#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fhq n ASN 574 N 0.00 0.92 0.00 1.61 4.13 -1.26 -4.92 115.26 115.74 1fhq n ASN 574 Ca 0.00 -0.92 0.00 0.00 1.68 0.00 0.00 54.58 55.34 1fhq n ASN 574 Cb 0.00 1.08 0.00 0.00 -1.54 0.00 0.00 39.78 39.32 1fhq n ASN 574 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1fhq n GLY 575 N 1.48 0.37 3.46 7.41 0.00 -1.26 -5.13 105.19 111.52 1fhq n GLY 575 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 3.01 0.00 1.61 3.00 -1.26 -3.27 118.95 122.04 1fhq s ARG 576 Ca 0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 55.73 54.09 1fhq s ARG 576 Cb 0.00 -2.57 0.00 0.00 0.00 0.00 0.00 34.95 32.38 1fhq s ARG 576 CO 0.00 0.44 0.00 1.97 0.00 0.00 0.00 175.30 177.71 1fhq n PHE 577 N 2.88 0.00 -4.89 5.12 -1.74 -0.84 -4.52 117.46 113.47 1fhq n PHE 577 Ca -0.18 0.00 -0.31 0.00 -0.56 0.00 0.00 57.45 56.41 1fhq n PHE 577 Cb 0.53 0.02 -0.17 0.00 1.52 0.00 0.00 39.48 41.38 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 -5.41 1.99 -0.33 5.98 0.20 -0.71 -1.47 118.68 118.93 1fhq s LEU 578 Ca 0.00 -0.52 -0.09 0.00 0.69 0.00 0.00 54.13 54.21 1fhq s LEU 578 Cb 0.00 -1.31 0.01 0.00 -0.43 0.00 0.00 46.19 44.47 1fhq s LEU 578 CO 0.00 0.10 0.14 -0.89 -0.29 0.00 0.00 176.35 175.41 1fhq s THR 579 N 0.60 4.29 -0.32 3.68 2.01 0.46 0.16 115.64 126.51 1fhq s THR 579 Ca -0.14 -0.72 -0.03 0.00 0.31 0.00 0.00 61.69 61.12 1fhq s THR 579 Cb -0.17 -3.28 0.05 0.00 0.01 0.00 0.00 72.50 69.11 1fhq s THR 579 CO 0.04 -0.04 0.04 -0.22 -0.69 0.00 0.00 174.62 173.74 1fhq s LEU 580 N 1.53 4.08 -0.17 4.42 2.96 0.58 0.26 118.68 132.35 1fhq s LEU 580 Ca 0.02 -1.31 0.01 0.00 -0.22 0.00 0.00 54.13 52.64 1fhq s LEU 580 Cb -0.18 -1.75 0.02 0.00 0.50 0.00 0.00 46.19 44.78 1fhq s LEU 580 CO 0.05 -0.29 -0.19 -1.59 -1.32 0.00 0.00 176.35 173.00 1fhq s LYS 581 N 1.27 2.87 0.01 1.98 -2.85 -0.77 0.17 119.74 122.42 1fhq s LYS 581 Ca -0.03 -0.78 -0.33 0.00 -1.00 0.00 0.00 55.97 53.82 1fhq s LYS 581 Cb -0.20 -2.49 -0.12 0.00 -2.06 0.00 0.00 37.83 32.97 1fhq s LYS 581 CO -0.01 -0.21 1.83 -0.35 0.10 0.00 0.00 175.35 176.71 1fhq n PRO 582 N 4.64 2.36 -2.29 1.78 -0.04 0.25 -2.13 135.00 139.57 1fhq n PRO 582 Ca -0.20 0.86 -0.30 0.00 -0.04 0.00 0.00 63.50 63.82 1fhq n PRO 582 Cb 0.50 -2.72 -0.01 0.00 -0.04 0.00 0.00 33.50 31.23 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 3.27 3.49 0.50 1.53 1.43 -0.21 -2.16 118.68 126.53 1fhq s LEU 583 Ca 0.88 1.32 0.28 0.00 -1.03 0.00 0.00 54.13 55.58 1fhq s LEU 583 Cb -0.62 -4.30 1.38 0.00 0.03 0.00 0.00 46.19 42.67 1fhq s LEU 583 CO 0.45 -0.67 1.86 -0.65 0.23 0.00 0.00 176.35 177.56 1fhq h PRO 584 N 0.33 0.12 0.00 1.29 0.11 -1.89 0.43 132.00 132.38 1fhq h PRO 584 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1fhq h PRO 584 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1fhq h PRO 584 CO 0.62 0.08 0.00 -0.44 -0.21 0.00 0.00 178.00 178.05 1fhq h ASP 585 N 0.12 0.00 -3.44 -2.05 3.32 -1.92 -3.42 116.42 109.03 1fhq h ASP 585 Ca 0.48 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.99 1fhq h ASP 585 Cb 1.68 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 41.19 1fhq h ASP 585 CO -0.07 0.00 -0.07 -0.94 -1.72 0.00 0.00 179.24 176.44 1fhq s SER 586 N -5.30 6.73 0.56 6.45 1.04 0.15 -4.71 113.70 118.63 1fhq s SER 586 Ca -0.03 1.04 0.33 0.00 0.48 0.00 0.00 55.95 57.77 1fhq s SER 586 Cb 0.11 -2.27 1.47 0.00 0.10 0.00 0.00 66.02 65.43 1fhq s SER 586 CO 0.45 -0.03 1.82 -0.29 0.98 0.00 0.00 173.24 176.17 1fhq h ILE 587 N 2.30 0.40 -3.26 -1.02 6.09 -1.20 -3.35 117.51 117.46 1fhq h ILE 587 Ca -0.48 0.00 -0.66 0.00 -1.37 0.00 0.00 64.86 62.35 1fhq h ILE 587 Cb 1.18 0.47 -0.31 0.00 0.47 0.00 0.00 36.82 38.63 1fhq h ILE 587 CO 0.67 0.00 -0.78 -0.51 -3.07 0.00 0.00 178.15 174.46 1fhq s ILE 588 N -4.83 2.84 -0.97 2.19 2.07 -1.26 -5.05 121.20 116.19 1fhq s ILE 588 Ca -0.05 -0.68 -0.08 0.00 -1.41 0.00 0.00 60.65 58.44 1fhq s ILE 588 Cb 0.20 -2.26 0.24 0.00 0.13 0.00 0.00 42.46 40.77 1fhq s ILE 588 CO 0.70 0.47 0.91 -1.10 -1.91 0.00 0.00 174.94 174.01 1fhq s GLN 589 N 1.40 3.73 0.38 3.50 -1.52 -1.26 -4.23 119.66 121.67 1fhq s GLN 589 Ca 0.05 -3.05 0.04 0.00 -1.95 0.00 0.00 55.36 50.45 1fhq s GLN 589 Cb -0.14 -4.31 -0.04 0.00 -0.22 0.00 0.00 33.01 28.30 1fhq s GLN 589 CO -0.07 -1.25 0.08 -1.21 -0.25 0.00 0.00 175.29 172.59 1fhq s GLU 590 N -0.95 1.84 -0.08 2.91 0.41 -0.92 -4.97 118.70 116.94 1fhq s GLU 590 Ca 0.27 -2.09 -0.00 0.00 -0.41 0.00 0.00 54.97 52.74 1fhq s GLU 590 Cb -0.10 -0.82 0.02 0.00 -1.78 0.00 0.00 34.13 31.45 1fhq s GLU 590 CO -0.09 -0.34 -0.05 -1.54 -0.49 0.00 0.00 175.26 172.75 1fhq s SER 591 N -3.58 1.74 -0.01 -0.19 1.04 -1.26 0.88 113.70 112.32 1fhq s SER 591 Ca 0.28 -0.20 0.04 0.00 0.48 0.00 0.00 55.95 56.54 1fhq s SER 591 Cb 0.05 -0.64 -0.03 0.00 0.10 0.00 0.00 66.02 65.50 1fhq s SER 591 CO 0.14 -0.12 -0.11 -0.76 0.98 0.00 0.00 173.24 173.37 1fhq s LEU 592 N 1.56 2.95 -0.17 2.42 2.01 0.45 -4.91 118.68 122.99 1fhq s LEU 592 Ca 0.00 -0.19 0.00 0.00 0.01 0.00 0.00 54.13 53.96 1fhq s LEU 592 Cb -0.13 -1.68 0.03 0.00 0.01 0.00 0.00 46.19 44.43 1fhq s LEU 592 CO -0.05 0.31 -0.10 -1.61 1.01 0.00 0.00 176.35 175.91 1fhq s GLU 593 N -1.15 1.95 0.03 1.70 8.01 -1.26 0.22 118.70 128.20 1fhq s GLU 593 Ca 0.14 -0.64 -0.30 0.00 0.01 0.00 0.00 54.97 54.18 1fhq s GLU 593 Cb -0.11 -2.17 -0.04 0.00 -4.31 0.00 0.00 34.13 27.50 1fhq s GLU 593 CO 0.04 -0.36 1.06 0.42 0.01 0.00 0.00 175.26 176.44 1fhq s ILE 594 N 1.50 4.51 0.14 -1.63 1.01 0.41 -4.94 121.20 122.20 1fhq s ILE 594 Ca 0.02 1.82 -0.28 0.00 0.00 0.00 0.00 60.65 62.21 1fhq s ILE 594 Cb -0.15 -4.17 -0.07 0.00 0.01 0.00 0.00 42.46 38.09 1fhq s ILE 594 CO -0.09 0.15 0.88 -1.58 0.00 0.00 0.00 174.94 174.30 1fhq s GLN 595 N 0.94 4.66 0.59 2.79 0.74 -1.26 -1.74 119.66 126.38 1fhq s GLN 595 Ca 0.54 1.31 0.30 0.00 0.05 0.00 0.00 55.36 57.56 1fhq s GLN 595 Cb -0.25 -3.33 1.38 0.00 1.10 0.00 0.00 33.01 31.92 1fhq s GLN 595 CO 0.29 0.37 1.77 -0.56 -0.55 0.00 0.00 175.29 176.61 1fhq h GLN 596 N 5.03 0.00 0.00 1.67 -0.00 -1.82 0.69 115.11 120.68 1fhq h GLN 596 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.21 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 0.70 0.00 -1.14 0.41 -0.00 0.00 0.00 178.83 178.80 1fhq n GLY 597 N -1.58 -1.12 3.60 0.06 0.00 -1.26 -4.87 105.19 100.03 1fhq n GLY 597 Ca 0.14 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.17 4.65 -0.11 1.61 1.01 0.24 -5.00 120.40 119.62 1fhq s VAL 598 Ca 0.04 1.15 -0.05 0.00 0.00 0.00 0.00 61.98 63.12 1fhq s VAL 598 Cb 0.15 -4.28 0.05 0.00 0.00 0.00 0.00 36.38 32.31 1fhq s VAL 598 CO 0.83 -0.46 0.24 0.21 0.00 0.00 0.00 175.10 175.92 1fhq s ASN 599 N 1.81 0.14 0.41 3.32 2.47 -1.26 -4.30 114.94 117.52 1fhq s ASN 599 Ca 0.36 0.53 -0.01 0.00 0.42 0.00 0.00 52.86 54.16 1fhq s ASN 599 Cb -0.13 0.53 -0.03 0.00 -1.45 0.00 0.00 41.25 40.17 1fhq s ASN 599 CO 0.17 -0.21 0.65 -2.16 -3.72 0.00 0.00 177.10 171.83 1fhq s PRO 600 N 1.92 3.44 -0.36 0.43 0.04 -1.26 -5.03 135.00 134.17 1fhq s PRO 600 Ca -0.03 -0.18 -0.22 0.00 0.04 0.00 0.00 61.00 60.61 1fhq s PRO 600 Cb -0.11 -2.55 0.01 0.00 0.04 0.00 0.00 34.50 31.88 1fhq s PRO 600 CO -0.08 -0.04 0.72 0.12 0.04 0.00 0.00 177.00 177.76 1fhq s PHE 601 N -2.50 3.13 0.04 0.56 5.36 0.28 -4.89 117.98 119.95 1fhq s PHE 601 Ca 0.44 0.45 -0.19 0.00 -0.96 0.00 0.00 56.93 56.67 1fhq s PHE 601 Cb -0.10 -3.29 -0.06 0.00 -0.34 0.00 0.00 43.02 39.23 1fhq s PHE 601 CO 0.39 -0.69 0.54 -0.06 -1.46 0.00 0.00 175.22 173.94 1fhq s PHE 602 N 2.93 3.76 -0.03 10.12 0.08 -1.26 0.13 117.98 133.70 1fhq s PHE 602 Ca 0.28 1.19 0.02 0.00 0.12 0.00 0.00 56.93 58.55 1fhq s PHE 602 Cb -0.14 -2.49 0.00 0.00 -0.57 0.00 0.00 43.02 39.83 1fhq s PHE 602 CO 0.16 0.53 -0.09 0.42 -0.10 0.00 0.00 175.22 176.15 1fhq s ILE 603 N -0.84 0.75 -1.20 0.64 1.01 0.91 0.21 121.20 122.69 1fhq s ILE 603 Ca 0.28 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.59 1fhq s ILE 603 Cb -0.19 -0.67 0.00 0.00 0.01 0.00 0.00 42.46 41.61 1fhq s ILE 603 CO 0.17 0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.96 1fhq n GLY 604 N 3.32 -1.40 0.24 6.18 0.00 -1.25 0.13 105.19 112.40 1fhq n GLY 604 Ca -0.18 -0.99 -0.04 0.00 0.00 0.00 0.00 46.02 44.80 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 0.52 -6.14 1.61 2.47 0.80 -3.10 114.38 110.54 1fhq h ARG 605 Ca 0.00 -0.21 -0.57 0.00 -1.26 0.00 0.00 59.98 57.94 1fhq h ARG 605 Cb 0.00 -0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 28.24 1fhq h ARG 605 CO 0.00 0.74 0.85 -1.12 0.56 0.00 0.00 179.97 181.00 1fhq s SER 606 N -6.81 7.01 0.66 7.04 0.01 -1.23 -4.67 113.70 115.70 1fhq s SER 606 Ca -0.07 1.44 0.25 0.00 1.31 0.00 0.00 55.95 58.88 1fhq s SER 606 Cb 0.13 -2.54 1.36 0.00 0.21 0.00 0.00 66.02 65.18 1fhq s SER 606 CO 0.80 -0.74 1.77 1.05 0.41 0.00 0.00 173.24 176.52 1fhq h GLU 607 N 7.86 0.00 -1.39 12.44 4.11 -1.87 0.99 114.58 136.72 1fhq h GLU 607 Ca -0.22 0.00 0.41 0.00 0.07 0.00 0.00 59.36 59.62 1fhq h GLU 607 Cb 1.08 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.26 1fhq h GLU 607 CO 0.99 0.00 0.99 -0.44 0.07 0.00 0.00 179.01 180.62 1fhq h ASP 608 N 0.00 0.04 -2.80 3.06 3.32 -1.89 -3.37 116.42 114.79 1fhq h ASP 608 Ca 0.02 0.01 -0.55 0.00 0.02 0.00 0.00 57.03 56.53 1fhq h ASP 608 Cb 0.93 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 1fhq h ASP 608 CO -0.00 -0.01 0.94 0.00 -1.72 0.00 0.00 179.24 178.46 1fhq n ASN 610 N 6.26 0.12 -4.87 0.00 2.85 0.13 -4.01 115.26 115.75 1fhq n ASN 610 Ca 0.15 1.18 -0.35 0.00 -0.11 0.00 0.00 54.58 55.44 1fhq n ASN 610 Cb 0.43 -0.58 -0.06 0.00 1.24 0.00 0.00 39.78 40.82 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 -1.63 2.55 -0.15 0.00 1.02 -1.26 -3.97 119.74 116.30 1fhq s LYS 612 Ca 0.28 -1.14 -0.04 0.00 0.02 0.00 0.00 55.97 55.09 1fhq s LYS 612 Cb -0.14 -2.77 0.05 0.00 -0.52 0.00 0.00 37.83 34.46 1fhq s LYS 612 CO 0.15 -0.43 0.07 0.42 -0.92 0.00 0.00 175.35 174.65 1fhq s ILE 613 N 1.18 0.06 -0.65 2.17 -1.09 -1.17 -4.97 121.20 116.72 1fhq s ILE 613 Ca -0.03 -0.14 -0.18 0.00 -2.23 0.00 0.00 60.65 58.07 1fhq s ILE 613 Cb -0.17 -0.60 0.12 0.00 -1.58 0.00 0.00 42.46 40.23 1fhq s ILE 613 CO -0.08 -0.16 0.73 -1.83 -1.23 0.00 0.00 174.94 172.37 1fhq s GLU 614 N 2.08 3.16 -0.22 2.79 -1.05 -1.26 -3.45 118.70 120.75 1fhq s GLU 614 Ca 0.02 -1.55 -0.02 0.00 -0.15 0.00 0.00 54.97 53.26 1fhq s GLU 614 Cb -0.15 -4.35 0.07 0.00 -0.44 0.00 0.00 34.13 29.25 1fhq s GLU 614 CO -0.08 -1.51 0.04 -0.51 0.95 0.00 0.00 175.26 174.15 1fhq s ASP 615 N 3.44 3.16 0.39 0.83 1.11 -1.26 -4.93 116.67 119.41 1fhq s ASP 615 Ca 0.13 -0.98 0.35 0.00 0.18 0.00 0.00 52.55 52.23 1fhq s ASP 615 Cb -0.21 -0.66 1.23 0.00 1.07 0.00 0.00 42.92 44.35 1fhq s ASP 615 CO 0.02 -0.32 1.13 0.59 1.18 0.00 0.00 175.17 177.77 1fhq n ASN 616 N 5.00 0.02 0.08 0.27 3.02 -1.26 0.14 115.26 122.53 1fhq n ASN 616 Ca -0.08 0.75 -0.15 0.00 -0.03 0.00 0.00 54.58 55.07 1fhq n ASN 616 Cb 0.46 -0.38 -0.08 0.00 -0.61 0.00 0.00 39.78 39.18 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 0.40 -7.25 3.52 2.47 -1.99 -3.46 114.38 108.08 1fhq h ARG 617 Ca 0.68 -0.49 -0.52 0.00 -1.26 0.00 0.00 59.98 58.38 1fhq h ARG 617 Cb 2.66 0.15 0.20 0.00 -1.65 0.00 0.00 29.97 31.33 1fhq h ARG 617 CO -0.05 1.16 0.22 1.28 0.56 0.00 0.00 179.97 183.15 1fhq n LEU 618 N -3.70 3.45 0.00 3.04 4.77 0.37 -4.82 117.00 120.11 1fhq n LEU 618 Ca -0.08 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 1fhq n LEU 618 Cb 0.90 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.51 1fhq n LEU 618 CO 0.53 -2.11 0.00 -1.20 -1.33 0.00 0.00 177.39 173.27 1fhq n SER 619 N -4.03 0.77 -0.10 -1.43 7.64 -1.26 -4.49 113.62 110.72 1fhq n SER 619 Ca 0.12 -0.91 -0.07 0.00 1.01 0.00 0.00 58.87 59.02 1fhq n SER 619 Cb 0.52 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.82 1fhq n SER 619 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1fhq h ARG 620 N 0.00 0.80 -1.18 1.43 2.43 -1.93 0.89 114.38 116.82 1fhq h ARG 620 Ca 0.00 -0.30 -0.49 0.00 -0.81 0.00 0.00 59.98 58.38 1fhq h ARG 620 Cb 0.00 -0.05 -0.41 0.00 -0.42 0.00 0.00 29.97 29.09 1fhq h ARG 620 CO 0.00 0.91 -0.91 0.28 -1.51 0.00 0.00 179.97 178.74 1fhq n VAL 621 N -4.14 1.92 -0.39 0.20 0.31 -1.26 -4.16 118.33 110.81 1fhq n VAL 621 Ca 0.01 -4.15 0.33 0.00 -0.01 0.00 0.00 64.34 60.52 1fhq n VAL 621 Cb 0.40 -0.50 0.56 0.00 -0.91 0.00 0.00 33.84 33.39 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 -0.40 0.61 0.00 3.52 -0.00 0.02 -4.10 115.22 114.87 1fhq n HIS 622 Ca 0.29 0.61 0.00 0.00 0.46 0.00 0.00 57.72 59.08 1fhq n HIS 622 Cb 0.76 -1.03 0.00 0.00 -0.12 0.00 0.00 29.99 29.60 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 0.01 -0.30 0.00 -0.71 0.27 0.31 117.98 115.56 1fhq s PHE 624 Ca 0.00 -0.03 -0.11 0.00 -1.04 0.00 0.00 56.93 55.76 1fhq s PHE 624 Cb 0.00 -0.03 -0.03 0.00 -1.21 0.00 0.00 43.02 41.75 1fhq s PHE 624 CO 0.00 -0.21 0.18 0.42 -1.34 0.00 0.00 175.22 174.27 1fhq s ILE 625 N -0.96 5.03 0.14 -4.49 1.01 0.35 0.22 121.20 122.49 1fhq s ILE 625 Ca -0.11 -0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.51 1fhq s ILE 625 Cb -0.06 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 1fhq s ILE 625 CO 0.01 0.15 -0.01 0.12 0.00 0.00 0.00 174.94 175.21 1fhq s PHE 626 N 1.70 2.89 -0.07 3.97 5.36 0.45 0.98 117.98 133.26 1fhq s PHE 626 Ca 0.06 -0.10 0.03 0.00 -0.96 0.00 0.00 56.93 55.97 1fhq s PHE 626 Cb -0.16 -1.44 -0.02 0.00 -0.34 0.00 0.00 43.02 41.05 1fhq s PHE 626 CO 0.09 0.49 -0.18 0.21 -1.46 0.00 0.00 175.22 174.38 1fhq s LYS 627 N -2.63 2.76 0.09 10.12 2.20 -1.26 0.24 119.74 131.26 1fhq s LYS 627 Ca 0.26 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 55.13 1fhq s LYS 627 Cb -0.10 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.80 1fhq s LYS 627 CO 0.18 0.43 -0.07 0.21 -0.36 0.00 0.00 175.35 175.74 1fhq s LYS 628 N -0.24 0.80 -0.16 4.03 2.36 0.11 -4.94 119.74 121.70 1fhq s LYS 628 Ca 0.00 -1.26 -0.29 0.00 -2.55 0.00 0.00 55.97 51.87 1fhq s LYS 628 Cb -0.13 -0.23 -0.01 0.00 -1.05 0.00 0.00 37.83 36.41 1fhq s LYS 628 CO 0.03 -0.01 1.20 0.50 1.55 0.00 0.00 175.35 178.62 1fhq s ARG 629 N -3.54 4.26 0.07 4.03 6.06 -1.26 0.26 118.95 128.84 1fhq s ARG 629 Ca 0.09 1.60 -0.30 0.00 -2.50 0.00 0.00 55.73 54.61 1fhq s ARG 629 Cb 0.03 -3.70 -0.09 0.00 0.06 0.00 0.00 34.95 31.25 1fhq s ARG 629 CO -0.04 -0.63 1.89 -1.58 -2.50 0.00 0.00 175.30 172.43 1fhq s HIS 630 N 3.17 1.72 -0.58 5.12 5.65 0.53 -4.81 115.29 126.09 1fhq s HIS 630 Ca 0.53 -0.22 -0.27 0.00 0.25 0.00 0.00 55.06 55.35 1fhq s HIS 630 Cb -0.21 -4.20 -0.02 0.00 -1.18 0.00 0.00 32.58 26.97 1fhq s HIS 630 CO 0.14 -5.16 1.87 0.00 -0.65 0.00 0.00 174.74 170.94 1fhq s ALA 631 N 3.63 2.22 0.39 1.58 0.00 -1.26 -4.42 121.76 123.90 1fhq s ALA 631 Ca 0.84 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 52.29 1fhq s ALA 631 Cb -0.44 -4.28 -0.05 0.00 0.00 0.00 0.00 23.12 18.35 1fhq s ALA 631 CO 0.39 -3.79 0.05 0.54 0.00 0.00 0.00 175.76 172.94 1fhq s VAL 632 N 8.95 1.25 0.00 0.00 0.11 -1.26 -5.14 120.40 124.31 1fhq s VAL 632 Ca 0.69 -2.00 0.00 0.00 -2.93 0.00 0.00 61.98 57.74 1fhq s VAL 632 Cb -0.14 -2.65 0.00 0.00 -1.53 0.00 0.00 36.38 32.07 1fhq s VAL 632 CO 0.22 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.60 1fhq n GLY 633 N -0.89 2.79 2.80 6.54 0.00 -1.26 -5.02 105.19 110.15 1fhq n GLY 633 Ca -0.06 -1.89 -0.16 0.00 0.00 0.00 0.00 46.02 43.91 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 0.00 0.27 -3.20 1.61 4.01 -1.26 -4.85 118.16 114.74 1fhq n LYS 634 Ca 0.00 -2.04 0.04 0.00 -0.51 0.00 0.00 58.31 55.80 1fhq n LYS 634 Cb 0.00 -0.39 -0.03 0.00 -0.51 0.00 0.00 35.03 34.10 1fhq n LYS 634 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1fhq s SER 635 N -3.84 -0.31 -0.35 4.39 1.04 -1.26 -5.03 113.70 108.35 1fhq s SER 635 Ca 0.47 0.28 0.07 0.00 0.48 0.00 0.00 55.95 57.24 1fhq s SER 635 Cb -0.03 1.30 0.66 0.00 0.10 0.00 0.00 66.02 68.05 1fhq s SER 635 CO 0.31 -0.06 1.78 0.80 0.98 0.00 0.00 173.24 177.05 1fhq n MET 636 N 5.18 2.96 0.00 4.02 1.56 -1.26 -4.90 117.12 124.68 1fhq n MET 636 Ca -0.08 -2.81 0.00 0.00 -0.27 0.00 0.00 57.70 54.54 1fhq n MET 636 Cb 0.54 -2.13 0.00 0.00 2.15 0.00 0.00 33.22 33.79 1fhq n MET 636 CO 0.00 0.00 0.00 2.48 -0.73 0.00 0.00 175.97 177.72 1fhq n TYR 637 N -0.49 0.00 -3.81 1.12 4.11 -1.26 -5.11 117.16 111.72 1fhq n TYR 637 Ca 0.45 0.00 -0.35 0.00 -0.00 0.00 0.00 57.90 58.00 1fhq n TYR 637 Cb 1.43 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 40.65 1fhq n TYR 637 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.86 174.86 1fhq s GLU 638 N 1.83 1.93 0.05 -3.48 2.12 -1.26 -5.06 118.70 114.83 1fhq s GLU 638 Ca 0.00 -1.86 0.00 0.00 0.36 0.00 0.00 54.97 53.47 1fhq s GLU 638 Cb 0.00 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.83 1fhq s GLU 638 CO 0.00 -1.06 -0.04 0.45 -0.54 0.00 0.00 175.26 174.07 1fhq s SER 639 N 1.63 0.59 0.00 -1.70 0.15 -1.26 -5.17 113.70 107.94 1fhq s SER 639 Ca 0.09 -0.84 0.00 0.00 0.70 0.00 0.00 55.95 55.90 1fhq s SER 639 Cb -0.22 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 1fhq s SER 639 CO -0.05 -0.46 0.00 -0.81 1.20 0.00 0.00 173.24 173.12 1fhq n PRO 640 N 0.56 1.66 0.00 5.44 -0.04 -1.26 -4.40 135.00 136.97 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 -3.92 0.55 0.00 -0.73 -4.71 120.51 108.71 1fhq n ALA 641 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 1fhq n ALA 641 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 -0.95 -2.36 0.00 7.27 -1.26 -3.48 117.38 116.60 1fhq n GLN 642 Ca 0.00 0.11 0.00 0.00 0.07 0.00 0.00 57.00 57.18 1fhq n GLN 642 Cb 0.00 -4.01 0.00 0.00 2.41 0.00 0.00 30.24 28.64 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 -0.92 -5.81 0.00 1.69 0.00 -1.26 -5.07 105.19 93.81 1fhq n GLY 643 Ca 0.09 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 1.87 0.00 -4.23 0.99 4.77 -1.23 -4.89 117.00 114.28 1fhq n LEU 644 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 1fhq n LEU 644 Cb 0.00 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 40.93 1fhq n LEU 644 CO 0.00 0.00 -0.54 -1.81 -1.33 0.00 0.00 177.39 173.71 1fhq s ASP 645 N -0.20 2.60 0.05 -1.43 1.01 -1.21 0.20 116.67 117.70 1fhq s ASP 645 Ca 0.00 -0.41 -0.00 0.00 0.71 0.00 0.00 52.55 52.85 1fhq s ASP 645 Cb 0.00 -0.42 -0.04 0.00 1.01 0.00 0.00 42.92 43.47 1fhq s ASP 645 CO 0.00 0.25 0.19 -0.62 0.21 0.00 0.00 175.17 175.20 1fhq s ASP 646 N -0.38 6.28 -0.37 0.27 -1.08 0.74 -4.21 116.67 117.91 1fhq s ASP 646 Ca 0.05 0.26 -0.14 0.00 -0.52 0.00 0.00 52.55 52.20 1fhq s ASP 646 Cb -0.10 -1.92 -0.00 0.00 -1.46 0.00 0.00 42.92 39.44 1fhq s ASP 646 CO 0.00 0.19 0.26 0.27 0.52 0.00 0.00 175.17 176.42 1fhq s ILE 647 N -1.46 5.23 -0.16 4.11 -4.36 -1.26 0.04 121.20 123.35 1fhq s ILE 647 Ca 0.33 -0.42 -0.10 0.00 -0.26 0.00 0.00 60.65 60.20 1fhq s ILE 647 Cb -0.13 -3.79 -0.05 0.00 1.25 0.00 0.00 42.46 39.75 1fhq s ILE 647 CO 0.25 -0.14 0.18 0.26 0.24 0.00 0.00 174.94 175.74 1fhq s TRP 648 N 1.70 3.50 -0.32 1.37 0.52 0.67 -2.29 118.94 124.09 1fhq s TRP 648 Ca 0.05 0.48 -0.20 0.00 0.02 0.00 0.00 56.10 56.46 1fhq s TRP 648 Cb -0.18 -2.13 -0.01 0.00 -1.15 0.00 0.00 33.47 30.00 1fhq s TRP 648 CO 0.10 0.45 0.63 -0.47 0.02 0.00 0.00 176.95 177.67 1fhq s TYR 649 N -0.15 3.20 -0.38 -1.98 5.04 0.65 0.17 117.35 123.89 1fhq s TYR 649 Ca 0.13 0.52 -0.07 0.00 -2.44 0.00 0.00 57.07 55.21 1fhq s TYR 649 Cb -0.12 -3.02 0.07 0.00 0.35 0.00 0.00 41.96 39.24 1fhq s TYR 649 CO 0.02 -0.51 0.18 0.00 -1.34 0.00 0.00 175.55 173.90 1fhq s HIS 651 N 1.35 3.62 0.00 0.00 2.46 -0.80 0.96 115.29 122.88 1fhq s HIS 651 Ca 0.02 1.60 0.00 0.00 0.47 0.00 0.00 55.06 57.15 1fhq s HIS 651 Cb -0.22 -3.20 0.00 0.00 -0.13 0.00 0.00 32.58 29.03 1fhq s HIS 651 CO 0.01 -0.36 0.66 0.25 -2.47 0.00 0.00 174.74 172.84 1fhq n THR 652 N 3.68 0.43 -3.39 0.89 -2.24 -0.64 0.19 114.28 113.20 1fhq n THR 652 Ca 0.06 -0.51 -0.38 0.00 -2.27 0.00 0.00 64.05 60.95 1fhq n THR 652 Cb 0.49 0.89 -0.06 0.00 -2.10 0.00 0.00 70.33 69.55 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 -0.43 2.56 0.54 3.38 0.00 0.58 -4.60 107.32 109.34 1fhq s GLY 653 Ca 0.00 -0.11 0.29 0.00 0.00 0.00 0.00 44.72 44.90 1fhq s GLY 653 CO 0.00 0.32 2.12 -0.84 0.00 0.00 0.00 173.10 174.70 1fhq h THR 654 N 3.71 0.51 0.00 0.90 2.02 -1.92 -2.06 112.91 116.07 1fhq h THR 654 Ca -0.50 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 66.28 1fhq h THR 654 Cb 1.21 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.89 1fhq h THR 654 CO 0.63 0.08 0.00 0.59 0.37 0.00 0.00 175.52 177.20 1fhq n ASN 655 N -3.64 0.00 -1.13 4.18 3.02 -1.26 -4.81 115.26 111.62 1fhq n ASN 655 Ca -0.02 -1.23 0.04 0.00 -0.03 0.00 0.00 54.58 53.34 1fhq n ASN 655 Cb 0.20 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.35 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 -0.95 -4.48 2.41 3.14 -0.78 -4.78 118.33 112.11 1fhq n VAL 656 Ca 0.11 0.59 -0.23 0.00 -2.96 0.00 0.00 64.34 61.85 1fhq n VAL 656 Cb 0.05 -0.94 -0.10 0.00 -1.06 0.00 0.00 33.84 31.79 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 -5.35 3.17 -0.06 6.55 0.15 0.18 -4.31 113.70 114.03 1fhq s SER 657 Ca 0.00 -1.21 0.01 0.00 0.70 0.00 0.00 55.95 55.45 1fhq s SER 657 Cb 0.00 -0.24 0.02 0.00 -1.71 0.00 0.00 66.02 64.08 1fhq s SER 657 CO 0.00 -0.31 -0.08 -0.31 1.20 0.00 0.00 173.24 173.74 1fhq s TYR 658 N -2.86 1.11 -0.29 3.44 1.51 0.52 -0.70 117.35 120.09 1fhq s TYR 658 Ca 0.31 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 56.02 1fhq s TYR 658 Cb 0.04 -0.88 0.07 0.00 -0.11 0.00 0.00 41.96 41.08 1fhq s TYR 658 CO 0.14 -0.25 -0.05 -1.17 -1.11 0.00 0.00 175.55 173.11 1fhq s LEU 659 N 0.87 3.90 0.00 -1.29 0.20 0.02 0.22 118.68 122.60 1fhq s LEU 659 Ca -0.11 -1.66 0.00 0.00 0.69 0.00 0.00 54.13 53.04 1fhq s LEU 659 Cb -0.15 -1.57 0.00 0.00 -0.43 0.00 0.00 46.19 44.04 1fhq s LEU 659 CO 0.01 -0.26 0.00 -3.20 -0.29 0.00 0.00 176.35 172.61 1fhq n ASN 660 N 4.37 0.00 -0.58 3.68 2.85 -1.22 -1.31 115.26 123.05 1fhq n ASN 660 Ca -0.08 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.39 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 -0.46 -2.11 0.00 0.00 177.26 174.69 1fhq n ASN 661 N 1.42 -0.02 -4.28 1.20 6.94 -1.26 -5.11 115.26 114.16 1fhq n ASN 661 Ca 0.00 -1.50 -0.29 0.00 -0.02 0.00 0.00 54.58 52.77 1fhq n ASN 661 Cb 0.00 -0.07 -0.15 0.00 -2.36 0.00 0.00 39.78 37.19 1fhq n ASN 661 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1fhq s ASN 662 N -0.55 2.77 -0.20 0.53 -0.87 -0.43 -5.13 114.94 111.07 1fhq s ASN 662 Ca 0.02 -0.46 -0.09 0.00 -1.57 0.00 0.00 52.86 50.76 1fhq s ASN 662 Cb 0.02 -0.29 -0.04 0.00 -0.02 0.00 0.00 41.25 40.91 1fhq s ASN 662 CO -0.01 0.27 0.10 -0.60 -2.57 0.00 0.00 177.10 174.29 1fhq s ARG 663 N -0.72 4.05 -0.19 -0.60 3.52 -1.26 -0.80 118.95 122.95 1fhq s ARG 663 Ca 0.09 -0.29 0.01 0.00 -0.13 0.00 0.00 55.73 55.40 1fhq s ARG 663 Cb -0.09 -3.34 0.04 0.00 -1.56 0.00 0.00 34.95 30.00 1fhq s ARG 663 CO -0.00 0.23 -0.10 0.00 -0.81 0.00 0.00 175.30 174.62 1fhq s MET 664 N 0.52 1.98 0.57 5.12 0.23 0.13 -4.86 119.30 122.99 1fhq s MET 664 Ca 0.06 -0.77 -0.05 0.00 -1.03 0.00 0.00 55.69 53.90 1fhq s MET 664 Cb -0.12 -2.33 0.01 0.00 -1.53 0.00 0.00 34.83 30.86 1fhq s MET 664 CO 0.00 -0.41 0.86 0.96 -2.03 0.00 0.00 175.02 174.41 1fhq s ILE 665 N 1.44 3.57 -0.66 3.16 -4.36 -1.26 -0.65 121.20 122.43 1fhq s ILE 665 Ca -0.00 -0.13 -0.27 0.00 -0.26 0.00 0.00 60.65 59.99 1fhq s ILE 665 Cb -0.16 -3.40 -0.12 0.00 1.25 0.00 0.00 42.46 40.03 1fhq s ILE 665 CO -0.08 -0.39 2.49 1.67 0.24 0.00 0.00 174.94 178.87 1fhq n GLN 666 N -2.51 0.70 0.00 0.37 7.27 -1.16 -1.54 117.38 120.50 1fhq n GLN 666 Ca 0.04 -0.06 0.00 0.00 0.07 0.00 0.00 57.00 57.06 1fhq n GLN 666 Cb 0.58 -2.87 0.00 0.00 2.41 0.00 0.00 30.24 30.36 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 6.18 1.40 3.42 1.69 0.00 0.13 -4.89 105.19 113.13 1fhq n GLY 667 Ca 0.46 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.40 2.14 0.06 2.61 -4.23 -0.59 -0.96 115.64 113.27 1fhq s THR 668 Ca 0.00 -2.31 0.08 0.00 -1.18 0.00 0.00 61.69 58.28 1fhq s THR 668 Cb 0.00 -2.23 -0.03 0.00 1.34 0.00 0.00 72.50 71.58 1fhq s THR 668 CO 0.00 -0.46 -0.23 -0.75 -0.54 0.00 0.00 174.62 172.64 1fhq s LYS 669 N -3.58 1.44 -0.06 3.99 2.20 0.31 -1.90 119.74 122.14 1fhq s LYS 669 Ca 0.27 -1.06 -0.10 0.00 -0.36 0.00 0.00 55.97 54.72 1fhq s LYS 669 Cb -0.03 -1.63 0.02 0.00 -1.51 0.00 0.00 37.83 34.68 1fhq s LYS 669 CO 0.12 0.41 0.25 0.12 -0.36 0.00 0.00 175.35 175.89 1fhq s PHE 670 N -0.89 -0.20 0.25 4.03 5.36 0.15 -1.54 117.98 125.13 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 0.03 -0.22 1.14 -1.17 -1.46 0.00 0.00 175.22 173.54 1fhq s LEU 671 N -0.48 4.51 -0.44 6.12 1.98 -1.26 0.24 118.68 129.35 1fhq s LEU 671 Ca -0.06 2.28 -0.03 0.00 -2.89 0.00 0.00 54.13 53.42 1fhq s LEU 671 Cb -0.04 -3.62 0.12 0.00 0.66 0.00 0.00 46.19 43.31 1fhq s LEU 671 CO 0.01 -0.25 0.24 -0.76 -1.89 0.00 0.00 176.35 173.71 1fhq s LEU 672 N -1.01 5.28 -0.08 -0.68 1.43 -0.97 -4.80 118.68 117.84 1fhq s LEU 672 Ca 0.48 -2.12 -0.20 0.00 -1.03 0.00 0.00 54.13 51.25 1fhq s LEU 672 Cb -0.33 -1.84 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 1fhq s LEU 672 CO 0.40 -0.53 0.58 -1.10 0.23 0.00 0.00 176.35 175.92 1fhq s GLN 673 N 1.01 4.37 -0.24 1.70 -0.21 -1.23 -4.55 119.66 120.51 1fhq s GLN 673 Ca 0.09 0.65 -0.27 0.00 0.02 0.00 0.00 55.36 55.85 1fhq s GLN 673 Cb -0.23 -3.43 -0.12 0.00 1.00 0.00 0.00 33.01 30.24 1fhq s GLN 673 CO -0.04 0.16 0.89 -0.40 -2.12 0.00 0.00 175.29 173.77 1fhq n ASP 674 N 3.57 0.59 -0.19 5.90 5.75 0.58 -1.45 116.55 131.30 1fhq n ASP 674 Ca -0.05 0.70 0.00 0.00 -0.01 0.00 0.00 54.79 55.43 1fhq n ASP 674 Cb 0.51 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 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 2.09 0.92 3.64 6.12 0.00 0.45 -4.91 105.19 113.50 1fhq n GLY 675 Ca 0.17 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 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 6.42 -0.44 1.61 1.11 -0.53 -4.80 116.67 117.35 1fhq s ASP 676 Ca 0.00 0.50 -0.18 0.00 0.18 0.00 0.00 52.55 53.05 1fhq s ASP 676 Cb 0.00 -2.25 0.03 0.00 1.07 0.00 0.00 42.92 41.76 1fhq s ASP 676 CO 0.00 -0.19 0.47 -1.61 1.18 0.00 0.00 175.17 175.02 1fhq s GLU 677 N 1.87 3.10 -0.25 8.23 8.01 -1.25 0.31 118.70 138.72 1fhq s GLU 677 Ca 0.20 -0.78 -0.08 0.00 0.01 0.00 0.00 54.97 54.32 1fhq s GLU 677 Cb -0.15 -3.99 -0.03 0.00 -4.31 0.00 0.00 34.13 25.64 1fhq s GLU 677 CO 0.09 -0.92 0.08 0.42 0.01 0.00 0.00 175.26 174.95 1fhq s ILE 678 N 2.21 4.45 -0.33 -1.63 1.01 0.31 -3.41 121.20 123.81 1fhq s ILE 678 Ca 0.13 -0.13 -0.13 0.00 0.00 0.00 0.00 60.65 60.53 1fhq s ILE 678 Cb -0.17 -3.08 -0.03 0.00 0.01 0.00 0.00 42.46 39.19 1fhq s ILE 678 CO 0.13 0.34 0.23 -0.54 0.00 0.00 0.00 174.94 175.10 1fhq s LYS 679 N 1.55 3.61 0.19 2.79 1.02 0.13 -0.29 119.74 128.75 1fhq s LYS 679 Ca 0.06 -0.56 0.20 0.00 0.02 0.00 0.00 55.97 55.69 1fhq s LYS 679 Cb -0.15 -3.77 -0.00 0.00 -0.52 0.00 0.00 37.83 33.39 1fhq s LYS 679 CO 0.04 -0.38 1.08 0.82 -0.92 0.00 0.00 175.35 175.99 1fhq h ILE 680 N 5.46 0.27 -2.77 2.17 2.04 -1.83 1.53 117.51 124.38 1fhq h ILE 680 Ca -0.32 -1.48 -0.14 0.00 1.00 0.00 0.00 64.86 63.92 1fhq h ILE 680 Cb 1.16 1.84 -0.28 0.00 -0.74 0.00 0.00 36.82 38.81 1fhq h ILE 680 CO 0.62 0.15 -0.36 -0.51 0.00 0.00 0.00 178.15 178.05 1fhq s ILE 681 N -3.15 -0.03 -0.05 -0.67 1.10 -1.26 -4.06 121.20 113.08 1fhq s ILE 681 Ca 0.00 0.11 -0.01 0.00 -0.51 0.00 0.00 60.65 60.24 1fhq s ILE 681 Cb 0.08 -0.53 0.03 0.00 0.15 0.00 0.00 42.46 42.19 1fhq s ILE 681 CO 0.78 0.04 0.02 0.86 -2.11 0.00 0.00 174.94 174.53 1fhq s TRP 682 N 1.34 0.39 -0.16 3.50 -0.00 -1.23 -0.24 118.94 122.54 1fhq s TRP 682 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 56.10 56.01 1fhq s TRP 682 Cb -0.09 -0.60 0.03 0.00 -0.00 0.00 0.00 33.47 32.82 1fhq s TRP 682 CO -0.11 -0.23 -0.09 -0.51 -0.00 0.00 0.00 176.95 176.01 1fhq s ASP 683 N 1.75 2.81 0.05 5.86 1.01 0.30 -4.95 116.67 123.50 1fhq s ASP 683 Ca 0.01 -0.61 -0.21 0.00 0.71 0.00 0.00 52.55 52.44 1fhq s ASP 683 Cb -0.13 -1.04 -0.13 0.00 1.01 0.00 0.00 42.92 42.63 1fhq s ASP 683 CO -0.03 -0.13 1.45 0.11 0.21 0.00 0.00 175.17 176.77 1fhq h LYS 684 N 8.08 0.25 0.19 8.23 1.57 -1.96 -0.80 116.57 132.12 1fhq h LYS 684 Ca -0.30 -0.09 -0.34 0.00 -1.87 0.00 0.00 60.65 58.06 1fhq h LYS 684 Cb 1.12 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 33.43 1fhq h LYS 684 CO 0.45 0.52 -1.63 -0.91 -0.57 0.00 0.00 179.45 177.31 1fhq h ASN 685 N -0.05 0.64 0.70 0.86 2.35 -1.98 -3.30 115.58 114.81 1fhq h ASN 685 Ca 0.04 -0.93 0.00 0.00 -0.55 0.00 0.00 56.30 54.86 1fhq h ASN 685 Cb 0.42 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1fhq h ASN 685 CO 0.01 1.75 0.00 -3.20 -1.65 0.00 0.00 177.43 174.34 1fhq n ASN 686 N -3.68 0.14 -2.22 5.81 2.85 -1.25 -4.87 115.26 112.04 1fhq n ASN 686 Ca -0.23 0.53 -0.18 0.00 -0.11 0.00 0.00 54.58 54.59 1fhq n ASN 686 Cb 1.06 -0.56 -0.02 0.00 1.24 0.00 0.00 39.78 41.49 1fhq n ASN 686 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1fhq n LYS 687 N -1.65 -1.76 -3.42 1.20 4.81 -0.33 -4.93 118.16 112.09 1fhq n LYS 687 Ca 0.04 0.92 -0.44 0.00 -0.87 0.00 0.00 58.31 57.97 1fhq n LYS 687 Cb 0.23 -5.51 -0.08 0.00 0.02 0.00 0.00 35.03 29.70 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 -2.83 3.26 -0.06 5.64 5.36 -1.06 -4.91 117.98 123.38 1fhq s PHE 688 Ca 0.00 -1.00 0.03 0.00 -0.96 0.00 0.00 56.93 55.00 1fhq s PHE 688 Cb 0.00 -3.13 0.00 0.00 -0.34 0.00 0.00 43.02 39.55 1fhq s PHE 688 CO 0.00 -0.80 -0.16 0.14 -1.46 0.00 0.00 175.22 172.94 1fhq s VAL 689 N 1.61 1.35 0.17 3.12 -7.23 -1.26 0.11 120.40 118.27 1fhq s VAL 689 Ca 0.04 -0.64 0.08 0.00 -1.81 0.00 0.00 61.98 59.65 1fhq s VAL 689 Cb -0.24 -1.18 -0.04 0.00 0.56 0.00 0.00 36.38 35.47 1fhq s VAL 689 CO 0.06 0.40 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.45 1fhq s ILE 690 N 0.32 1.69 -0.30 -0.62 -1.09 0.66 -0.75 121.20 121.11 1fhq s ILE 690 Ca -0.09 -1.95 -0.17 0.00 -2.23 0.00 0.00 60.65 56.21 1fhq s ILE 690 Cb -0.14 -1.83 0.19 0.00 -1.58 0.00 0.00 42.46 39.11 1fhq s ILE 690 CO 0.03 -0.41 1.20 -0.83 -1.23 0.00 0.00 174.94 173.71 1fhq s GLY 691 N -2.79 0.39 0.13 6.18 0.00 -1.26 -3.89 107.32 106.09 1fhq s GLY 691 Ca 0.16 3.63 0.09 0.00 0.00 0.00 0.00 44.72 48.61 1fhq s GLY 691 CO 0.06 2.94 -0.17 -1.36 0.00 0.00 0.00 173.10 174.56 1fhq s PHE 692 N 1.45 2.53 -0.23 1.90 0.08 0.60 -1.04 117.98 123.27 1fhq s PHE 692 Ca -0.06 -0.27 -0.02 0.00 0.12 0.00 0.00 56.93 56.71 1fhq s PHE 692 Cb -0.02 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 41.12 1fhq s PHE 692 CO -0.13 0.41 -0.07 0.21 -0.10 0.00 0.00 175.22 175.54 1fhq s LYS 693 N -2.28 3.00 -0.16 0.44 2.20 -0.91 0.11 119.74 122.14 1fhq s LYS 693 Ca 0.19 -0.87 -0.29 0.00 -0.36 0.00 0.00 55.97 54.64 1fhq s LYS 693 Cb -0.10 -2.94 -0.01 0.00 -1.51 0.00 0.00 37.83 33.27 1fhq s LYS 693 CO 0.11 -0.32 1.13 0.08 -0.36 0.00 0.00 175.35 175.98 1fhq s VAL 694 N 1.36 4.51 -0.21 4.02 1.01 0.15 -1.85 120.40 129.39 1fhq s VAL 694 Ca 0.02 1.82 -0.00 0.00 0.00 0.00 0.00 61.98 63.82 1fhq s VAL 694 Cb -0.15 -4.17 0.06 0.00 0.00 0.00 0.00 36.38 32.11 1fhq s VAL 694 CO -0.05 -0.11 -0.03 -0.70 0.00 0.00 0.00 175.10 174.21 1fhq s GLU 695 N 2.93 1.38 -0.27 2.72 2.56 0.74 0.17 118.70 128.92 1fhq s GLU 695 Ca 0.50 -0.77 -0.23 0.00 0.00 0.00 0.00 54.97 54.47 1fhq s GLU 695 Cb -0.19 -2.37 -0.01 0.00 2.00 0.00 0.00 34.13 33.56 1fhq s GLU 695 CO 0.13 -0.57 0.75 0.42 -0.56 0.00 0.00 175.26 175.43 1fhq s ILE 696 N 1.54 4.87 -0.23 -3.70 1.01 -1.26 0.17 121.20 123.60 1fhq s ILE 696 Ca -0.03 1.28 -0.07 0.00 0.00 0.00 0.00 60.65 61.82 1fhq s ILE 696 Cb -0.18 -4.07 -0.18 0.00 0.01 0.00 0.00 42.46 38.04 1fhq s ILE 696 CO -0.07 -0.11 -0.07 0.59 0.00 0.00 0.00 174.94 175.28 1fhq n ASN 697 N 5.99 1.99 -4.55 3.58 5.03 -0.67 -4.93 115.26 121.70 1fhq n ASN 697 Ca 0.03 0.14 -0.34 0.00 0.87 0.00 0.00 54.58 55.29 1fhq n ASN 697 Cb 0.48 -0.70 -0.12 0.00 -1.02 0.00 0.00 39.78 38.43 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 4.50 -0.49 6.41 1.11 -0.54 -5.07 116.67 115.65 1fhq s ASP 698 Ca -0.32 -0.07 -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 0.61 0.35 0.29 0.42 1.18 0.00 0.00 175.17 178.02 1fhq s THR 699 N -0.74 3.42 -1.43 -1.27 -4.23 -1.26 -4.50 115.64 105.62 1fhq s THR 699 Ca 0.11 -2.43 -0.11 0.00 -1.18 0.00 0.00 61.69 58.08 1fhq s THR 699 Cb -0.11 -3.30 -0.06 0.00 1.34 0.00 0.00 72.50 70.37 1fhq s THR 699 CO 0.01 -0.76 2.60 0.41 -0.54 0.00 0.00 174.62 176.34 1fhq n THR 700 N 4.13 3.68 -2.19 3.99 -1.04 -1.26 -4.35 114.28 117.25 1fhq n THR 700 Ca 0.02 -2.45 -0.04 0.00 -2.04 0.00 0.00 64.05 59.54 1fhq n THR 700 Cb 0.40 -2.52 0.02 0.00 -1.82 0.00 0.00 70.33 66.40 1fhq n THR 700 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1fhq n GLY 701 N 3.79 -0.22 3.56 3.41 0.00 -1.26 -4.89 105.19 109.57 1fhq n GLY 701 Ca 0.66 0.08 -0.39 0.00 0.00 0.00 0.00 46.02 46.36 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 -3.55 4.29 0.13 0.99 2.01 -1.26 -3.30 118.68 117.99 1fhq s LEU 702 Ca 0.12 -0.22 0.03 0.00 0.01 0.00 0.00 54.13 54.06 1fhq s LEU 702 Cb -0.02 -2.15 0.35 0.00 0.01 0.00 0.00 46.19 44.39 1fhq s LEU 702 CO 0.31 -0.16 0.61 2.22 1.01 0.00 0.00 176.35 180.33 1fhq n PHE 703 N 5.10 0.30 0.00 0.29 -1.74 -1.26 -1.74 117.46 118.42 1fhq n PHE 703 Ca -0.13 0.46 0.00 0.00 -0.56 0.00 0.00 57.45 57.22 1fhq n PHE 703 Cb 0.51 -0.82 0.00 0.00 1.52 0.00 0.00 39.48 40.68 1fhq n PHE 703 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1fhq n ASN 704 N -4.24 3.96 0.00 5.98 5.15 -1.26 -1.77 115.26 123.08 1fhq n ASN 704 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1fhq n ASN 704 Cb 0.35 0.04 0.00 0.00 -0.53 0.00 0.00 39.78 39.64 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 -2.42 0.00 0.00 1.20 0.28 -0.71 -4.79 120.64 114.19 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 0.48 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.35 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 1.38 1.11 -1.84 0.00 -1.26 -4.86 105.19 99.72 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 3.55 0.00 0.99 0.00 -1.26 0.22 117.00 120.49 1fhq n LEU 707 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 56.01 54.15 1fhq n LEU 707 Cb 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 43.42 43.06 1fhq n LEU 707 CO 0.00 0.86 0.00 0.61 0.00 0.00 0.00 177.39 178.86 1fhq n GLY 708 N 1.32 0.40 0.90 -3.96 0.00 -1.26 -4.54 105.19 98.05 1fhq n GLY 708 Ca 0.20 -2.27 -0.02 0.00 0.00 0.00 0.00 46.02 43.93 1fhq n GLY 708 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1fhq n MET 709 N 0.00 0.00 -3.55 1.61 0.00 -1.26 -4.69 117.12 109.22 1fhq n MET 709 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 57.70 56.78 1fhq n MET 709 Cb 0.00 0.16 0.00 0.00 0.00 0.00 0.00 33.22 33.38 1fhq n MET 709 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 175.97 177.44 1fhq n LEU 710 N 0.09 0.00 0.00 3.17 -0.00 -1.26 -5.06 117.00 113.94 1fhq n LEU 710 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.90 1fhq n LEU 710 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.15 1fhq n LEU 710 CO -0.07 0.00 0.17 0.00 -0.00 0.00 0.00 177.39 177.49 1fhq n GLN 711 N -0.15 0.00 -3.83 1.47 1.13 -1.26 -4.54 117.38 110.20 1fhq n GLN 711 Ca 0.00 0.08 -0.35 0.00 -1.94 0.00 0.00 57.00 54.79 1fhq n GLN 711 Cb 0.00 -0.84 -0.12 0.00 0.11 0.00 0.00 30.24 29.38 1fhq n GLN 711 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1fhq s GLU 712 N -0.69 1.90 -0.42 -1.09 0.41 -1.26 -5.04 118.70 112.52 1fhq s GLU 712 Ca 0.00 -1.86 0.01 0.00 -0.41 0.00 0.00 54.97 52.71 1fhq s GLU 712 Cb 0.00 -3.51 0.11 0.00 -1.78 0.00 0.00 34.13 28.96 1fhq s GLU 712 CO 0.00 -1.05 0.17 -1.14 -0.49 0.00 0.00 175.26 172.75 1fhq s GLN 713 N 1.04 1.83 -0.45 1.61 -0.44 -1.26 -4.99 119.66 117.01 1fhq s GLN 713 Ca 0.09 -2.06 0.05 0.00 -2.50 0.00 0.00 55.36 50.95 1fhq s GLN 713 Cb -0.22 -3.40 0.18 0.00 -1.64 0.00 0.00 33.01 27.93 1fhq s GLN 713 CO -0.05 -1.03 0.52 1.03 0.50 0.00 0.00 175.29 176.25 1fhq s ARG 714 N 0.67 0.92 0.01 1.67 1.81 -1.26 -4.88 118.95 117.89 1fhq s ARG 714 Ca 0.12 -1.40 0.06 0.00 -1.72 0.00 0.00 55.73 52.79 1fhq s ARG 714 Cb -0.21 -0.68 -0.02 0.00 -0.45 0.00 0.00 34.95 33.59 1fhq s ARG 714 CO -0.05 -1.32 -0.17 0.14 -0.68 0.00 0.00 175.30 173.21 1fhq s VAL 715 N 0.70 1.39 -0.13 3.52 -7.23 -1.26 -4.89 120.40 112.50 1fhq s VAL 715 Ca 0.28 -0.91 -0.18 0.00 -1.81 0.00 0.00 61.98 59.36 1fhq s VAL 715 Cb -0.01 -1.19 -0.04 0.00 0.56 0.00 0.00 36.38 35.69 1fhq s VAL 715 CO -0.10 0.26 0.48 -0.69 -0.31 0.00 0.00 175.10 174.73 1fhq s VAL 716 N -0.60 5.18 0.35 1.32 1.01 -1.26 -4.59 120.40 121.81 1fhq s VAL 716 Ca 0.06 0.95 0.09 0.00 0.00 0.00 0.00 61.98 63.08 1fhq s VAL 716 Cb -0.07 -3.82 -0.06 0.00 0.00 0.00 0.00 36.38 32.43 1fhq s VAL 716 CO 0.00 0.31 -0.05 -1.48 0.00 0.00 0.00 175.10 173.89 1fhq s LEU 717 N 0.73 2.84 0.18 3.92 2.34 -0.59 -4.94 118.68 123.15 1fhq s LEU 717 Ca 0.26 -1.12 -0.05 0.00 0.06 0.00 0.00 54.13 53.28 1fhq s LEU 717 Cb -0.15 -1.14 -0.06 0.00 -0.56 0.00 0.00 46.19 44.28 1fhq s LEU 717 CO 0.10 -0.23 0.42 -0.75 -1.06 0.00 0.00 176.35 174.83 1fhq s LYS 718 N -3.66 3.64 0.42 1.48 2.36 -1.26 0.11 119.74 122.83 1fhq s LYS 718 Ca 0.34 -0.05 -0.03 0.00 -2.55 0.00 0.00 55.97 53.68 1fhq s LYS 718 Cb 0.02 -2.80 -0.03 0.00 -1.05 0.00 0.00 37.83 33.97 1fhq s LYS 718 CO 0.18 0.41 0.68 1.14 1.55 0.00 0.00 175.35 179.31 1fhq s GLN 719 N -2.84 3.51 0.24 4.03 -2.07 -0.14 -4.68 119.66 117.72 1fhq s GLN 719 Ca 0.42 -0.05 0.01 0.00 -1.82 0.00 0.00 55.36 53.92 1fhq s GLN 719 Cb -0.12 -2.50 0.01 0.00 -1.09 0.00 0.00 33.01 29.31 1fhq s GLN 719 CO 0.25 -0.05 0.04 0.25 -1.32 0.00 0.00 175.29 174.46 1fhq n THR 720 N -2.05 0.00 0.01 3.63 -2.24 -1.26 -4.98 114.28 107.39 1fhq n THR 720 Ca -0.02 -1.11 0.21 0.00 -2.27 0.00 0.00 64.05 60.87 1fhq n THR 720 Cb 0.56 0.11 0.71 0.00 -2.10 0.00 0.00 70.33 69.61 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 1.03 2.43 0.22 6.98 0.00 -1.99 -1.44 119.26 126.49 1fhq h ALA 721 Ca -0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1fhq h ALA 721 Cb 0.60 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1fhq h ALA 721 CO 0.31 -0.68 -0.10 1.49 0.00 0.00 0.00 179.25 180.27 1fhq h GLU 722 N 0.00 -0.28 -0.34 0.00 4.57 -2.00 -1.57 114.58 114.96 1fhq h GLU 722 Ca 0.25 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.43 1fhq h GLU 722 Cb 1.07 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.71 1fhq h GLU 722 CO -0.00 -0.07 0.14 0.93 -1.18 0.00 0.00 179.01 178.83 1fhq h GLU 723 N -0.45 0.51 -0.69 1.92 3.07 -1.68 -2.10 114.58 115.16 1fhq h GLU 723 Ca -0.03 -0.09 0.16 0.00 -0.50 0.00 0.00 59.36 58.90 1fhq h GLU 723 Cb 0.34 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.13 1fhq h GLU 723 CO 0.05 0.50 0.47 -0.22 -1.40 0.00 0.00 179.01 178.41 1fhq h LYS 724 N 0.41 0.22 -0.65 2.33 3.64 -1.27 0.39 116.57 121.64 1fhq h LYS 724 Ca 0.12 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 1fhq h LYS 724 Cb 0.18 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1fhq h LYS 724 CO -0.01 0.15 0.06 -0.44 -2.27 0.00 0.00 179.45 176.93 1fhq h ASP 725 N 0.23 1.07 -0.45 4.20 3.32 -0.57 0.16 116.42 124.37 1fhq h ASP 725 Ca 0.33 -0.28 0.06 0.00 0.02 0.00 0.00 57.03 57.17 1fhq h ASP 725 Cb 0.99 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.20 1fhq h ASP 725 CO -0.07 1.09 0.13 -0.07 -1.72 0.00 0.00 179.24 178.60 1fhq h LEU 726 N 1.02 0.11 -0.27 1.55 4.07 -0.77 -0.26 115.31 120.76 1fhq h LEU 726 Ca 0.19 0.06 -0.18 0.00 0.08 0.00 0.00 57.88 58.03 1fhq h LEU 726 Cb 0.50 0.06 -0.03 0.00 1.08 0.00 0.00 40.66 42.28 1fhq h LEU 726 CO 0.02 0.09 -0.87 1.62 -1.08 0.00 0.00 178.44 178.23 1fhq h VAL 727 N 0.29 1.62 0.00 1.22 3.04 -1.44 -2.94 116.25 118.04 1fhq h VAL 727 Ca 0.22 -2.96 -0.04 0.00 -1.01 0.00 0.00 66.70 62.90 1fhq h VAL 727 Cb 0.24 2.60 -0.01 0.00 -2.01 0.00 0.00 31.29 32.11 1fhq h VAL 727 CO -0.24 0.85 -0.20 0.50 -1.01 0.00 0.00 177.57 177.47 1fhq h LYS 728 N 0.00 0.00 0.00 4.17 3.64 0.20 -1.76 116.57 122.82 1fhq h LYS 728 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1fhq h LYS 728 Cb 1.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 1fhq h LYS 728 CO 0.11 0.20 -0.68 1.63 -2.27 0.00 0.00 179.45 178.44 1fhq n LYS 729 N -4.29 0.28 0.00 1.90 5.02 -0.19 -5.06 118.16 115.82 1fhq n LYS 729 Ca -0.02 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1fhq n LYS 729 Cb 0.26 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 1fhq n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77