#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 -1.33 1.61 -1.24 -2.04 -3.40 115.58 109.18 1fhq h ASN 574 Ca 0.00 0.00 -0.40 0.00 0.71 0.00 0.00 56.30 56.61 1fhq h ASN 574 Cb 0.00 0.00 -0.32 0.00 0.73 0.00 0.00 38.32 38.73 1fhq h ASN 574 CO 0.00 0.23 -0.96 0.61 -1.29 0.00 0.00 177.43 176.01 1fhq n GLY 575 N 1.26 2.60 3.60 1.57 0.00 -1.26 -5.08 105.19 107.88 1fhq n GLY 575 Ca -0.03 -1.14 -0.43 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.62 3.81 -0.17 1.61 3.52 -1.26 0.15 118.95 124.99 1fhq s ARG 576 Ca 0.34 0.58 -0.05 0.00 -0.13 0.00 0.00 55.73 56.46 1fhq s ARG 576 Cb 0.34 -3.83 -0.08 0.00 -1.56 0.00 0.00 34.95 29.82 1fhq s ARG 576 CO -0.07 -1.05 -0.19 0.34 -0.81 0.00 0.00 175.30 173.52 1fhq n PHE 577 N 7.01 0.00 -4.97 5.12 7.35 -1.01 -4.20 117.46 126.76 1fhq n PHE 577 Ca 0.08 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.46 1fhq n PHE 577 Cb 0.48 -0.61 -0.14 0.00 0.35 0.00 0.00 39.48 39.56 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 -6.60 2.35 -0.22 -2.13 0.20 -0.28 -1.80 118.68 110.20 1fhq s LEU 578 Ca -0.23 -0.44 0.02 0.00 0.69 0.00 0.00 54.13 54.17 1fhq s LEU 578 Cb 0.08 -1.41 0.04 0.00 -0.43 0.00 0.00 46.19 44.47 1fhq s LEU 578 CO 0.32 0.29 -0.15 -0.89 -0.29 0.00 0.00 176.35 175.64 1fhq s THR 579 N -0.76 2.08 -0.43 3.68 2.01 0.20 0.11 115.64 122.55 1fhq s THR 579 Ca 0.12 -1.30 -0.15 0.00 0.31 0.00 0.00 61.69 60.67 1fhq s THR 579 Cb -0.10 -2.06 0.04 0.00 0.01 0.00 0.00 72.50 70.38 1fhq s THR 579 CO 0.02 0.22 0.32 -0.76 -0.69 0.00 0.00 174.62 173.73 1fhq s LEU 580 N 1.20 5.24 -0.38 4.42 1.43 0.85 0.13 118.68 131.56 1fhq s LEU 580 Ca -0.03 -1.02 -0.02 0.00 -1.03 0.00 0.00 54.13 52.03 1fhq s LEU 580 Cb -0.17 -2.16 0.10 0.00 0.03 0.00 0.00 46.19 43.99 1fhq s LEU 580 CO -0.09 -0.50 0.15 -1.59 0.23 0.00 0.00 176.35 174.55 1fhq s LYS 581 N 1.66 2.02 -0.04 1.70 -2.85 -0.28 0.30 119.74 122.25 1fhq s LYS 581 Ca 0.05 -1.73 -0.33 0.00 -1.00 0.00 0.00 55.97 52.96 1fhq s LYS 581 Cb -0.20 -3.47 -0.11 0.00 -2.06 0.00 0.00 37.83 31.99 1fhq s LYS 581 CO 0.09 -0.98 1.90 -0.35 0.10 0.00 0.00 175.35 176.12 1fhq n PRO 582 N 4.56 2.41 -2.13 1.78 -0.04 0.15 -2.48 135.00 139.24 1fhq n PRO 582 Ca -0.03 0.88 -0.32 0.00 -0.04 0.00 0.00 63.50 63.99 1fhq n PRO 582 Cb 0.42 -2.76 -0.01 0.00 -0.04 0.00 0.00 33.50 31.11 1fhq n PRO 582 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fhq s LEU 583 N 4.08 3.44 0.53 1.53 1.43 -0.73 -2.10 118.68 126.86 1fhq s LEU 583 Ca 0.91 1.53 0.27 0.00 -1.03 0.00 0.00 54.13 55.81 1fhq s LEU 583 Cb -0.61 -4.49 1.40 0.00 0.03 0.00 0.00 46.19 42.52 1fhq s LEU 583 CO 0.48 -0.77 1.96 -0.65 0.23 0.00 0.00 176.35 177.59 1fhq h PRO 584 N 0.33 0.03 0.00 1.29 0.11 -1.90 0.20 132.00 132.05 1fhq h PRO 584 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1fhq h PRO 584 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1fhq h PRO 584 CO 0.61 0.02 0.00 -0.44 -0.21 0.00 0.00 178.00 177.98 1fhq h ASP 585 N 0.03 0.00 -3.26 -2.05 5.19 -1.91 -3.42 116.42 110.99 1fhq h ASP 585 Ca 0.32 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 56.18 1fhq h ASP 585 Cb 1.24 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.72 1fhq h ASP 585 CO -0.01 0.00 -0.21 -0.94 -3.12 0.00 0.00 179.24 174.96 1fhq s SER 586 N -5.13 6.53 0.60 6.45 1.04 0.70 -4.72 113.70 119.17 1fhq s SER 586 Ca -0.03 0.73 0.29 0.00 0.48 0.00 0.00 55.95 57.42 1fhq s SER 586 Cb 0.11 -2.15 1.44 0.00 0.10 0.00 0.00 66.02 65.53 1fhq s SER 586 CO 0.42 -0.05 1.85 0.16 0.98 0.00 0.00 173.24 176.61 1fhq h ILE 587 N 1.87 0.31 -3.33 -1.02 3.07 -1.76 -3.36 117.51 113.30 1fhq h ILE 587 Ca -0.47 0.00 -0.66 0.00 1.55 0.00 0.00 64.86 65.28 1fhq h ILE 587 Cb 1.17 0.57 -0.31 0.00 -0.27 0.00 0.00 36.82 37.99 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 -4.57 2.88 -0.92 0.16 2.07 -1.26 -5.05 121.20 114.51 1fhq s ILE 588 Ca -0.04 -0.74 -0.05 0.00 -1.41 0.00 0.00 60.65 58.41 1fhq s ILE 588 Cb 0.15 -2.33 0.23 0.00 0.13 0.00 0.00 42.46 40.64 1fhq s ILE 588 CO 0.53 0.40 0.83 -1.10 -1.91 0.00 0.00 174.94 173.69 1fhq s GLN 589 N 1.39 3.47 0.37 3.50 -1.52 -1.26 -4.13 119.66 121.48 1fhq s GLN 589 Ca 0.04 -3.13 0.04 0.00 -1.95 0.00 0.00 55.36 50.36 1fhq s GLN 589 Cb -0.14 -4.12 -0.04 0.00 -0.22 0.00 0.00 33.01 28.48 1fhq s GLN 589 CO -0.06 -1.25 0.09 -1.21 -0.25 0.00 0.00 175.29 172.60 1fhq s GLU 590 N -1.09 1.81 -0.09 2.91 0.41 -0.89 -4.96 118.70 116.80 1fhq s GLU 590 Ca 0.26 -2.06 -0.01 0.00 -0.41 0.00 0.00 54.97 52.75 1fhq s GLU 590 Cb -0.09 -0.79 0.03 0.00 -1.78 0.00 0.00 34.13 31.49 1fhq s GLU 590 CO -0.10 -0.33 -0.04 -1.54 -0.49 0.00 0.00 175.26 172.75 1fhq s SER 591 N -3.57 1.88 0.01 -0.19 1.04 -1.26 0.33 113.70 111.94 1fhq s SER 591 Ca 0.29 -0.21 0.04 0.00 0.48 0.00 0.00 55.95 56.55 1fhq s SER 591 Cb 0.05 -0.66 -0.03 0.00 0.10 0.00 0.00 66.02 65.48 1fhq s SER 591 CO 0.14 -0.14 -0.10 -0.76 0.98 0.00 0.00 173.24 173.36 1fhq s LEU 592 N 1.77 3.00 -0.17 2.42 1.43 0.89 -4.94 118.68 123.08 1fhq s LEU 592 Ca 0.04 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 1fhq s LEU 592 Cb -0.13 -1.72 0.03 0.00 0.03 0.00 0.00 46.19 44.41 1fhq s LEU 592 CO -0.06 0.28 -0.12 -1.61 0.23 0.00 0.00 176.35 175.07 1fhq s GLU 593 N -1.35 2.13 -0.23 1.70 2.02 -1.26 0.29 118.70 122.00 1fhq s GLU 593 Ca 0.16 -0.64 -0.25 0.00 0.02 0.00 0.00 54.97 54.25 1fhq s GLU 593 Cb -0.11 -2.19 -0.00 0.00 0.10 0.00 0.00 34.13 31.93 1fhq s GLU 593 CO 0.06 -0.32 0.86 0.42 0.02 0.00 0.00 175.26 176.31 1fhq s ILE 594 N 1.47 4.82 0.24 -1.63 1.01 0.31 -4.94 121.20 122.48 1fhq s ILE 594 Ca 0.03 1.64 -0.30 0.00 0.00 0.00 0.00 60.65 62.02 1fhq s ILE 594 Cb -0.14 -4.15 -0.09 0.00 0.01 0.00 0.00 42.46 38.09 1fhq s ILE 594 CO -0.10 -0.08 0.98 -1.10 0.00 0.00 0.00 174.94 174.64 1fhq s GLN 595 N 2.81 4.80 0.54 2.79 -1.52 -1.26 -1.12 119.66 126.70 1fhq s GLN 595 Ca 0.36 1.56 0.36 0.00 -1.95 0.00 0.00 55.36 55.69 1fhq s GLN 595 Cb -0.15 -3.27 1.54 0.00 -0.22 0.00 0.00 33.01 30.91 1fhq s GLN 595 CO 0.08 0.43 1.81 -0.56 -0.25 0.00 0.00 175.29 176.80 1fhq h GLN 596 N 4.19 0.01 0.00 2.91 3.07 0.10 1.26 115.11 126.64 1fhq h GLN 596 Ca -0.45 -0.00 -0.15 0.00 0.09 0.00 0.00 58.65 58.14 1fhq h GLN 596 Cb 1.20 -0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.74 1fhq h GLN 596 CO 0.68 0.01 -0.73 0.78 0.09 0.00 0.00 178.83 179.65 1fhq h GLY 597 N 0.01 0.00 -6.40 0.06 0.00 -1.91 -3.43 103.07 91.40 1fhq h GLY 597 Ca 0.55 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 47.31 1fhq h GLY 597 CO -0.01 0.00 0.78 0.14 0.00 0.00 0.00 176.54 177.44 1fhq s VAL 598 N -2.86 4.41 -0.13 4.60 1.01 0.43 -4.98 120.40 122.87 1fhq s VAL 598 Ca 0.03 1.27 -0.05 0.00 0.00 0.00 0.00 61.98 63.22 1fhq s VAL 598 Cb 0.08 -4.47 0.06 0.00 0.00 0.00 0.00 36.38 32.06 1fhq s VAL 598 CO 0.78 -0.74 0.28 0.21 0.00 0.00 0.00 175.10 175.63 1fhq s ASN 599 N 2.10 0.14 0.42 3.32 3.84 -1.26 -4.30 114.94 119.19 1fhq s ASN 599 Ca 0.43 0.64 -0.02 0.00 0.21 0.00 0.00 52.86 54.12 1fhq s ASN 599 Cb -0.10 0.72 -0.03 0.00 -0.55 0.00 0.00 41.25 41.30 1fhq s ASN 599 CO 0.24 -0.22 0.67 -2.16 -2.79 0.00 0.00 177.10 172.83 1fhq s PRO 600 N 2.19 3.42 -0.33 0.43 0.04 -1.26 -4.96 135.00 134.53 1fhq s PRO 600 Ca -0.01 -0.14 -0.22 0.00 0.04 0.00 0.00 61.00 60.66 1fhq s PRO 600 Cb -0.12 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1fhq s PRO 600 CO -0.09 -0.08 0.71 0.12 0.04 0.00 0.00 177.00 177.71 1fhq s PHE 601 N -2.54 3.17 0.04 0.56 5.36 0.53 -4.87 117.98 120.23 1fhq s PHE 601 Ca 0.44 0.59 -0.20 0.00 -0.96 0.00 0.00 56.93 56.80 1fhq s PHE 601 Cb -0.10 -3.19 -0.06 0.00 -0.34 0.00 0.00 43.02 39.33 1fhq s PHE 601 CO 0.40 -0.60 0.59 -0.06 -1.46 0.00 0.00 175.22 174.08 1fhq s PHE 602 N 2.85 3.75 -0.02 10.12 0.08 -1.26 0.11 117.98 133.62 1fhq s PHE 602 Ca 0.29 1.25 0.03 0.00 0.12 0.00 0.00 56.93 58.61 1fhq s PHE 602 Cb -0.14 -2.56 -0.00 0.00 -0.57 0.00 0.00 43.02 39.75 1fhq s PHE 602 CO 0.14 0.47 -0.10 0.42 -0.10 0.00 0.00 175.22 176.06 1fhq s ILE 603 N -0.67 0.79 -1.53 0.64 1.01 0.82 0.22 121.20 122.48 1fhq s ILE 603 Ca 0.30 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.55 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 0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.97 1fhq n GLY 604 N 3.05 -1.53 0.24 6.18 0.00 -1.25 0.11 105.19 111.98 1fhq n GLY 604 Ca -0.16 -1.05 -0.03 0.00 0.00 0.00 0.00 46.02 44.78 1fhq n GLY 604 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1fhq h ARG 605 N 0.00 0.46 -6.11 1.61 2.47 0.11 -3.20 114.38 109.73 1fhq h ARG 605 Ca 0.00 -0.17 -0.58 0.00 -1.26 0.00 0.00 59.98 57.97 1fhq h ARG 605 Cb 0.00 -0.03 -0.06 0.00 -1.65 0.00 0.00 29.97 28.23 1fhq h ARG 605 CO 0.00 0.68 0.81 -1.12 0.56 0.00 0.00 179.97 180.90 1fhq s SER 606 N -6.81 7.07 0.64 7.04 0.01 -1.25 -4.73 113.70 115.67 1fhq s SER 606 Ca -0.07 1.36 0.23 0.00 1.31 0.00 0.00 55.95 58.79 1fhq s SER 606 Cb 0.14 -2.54 1.18 0.00 0.21 0.00 0.00 66.02 65.01 1fhq s SER 606 CO 0.79 -0.70 1.66 -0.08 0.41 0.00 0.00 173.24 175.32 1fhq h GLU 607 N 7.56 0.00 -1.49 12.44 4.81 -1.86 0.15 114.58 136.19 1fhq h GLU 607 Ca -0.20 0.00 0.44 0.00 -0.13 0.00 0.00 59.36 59.47 1fhq h GLU 607 Cb 1.06 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.37 1fhq h GLU 607 CO 0.99 0.00 1.05 0.22 -0.73 0.00 0.00 179.01 180.54 1fhq h ASP 608 N 0.00 0.07 -2.99 1.04 1.82 -1.89 -3.36 116.42 111.11 1fhq h ASP 608 Ca 0.12 0.03 -0.55 0.00 -0.39 0.00 0.00 57.03 56.24 1fhq h ASP 608 Cb 1.35 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 41.36 1fhq h ASP 608 CO -0.00 -0.02 0.78 0.00 -1.61 0.00 0.00 179.24 178.39 1fhq n ASN 610 N 5.44 0.06 -4.88 0.00 2.85 0.28 -4.08 115.26 114.93 1fhq n ASN 610 Ca 0.12 1.07 -0.35 0.00 -0.11 0.00 0.00 54.58 55.32 1fhq n ASN 610 Cb 0.45 -0.53 -0.05 0.00 1.24 0.00 0.00 39.78 40.88 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 -1.70 2.48 -0.06 0.00 -0.14 -1.26 -3.89 119.74 115.17 1fhq s LYS 612 Ca 0.26 -1.16 -0.02 0.00 -1.36 0.00 0.00 55.97 53.70 1fhq s LYS 612 Cb -0.13 -2.76 0.03 0.00 -1.68 0.00 0.00 37.83 33.29 1fhq s LYS 612 CO 0.15 -0.45 0.03 0.42 -0.76 0.00 0.00 175.35 174.75 1fhq s ILE 613 N 1.18 0.14 -0.62 2.17 -1.09 -1.21 -5.04 121.20 116.74 1fhq s ILE 613 Ca -0.04 0.23 -0.19 0.00 -2.23 0.00 0.00 60.65 58.42 1fhq s ILE 613 Cb -0.18 -0.38 0.11 0.00 -1.58 0.00 0.00 42.46 40.44 1fhq s ILE 613 CO -0.08 0.19 0.72 -1.61 -1.23 0.00 0.00 174.94 172.94 1fhq s GLU 614 N 2.06 3.09 -0.23 2.79 8.01 -1.26 -3.72 118.70 129.44 1fhq s GLU 614 Ca 0.05 -1.39 -0.02 0.00 0.01 0.00 0.00 54.97 53.62 1fhq s GLU 614 Cb -0.12 -4.30 0.07 0.00 -4.31 0.00 0.00 34.13 25.46 1fhq s GLU 614 CO -0.04 -1.54 0.03 0.34 0.01 0.00 0.00 175.26 174.06 1fhq s ASP 615 N 3.57 3.34 0.38 -0.19 -1.08 -1.26 -4.93 116.67 116.50 1fhq s ASP 615 Ca 0.13 -1.07 0.26 0.00 -0.52 0.00 0.00 52.55 51.34 1fhq s ASP 615 Cb -0.23 -0.76 1.34 0.00 -1.46 0.00 0.00 42.92 41.81 1fhq s ASP 615 CO 0.05 -0.32 1.46 0.59 0.52 0.00 0.00 175.17 177.47 1fhq n ASN 616 N 4.94 0.25 0.13 -0.34 3.02 -1.26 0.19 115.26 122.19 1fhq n ASN 616 Ca -0.08 1.41 0.00 0.00 -0.03 0.00 0.00 54.58 55.88 1fhq n ASN 616 Cb 0.45 -0.69 0.05 0.00 -0.61 0.00 0.00 39.78 38.99 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 0.00 -7.20 3.52 -0.00 -2.00 -3.46 114.38 105.24 1fhq h ARG 617 Ca 0.81 0.00 -0.53 0.00 -0.50 0.00 0.00 59.98 59.76 1fhq h ARG 617 Cb 2.41 0.00 0.20 0.00 0.00 0.00 0.00 29.97 32.58 1fhq h ARG 617 CO -0.56 0.61 0.16 1.28 0.00 0.00 0.00 179.97 181.46 1fhq n LEU 618 N -3.34 3.18 -4.81 3.04 4.32 0.50 -4.68 117.00 115.21 1fhq n LEU 618 Ca 0.01 0.45 -0.26 0.00 -0.02 0.00 0.00 56.01 56.18 1fhq n LEU 618 Cb 0.74 -1.46 -0.05 0.00 -1.62 0.00 0.00 43.42 41.04 1fhq n LEU 618 CO 0.42 -2.22 -0.09 -0.94 -1.22 0.00 0.00 177.39 173.34 1fhq s SER 619 N -2.45 4.50 0.17 -1.43 1.04 -1.26 -4.57 113.70 109.68 1fhq s SER 619 Ca 0.67 -1.21 -0.14 0.00 0.48 0.00 0.00 55.95 55.75 1fhq s SER 619 Cb -0.24 -0.00 0.10 0.00 0.10 0.00 0.00 66.02 65.98 1fhq s SER 619 CO 0.57 -0.80 1.77 0.03 0.98 0.00 0.00 173.24 175.79 1fhq h ARG 620 N 1.14 0.40 -1.22 4.02 -0.00 -1.92 1.07 114.38 117.87 1fhq h ARG 620 Ca -0.41 -0.02 -0.59 0.00 -0.50 0.00 0.00 59.98 58.46 1fhq h ARG 620 Cb 1.28 -0.09 -0.40 0.00 0.00 0.00 0.00 29.97 30.76 1fhq h ARG 620 CO 0.65 0.27 -0.53 0.28 0.00 0.00 0.00 179.97 180.63 1fhq n VAL 621 N -4.93 2.60 -0.40 2.04 0.31 -1.26 -3.98 118.33 112.71 1fhq n VAL 621 Ca 0.03 -4.49 0.34 0.00 -0.01 0.00 0.00 64.34 60.21 1fhq n VAL 621 Cb 0.13 -1.21 0.56 0.00 -0.91 0.00 0.00 33.84 32.41 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 -0.60 0.54 0.00 3.52 -0.00 -0.09 -3.90 115.22 114.69 1fhq n HIS 622 Ca 0.44 0.55 0.00 0.00 0.46 0.00 0.00 57.72 59.16 1fhq n HIS 622 Cb 0.75 -0.96 0.00 0.00 -0.12 0.00 0.00 29.99 29.66 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 0.04 -0.25 0.00 -0.12 0.93 0.28 117.98 116.87 1fhq s PHE 624 Ca 0.00 -0.14 -0.10 0.00 -0.05 0.00 0.00 56.93 56.65 1fhq s PHE 624 Cb 0.00 -0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.30 1fhq s PHE 624 CO 0.00 -0.29 0.14 0.42 -0.05 0.00 0.00 175.22 175.44 1fhq s ILE 625 N -1.39 5.04 0.14 -4.49 1.01 0.31 0.16 121.20 121.98 1fhq s ILE 625 Ca -0.15 0.07 0.06 0.00 0.00 0.00 0.00 60.65 60.63 1fhq s ILE 625 Cb -0.08 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 1fhq s ILE 625 CO 0.02 0.33 0.01 0.12 0.00 0.00 0.00 174.94 175.42 1fhq s PHE 626 N 1.33 2.93 -0.10 3.97 5.36 0.63 0.20 117.98 132.29 1fhq s PHE 626 Ca 0.06 -0.09 0.03 0.00 -0.96 0.00 0.00 56.93 55.98 1fhq s PHE 626 Cb -0.15 -1.45 -0.01 0.00 -0.34 0.00 0.00 43.02 41.08 1fhq s PHE 626 CO 0.06 0.50 -0.20 0.21 -1.46 0.00 0.00 175.22 174.33 1fhq s LYS 627 N -2.73 3.09 0.10 10.12 2.20 -1.26 0.25 119.74 131.52 1fhq s LYS 627 Ca 0.27 -0.80 0.02 0.00 -0.36 0.00 0.00 55.97 55.10 1fhq s LYS 627 Cb -0.10 -2.41 -0.04 0.00 -1.51 0.00 0.00 37.83 33.77 1fhq s LYS 627 CO 0.19 0.24 -0.08 0.21 -0.36 0.00 0.00 175.35 175.55 1fhq s LYS 628 N 0.23 0.86 -0.19 4.03 2.36 0.05 -4.96 119.74 122.12 1fhq s LYS 628 Ca -0.13 -1.31 -0.29 0.00 -2.55 0.00 0.00 55.97 51.69 1fhq s LYS 628 Cb -0.16 -0.32 -0.01 0.00 -1.05 0.00 0.00 37.83 36.29 1fhq s LYS 628 CO 0.07 0.01 1.22 -0.98 1.55 0.00 0.00 175.35 177.22 1fhq s ARG 629 N -3.60 4.22 0.09 4.03 1.04 -1.26 0.23 118.95 123.70 1fhq s ARG 629 Ca 0.11 1.58 -0.31 0.00 -1.04 0.00 0.00 55.73 56.07 1fhq s ARG 629 Cb 0.03 -3.75 -0.10 0.00 -2.04 0.00 0.00 34.95 29.10 1fhq s ARG 629 CO -0.03 -0.72 1.81 -1.58 -0.04 0.00 0.00 175.30 174.74 1fhq s HIS 630 N 3.50 2.05 -0.53 5.89 5.65 0.47 -4.74 115.29 127.58 1fhq s HIS 630 Ca 0.53 -0.03 -0.02 0.00 0.25 0.00 0.00 55.06 55.79 1fhq s HIS 630 Cb -0.20 -4.14 0.14 0.00 -1.18 0.00 0.00 32.58 27.20 1fhq s HIS 630 CO 0.13 -4.76 0.33 0.00 -0.65 0.00 0.00 174.74 169.79 1fhq s ALA 631 N 3.05 3.38 0.59 1.58 0.00 -1.26 -1.65 121.76 127.46 1fhq s ALA 631 Ca 0.81 -2.98 -0.08 0.00 0.00 0.00 0.00 51.96 49.71 1fhq s ALA 631 Cb -0.44 -2.51 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 1fhq s ALA 631 CO 0.36 -1.97 0.94 0.54 0.00 0.00 0.00 175.76 175.63 1fhq s VAL 632 N 0.38 4.18 1.03 0.00 0.11 -1.26 -5.03 120.40 119.81 1fhq s VAL 632 Ca 0.14 0.36 -0.17 0.00 -2.93 0.00 0.00 61.98 59.37 1fhq s VAL 632 Cb -0.22 -3.66 0.09 0.00 -1.53 0.00 0.00 36.38 31.07 1fhq s VAL 632 CO -0.04 -0.75 -0.07 0.61 -3.33 0.00 0.00 175.10 171.52 1fhq n GLY 633 N -2.63 -2.52 3.66 6.54 0.00 -1.26 -4.83 105.19 104.15 1fhq n GLY 633 Ca 0.04 -0.68 -0.34 0.00 0.00 0.00 0.00 46.02 45.04 1fhq n GLY 633 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fhq n LYS 634 N -1.19 0.15 -3.58 1.61 5.02 -1.26 -4.92 118.16 113.99 1fhq n LYS 634 Ca 0.03 0.12 -0.24 0.00 -2.02 0.00 0.00 58.31 56.20 1fhq n LYS 634 Cb 0.50 -2.35 -0.16 0.00 -0.02 0.00 0.00 35.03 33.00 1fhq n LYS 634 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1fhq s SER 635 N -2.07 2.08 -1.23 4.39 1.04 -1.26 -5.04 113.70 111.62 1fhq s SER 635 Ca 0.72 -0.51 -0.09 0.00 0.48 0.00 0.00 55.95 56.55 1fhq s SER 635 Cb -0.29 -0.07 -0.13 0.00 0.10 0.00 0.00 66.02 65.64 1fhq s SER 635 CO 0.52 -0.34 3.07 0.23 0.98 0.00 0.00 173.24 177.70 1fhq n MET 636 N 5.29 3.24 -3.18 4.02 2.81 -1.26 -4.75 117.12 123.29 1fhq n MET 636 Ca -0.07 -1.89 0.00 0.00 -1.81 0.00 0.00 57.70 53.94 1fhq n MET 636 Cb 0.49 -2.60 0.00 0.00 -0.71 0.00 0.00 33.22 30.40 1fhq n MET 636 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 1fhq n TYR 637 N 3.36 0.00 -3.86 2.03 4.19 -1.26 -5.10 117.16 116.52 1fhq n TYR 637 Ca 0.69 0.00 -0.34 0.00 3.31 0.00 0.00 57.90 61.56 1fhq n TYR 637 Cb 0.38 0.00 -0.13 0.00 0.49 0.00 0.00 39.34 40.08 1fhq n TYR 637 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 1fhq s GLU 638 N -0.44 1.82 0.05 2.98 2.12 -1.26 -5.07 118.70 118.90 1fhq s GLU 638 Ca 0.00 -1.84 0.00 0.00 0.36 0.00 0.00 54.97 53.49 1fhq s GLU 638 Cb 0.00 -3.46 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 1fhq s GLU 638 CO 0.00 -1.03 -0.04 -1.54 -0.54 0.00 0.00 175.26 172.11 1fhq s SER 639 N 1.52 0.61 0.00 -1.70 1.04 -1.26 -5.17 113.70 108.74 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 -0.22 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.04 1fhq s SER 639 CO -0.05 -0.45 0.00 -0.81 0.98 0.00 0.00 173.24 172.91 1fhq n PRO 640 N 0.62 2.12 0.00 4.02 -0.04 -1.26 -4.42 135.00 136.04 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 -1.75 0.55 0.00 -1.26 -4.76 120.51 110.29 1fhq n ALA 641 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 1fhq n ALA 641 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 0.76 0.00 0.00 7.27 -1.26 -1.04 117.38 123.11 1fhq n GLN 642 Ca 0.00 -2.02 0.00 0.00 0.07 0.00 0.00 57.00 55.05 1fhq n GLN 642 Cb 0.00 -3.81 0.00 0.00 2.41 0.00 0.00 30.24 28.84 1fhq n GLN 642 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1fhq n GLY 643 N 5.93 -0.04 0.00 1.69 0.00 -0.66 -4.95 105.19 107.16 1fhq n GLY 643 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -4.19 0.99 7.99 -0.21 -4.69 117.00 116.90 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 -0.48 -0.53 -1.81 -1.51 0.00 0.00 177.39 173.06 1fhq s ASP 645 N -1.18 2.50 -0.10 -1.43 1.01 -1.25 0.18 116.67 116.40 1fhq s ASP 645 Ca 0.00 -0.41 0.04 0.00 0.71 0.00 0.00 52.55 52.89 1fhq s ASP 645 Cb 0.00 -0.65 0.00 0.00 1.01 0.00 0.00 42.92 43.29 1fhq s ASP 645 CO 0.00 0.20 -0.23 -0.62 0.21 0.00 0.00 175.17 174.72 1fhq s ASP 646 N -0.09 3.02 -0.25 0.27 -1.08 0.64 -4.32 116.67 114.86 1fhq s ASP 646 Ca -0.02 -0.55 -0.21 0.00 -0.52 0.00 0.00 52.55 51.25 1fhq s ASP 646 Cb -0.12 -1.38 -0.02 0.00 -1.46 0.00 0.00 42.92 39.94 1fhq s ASP 646 CO 0.02 0.15 0.65 0.27 0.52 0.00 0.00 175.17 176.79 1fhq s ILE 647 N 0.37 4.97 -0.17 4.11 -4.36 -1.26 -0.77 121.20 124.09 1fhq s ILE 647 Ca -0.18 1.19 -0.06 0.00 -0.26 0.00 0.00 60.65 61.34 1fhq s ILE 647 Cb -0.18 -3.96 -0.04 0.00 1.25 0.00 0.00 42.46 39.54 1fhq s ILE 647 CO 0.08 0.02 0.03 0.26 0.24 0.00 0.00 174.94 175.58 1fhq s TRP 648 N 2.50 3.19 -0.30 1.37 0.52 0.70 -2.30 118.94 124.62 1fhq s TRP 648 Ca 0.27 -0.01 -0.21 0.00 0.02 0.00 0.00 56.10 56.18 1fhq s TRP 648 Cb -0.15 -2.02 -0.01 0.00 -1.15 0.00 0.00 33.47 30.13 1fhq s TRP 648 CO 0.08 0.14 0.65 -0.47 0.02 0.00 0.00 176.95 177.36 1fhq s TYR 649 N 0.26 3.21 -0.35 -1.98 5.04 0.84 0.23 117.35 124.60 1fhq s TYR 649 Ca 0.02 0.61 -0.04 0.00 -2.44 0.00 0.00 57.07 55.22 1fhq s TYR 649 Cb -0.13 -3.01 0.07 0.00 0.35 0.00 0.00 41.96 39.24 1fhq s TYR 649 CO 0.01 -0.48 0.11 0.00 -1.34 0.00 0.00 175.55 173.85 1fhq s HIS 651 N 1.27 3.39 0.00 0.00 2.46 -0.56 -0.05 115.29 121.81 1fhq s HIS 651 Ca 0.00 1.43 0.00 0.00 0.47 0.00 0.00 55.06 56.96 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 0.28 0.25 -2.47 0.00 0.00 174.74 172.07 1fhq n THR 652 N 4.46 0.00 -2.71 0.89 -2.24 -0.84 -0.29 114.28 113.55 1fhq n THR 652 Ca 0.09 -0.46 -0.33 0.00 -2.27 0.00 0.00 64.05 61.08 1fhq n THR 652 Cb 0.48 1.05 -0.06 0.00 -2.10 0.00 0.00 70.33 69.71 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 -0.35 2.44 0.26 3.38 0.00 1.01 -4.68 107.32 109.40 1fhq s GLY 653 Ca 0.00 0.49 0.14 0.00 0.00 0.00 0.00 44.72 45.35 1fhq s GLY 653 CO 0.00 0.79 1.42 -0.84 0.00 0.00 0.00 173.10 174.46 1fhq h THR 654 N 1.78 0.93 0.00 0.90 2.02 -1.91 -2.66 112.91 113.97 1fhq h THR 654 Ca -0.49 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.36 1fhq h THR 654 Cb 1.20 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 70.06 1fhq h THR 654 CO 0.60 0.53 0.00 0.59 0.37 0.00 0.00 175.52 177.61 1fhq n ASN 655 N -3.23 0.00 -1.12 4.18 3.02 -1.26 -4.84 115.26 112.01 1fhq n ASN 655 Ca 0.02 -1.02 0.04 0.00 -0.03 0.00 0.00 54.58 53.58 1fhq n ASN 655 Cb 0.76 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.91 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 -0.81 -0.92 -4.29 2.41 3.14 -1.22 -4.91 118.33 111.73 1fhq n VAL 656 Ca 0.11 0.56 -0.16 0.00 -2.96 0.00 0.00 64.34 61.89 1fhq n VAL 656 Cb 0.05 -0.90 -0.10 0.00 -1.06 0.00 0.00 33.84 31.83 1fhq n VAL 656 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1fhq s SER 657 N -5.27 1.48 -0.16 6.55 0.01 0.25 -4.57 113.70 111.99 1fhq s SER 657 Ca 0.00 -1.23 0.01 0.00 1.31 0.00 0.00 55.95 56.04 1fhq s SER 657 Cb 0.00 0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.33 1fhq s SER 657 CO 0.00 -0.57 -0.18 -0.31 0.41 0.00 0.00 173.24 172.59 1fhq s TYR 658 N -3.57 2.52 -0.47 2.43 1.51 0.53 0.69 117.35 120.98 1fhq s TYR 658 Ca 0.28 -1.44 -0.10 0.00 -1.01 0.00 0.00 57.07 54.80 1fhq s TYR 658 Cb 0.06 -1.77 0.11 0.00 -0.11 0.00 0.00 41.96 40.25 1fhq s TYR 658 CO 0.08 -0.73 0.35 -1.17 -1.11 0.00 0.00 175.55 172.96 1fhq s LEU 659 N 1.32 5.64 0.00 -1.29 2.96 -0.24 0.19 118.68 127.27 1fhq s LEU 659 Ca 0.04 -1.80 0.00 0.00 -0.22 0.00 0.00 54.13 52.15 1fhq s LEU 659 Cb -0.13 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.52 1fhq s LEU 659 CO -0.11 -0.68 0.00 -3.20 -1.32 0.00 0.00 176.35 171.04 1fhq n ASN 660 N 4.96 0.00 -0.47 3.68 4.05 -1.18 -1.15 115.26 125.15 1fhq n ASN 660 Ca -0.09 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.94 1fhq n ASN 660 Cb 0.41 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.42 1fhq n ASN 660 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1fhq n ASN 661 N 1.43 0.00 -4.25 1.20 3.02 -1.26 -5.09 115.26 110.31 1fhq n ASN 661 Ca 0.00 -1.39 -0.28 0.00 -0.03 0.00 0.00 54.58 52.88 1fhq n ASN 661 Cb 0.00 -0.08 -0.15 0.00 -0.61 0.00 0.00 39.78 38.94 1fhq n ASN 661 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1fhq s ASN 662 N -0.39 2.60 0.34 6.41 0.02 -0.30 -5.12 114.94 118.50 1fhq s ASN 662 Ca 0.00 -0.43 -0.28 0.00 -1.02 0.00 0.00 52.86 51.13 1fhq s ASN 662 Cb 0.00 -0.27 -0.09 0.00 0.02 0.00 0.00 41.25 40.90 1fhq s ASN 662 CO 0.00 0.25 1.19 -0.13 0.02 0.00 0.00 177.10 178.43 1fhq s ARG 663 N -0.68 4.34 -0.60 -0.60 1.81 -1.26 -1.07 118.95 120.89 1fhq s ARG 663 Ca 0.09 1.94 0.04 0.00 -1.72 0.00 0.00 55.73 56.08 1fhq s ARG 663 Cb -0.09 -2.97 0.16 0.00 -0.45 0.00 0.00 34.95 31.61 1fhq s ARG 663 CO -0.00 -0.10 0.41 -1.64 -0.68 0.00 0.00 175.30 173.29 1fhq s MET 664 N -1.86 1.97 0.34 3.54 -1.94 0.22 -4.82 119.30 116.73 1fhq s MET 664 Ca 0.50 -2.88 -0.12 0.00 -1.71 0.00 0.00 55.69 51.49 1fhq s MET 664 Cb -0.34 -2.88 -0.07 0.00 2.01 0.00 0.00 34.83 33.55 1fhq s MET 664 CO 0.44 -1.28 0.70 0.96 -0.01 0.00 0.00 175.02 175.83 1fhq s ILE 665 N -0.84 4.79 -0.42 2.53 -4.36 -1.26 -0.58 121.20 121.06 1fhq s ILE 665 Ca 0.25 0.67 -0.29 0.00 -0.26 0.00 0.00 60.65 61.01 1fhq s ILE 665 Cb -0.07 -3.67 -0.09 0.00 1.25 0.00 0.00 42.46 39.88 1fhq s ILE 665 CO -0.14 -0.30 2.33 1.67 0.24 0.00 0.00 174.94 178.74 1fhq n GLN 666 N -0.73 1.23 0.00 0.37 7.27 -1.00 -1.81 117.38 122.70 1fhq n GLN 666 Ca 0.02 0.23 0.00 0.00 0.07 0.00 0.00 57.00 57.32 1fhq n GLN 666 Cb 0.53 -2.97 0.00 0.00 2.41 0.00 0.00 30.24 30.21 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 6.12 1.80 3.29 1.69 0.00 0.60 -4.91 105.19 113.78 1fhq n GLY 667 Ca 0.39 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.80 1.59 -0.04 2.61 -4.23 -0.75 -2.92 115.64 110.10 1fhq s THR 668 Ca 0.00 -1.78 0.06 0.00 -1.18 0.00 0.00 61.69 58.79 1fhq s THR 668 Cb 0.00 -1.67 -0.01 0.00 1.34 0.00 0.00 72.50 72.16 1fhq s THR 668 CO 0.00 -0.32 -0.22 -0.75 -0.54 0.00 0.00 174.62 172.79 1fhq s LYS 669 N -2.62 2.11 -0.01 3.99 2.20 0.28 -1.50 119.74 124.19 1fhq s LYS 669 Ca 0.11 -0.78 0.00 0.00 -0.36 0.00 0.00 55.97 54.95 1fhq s LYS 669 Cb -0.06 -1.85 0.01 0.00 -1.51 0.00 0.00 37.83 34.42 1fhq s LYS 669 CO 0.05 0.36 0.01 0.12 -0.36 0.00 0.00 175.35 175.53 1fhq s PHE 670 N -0.18 0.02 0.34 4.03 5.36 0.39 0.11 117.98 128.05 1fhq s PHE 670 Ca -0.01 0.06 -0.28 0.00 -0.96 0.00 0.00 56.93 55.74 1fhq s PHE 670 Cb -0.12 -0.12 -0.10 0.00 -0.34 0.00 0.00 43.02 42.35 1fhq s PHE 670 CO 0.02 -0.04 1.21 -0.51 -1.46 0.00 0.00 175.22 174.44 1fhq s LEU 671 N 0.49 4.38 -0.42 6.12 1.43 -1.26 0.29 118.68 129.72 1fhq s LEU 671 Ca -0.04 2.48 -0.08 0.00 -1.03 0.00 0.00 54.13 55.47 1fhq s LEU 671 Cb -0.06 -3.76 0.09 0.00 0.03 0.00 0.00 46.19 42.49 1fhq s LEU 671 CO -0.01 -0.49 0.25 -0.76 0.23 0.00 0.00 176.35 175.57 1fhq s LEU 672 N -1.93 5.20 0.36 1.79 1.43 -0.97 -4.78 118.68 119.78 1fhq s LEU 672 Ca 0.50 -1.66 -0.25 0.00 -1.03 0.00 0.00 54.13 51.69 1fhq s LEU 672 Cb -0.35 -1.95 -0.09 0.00 0.03 0.00 0.00 46.19 43.83 1fhq s LEU 672 CO 0.46 -0.55 1.00 -1.10 0.23 0.00 0.00 176.35 176.39 1fhq s GLN 673 N 1.35 4.36 -0.42 1.70 -0.21 -1.20 -4.27 119.66 120.99 1fhq s GLN 673 Ca 0.04 1.43 -0.43 0.00 0.02 0.00 0.00 55.36 56.42 1fhq s GLN 673 Cb -0.23 -2.66 -0.17 0.00 1.00 0.00 0.00 33.01 30.95 1fhq s GLN 673 CO 0.00 0.05 1.84 -0.40 -2.12 0.00 0.00 175.29 174.66 1fhq n ASP 674 N 0.21 1.58 -0.27 5.90 5.75 -1.26 -0.44 116.55 128.03 1fhq n ASP 674 Ca 0.04 0.95 0.00 0.00 -0.01 0.00 0.00 54.79 55.76 1fhq n ASP 674 Cb 0.50 -1.01 0.00 0.00 -1.03 0.00 0.00 41.12 39.58 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 5.16 0.94 3.55 6.12 0.00 0.19 -4.93 105.19 116.22 1fhq n GLY 675 Ca 0.36 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.70 6.34 -0.27 1.61 1.11 0.42 -4.75 116.67 118.44 1fhq s ASP 676 Ca 0.00 -0.04 -0.14 0.00 0.18 0.00 0.00 52.55 52.56 1fhq s ASP 676 Cb 0.00 -2.29 -0.04 0.00 1.07 0.00 0.00 42.92 41.66 1fhq s ASP 676 CO 0.00 -0.54 0.31 -1.61 1.18 0.00 0.00 175.17 174.51 1fhq s GLU 677 N 2.50 4.01 -0.15 8.23 2.02 -1.25 -0.24 118.70 133.82 1fhq s GLU 677 Ca 0.20 -0.07 -0.05 0.00 0.02 0.00 0.00 54.97 55.07 1fhq s GLU 677 Cb -0.15 -3.64 -0.03 0.00 0.10 0.00 0.00 34.13 30.40 1fhq s GLU 677 CO 0.14 -0.21 0.02 0.96 0.02 0.00 0.00 175.26 176.19 1fhq s ILE 678 N 1.87 4.38 -0.33 -1.63 -4.36 -0.15 -3.09 121.20 117.89 1fhq s ILE 678 Ca 0.12 -0.19 -0.17 0.00 -0.26 0.00 0.00 60.65 60.15 1fhq s ILE 678 Cb -0.16 -2.93 -0.01 0.00 1.25 0.00 0.00 42.46 40.62 1fhq s ILE 678 CO 0.10 0.51 0.47 -0.54 0.24 0.00 0.00 174.94 175.72 1fhq s LYS 679 N 0.05 3.68 0.06 0.37 3.01 0.51 -0.32 119.74 127.10 1fhq s LYS 679 Ca 0.03 -0.15 0.00 0.00 -1.01 0.00 0.00 55.97 54.84 1fhq s LYS 679 Cb -0.13 -3.78 -0.26 0.00 -1.01 0.00 0.00 37.83 32.65 1fhq s LYS 679 CO 0.02 -0.57 1.08 0.82 0.51 0.00 0.00 175.35 177.21 1fhq h ILE 680 N 5.56 1.43 -2.39 2.17 2.04 -1.79 1.54 117.51 126.08 1fhq h ILE 680 Ca -0.29 -3.08 -0.06 0.00 1.00 0.00 0.00 64.86 62.44 1fhq h ILE 680 Cb 1.13 2.84 -0.24 0.00 -0.74 0.00 0.00 36.82 39.81 1fhq h ILE 680 CO 0.74 0.87 -0.16 -0.51 0.00 0.00 0.00 178.15 179.10 1fhq s ILE 681 N -2.66 -0.01 -0.08 -0.67 2.07 -1.26 -4.29 121.20 114.31 1fhq s ILE 681 Ca -0.04 0.05 -0.02 0.00 -1.41 0.00 0.00 60.65 59.23 1fhq s ILE 681 Cb 0.08 -0.77 0.03 0.00 0.13 0.00 0.00 42.46 41.93 1fhq s ILE 681 CO 0.86 0.02 0.02 0.86 -1.91 0.00 0.00 174.94 174.79 1fhq s TRP 682 N 1.38 0.50 -0.15 3.50 -0.00 -1.20 0.88 118.94 123.86 1fhq s TRP 682 Ca -0.09 -0.10 -0.00 0.00 -0.00 0.00 0.00 56.10 55.91 1fhq s TRP 682 Cb -0.07 -0.72 0.03 0.00 -0.00 0.00 0.00 33.47 32.71 1fhq s TRP 682 CO -0.14 -0.32 -0.09 -0.51 -0.00 0.00 0.00 176.95 175.89 1fhq s ASP 683 N 2.03 2.63 0.07 5.86 1.01 0.14 -4.96 116.67 123.46 1fhq s ASP 683 Ca 0.04 -0.51 -0.20 0.00 0.71 0.00 0.00 52.55 52.59 1fhq s ASP 683 Cb -0.13 -1.01 -0.10 0.00 1.01 0.00 0.00 42.92 42.69 1fhq s ASP 683 CO -0.05 -0.12 1.52 0.11 0.21 0.00 0.00 175.17 176.84 1fhq h LYS 684 N 8.10 0.34 0.21 8.23 1.57 -1.97 0.49 116.57 133.55 1fhq h LYS 684 Ca -0.31 -0.10 -0.34 0.00 -1.87 0.00 0.00 60.65 58.03 1fhq h LYS 684 Cb 1.12 -0.03 0.02 0.00 0.08 0.00 0.00 32.23 33.42 1fhq h LYS 684 CO 0.45 0.53 -1.62 -0.97 -0.57 0.00 0.00 179.45 177.27 1fhq h ASN 685 N 0.11 0.69 0.99 0.86 -1.24 -1.99 -3.30 115.58 111.70 1fhq h ASN 685 Ca 0.06 -0.93 0.00 0.00 0.71 0.00 0.00 56.30 56.14 1fhq h ASN 685 Cb 0.37 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.20 1fhq h ASN 685 CO 0.01 1.75 0.00 -1.13 -1.29 0.00 0.00 177.43 176.77 1fhq h ASN 686 N 0.08 0.00 -3.09 1.15 -1.24 -1.98 -3.46 115.58 107.05 1fhq h ASN 686 Ca -0.31 0.00 -0.39 0.00 0.71 0.00 0.00 56.30 56.31 1fhq h ASN 686 Cb 2.10 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 41.14 1fhq h ASN 686 CO 0.21 0.00 -0.52 1.17 -1.29 0.00 0.00 177.43 177.00 1fhq n LYS 687 N -2.77 -2.21 -3.61 6.67 4.81 0.14 -4.96 118.16 116.23 1fhq n LYS 687 Ca 0.01 0.93 -0.40 0.00 -0.87 0.00 0.00 58.31 57.98 1fhq n LYS 687 Cb 0.30 -5.55 -0.11 0.00 0.02 0.00 0.00 35.03 29.69 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 -3.01 3.29 -0.10 5.64 5.36 -1.08 -4.93 117.98 123.15 1fhq s PHE 688 Ca 0.06 -1.32 0.03 0.00 -0.96 0.00 0.00 56.93 54.74 1fhq s PHE 688 Cb -0.03 -2.71 0.01 0.00 -0.34 0.00 0.00 43.02 39.95 1fhq s PHE 688 CO 0.07 -0.77 -0.19 0.14 -1.46 0.00 0.00 175.22 173.02 1fhq s VAL 689 N 1.47 1.73 0.08 3.12 -7.23 -1.25 0.27 120.40 118.59 1fhq s VAL 689 Ca 0.02 -0.81 0.06 0.00 -1.81 0.00 0.00 61.98 59.45 1fhq s VAL 689 Cb -0.21 -1.53 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 1fhq s VAL 689 CO 0.04 0.49 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.51 1fhq s ILE 690 N 0.65 1.38 -0.29 -0.62 1.01 0.26 -2.60 121.20 120.98 1fhq s ILE 690 Ca -0.13 -1.34 -0.21 0.00 0.00 0.00 0.00 60.65 58.97 1fhq s ILE 690 Cb -0.16 -1.27 0.15 0.00 0.01 0.00 0.00 42.46 41.18 1fhq s ILE 690 CO 0.03 -0.10 1.08 -0.83 0.00 0.00 0.00 174.94 175.13 1fhq s GLY 691 N -1.67 0.03 0.37 6.18 0.00 -1.26 -2.91 107.32 108.06 1fhq s GLY 691 Ca 0.02 3.05 0.08 0.00 0.00 0.00 0.00 44.72 47.87 1fhq s GLY 691 CO 0.03 2.19 0.03 -1.36 0.00 0.00 0.00 173.10 173.99 1fhq s PHE 692 N 0.67 2.53 -0.13 1.90 0.08 0.56 -1.77 117.98 121.82 1fhq s PHE 692 Ca -0.02 -0.52 -0.01 0.00 0.12 0.00 0.00 56.93 56.50 1fhq s PHE 692 Cb -0.04 -1.62 0.03 0.00 -0.57 0.00 0.00 43.02 40.82 1fhq s PHE 692 CO -0.11 0.43 -0.04 0.21 -0.10 0.00 0.00 175.22 175.61 1fhq s LYS 693 N -3.73 1.23 -0.37 0.44 2.20 -1.04 -0.98 119.74 117.49 1fhq s LYS 693 Ca 0.36 -0.27 -0.27 0.00 -0.36 0.00 0.00 55.97 55.42 1fhq s LYS 693 Cb 0.03 -1.63 0.02 0.00 -1.51 0.00 0.00 37.83 34.74 1fhq s LYS 693 CO 0.19 -0.36 1.01 0.08 -0.36 0.00 0.00 175.35 175.91 1fhq s VAL 694 N 1.76 4.51 -0.24 4.02 1.01 0.66 -1.12 120.40 130.98 1fhq s VAL 694 Ca 0.03 1.39 0.02 0.00 0.00 0.00 0.00 61.98 63.42 1fhq s VAL 694 Cb -0.14 -4.40 0.05 0.00 0.00 0.00 0.00 36.38 31.90 1fhq s VAL 694 CO -0.07 -0.58 -0.11 -0.70 0.00 0.00 0.00 175.10 173.63 1fhq s GLU 695 N 3.67 2.21 -0.34 2.72 2.12 0.34 0.55 118.70 129.98 1fhq s GLU 695 Ca 0.42 -1.21 -0.23 0.00 0.36 0.00 0.00 54.97 54.31 1fhq s GLU 695 Cb -0.11 -2.78 0.01 0.00 0.26 0.00 0.00 34.13 31.50 1fhq s GLU 695 CO 0.19 -0.53 0.78 0.42 -0.54 0.00 0.00 175.26 175.59 1fhq s ILE 696 N 1.18 4.76 -0.23 -3.70 1.01 -1.26 0.62 121.20 123.58 1fhq s ILE 696 Ca -0.07 0.98 -0.07 0.00 0.00 0.00 0.00 60.65 61.49 1fhq s ILE 696 Cb -0.19 -4.18 -0.18 0.00 0.01 0.00 0.00 42.46 37.92 1fhq s ILE 696 CO -0.06 -0.37 -0.09 0.59 0.00 0.00 0.00 174.94 175.01 1fhq n ASN 697 N 6.33 1.99 -4.58 3.58 5.03 -0.75 -4.94 115.26 121.93 1fhq n ASN 697 Ca 0.03 0.14 -0.33 0.00 0.87 0.00 0.00 54.58 55.28 1fhq n ASN 697 Cb 0.48 -0.69 -0.11 0.00 -1.02 0.00 0.00 39.78 38.44 1fhq n ASN 697 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1fhq s ASP 698 N -6.94 4.59 -0.49 6.41 1.11 -1.02 -5.08 116.67 115.25 1fhq s ASP 698 Ca -0.33 -0.06 -0.03 0.00 0.18 0.00 0.00 52.55 52.31 1fhq s ASP 698 Cb 0.10 -1.12 0.13 0.00 1.07 0.00 0.00 42.92 43.10 1fhq s ASP 698 CO 0.60 0.35 0.29 0.42 1.18 0.00 0.00 175.17 178.01 1fhq s THR 699 N -0.84 3.42 -0.64 -1.27 -4.23 -1.26 -4.55 115.64 106.27 1fhq s THR 699 Ca 0.13 -2.41 -0.24 0.00 -1.18 0.00 0.00 61.69 58.00 1fhq s THR 699 Cb -0.11 -3.30 -0.20 0.00 1.34 0.00 0.00 72.50 70.23 1fhq s THR 699 CO 0.03 -0.76 1.87 1.07 -0.54 0.00 0.00 174.62 176.28 1fhq n THR 700 N 4.17 1.47 -3.42 3.99 5.66 -1.26 -3.96 114.28 120.92 1fhq n THR 700 Ca 0.01 -1.29 -0.17 0.00 -3.05 0.00 0.00 64.05 59.55 1fhq n THR 700 Cb 0.40 -2.26 0.09 0.00 -1.55 0.00 0.00 70.33 67.01 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 4.65 -0.36 3.91 1.09 0.00 -1.26 -4.86 105.19 108.35 1fhq n GLY 701 Ca 0.49 0.10 -0.31 0.00 0.00 0.00 0.00 46.02 46.30 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 -6.36 4.29 0.38 0.99 1.43 -1.25 -3.97 118.68 114.19 1fhq s LEU 702 Ca 0.03 0.48 0.07 0.00 -1.03 0.00 0.00 54.13 53.69 1fhq s LEU 702 Cb -0.01 -3.20 0.80 0.00 0.03 0.00 0.00 46.19 43.81 1fhq s LEU 702 CO 0.72 0.09 1.98 2.19 0.23 0.00 0.00 176.35 181.55 1fhq h PHE 703 N 2.88 0.68 0.00 0.29 -5.15 -1.89 -3.41 116.94 110.34 1fhq h PHE 703 Ca -0.46 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 1fhq h PHE 703 Cb 1.16 -0.22 0.00 0.00 0.22 0.00 0.00 35.95 37.11 1fhq h PHE 703 CO 0.61 0.36 0.00 -1.71 -2.00 0.00 0.00 178.31 175.57 1fhq n ASN 704 N -4.48 -0.41 0.00 -0.68 5.15 -1.26 -4.77 115.26 108.81 1fhq n ASN 704 Ca 0.09 0.17 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 1fhq n ASN 704 Cb 0.23 0.55 0.00 0.00 -0.53 0.00 0.00 39.78 40.03 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 -2.75 0.00 0.00 1.20 0.28 -1.26 -4.91 120.64 113.20 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 0.32 0.43 -1.84 0.00 -1.26 -4.71 105.19 98.12 1fhq n GLY 706 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1fhq n GLY 706 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1fhq n LEU 707 N 0.00 1.26 -4.59 0.99 -0.00 -1.26 -3.20 117.00 110.20 1fhq n LEU 707 Ca 0.00 -0.61 -0.42 0.00 -0.00 0.00 0.00 56.01 54.98 1fhq n LEU 707 Cb 0.00 -0.14 -0.06 0.00 -0.00 0.00 0.00 43.42 43.22 1fhq n LEU 707 CO 0.00 0.31 0.47 -0.83 -0.00 0.00 0.00 177.39 177.33 1fhq s GLY 708 N -1.12 1.73 -0.09 1.47 0.00 -1.26 -4.89 107.32 103.16 1fhq s GLY 708 Ca 0.19 -0.67 -0.00 0.00 0.00 0.00 0.00 44.72 44.25 1fhq s GLY 708 CO 0.14 1.59 -0.06 1.06 0.00 0.00 0.00 173.10 175.83 1fhq s MET 709 N 2.81 1.20 0.00 2.90 -1.94 -1.26 -5.08 119.30 117.93 1fhq s MET 709 Ca 0.28 -0.15 0.00 0.00 -1.71 0.00 0.00 55.69 54.10 1fhq s MET 709 Cb -0.14 -1.29 0.00 0.00 2.01 0.00 0.00 34.83 35.41 1fhq s MET 709 CO 0.14 -0.21 0.00 1.47 -0.01 0.00 0.00 175.02 176.41 1fhq n LEU 710 N 4.73 0.00 -0.32 -0.03 -0.00 -1.26 -4.73 117.00 115.39 1fhq n LEU 710 Ca -0.14 0.00 0.29 0.00 -0.00 0.00 0.00 56.01 56.16 1fhq n LEU 710 Cb 0.50 0.00 0.54 0.00 -0.00 0.00 0.00 43.42 44.46 1fhq n LEU 710 CO 0.17 -0.23 1.06 -0.61 -0.00 0.00 0.00 177.39 177.78 1fhq h GLN 711 N 0.00 0.08 -6.87 1.47 5.75 -2.05 -3.40 115.11 110.09 1fhq h GLN 711 Ca 0.00 -0.01 -0.53 0.00 -0.15 0.00 0.00 58.65 57.96 1fhq h GLN 711 Cb 0.00 -0.02 0.08 0.00 1.07 0.00 0.00 27.48 28.61 1fhq h GLN 711 CO 0.00 0.06 0.74 -1.21 -2.65 0.00 0.00 178.83 175.77 1fhq s GLU 712 N -5.59 4.22 -0.43 1.69 2.02 -1.26 -4.98 118.70 114.36 1fhq s GLU 712 Ca -0.10 2.41 0.00 0.00 0.02 0.00 0.00 54.97 57.31 1fhq s GLU 712 Cb 0.33 -3.03 0.12 0.00 0.10 0.00 0.00 34.13 31.64 1fhq s GLU 712 CO 0.78 -0.41 0.20 -1.14 0.02 0.00 0.00 175.26 174.71 1fhq s GLN 713 N -1.50 1.91 -0.35 1.61 0.74 -1.26 -4.84 119.66 115.97 1fhq s GLN 713 Ca 0.54 -2.05 -0.31 0.00 0.05 0.00 0.00 55.36 53.58 1fhq s GLN 713 Cb -0.44 -3.45 0.05 0.00 1.10 0.00 0.00 33.01 30.27 1fhq s GLN 713 CO 0.54 -1.05 0.52 0.54 -0.55 0.00 0.00 175.29 175.30 1fhq n ARG 714 N 4.12 -1.54 -4.69 1.67 5.12 -1.26 -4.99 116.66 115.09 1fhq n ARG 714 Ca 0.02 1.21 -0.26 0.00 -1.93 0.00 0.00 57.85 56.90 1fhq n ARG 714 Cb 0.40 -1.68 -0.14 0.00 -1.16 0.00 0.00 32.46 29.87 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 -1.27 1.66 -0.26 1.55 -7.23 -1.26 -4.93 120.40 108.66 1fhq s VAL 715 Ca 0.30 -1.15 -0.29 0.00 -1.81 0.00 0.00 61.98 59.03 1fhq s VAL 715 Cb -0.03 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1fhq s VAL 715 CO 0.69 0.24 1.20 -0.69 -0.31 0.00 0.00 175.10 176.22 1fhq s VAL 716 N -0.76 4.34 0.50 1.32 1.01 -1.26 -4.72 120.40 120.84 1fhq s VAL 716 Ca 0.07 1.57 0.05 0.00 0.00 0.00 0.00 61.98 63.67 1fhq s VAL 716 Cb -0.09 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.12 1fhq s VAL 716 CO 0.01 -0.36 0.69 -0.76 0.00 0.00 0.00 175.10 174.68 1fhq s LEU 717 N 3.82 3.43 -0.05 3.92 1.02 0.12 -4.91 118.68 126.02 1fhq s LEU 717 Ca 0.51 -0.30 -0.03 0.00 0.02 0.00 0.00 54.13 54.33 1fhq s LEU 717 Cb -0.16 -2.61 -0.04 0.00 0.02 0.00 0.00 46.19 43.40 1fhq s LEU 717 CO 0.17 -1.02 0.10 -0.54 0.02 0.00 0.00 176.35 175.08 1fhq s LYS 718 N -4.58 3.20 0.54 1.70 1.02 -1.26 0.99 119.74 121.35 1fhq s LYS 718 Ca 0.57 -0.35 -0.09 0.00 0.02 0.00 0.00 55.97 56.12 1fhq s LYS 718 Cb -0.09 -2.97 -0.04 0.00 -0.52 0.00 0.00 37.83 34.21 1fhq s LYS 718 CO 0.36 0.70 0.91 1.14 -0.92 0.00 0.00 175.35 177.53 1fhq s GLN 719 N -1.41 3.60 0.18 1.68 -2.07 -1.15 -4.59 119.66 115.90 1fhq s GLN 719 Ca 0.20 0.50 0.01 0.00 -1.82 0.00 0.00 55.36 54.24 1fhq s GLN 719 Cb -0.12 -2.23 -0.00 0.00 -1.09 0.00 0.00 33.01 29.57 1fhq s GLN 719 CO 0.10 -0.37 0.03 0.25 -1.32 0.00 0.00 175.29 173.98 1fhq n THR 720 N -2.41 0.00 -0.01 3.63 -2.24 -1.26 -4.97 114.28 107.01 1fhq n THR 720 Ca 0.03 -0.95 0.22 0.00 -2.27 0.00 0.00 64.05 61.08 1fhq n THR 720 Cb 0.54 0.26 0.71 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 1.18 2.49 0.21 6.98 0.00 -1.98 -1.45 119.26 126.69 1fhq h ALA 721 Ca -0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1fhq h ALA 721 Cb 0.50 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1fhq h ALA 721 CO 0.24 -0.72 -0.11 1.49 0.00 0.00 0.00 179.25 180.15 1fhq h GLU 722 N 0.00 -0.29 -0.16 0.00 4.57 -1.99 0.12 114.58 116.83 1fhq h GLU 722 Ca 0.27 0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.43 1fhq h GLU 722 Cb 1.12 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1fhq h GLU 722 CO -0.00 -0.19 -0.05 0.93 -1.18 0.00 0.00 179.01 178.51 1fhq h GLU 723 N -0.30 0.32 -0.49 1.92 4.39 -1.69 -2.90 114.58 115.83 1fhq h GLU 723 Ca -0.03 -0.13 0.06 0.00 0.34 0.00 0.00 59.36 59.60 1fhq h GLU 723 Cb 0.24 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 1fhq h GLU 723 CO 0.04 0.61 0.33 -0.22 -1.16 0.00 0.00 179.01 178.61 1fhq h LYS 724 N 0.01 0.42 -0.33 2.33 3.11 -1.26 -1.46 116.57 119.39 1fhq h LYS 724 Ca 0.04 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.74 1fhq h LYS 724 Cb 0.50 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.63 1fhq h LYS 724 CO 0.02 0.28 -0.28 -0.44 -2.81 0.00 0.00 179.45 176.22 1fhq h ASP 725 N 0.43 0.71 -0.54 4.20 3.32 -0.62 -1.32 116.42 122.60 1fhq h ASP 725 Ca 0.21 -0.27 0.02 0.00 0.02 0.00 0.00 57.03 57.01 1fhq h ASP 725 Cb 0.30 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1fhq h ASP 725 CO -0.05 0.95 0.34 -0.07 -1.72 0.00 0.00 179.24 178.68 1fhq h LEU 726 N 0.59 0.56 -0.41 1.55 3.38 -1.07 -2.40 115.31 117.52 1fhq h LEU 726 Ca 0.07 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 1fhq h LEU 726 Cb 0.78 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1fhq h LEU 726 CO 0.06 0.40 -0.78 1.62 0.09 0.00 0.00 178.44 179.84 1fhq h VAL 727 N 0.68 1.53 -0.52 1.22 3.04 -1.46 -3.16 116.25 117.58 1fhq h VAL 727 Ca 0.21 -2.68 0.15 0.00 -1.01 0.00 0.00 66.70 63.37 1fhq h VAL 727 Cb -0.02 2.46 -0.02 0.00 -2.01 0.00 0.00 31.29 31.70 1fhq h VAL 727 CO -0.08 0.76 0.48 0.50 -1.01 0.00 0.00 177.57 178.22 1fhq h LYS 728 N 0.00 0.00 -0.31 4.17 3.64 -0.71 0.33 116.57 123.70 1fhq h LYS 728 Ca -0.01 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.24 1fhq h LYS 728 Cb 1.39 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 33.14 1fhq h LYS 728 CO 0.10 0.00 -0.07 1.63 -2.27 0.00 0.00 179.45 178.85 1fhq n LYS 729 N -3.90 2.03 0.00 1.90 5.02 -1.19 -5.09 118.16 116.92 1fhq n LYS 729 Ca 0.10 -3.09 0.13 0.00 -2.02 0.00 0.00 58.31 53.43 1fhq n LYS 729 Cb 0.69 -1.81 0.78 0.00 -0.02 0.00 0.00 35.03 34.68 1fhq n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77