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1fhq s VAL 689 CO 0.17 0.51 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.69 1fhq s ILE 690 N 0.97 1.52 0.00 -0.62 -1.09 -0.13 -0.78 121.20 121.08 1fhq s ILE 690 Ca -0.02 -1.93 0.00 0.00 -2.23 0.00 0.00 60.65 56.46 1fhq s ILE 690 Cb -0.15 -1.77 0.00 0.00 -1.58 0.00 0.00 42.46 38.96 1fhq s ILE 690 CO -0.02 -0.48 0.00 0.61 -1.23 0.00 0.00 174.94 173.81 1fhq n GLY 691 N 0.15 2.00 3.40 6.18 0.00 -1.26 -3.09 105.19 112.58 1fhq n GLY 691 Ca -0.12 0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1fhq n GLY 691 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fhq s PHE 692 N -0.38 2.40 -0.25 1.61 0.08 -0.37 -2.44 117.98 118.64 1fhq s PHE 692 Ca 0.00 -0.35 -0.10 0.00 0.12 0.00 0.00 56.93 56.60 1fhq s PHE 692 Cb 0.00 -1.37 -0.05 0.00 -0.57 0.00 0.00 43.02 41.04 1fhq s PHE 692 CO 0.00 0.24 0.15 0.21 -0.10 0.00 0.00 175.22 175.72 1fhq s LYS 693 N -1.59 3.97 -0.19 0.44 2.20 -0.77 -0.24 119.74 123.56 1fhq s LYS 693 Ca 0.14 -0.32 -0.27 0.00 -0.36 0.00 0.00 55.97 55.16 1fhq s LYS 693 Cb -0.10 -3.51 -0.00 0.00 -1.51 0.00 0.00 37.83 32.70 1fhq s LYS 693 CO 0.05 -0.02 0.92 0.08 -0.36 0.00 0.00 175.35 176.02 1fhq s VAL 694 N 1.26 4.79 -0.20 4.02 1.01 0.23 -0.43 120.40 131.09 1fhq s VAL 694 Ca 0.07 1.81 -0.02 0.00 0.00 0.00 0.00 61.98 63.84 1fhq s VAL 694 Cb -0.14 -4.21 0.06 0.00 0.00 0.00 0.00 36.38 32.08 1fhq s VAL 694 CO 0.06 -0.06 0.00 -0.70 0.00 0.00 0.00 175.10 174.40 1fhq s GLU 695 N 2.61 0.98 -0.49 2.72 2.56 0.39 0.94 118.70 128.42 1fhq s GLU 695 Ca 0.41 -0.55 -0.23 0.00 0.00 0.00 0.00 54.97 54.60 1fhq s GLU 695 Cb -0.16 -2.17 0.03 0.00 2.00 0.00 0.00 34.13 33.83 1fhq s GLU 695 CO 0.10 -0.59 0.82 0.42 -0.56 0.00 0.00 175.26 175.45 1fhq s ILE 696 N 1.72 4.59 -0.09 -3.70 1.01 -1.26 1.00 121.20 124.47 1fhq s ILE 696 Ca -0.02 0.28 -0.19 0.00 0.00 0.00 0.00 60.65 60.73 1fhq s ILE 696 Cb -0.17 -4.39 -0.28 0.00 0.01 0.00 0.00 42.46 37.62 1fhq s ILE 696 CO -0.07 -0.86 0.69 0.78 0.00 0.00 0.00 174.94 175.48 1fhq h ASN 697 N 9.09 0.38 -3.67 3.58 -0.26 -1.50 -3.46 115.58 119.74 1fhq h ASN 697 Ca -0.25 -0.88 -0.68 0.00 -0.56 0.00 0.00 56.30 53.92 1fhq h ASN 697 Cb 1.08 -0.12 -0.19 0.00 -1.06 0.00 0.00 38.32 38.03 1fhq h ASN 697 CO 1.00 1.50 -0.70 -1.81 -1.06 0.00 0.00 177.43 176.36 1fhq s ASP 698 N -6.97 4.62 -0.48 5.81 1.11 -0.68 -5.07 116.67 115.01 1fhq s ASP 698 Ca -0.18 -0.03 -0.02 0.00 0.18 0.00 0.00 52.55 52.50 1fhq s ASP 698 Cb 0.03 -1.17 0.13 0.00 1.07 0.00 0.00 42.92 42.97 1fhq s ASP 698 CO 0.78 0.36 0.28 0.42 1.18 0.00 0.00 175.17 178.19 1fhq s THR 699 N -0.78 3.36 -0.70 -1.27 -4.23 -1.26 -4.50 115.64 106.25 1fhq s THR 699 Ca 0.12 -2.42 -0.24 0.00 -1.18 0.00 0.00 61.69 57.97 1fhq s THR 699 Cb -0.11 -3.27 -0.19 0.00 1.34 0.00 0.00 72.50 70.27 1fhq s THR 699 CO 0.01 -0.75 1.87 1.07 -0.54 0.00 0.00 174.62 176.28 1fhq n THR 700 N 4.16 1.47 -3.39 3.99 5.66 -1.26 -3.92 114.28 120.99 1fhq n THR 700 Ca 0.02 -1.33 -0.17 0.00 -3.05 0.00 0.00 64.05 59.52 1fhq n THR 700 Cb 0.40 -2.24 0.08 0.00 -1.55 0.00 0.00 70.33 67.03 1fhq n THR 700 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1fhq n GLY 701 N 4.82 -0.34 3.89 1.09 0.00 -1.26 -4.85 105.19 108.53 1fhq n GLY 701 Ca 0.48 0.09 -0.31 0.00 0.00 0.00 0.00 46.02 46.28 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 -6.28 4.24 0.44 0.99 1.43 -1.25 -3.92 118.68 114.33 1fhq s LEU 702 Ca 0.08 0.66 0.12 0.00 -1.03 0.00 0.00 54.13 53.95 1fhq s LEU 702 Cb -0.03 -3.40 1.00 0.00 0.03 0.00 0.00 46.19 43.79 1fhq s LEU 702 CO 0.70 0.02 2.04 2.19 0.23 0.00 0.00 176.35 181.52 1fhq h PHE 703 N 2.74 0.40 0.00 0.29 -5.15 -1.90 -3.41 116.94 109.91 1fhq h PHE 703 Ca -0.46 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.32 1fhq h PHE 703 Cb 1.17 -0.13 0.00 0.00 0.22 0.00 0.00 35.95 37.20 1fhq h PHE 703 CO 0.61 0.22 0.00 -1.71 -2.00 0.00 0.00 178.31 175.44 1fhq n ASN 704 N -4.48 -0.58 0.00 -0.68 5.15 -1.26 -4.78 115.26 108.63 1fhq n ASN 704 Ca 0.05 0.20 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 1fhq n ASN 704 Cb 0.21 0.73 0.00 0.00 -0.53 0.00 0.00 39.78 40.19 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 -2.79 0.00 0.00 1.20 0.28 -1.26 -4.91 120.64 113.15 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 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 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 0.06 0.20 -1.84 0.00 -1.26 -4.71 105.19 97.64 1fhq n GLY 706 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 0.59 0.00 0.99 0.00 -1.26 -3.33 117.00 113.99 1fhq n LEU 707 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 56.01 55.72 1fhq n LEU 707 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 43.42 43.35 1fhq n LEU 707 CO 0.00 0.14 0.00 0.61 0.00 0.00 0.00 177.39 178.14 1fhq n GLY 708 N 0.72 1.34 3.34 -3.96 0.00 -1.26 -4.86 105.19 100.52 1fhq n GLY 708 Ca 0.06 -0.57 0.02 0.00 0.00 0.00 0.00 46.02 45.53 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 0.22 0.09 1.61 0.23 -1.26 -4.81 119.30 115.38 1fhq s MET 709 Ca 0.00 0.55 0.00 0.00 -1.03 0.00 0.00 55.69 55.21 1fhq s MET 709 Cb 0.00 0.33 0.00 0.00 -1.53 0.00 0.00 34.83 33.63 1fhq s MET 709 CO 0.00 -0.08 0.00 1.47 -2.03 0.00 0.00 175.02 174.38 1fhq n LEU 710 N 4.85 -2.44 -3.02 0.18 -0.00 -1.26 -4.95 117.00 110.37 1fhq n LEU 710 Ca -0.08 0.65 -0.01 0.00 -0.00 0.00 0.00 56.01 56.57 1fhq n LEU 710 Cb 0.53 0.16 -0.01 0.00 -0.00 0.00 0.00 43.42 44.11 1fhq n LEU 710 CO -0.05 -0.07 -0.32 1.67 -0.00 0.00 0.00 177.39 178.63 1fhq n GLN 711 N -0.49 -1.62 -1.85 1.47 0.00 -1.26 -4.76 117.38 108.87 1fhq n GLN 711 Ca 0.00 1.54 -0.42 0.00 -0.00 0.00 0.00 57.00 58.12 1fhq n GLN 711 Cb 0.00 -1.94 -0.03 0.00 0.00 0.00 0.00 30.24 28.27 1fhq n GLN 711 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1fhq s GLU 712 N -0.62 4.17 -0.44 3.69 2.02 -1.26 -4.96 118.70 121.31 1fhq s GLU 712 Ca -0.04 2.42 -0.01 0.00 0.02 0.00 0.00 54.97 57.36 1fhq s GLU 712 Cb 0.00 -3.83 0.12 0.00 0.10 0.00 0.00 34.13 30.52 1fhq s GLU 712 CO 0.19 -0.83 0.21 -1.14 0.02 0.00 0.00 175.26 173.71 1fhq s GLN 713 N 3.44 1.97 -0.76 1.61 0.74 -1.26 -5.00 119.66 120.39 1fhq s GLN 713 Ca 0.79 -2.03 0.03 0.00 0.05 0.00 0.00 55.36 54.19 1fhq s GLN 713 Cb -0.40 -3.49 0.20 0.00 1.10 0.00 0.00 33.01 30.41 1fhq s GLN 713 CO 0.35 -1.06 0.64 0.54 -0.55 0.00 0.00 175.29 175.20 1fhq n ARG 714 N 4.18 2.23 -4.82 1.67 5.12 -1.26 -4.87 116.66 118.90 1fhq n ARG 714 Ca 0.02 -4.52 -0.26 0.00 -1.93 0.00 0.00 57.85 51.15 1fhq n ARG 714 Cb 0.40 -2.32 -0.15 0.00 -1.16 0.00 0.00 32.46 29.23 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 -1.64 1.65 -0.11 1.55 -7.23 -1.26 -4.89 120.40 108.47 1fhq s VAL 715 Ca 0.28 -1.04 -0.30 0.00 -1.81 0.00 0.00 61.98 59.11 1fhq s VAL 715 Cb -0.02 -1.40 -0.02 0.00 0.56 0.00 0.00 36.38 35.50 1fhq s VAL 715 CO -0.13 0.33 1.12 -0.69 -0.31 0.00 0.00 175.10 175.42 1fhq s VAL 716 N -0.64 4.51 0.40 1.32 1.01 -1.26 -4.62 120.40 121.11 1fhq s VAL 716 Ca 0.08 1.81 0.08 0.00 0.00 0.00 0.00 61.98 63.94 1fhq s VAL 716 Cb -0.08 -4.16 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 1fhq s VAL 716 CO 0.01 -0.05 0.47 -0.76 0.00 0.00 0.00 175.10 174.77 1fhq s LEU 717 N 2.47 3.62 -0.15 3.92 1.43 0.16 -4.91 118.68 125.21 1fhq s LEU 717 Ca 0.51 -0.49 -0.07 0.00 -1.03 0.00 0.00 54.13 53.05 1fhq s LEU 717 Cb -0.21 -2.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.53 1fhq s LEU 717 CO 0.17 -0.64 0.07 -0.54 0.23 0.00 0.00 176.35 175.64 1fhq s LYS 718 N -4.22 3.72 0.60 1.70 1.02 -1.26 0.11 119.74 121.42 1fhq s LYS 718 Ca 0.50 -0.31 -0.10 0.00 0.02 0.00 0.00 55.97 56.08 1fhq s LYS 718 Cb -0.07 -3.15 -0.04 0.00 -0.52 0.00 0.00 37.83 34.05 1fhq s LYS 718 CO 0.30 0.44 0.99 1.14 -0.92 0.00 0.00 175.35 177.31 1fhq s GLN 719 N -0.11 3.53 0.17 1.68 -2.07 0.13 -4.67 119.66 118.33 1fhq s GLN 719 Ca 0.07 0.63 0.01 0.00 -1.82 0.00 0.00 55.36 54.25 1fhq s GLN 719 Cb -0.12 -2.13 -0.00 0.00 -1.09 0.00 0.00 33.01 29.67 1fhq s GLN 719 CO 0.01 -0.54 0.03 0.25 -1.32 0.00 0.00 175.29 173.71 1fhq n THR 720 N -2.68 0.00 -0.03 3.63 -2.24 -1.26 -4.90 114.28 106.79 1fhq n THR 720 Ca 0.05 -0.90 0.23 0.00 -2.27 0.00 0.00 64.05 61.16 1fhq n THR 720 Cb 0.54 0.25 0.72 0.00 -2.10 0.00 0.00 70.33 69.74 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 2.50 -0.07 6.98 0.00 -1.98 -0.47 119.26 127.39 1fhq h ALA 721 Ca -0.14 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1fhq h ALA 721 Cb 0.47 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1fhq h ALA 721 CO 0.23 -0.81 0.01 0.93 0.00 0.00 0.00 179.25 179.61 1fhq h GLU 722 N 0.00 0.04 -0.05 0.00 4.39 -1.99 0.36 114.58 117.33 1fhq h GLU 722 Ca 0.29 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.98 1fhq h GLU 722 Cb 1.27 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.91 1fhq h GLU 722 CO -0.00 0.02 -0.01 0.93 -1.16 0.00 0.00 179.01 178.79 1fhq h GLU 723 N 0.04 0.09 -0.49 2.33 4.39 -1.49 -2.83 114.58 116.61 1fhq h GLU 723 Ca 0.03 -0.03 0.08 0.00 0.34 0.00 0.00 59.36 59.78 1fhq h GLU 723 Cb 0.03 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 1fhq h GLU 723 CO -0.05 0.42 0.33 0.87 -1.16 0.00 0.00 179.01 179.42 1fhq h LYS 724 N -0.25 0.30 -0.44 2.33 1.57 -1.25 -0.48 116.57 118.35 1fhq h LYS 724 Ca 0.01 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1fhq h LYS 724 Cb 0.38 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1fhq h LYS 724 CO 0.00 0.20 -0.04 0.22 -0.57 0.00 0.00 179.45 179.27 1fhq h ASP 725 N 0.31 0.72 -0.47 0.86 3.58 -0.07 -0.10 116.42 121.25 1fhq h ASP 725 Ca 0.22 -0.18 0.01 0.00 0.42 0.00 0.00 57.03 57.50 1fhq h ASP 725 Cb 0.48 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.31 1fhq h ASP 725 CO -0.05 0.81 0.30 -0.07 -2.88 0.00 0.00 179.24 177.36 1fhq h LEU 726 N 0.69 0.52 -0.59 2.28 3.38 -0.85 -2.22 115.31 118.52 1fhq h LEU 726 Ca 0.13 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.95 1fhq h LEU 726 Cb 0.48 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1fhq h LEU 726 CO 0.02 0.38 -0.68 1.62 0.09 0.00 0.00 178.44 179.87 1fhq h VAL 727 N 0.62 1.44 -0.90 1.22 3.04 -1.41 -3.12 116.25 117.13 1fhq h VAL 727 Ca 0.17 -2.36 0.26 0.00 -1.01 0.00 0.00 66.70 63.77 1fhq h VAL 727 Cb -0.06 2.29 -0.04 0.00 -2.01 0.00 0.00 31.29 31.48 1fhq h VAL 727 CO -0.05 0.66 0.69 0.11 -1.01 0.00 0.00 177.57 177.98 1fhq h LYS 728 N 0.00 0.00 -0.30 4.17 1.79 -0.37 0.58 116.57 122.44 1fhq h LYS 728 Ca -0.01 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.34 1fhq h LYS 728 Cb 1.24 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.81 1fhq h LYS 728 CO 0.09 0.00 -0.07 1.63 -1.08 0.00 0.00 179.45 180.02 1fhq n LYS 729 N -4.12 2.04 0.00 3.15 5.02 -1.18 -5.09 118.16 117.98 1fhq n LYS 729 Ca 0.19 -3.08 0.07 0.00 -2.02 0.00 0.00 58.31 53.47 1fhq n LYS 729 Cb 1.00 -1.80 0.43 0.00 -0.02 0.00 0.00 35.03 34.64 1fhq n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77