#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 0.02 0.00 1.61 3.02 -1.26 -4.80 115.26 113.85 1fhq n ASN 574 Ca 0.00 0.50 0.00 0.00 -0.03 0.00 0.00 54.58 55.05 1fhq n ASN 574 Cb 0.00 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.66 1fhq n ASN 574 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fhq n GLY 575 N 0.56 0.94 3.53 7.41 0.00 -1.26 -5.11 105.19 111.27 1fhq n GLY 575 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 3.58 -0.21 1.61 3.52 -1.26 -1.12 118.95 125.07 1fhq s ARG 576 Ca 0.00 -0.58 -0.08 0.00 -0.13 0.00 0.00 55.73 54.94 1fhq s ARG 576 Cb 0.00 -3.74 -0.10 0.00 -1.56 0.00 0.00 34.95 29.55 1fhq s ARG 576 CO 0.00 -0.38 -0.25 0.34 -0.81 0.00 0.00 175.30 174.20 1fhq n PHE 577 N 5.08 0.00 -5.06 5.12 7.35 -1.09 -3.86 117.46 125.00 1fhq n PHE 577 Ca -0.13 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.25 1fhq n PHE 577 Cb 0.50 -0.76 -0.15 0.00 0.35 0.00 0.00 39.48 39.42 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 -6.94 2.20 -0.20 -2.13 0.20 -0.58 -1.43 118.68 109.79 1fhq s LEU 578 Ca -0.29 -0.50 0.02 0.00 0.69 0.00 0.00 54.13 54.05 1fhq s LEU 578 Cb 0.10 -1.35 0.03 0.00 -0.43 0.00 0.00 46.19 44.55 1fhq s LEU 578 CO 0.39 0.29 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.68 1fhq s THR 579 N -0.73 2.10 -0.42 3.68 2.01 0.30 0.13 115.64 122.71 1fhq s THR 579 Ca 0.11 -1.16 -0.15 0.00 0.31 0.00 0.00 61.69 60.81 1fhq s THR 579 Cb -0.10 -1.99 0.03 0.00 0.01 0.00 0.00 72.50 70.45 1fhq s THR 579 CO 0.01 0.36 0.31 -0.76 -0.69 0.00 0.00 174.62 173.85 1fhq s LEU 580 N 1.23 5.17 -0.37 4.42 1.43 0.69 0.71 118.68 131.96 1fhq s LEU 580 Ca 0.01 -0.96 -0.01 0.00 -1.03 0.00 0.00 54.13 52.13 1fhq s LEU 580 Cb -0.15 -2.16 0.10 0.00 0.03 0.00 0.00 46.19 44.01 1fhq s LEU 580 CO -0.11 -0.48 0.13 -0.54 0.23 0.00 0.00 176.35 175.59 1fhq s LYS 581 N 1.67 1.98 -0.57 1.70 1.02 -0.70 0.24 119.74 125.08 1fhq s LYS 581 Ca 0.05 -1.73 -0.26 0.00 0.02 0.00 0.00 55.97 54.05 1fhq s LYS 581 Cb -0.20 -3.43 -0.09 0.00 -0.52 0.00 0.00 37.83 33.59 1fhq s LYS 581 CO 0.09 -0.96 2.44 -0.35 -0.92 0.00 0.00 175.35 175.66 1fhq n PRO 582 N 4.53 0.89 -1.65 -1.68 -0.04 0.35 -2.10 135.00 135.30 1fhq n PRO 582 Ca -0.03 -0.08 -0.31 0.00 -0.04 0.00 0.00 63.50 63.04 1fhq n PRO 582 Cb 0.42 -3.27 0.04 0.00 -0.04 0.00 0.00 33.50 30.65 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 12.08 3.16 0.59 1.53 -0.00 -1.06 -2.17 118.68 132.81 1fhq s LEU 583 Ca 1.02 1.57 0.29 0.00 -0.00 0.00 0.00 54.13 57.01 1fhq s LEU 583 Cb -0.28 -4.49 1.37 0.00 -0.00 0.00 0.00 46.19 42.79 1fhq s LEU 583 CO 0.27 -1.30 1.76 -0.65 -0.00 0.00 0.00 176.35 176.43 1fhq h PRO 584 N -0.61 0.00 0.00 1.48 0.11 -1.90 0.90 132.00 131.97 1fhq h PRO 584 Ca -0.44 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 1fhq h PRO 584 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1fhq h PRO 584 CO 0.58 0.00 -0.09 -0.44 -0.21 0.00 0.00 178.00 177.84 1fhq h ASP 585 N 0.00 0.00 -2.96 -2.05 3.32 -1.90 -3.42 116.42 109.41 1fhq h ASP 585 Ca 0.31 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.82 1fhq h ASP 585 Cb 1.68 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.21 1fhq h ASP 585 CO -0.00 0.09 -0.29 -0.94 -1.72 0.00 0.00 179.24 176.38 1fhq s SER 586 N -6.30 6.41 0.45 6.45 1.04 0.31 -4.69 113.70 117.37 1fhq s SER 586 Ca -0.04 0.49 0.25 0.00 0.48 0.00 0.00 55.95 57.14 1fhq s SER 586 Cb 0.14 -2.05 1.39 0.00 0.10 0.00 0.00 66.02 65.60 1fhq s SER 586 CO 0.59 -0.06 1.76 -0.29 0.98 0.00 0.00 173.24 176.22 1fhq h ILE 587 N 1.57 0.00 -3.45 -1.02 6.09 0.78 -3.40 117.51 118.08 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 1.19 0.57 -0.21 0.00 0.47 0.00 0.00 36.82 38.84 1fhq h ILE 587 CO 0.68 0.00 -0.68 -0.63 -3.07 0.00 0.00 178.15 174.45 1fhq s ILE 588 N -3.70 3.77 -0.57 2.19 -1.09 -1.26 -5.04 121.20 115.50 1fhq s ILE 588 Ca -0.03 -0.43 0.06 0.00 -2.23 0.00 0.00 60.65 58.03 1fhq s ILE 588 Cb 0.07 -2.60 0.31 0.00 -1.58 0.00 0.00 42.46 38.67 1fhq s ILE 588 CO 0.23 0.55 0.86 0.00 -1.23 0.00 0.00 174.94 175.35 1fhq n GLN 589 N 2.90 2.72 -4.55 2.79 3.00 -1.23 -3.65 117.38 119.36 1fhq n GLN 589 Ca -0.18 -4.59 -0.26 0.00 -0.01 0.00 0.00 57.00 51.96 1fhq n GLN 589 Cb 0.53 -2.14 -0.09 0.00 0.00 0.00 0.00 30.24 28.53 1fhq n GLN 589 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1fhq s GLU 590 N -3.01 1.88 -0.09 -1.09 2.02 -0.92 -4.99 118.70 112.49 1fhq s GLU 590 Ca 0.45 -2.12 -0.01 0.00 0.02 0.00 0.00 54.97 53.32 1fhq s GLU 590 Cb 0.25 -0.97 0.03 0.00 0.10 0.00 0.00 34.13 33.53 1fhq s GLU 590 CO -0.10 -0.31 -0.04 -1.54 0.02 0.00 0.00 175.26 173.30 1fhq s SER 591 N -3.62 1.84 0.11 -0.19 1.04 -1.26 -0.49 113.70 111.12 1fhq s SER 591 Ca 0.26 -0.19 0.07 0.00 0.48 0.00 0.00 55.95 56.58 1fhq s SER 591 Cb 0.05 -0.63 -0.04 0.00 0.10 0.00 0.00 66.02 65.51 1fhq s SER 591 CO 0.13 -0.15 -0.10 -0.76 0.98 0.00 0.00 173.24 173.34 1fhq s LEU 592 N 1.80 3.04 -0.10 2.42 2.01 0.66 -4.95 118.68 123.56 1fhq s LEU 592 Ca 0.04 -0.39 0.02 0.00 0.01 0.00 0.00 54.13 53.81 1fhq s LEU 592 Cb -0.12 -1.83 0.01 0.00 0.01 0.00 0.00 46.19 44.26 1fhq s LEU 592 CO -0.06 0.17 -0.15 -1.61 1.01 0.00 0.00 176.35 175.71 1fhq s GLU 593 N -2.24 2.21 -0.38 1.70 8.01 -1.26 0.25 118.70 127.00 1fhq s GLU 593 Ca 0.22 -0.56 -0.22 0.00 0.01 0.00 0.00 54.97 54.41 1fhq s GLU 593 Cb -0.11 -1.86 0.01 0.00 -4.31 0.00 0.00 34.13 27.86 1fhq s GLU 593 CO 0.14 -0.04 0.72 0.42 0.01 0.00 0.00 175.26 176.51 1fhq s ILE 594 N 0.92 4.79 0.27 -1.63 1.01 0.34 -4.92 121.20 121.98 1fhq s ILE 594 Ca -0.08 0.66 -0.29 0.00 0.00 0.00 0.00 60.65 60.94 1fhq s ILE 594 Cb -0.15 -4.17 -0.10 0.00 0.01 0.00 0.00 42.46 38.05 1fhq s ILE 594 CO -0.00 -0.43 1.21 -1.10 0.00 0.00 0.00 174.94 174.61 1fhq s GLN 595 N 2.96 4.49 0.56 2.79 1.11 -1.26 -1.52 119.66 128.79 1fhq s GLN 595 Ca 0.28 1.99 0.35 0.00 0.01 0.00 0.00 55.36 57.99 1fhq s GLN 595 Cb -0.14 -3.15 1.49 0.00 -1.01 0.00 0.00 33.01 30.20 1fhq s GLN 595 CO 0.17 -0.03 1.75 -0.56 0.01 0.00 0.00 175.29 176.64 1fhq h GLN 596 N 4.06 0.00 0.00 2.91 3.07 -1.42 1.24 115.11 124.97 1fhq h GLN 596 Ca -0.47 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.21 1fhq h GLN 596 Cb 1.22 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.77 1fhq h GLN 596 CO 0.69 0.00 -0.80 0.78 0.09 0.00 0.00 178.83 179.59 1fhq h GLY 597 N 0.00 0.00 -5.98 0.06 0.00 -1.89 -3.45 103.07 91.81 1fhq h GLY 597 Ca 0.52 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 47.28 1fhq h GLY 597 CO -0.01 0.00 0.88 0.14 0.00 0.00 0.00 176.54 177.56 1fhq s VAL 598 N -3.15 4.38 -0.12 4.60 1.01 0.43 -4.99 120.40 122.56 1fhq s VAL 598 Ca 0.01 1.55 -0.05 0.00 0.00 0.00 0.00 61.98 63.50 1fhq s VAL 598 Cb 0.08 -4.44 0.06 0.00 0.00 0.00 0.00 36.38 32.08 1fhq s VAL 598 CO 0.76 -0.62 0.26 0.21 0.00 0.00 0.00 175.10 175.71 1fhq s ASN 599 N 2.01 0.22 0.41 3.32 2.47 -1.26 -4.29 114.94 117.81 1fhq s ASN 599 Ca 0.47 0.57 -0.01 0.00 0.42 0.00 0.00 52.86 54.31 1fhq s ASN 599 Cb -0.11 0.62 -0.03 0.00 -1.45 0.00 0.00 41.25 40.28 1fhq s ASN 599 CO 0.21 -0.22 0.64 -2.16 -3.72 0.00 0.00 177.10 171.85 1fhq s PRO 600 N 2.15 3.40 -0.37 0.43 0.04 -1.26 -5.01 135.00 134.37 1fhq s PRO 600 Ca -0.01 -0.22 -0.23 0.00 0.04 0.00 0.00 61.00 60.58 1fhq s PRO 600 Cb -0.12 -2.56 0.01 0.00 0.04 0.00 0.00 34.50 31.88 1fhq s PRO 600 CO -0.08 -0.05 0.75 0.12 0.04 0.00 0.00 177.00 177.78 1fhq s PHE 601 N -2.49 3.11 0.05 0.56 5.36 0.32 -4.86 117.98 120.02 1fhq s PHE 601 Ca 0.44 0.46 -0.20 0.00 -0.96 0.00 0.00 56.93 56.67 1fhq s PHE 601 Cb -0.10 -3.38 -0.06 0.00 -0.34 0.00 0.00 43.02 39.14 1fhq s PHE 601 CO 0.39 -0.74 0.59 -0.06 -1.46 0.00 0.00 175.22 173.94 1fhq s PHE 602 N 3.04 3.76 -0.02 10.12 0.08 -1.26 0.11 117.98 133.82 1fhq s PHE 602 Ca 0.30 1.27 0.02 0.00 0.12 0.00 0.00 56.93 58.64 1fhq s PHE 602 Cb -0.13 -2.56 -0.00 0.00 -0.57 0.00 0.00 43.02 39.76 1fhq s PHE 602 CO 0.17 0.49 -0.09 0.42 -0.10 0.00 0.00 175.22 176.11 1fhq s ILE 603 N -0.74 0.72 -2.75 0.64 1.01 0.87 0.20 121.20 121.16 1fhq s ILE 603 Ca 0.30 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.60 1fhq s ILE 603 Cb -0.19 -0.63 0.00 0.00 0.01 0.00 0.00 42.46 41.65 1fhq s ILE 603 CO 0.19 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.96 1fhq n GLY 604 N 3.13 -1.07 0.08 6.18 0.00 -1.24 0.11 105.19 112.37 1fhq n GLY 604 Ca -0.16 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.08 -6.26 1.61 9.65 0.94 -2.83 114.38 117.41 1fhq h ARG 605 Ca 0.00 0.01 -0.55 0.00 -1.10 0.00 0.00 59.98 58.34 1fhq h ARG 605 Cb 0.00 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.59 1fhq h ARG 605 CO 0.00 0.30 1.10 0.45 2.80 0.00 0.00 179.97 184.62 1fhq s SER 606 N -5.49 6.62 0.61 -3.80 0.15 -1.25 -4.58 113.70 105.96 1fhq s SER 606 Ca -0.15 2.20 0.22 0.00 0.70 0.00 0.00 55.95 58.92 1fhq s SER 606 Cb 0.02 -2.53 1.17 0.00 -1.71 0.00 0.00 66.02 62.97 1fhq s SER 606 CO 0.64 -0.97 1.64 -0.08 1.20 0.00 0.00 173.24 175.67 1fhq h GLU 607 N 9.77 0.00 -1.39 5.44 4.81 -1.88 0.68 114.58 132.01 1fhq h GLU 607 Ca -0.39 0.00 0.40 0.00 -0.13 0.00 0.00 59.36 59.24 1fhq h GLU 607 Cb 1.18 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.50 1fhq h GLU 607 CO 0.96 0.00 1.02 -0.44 -0.73 0.00 0.00 179.01 179.81 1fhq h ASP 608 N 0.00 0.00 -2.78 1.04 5.19 -1.89 -3.37 116.42 114.61 1fhq h ASP 608 Ca 0.00 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.86 1fhq h ASP 608 Cb 0.91 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.41 1fhq h ASP 608 CO 0.00 0.00 0.97 0.00 -3.12 0.00 0.00 179.24 177.09 1fhq n ASN 610 N 6.51 0.15 -4.88 0.00 2.85 0.30 -3.96 115.26 116.24 1fhq n ASN 610 Ca 0.15 1.19 -0.35 0.00 -0.11 0.00 0.00 54.58 55.46 1fhq n ASN 610 Cb 0.44 -0.59 -0.05 0.00 1.24 0.00 0.00 39.78 40.81 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 -1.59 3.19 -0.02 0.00 2.36 -1.25 -3.84 119.74 118.58 1fhq s LYS 612 Ca 0.25 -0.75 0.00 0.00 -2.55 0.00 0.00 55.97 52.92 1fhq s LYS 612 Cb -0.13 -2.69 0.03 0.00 -1.05 0.00 0.00 37.83 33.99 1fhq s LYS 612 CO 0.14 -0.09 0.02 0.42 1.55 0.00 0.00 175.35 177.39 1fhq s ILE 613 N 1.08 -0.00 -0.50 5.43 1.01 -1.07 -5.00 121.20 122.16 1fhq s ILE 613 Ca -0.00 0.17 -0.06 0.00 0.00 0.00 0.00 60.65 60.75 1fhq s ILE 613 Cb -0.14 -0.11 0.13 0.00 0.01 0.00 0.00 42.46 42.34 1fhq s ILE 613 CO -0.04 0.09 0.34 -0.70 0.00 0.00 0.00 174.94 174.63 1fhq s GLU 614 N 0.94 2.40 -0.21 2.79 2.12 -1.26 -3.58 118.70 121.90 1fhq s GLU 614 Ca -0.08 -1.95 -0.02 0.00 0.36 0.00 0.00 54.97 53.27 1fhq s GLU 614 Cb -0.12 -3.81 0.07 0.00 0.26 0.00 0.00 34.13 30.53 1fhq s GLU 614 CO -0.02 -1.16 0.04 -0.51 -0.54 0.00 0.00 175.26 173.07 1fhq s ASP 615 N 2.04 3.09 0.40 -1.70 1.11 -1.26 -5.01 116.67 115.34 1fhq s ASP 615 Ca 0.09 -0.94 0.24 0.00 0.18 0.00 0.00 52.55 52.13 1fhq s ASP 615 Cb -0.23 -0.64 1.36 0.00 1.07 0.00 0.00 42.92 44.47 1fhq s ASP 615 CO -0.03 -0.32 1.60 0.78 1.18 0.00 0.00 175.17 178.39 1fhq h ASN 616 N 8.22 0.31 1.03 0.27 -0.26 -2.02 1.45 115.58 124.58 1fhq h ASN 616 Ca -0.16 0.20 -0.16 0.00 -0.56 0.00 0.00 56.30 55.62 1fhq h ASN 616 Cb 1.10 0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 38.54 1fhq h ASN 616 CO 0.36 -0.30 -0.75 0.03 -1.06 0.00 0.00 177.43 175.71 1fhq h ARG 617 N 0.07 0.00 -7.21 0.81 -0.00 -2.02 -3.46 114.38 102.58 1fhq h ARG 617 Ca 0.83 0.00 -0.53 0.00 -0.50 0.00 0.00 59.98 59.79 1fhq h ARG 617 Cb 2.36 0.00 0.20 0.00 0.00 0.00 0.00 29.97 32.53 1fhq h ARG 617 CO -0.61 0.75 0.19 1.28 0.00 0.00 0.00 179.97 181.58 1fhq n LEU 618 N -3.42 3.36 -4.80 3.04 4.32 0.50 -4.81 117.00 115.19 1fhq n LEU 618 Ca 0.00 0.46 -0.24 0.00 -0.02 0.00 0.00 56.01 56.22 1fhq n LEU 618 Cb 0.79 -1.47 -0.05 0.00 -1.62 0.00 0.00 43.42 41.07 1fhq n LEU 618 CO 0.43 -2.14 -0.09 -0.55 -1.22 0.00 0.00 177.39 173.82 1fhq s SER 619 N -2.43 4.61 0.08 -1.43 0.15 -1.26 -4.67 113.70 108.75 1fhq s SER 619 Ca 0.68 -1.02 -0.30 0.00 0.70 0.00 0.00 55.95 56.00 1fhq s SER 619 Cb -0.25 -0.37 -0.13 0.00 -1.71 0.00 0.00 66.02 63.56 1fhq s SER 619 CO 0.57 -0.65 1.48 -0.09 1.20 0.00 0.00 173.24 175.74 1fhq h ARG 620 N 1.23 -0.70 -1.79 5.44 2.43 -1.92 0.96 114.38 120.03 1fhq h ARG 620 Ca -0.42 0.05 -0.72 0.00 -0.81 0.00 0.00 59.98 58.08 1fhq h ARG 620 Cb 1.26 0.16 -0.31 0.00 -0.42 0.00 0.00 29.97 30.66 1fhq h ARG 620 CO 0.65 -0.47 0.61 0.28 -1.51 0.00 0.00 179.97 179.53 1fhq n VAL 621 N -5.07 3.30 -0.44 0.20 0.31 -1.26 -3.41 118.33 111.96 1fhq n VAL 621 Ca -0.08 -4.35 0.36 0.00 -0.01 0.00 0.00 64.34 60.25 1fhq n VAL 621 Cb 0.37 -1.24 0.58 0.00 -0.91 0.00 0.00 33.84 32.64 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 -0.56 0.36 0.00 3.52 -0.00 0.29 -3.82 115.22 115.02 1fhq n HIS 622 Ca 0.51 0.37 0.00 0.00 0.46 0.00 0.00 57.72 59.06 1fhq n HIS 622 Cb 0.37 -0.77 0.00 0.00 -0.12 0.00 0.00 29.99 29.47 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 0.06 -0.28 0.00 -0.71 0.21 0.30 117.98 115.56 1fhq s PHE 624 Ca 0.00 -0.16 -0.10 0.00 -1.04 0.00 0.00 56.93 55.63 1fhq s PHE 624 Cb 0.00 -0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 1fhq s PHE 624 CO 0.00 -0.27 0.16 0.42 -1.34 0.00 0.00 175.22 174.19 1fhq s ILE 625 N -1.35 5.03 0.14 -4.49 1.01 0.31 0.23 121.20 122.09 1fhq s ILE 625 Ca -0.14 0.04 0.07 0.00 0.00 0.00 0.00 60.65 60.61 1fhq s ILE 625 Cb -0.08 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1fhq s ILE 625 CO 0.01 0.25 -0.02 0.12 0.00 0.00 0.00 174.94 175.30 1fhq s PHE 626 N 1.72 2.85 -0.08 3.97 5.36 0.50 0.12 117.98 132.42 1fhq s PHE 626 Ca 0.07 -0.12 0.04 0.00 -0.96 0.00 0.00 56.93 55.96 1fhq s PHE 626 Cb -0.16 -1.42 -0.01 0.00 -0.34 0.00 0.00 43.02 41.08 1fhq s PHE 626 CO 0.09 0.49 -0.20 0.21 -1.46 0.00 0.00 175.22 174.34 1fhq s LYS 627 N -2.64 2.81 0.09 10.12 2.20 -1.26 0.24 119.74 131.31 1fhq s LYS 627 Ca 0.26 -0.82 0.01 0.00 -0.36 0.00 0.00 55.97 55.06 1fhq s LYS 627 Cb -0.10 -2.32 -0.04 0.00 -1.51 0.00 0.00 37.83 33.85 1fhq s LYS 627 CO 0.17 0.35 -0.06 0.21 -0.36 0.00 0.00 175.35 175.66 1fhq s LYS 628 N -0.06 0.82 -0.37 4.03 2.36 0.95 -4.96 119.74 122.52 1fhq s LYS 628 Ca -0.05 -1.33 -0.29 0.00 -2.55 0.00 0.00 55.97 51.75 1fhq s LYS 628 Cb -0.14 -0.17 0.01 0.00 -1.05 0.00 0.00 37.83 36.47 1fhq s LYS 628 CO 0.04 -0.03 1.34 0.50 1.55 0.00 0.00 175.35 178.76 1fhq s ARG 629 N -3.84 3.74 0.05 4.03 6.06 -1.26 0.19 118.95 127.91 1fhq s ARG 629 Ca 0.12 1.03 -0.30 0.00 -2.50 0.00 0.00 55.73 54.08 1fhq s ARG 629 Cb 0.06 -3.95 -0.08 0.00 0.06 0.00 0.00 34.95 31.03 1fhq s ARG 629 CO -0.05 -1.36 1.79 -1.58 -2.50 0.00 0.00 175.30 171.61 1fhq s HIS 630 N 4.88 1.90 -0.27 5.12 5.65 0.71 -4.81 115.29 128.47 1fhq s HIS 630 Ca 0.58 -0.04 -0.03 0.00 0.25 0.00 0.00 55.06 55.82 1fhq s HIS 630 Cb -0.14 -4.09 0.09 0.00 -1.18 0.00 0.00 32.58 27.25 1fhq s HIS 630 CO 0.28 -4.64 0.11 0.00 -0.65 0.00 0.00 174.74 169.84 1fhq s ALA 631 N 3.53 0.85 0.91 1.58 0.00 -1.26 -2.40 121.76 124.97 1fhq s ALA 631 Ca 0.80 -1.07 -0.11 0.00 0.00 0.00 0.00 51.96 51.58 1fhq s ALA 631 Cb -0.41 -1.37 0.13 0.00 0.00 0.00 0.00 23.12 21.47 1fhq s ALA 631 CO 0.36 -1.54 1.11 1.55 0.00 0.00 0.00 175.76 177.24 1fhq n VAL 632 N 5.14 0.25 0.23 0.00 3.14 -1.26 -4.94 118.33 120.88 1fhq n VAL 632 Ca -0.06 -0.04 -0.15 0.00 -2.96 0.00 0.00 64.34 61.13 1fhq n VAL 632 Cb 0.44 -1.00 -0.07 0.00 -1.06 0.00 0.00 33.84 32.14 1fhq n VAL 632 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1fhq h GLY 633 N -1.76 -0.69 -5.27 7.55 0.00 -2.00 -3.45 103.07 97.45 1fhq h GLY 633 Ca -0.43 0.32 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1fhq h GLY 633 CO 0.41 -0.26 -0.14 -1.59 0.00 0.00 0.00 176.54 174.96 1fhq s LYS 634 N -6.06 0.57 -0.48 4.80 -2.85 -1.26 -5.04 119.74 109.42 1fhq s LYS 634 Ca -0.16 0.83 -0.02 0.00 -1.00 0.00 0.00 55.97 55.62 1fhq s LYS 634 Cb 0.06 0.18 0.24 0.00 -2.06 0.00 0.00 37.83 36.24 1fhq s LYS 634 CO 0.64 -0.11 2.22 -1.13 0.10 0.00 0.00 175.35 177.07 1fhq n SER 635 N 3.48 6.85 -4.55 0.03 3.41 -1.26 -4.83 113.62 116.75 1fhq n SER 635 Ca -0.17 -3.33 -0.37 0.00 -0.26 0.00 0.00 58.87 54.73 1fhq n SER 635 Cb 0.56 -1.09 -0.03 0.00 -0.26 0.00 0.00 64.21 63.39 1fhq n SER 635 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1fhq s MET 636 N -2.44 2.77 0.00 4.33 0.00 -1.26 -2.98 119.30 119.71 1fhq s MET 636 Ca 0.48 0.25 0.00 0.00 0.00 0.00 0.00 55.69 56.41 1fhq s MET 636 Cb 0.36 -4.48 0.00 0.00 0.00 0.00 0.00 34.83 30.70 1fhq s MET 636 CO -0.10 -2.69 0.00 0.98 0.00 0.00 0.00 175.02 173.21 1fhq n TYR 637 N 12.11 0.00 -3.92 4.11 4.19 -1.26 -4.94 117.16 127.45 1fhq n TYR 637 Ca 0.20 0.00 -0.33 0.00 3.31 0.00 0.00 57.90 61.08 1fhq n TYR 637 Cb 0.51 -0.59 -0.14 0.00 0.49 0.00 0.00 39.34 39.61 1fhq n TYR 637 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 1fhq s GLU 638 N -0.41 1.81 -0.49 2.98 2.02 -1.16 -5.07 118.70 118.38 1fhq s GLU 638 Ca 0.00 -1.77 -0.23 0.00 0.02 0.00 0.00 54.97 53.00 1fhq s GLU 638 Cb 0.00 -3.32 0.04 0.00 0.10 0.00 0.00 34.13 30.94 1fhq s GLU 638 CO 0.00 -0.93 0.80 -1.54 0.02 0.00 0.00 175.26 173.60 1fhq s SER 639 N 1.29 6.35 0.00 -0.19 1.04 -1.26 -4.42 113.70 116.51 1fhq s SER 639 Ca 0.07 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.17 1fhq s SER 639 Cb -0.21 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.53 1fhq s SER 639 CO -0.06 -1.00 0.00 -0.81 0.98 0.00 0.00 173.24 172.35 1fhq n PRO 640 N 6.82 3.52 -0.76 4.02 -0.04 -1.26 -4.96 135.00 142.34 1fhq n PRO 640 Ca 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.48 1fhq n PRO 640 Cb 0.47 0.00 0.30 0.00 -0.04 0.00 0.00 33.50 34.23 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 3.81 -2.55 0.55 0.00 -1.26 -4.88 120.51 113.18 1fhq n ALA 641 Ca 0.00 -1.64 -0.17 0.00 0.00 0.00 0.00 53.44 51.63 1fhq n ALA 641 Cb 0.00 -1.14 0.01 0.00 0.00 0.00 0.00 19.45 18.32 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 0.31 -2.45 -1.84 0.00 7.27 -1.26 -4.49 117.38 114.92 1fhq n GLN 642 Ca 0.26 0.78 0.00 0.00 0.07 0.00 0.00 57.00 58.10 1fhq n GLN 642 Cb 1.07 -5.23 0.00 0.00 2.41 0.00 0.00 30.24 28.49 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 -1.17 -5.09 0.00 1.69 0.00 -1.26 -5.10 105.19 94.27 1fhq n GLY 643 Ca -0.15 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 1.50 0.00 -4.09 0.99 4.77 -1.01 -4.88 117.00 114.28 1fhq n LEU 644 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 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 -0.51 -1.81 -1.33 0.00 0.00 177.39 173.74 1fhq s ASP 645 N 1.00 2.83 0.19 -1.43 1.11 -1.26 0.26 116.67 119.37 1fhq s ASP 645 Ca 0.00 -0.54 0.05 0.00 0.18 0.00 0.00 52.55 52.25 1fhq s ASP 645 Cb 0.00 -1.29 -0.04 0.00 1.07 0.00 0.00 42.92 42.67 1fhq s ASP 645 CO 0.00 0.01 0.21 -1.81 1.18 0.00 0.00 175.17 174.77 1fhq s ASP 646 N 1.11 5.79 -0.24 0.27 1.01 0.51 -4.32 116.67 120.79 1fhq s ASP 646 Ca -0.02 -0.08 -0.05 0.00 0.71 0.00 0.00 52.55 53.12 1fhq s ASP 646 Cb -0.14 -1.58 -0.01 0.00 1.01 0.00 0.00 42.92 42.20 1fhq s ASP 646 CO -0.06 0.02 0.00 0.27 0.21 0.00 0.00 175.17 175.61 1fhq s ILE 647 N -1.88 3.64 -0.16 0.77 -4.36 -1.26 -0.03 121.20 117.92 1fhq s ILE 647 Ca 0.33 -0.49 -0.06 0.00 -0.26 0.00 0.00 60.65 60.16 1fhq s ILE 647 Cb -0.10 -2.72 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 1fhq s ILE 647 CO 0.26 0.33 0.06 0.26 0.24 0.00 0.00 174.94 176.09 1fhq s TRP 648 N 1.50 3.28 -0.33 1.37 0.52 0.66 -2.22 118.94 123.73 1fhq s TRP 648 Ca 0.05 0.15 -0.21 0.00 0.02 0.00 0.00 56.10 56.11 1fhq s TRP 648 Cb -0.15 -2.00 -0.00 0.00 -1.15 0.00 0.00 33.47 30.16 1fhq s TRP 648 CO -0.01 0.29 0.65 -0.47 0.02 0.00 0.00 176.95 177.43 1fhq s TYR 649 N -0.05 3.18 -0.41 -1.98 5.04 0.85 0.19 117.35 124.17 1fhq s TYR 649 Ca 0.06 0.49 -0.08 0.00 -2.44 0.00 0.00 57.07 55.10 1fhq s TYR 649 Cb -0.12 -3.09 0.07 0.00 0.35 0.00 0.00 41.96 39.18 1fhq s TYR 649 CO 0.01 -0.56 0.23 0.00 -1.34 0.00 0.00 175.55 173.89 1fhq s HIS 651 N 1.40 3.34 0.00 0.00 2.46 0.21 0.65 115.29 123.36 1fhq s HIS 651 Ca 0.03 1.40 0.00 0.00 0.47 0.00 0.00 55.06 56.95 1fhq s HIS 651 Cb -0.22 -3.31 0.00 0.00 -0.13 0.00 0.00 32.58 28.91 1fhq s HIS 651 CO 0.02 -0.79 0.32 0.25 -2.47 0.00 0.00 174.74 172.06 1fhq n THR 652 N 4.59 0.00 -2.63 0.89 -2.24 -0.81 0.46 114.28 114.54 1fhq n THR 652 Ca 0.10 -0.47 -0.33 0.00 -2.27 0.00 0.00 64.05 61.08 1fhq n THR 652 Cb 0.47 1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 69.70 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 -0.30 2.35 0.34 3.38 0.00 0.63 -4.70 107.32 109.02 1fhq s GLY 653 Ca 0.00 0.41 0.18 0.00 0.00 0.00 0.00 44.72 45.32 1fhq s GLY 653 CO 0.00 0.71 1.57 -0.84 0.00 0.00 0.00 173.10 174.54 1fhq h THR 654 N 1.56 0.69 0.00 0.90 2.02 -1.93 -3.15 112.91 113.01 1fhq h THR 654 Ca -0.49 -1.77 0.00 0.00 0.77 0.00 0.00 66.41 64.92 1fhq h THR 654 Cb 1.19 2.19 0.00 0.00 -1.74 0.00 0.00 68.15 69.79 1fhq h THR 654 CO 0.60 0.36 0.00 0.59 0.37 0.00 0.00 175.52 177.44 1fhq n ASN 655 N -3.27 0.00 -1.55 4.18 3.02 -1.26 -4.85 115.26 111.53 1fhq n ASN 655 Ca 0.02 -0.86 0.08 0.00 -0.03 0.00 0.00 54.58 53.79 1fhq n ASN 655 Cb 0.62 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.75 1fhq n ASN 655 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1fhq n VAL 656 N -0.76 -2.10 -4.39 2.41 0.31 -1.21 -4.66 118.33 107.94 1fhq n VAL 656 Ca 0.07 1.27 -0.21 0.00 -0.01 0.00 0.00 64.34 65.46 1fhq n VAL 656 Cb 0.03 -2.04 -0.10 0.00 -0.91 0.00 0.00 33.84 30.83 1fhq n VAL 656 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1fhq s SER 657 N -6.27 2.94 -0.06 4.52 0.15 0.26 -3.94 113.70 111.30 1fhq s SER 657 Ca 0.00 -1.02 -0.02 0.00 0.70 0.00 0.00 55.95 55.62 1fhq s SER 657 Cb 0.00 -0.19 0.03 0.00 -1.71 0.00 0.00 66.02 64.15 1fhq s SER 657 CO 0.00 -0.09 0.03 -0.31 1.20 0.00 0.00 173.24 174.07 1fhq s TYR 658 N -2.77 0.41 -0.32 3.44 1.51 0.43 -0.16 117.35 119.88 1fhq s TYR 658 Ca 0.25 -0.00 -0.07 0.00 -1.01 0.00 0.00 57.07 56.24 1fhq s TYR 658 Cb -0.02 -0.67 0.03 0.00 -0.11 0.00 0.00 41.96 41.18 1fhq s TYR 658 CO 0.10 -0.28 0.09 -1.17 -1.11 0.00 0.00 175.55 173.18 1fhq s LEU 659 N 2.06 4.13 0.00 -1.29 2.96 0.30 0.16 118.68 126.99 1fhq s LEU 659 Ca 0.05 -0.97 0.00 0.00 -0.22 0.00 0.00 54.13 52.99 1fhq s LEU 659 Cb -0.12 -1.87 0.00 0.00 0.50 0.00 0.00 46.19 44.69 1fhq s LEU 659 CO -0.04 -0.27 0.00 0.59 -1.32 0.00 0.00 176.35 175.30 1fhq n ASN 660 N 4.83 0.00 -0.15 3.68 5.03 -1.16 0.29 115.26 127.78 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 -0.46 -1.83 0.00 0.00 177.26 174.97 1fhq n ASN 661 N 0.93 0.01 -4.32 6.41 0.23 -1.26 -5.08 115.26 112.18 1fhq n ASN 661 Ca 0.00 -1.31 -0.32 0.00 -0.53 0.00 0.00 54.58 52.42 1fhq n ASN 661 Cb 0.00 -0.06 -0.16 0.00 -2.08 0.00 0.00 39.78 37.48 1fhq n ASN 661 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1fhq s ASN 662 N -0.32 3.23 -0.09 0.53 0.01 0.15 -5.13 114.94 113.33 1fhq s ASN 662 Ca 0.00 -0.45 -0.08 0.00 -0.71 0.00 0.00 52.86 51.63 1fhq s ASN 662 Cb 0.00 -0.69 -0.04 0.00 0.41 0.00 0.00 41.25 40.92 1fhq s ASN 662 CO 0.00 0.28 0.19 -0.60 -1.51 0.00 0.00 177.10 175.46 1fhq s ARG 663 N -0.38 3.51 -0.06 -0.60 3.52 -1.26 0.11 118.95 123.78 1fhq s ARG 663 Ca 0.03 -0.08 -0.00 0.00 -0.13 0.00 0.00 55.73 55.55 1fhq s ARG 663 Cb -0.12 -3.18 0.03 0.00 -1.56 0.00 0.00 34.95 30.12 1fhq s ARG 663 CO 0.02 0.75 -0.02 0.00 -0.81 0.00 0.00 175.30 175.24 1fhq s MET 664 N -1.18 0.73 0.48 5.12 0.23 0.77 -4.75 119.30 120.71 1fhq s MET 664 Ca 0.18 0.02 -0.05 0.00 -1.03 0.00 0.00 55.69 54.81 1fhq s MET 664 Cb -0.13 -0.95 -0.03 0.00 -1.53 0.00 0.00 34.83 32.19 1fhq s MET 664 CO 0.07 -0.22 0.78 0.96 -2.03 0.00 0.00 175.02 174.58 1fhq s ILE 665 N 1.58 4.79 -0.28 3.16 -4.36 -1.26 -0.57 121.20 124.26 1fhq s ILE 665 Ca -0.01 0.13 -0.33 0.00 -0.26 0.00 0.00 60.65 60.19 1fhq s ILE 665 Cb -0.13 -3.82 -0.09 0.00 1.25 0.00 0.00 42.46 39.67 1fhq s ILE 665 CO -0.04 -0.79 2.18 0.00 0.24 0.00 0.00 174.94 176.54 1fhq n GLN 666 N -2.26 1.47 0.00 0.37 10.64 -1.19 -1.98 117.38 124.43 1fhq n GLN 666 Ca 0.01 0.41 0.00 0.00 -1.83 0.00 0.00 57.00 55.59 1fhq n GLN 666 Cb 0.55 -2.76 0.00 0.00 -0.86 0.00 0.00 30.24 27.17 1fhq n GLN 666 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1fhq n GLY 667 N 6.13 1.66 3.28 2.61 0.00 0.17 -4.90 105.19 114.13 1fhq n GLY 667 Ca 0.36 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.82 1.57 -0.03 2.61 -4.23 -0.84 -0.90 115.64 112.00 1fhq s THR 668 Ca 0.00 -1.72 0.07 0.00 -1.18 0.00 0.00 61.69 58.85 1fhq s THR 668 Cb 0.00 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.21 1fhq s THR 668 CO 0.00 -0.29 -0.22 -1.59 -0.54 0.00 0.00 174.62 171.97 1fhq s LYS 669 N -2.49 1.94 -0.03 3.99 -2.85 0.72 -0.62 119.74 120.40 1fhq s LYS 669 Ca 0.10 -0.80 0.03 0.00 -1.00 0.00 0.00 55.97 54.29 1fhq s LYS 669 Cb -0.07 -1.81 0.00 0.00 -2.06 0.00 0.00 37.83 33.90 1fhq s LYS 669 CO 0.04 0.45 -0.10 0.12 0.10 0.00 0.00 175.35 175.96 1fhq s PHE 670 N -0.42 1.08 0.34 1.78 2.19 0.62 -1.12 117.98 122.45 1fhq s PHE 670 Ca 0.06 -0.29 -0.28 0.00 0.33 0.00 0.00 56.93 56.75 1fhq s PHE 670 Cb -0.10 -0.77 -0.10 0.00 -1.31 0.00 0.00 43.02 40.75 1fhq s PHE 670 CO 0.00 -0.12 1.28 -0.51 1.83 0.00 0.00 175.22 177.70 1fhq s LEU 671 N 0.22 4.41 -0.23 6.12 1.43 -1.26 0.29 118.68 129.66 1fhq s LEU 671 Ca -0.04 2.62 -0.05 0.00 -1.03 0.00 0.00 54.13 55.63 1fhq s LEU 671 Cb -0.10 -3.69 -0.01 0.00 0.03 0.00 0.00 46.19 42.42 1fhq s LEU 671 CO 0.01 -0.53 -0.01 -0.76 0.23 0.00 0.00 176.35 175.29 1fhq s LEU 672 N -1.86 3.08 -0.06 1.79 1.43 -0.94 -4.80 118.68 117.32 1fhq s LEU 672 Ca 0.50 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 53.10 1fhq s LEU 672 Cb -0.38 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 1fhq s LEU 672 CO 0.51 -0.04 0.29 -1.10 0.23 0.00 0.00 176.35 176.24 1fhq s GLN 673 N 1.51 3.75 -0.45 1.70 -0.21 0.05 -4.13 119.66 121.88 1fhq s GLN 673 Ca 0.06 0.17 -0.39 0.00 0.02 0.00 0.00 55.36 55.21 1fhq s GLN 673 Cb -0.15 -3.22 -0.16 0.00 1.00 0.00 0.00 33.01 30.48 1fhq s GLN 673 CO -0.01 0.69 2.18 -0.40 -2.12 0.00 0.00 175.29 175.63 1fhq n ASP 674 N 2.01 1.36 -0.04 5.90 5.75 -1.26 -0.53 116.55 129.74 1fhq n ASP 674 Ca -0.16 0.53 0.00 0.00 -0.01 0.00 0.00 54.79 55.15 1fhq n ASP 674 Cb 0.53 -1.07 0.00 0.00 -1.03 0.00 0.00 41.12 39.55 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 7.03 1.28 3.58 6.12 0.00 0.57 -4.95 105.19 118.81 1fhq n GLY 675 Ca 0.49 -0.10 -0.37 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.14 5.77 -0.44 1.61 1.11 0.31 -4.83 116.67 118.07 1fhq s ASP 676 Ca 0.00 -0.02 -0.17 0.00 0.18 0.00 0.00 52.55 52.54 1fhq s ASP 676 Cb 0.00 -2.05 0.03 0.00 1.07 0.00 0.00 42.92 41.98 1fhq s ASP 676 CO 0.00 0.01 0.46 -1.61 1.18 0.00 0.00 175.17 175.21 1fhq s GLU 677 N 1.38 3.08 -0.19 8.23 8.01 -1.25 -0.86 118.70 137.11 1fhq s GLU 677 Ca 0.06 -0.86 -0.06 0.00 0.01 0.00 0.00 54.97 54.12 1fhq s GLU 677 Cb -0.15 -4.01 -0.04 0.00 -4.31 0.00 0.00 34.13 25.63 1fhq s GLU 677 CO 0.06 -0.93 0.04 0.42 0.01 0.00 0.00 175.26 174.86 1fhq s ILE 678 N 2.15 4.49 -0.05 -1.63 1.01 -0.42 -2.99 121.20 123.75 1fhq s ILE 678 Ca 0.11 -0.14 -0.14 0.00 0.00 0.00 0.00 60.65 60.49 1fhq s ILE 678 Cb -0.18 -3.02 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 1fhq s ILE 678 CO 0.12 0.45 0.36 -0.54 0.00 0.00 0.00 174.94 175.33 1fhq s LYS 679 N 0.58 3.94 -0.01 2.79 1.02 0.43 -1.68 119.74 126.80 1fhq s LYS 679 Ca 0.02 0.29 0.08 0.00 0.02 0.00 0.00 55.97 56.38 1fhq s LYS 679 Cb -0.13 -3.26 -0.12 0.00 -0.52 0.00 0.00 37.83 33.79 1fhq s LYS 679 CO 0.02 0.59 0.21 -0.89 -0.92 0.00 0.00 175.35 174.36 1fhq n ILE 680 N 2.26 0.00 -3.67 2.17 5.41 -1.25 0.16 119.36 124.43 1fhq n ILE 680 Ca -0.14 -0.21 -0.09 0.00 1.00 0.00 0.00 62.75 63.30 1fhq n ILE 680 Cb 0.53 0.45 -0.09 0.00 -0.71 0.00 0.00 39.64 39.82 1fhq n ILE 680 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1fhq s ILE 681 N -2.41 -0.01 -0.05 1.39 2.07 -1.25 -4.08 121.20 116.85 1fhq s ILE 681 Ca -0.02 0.05 -0.01 0.00 -1.41 0.00 0.00 60.65 59.26 1fhq s ILE 681 Cb 0.05 -0.78 0.03 0.00 0.13 0.00 0.00 42.46 41.89 1fhq s ILE 681 CO 0.34 0.02 0.01 0.86 -1.91 0.00 0.00 174.94 174.26 1fhq s TRP 682 N 1.36 0.50 -0.15 3.50 -0.00 -1.20 -1.47 118.94 121.48 1fhq s TRP 682 Ca -0.09 -0.06 0.00 0.00 -0.00 0.00 0.00 56.10 55.95 1fhq s TRP 682 Cb -0.07 -0.65 0.03 0.00 -0.00 0.00 0.00 33.47 32.78 1fhq s TRP 682 CO -0.14 -0.25 -0.10 -0.51 -0.00 0.00 0.00 176.95 175.95 1fhq s ASP 683 N 1.71 2.73 0.07 5.86 1.11 0.13 -4.92 116.67 123.35 1fhq s ASP 683 Ca 0.00 -0.56 -0.20 0.00 0.18 0.00 0.00 52.55 51.98 1fhq s ASP 683 Cb -0.13 -1.04 -0.11 0.00 1.07 0.00 0.00 42.92 42.72 1fhq s ASP 683 CO -0.04 -0.12 1.49 0.11 1.18 0.00 0.00 175.17 177.80 1fhq h LYS 684 N 8.09 0.34 0.21 8.23 1.57 -1.95 0.27 116.57 133.32 1fhq h LYS 684 Ca -0.31 -0.11 -0.34 0.00 -1.87 0.00 0.00 60.65 58.02 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 0.46 0.56 -1.64 -0.97 -0.57 0.00 0.00 179.45 177.29 1fhq h ASN 685 N 0.09 0.69 0.92 0.86 -1.24 -1.99 -3.31 115.58 111.61 1fhq h ASN 685 Ca 0.05 -0.93 0.00 0.00 0.71 0.00 0.00 56.30 56.13 1fhq h ASN 685 Cb 0.41 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.23 1fhq h ASN 685 CO 0.01 1.76 0.00 -3.20 -1.29 0.00 0.00 177.43 174.71 1fhq n ASN 686 N -3.66 0.00 -1.97 1.15 2.85 -1.25 -4.89 115.26 107.50 1fhq n ASN 686 Ca -0.22 0.42 -0.16 0.00 -0.11 0.00 0.00 54.58 54.51 1fhq n ASN 686 Cb 1.08 -0.47 -0.04 0.00 1.24 0.00 0.00 39.78 41.58 1fhq n ASN 686 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1fhq n LYS 687 N -1.47 -1.68 -2.68 1.20 5.02 0.92 -4.88 118.16 114.58 1fhq n LYS 687 Ca 0.08 0.86 -0.42 0.00 -2.02 0.00 0.00 58.31 56.80 1fhq n LYS 687 Cb 0.32 -5.33 -0.03 0.00 -0.02 0.00 0.00 35.03 29.97 1fhq n LYS 687 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1fhq s PHE 688 N -2.59 2.65 -0.09 2.13 2.19 -1.08 -4.84 117.98 116.35 1fhq s PHE 688 Ca 0.00 0.19 0.02 0.00 0.33 0.00 0.00 56.93 57.47 1fhq s PHE 688 Cb 0.00 -4.36 0.01 0.00 -1.31 0.00 0.00 43.02 37.36 1fhq s PHE 688 CO 0.00 -1.55 -0.15 0.54 1.83 0.00 0.00 175.22 175.89 1fhq s VAL 689 N 4.63 1.42 0.20 3.12 0.11 -1.25 0.19 120.40 128.81 1fhq s VAL 689 Ca 0.37 -0.63 0.10 0.00 -2.93 0.00 0.00 61.98 58.89 1fhq s VAL 689 Cb -0.10 -1.29 -0.04 0.00 -1.53 0.00 0.00 36.38 33.42 1fhq s VAL 689 CO 0.22 0.42 -0.19 -0.63 -3.33 0.00 0.00 175.10 171.59 1fhq s ILE 690 N 0.75 2.04 0.00 7.04 -1.09 -0.54 0.13 121.20 129.53 1fhq s ILE 690 Ca -0.12 -2.08 0.00 0.00 -2.23 0.00 0.00 60.65 56.22 1fhq s ILE 690 Cb -0.16 -2.02 0.00 0.00 -1.58 0.00 0.00 42.46 38.70 1fhq s ILE 690 CO 0.03 -0.33 0.00 0.61 -1.23 0.00 0.00 174.94 174.01 1fhq n GLY 691 N 0.01 0.85 3.48 6.18 0.00 -1.26 -3.91 105.19 110.55 1fhq n GLY 691 Ca -0.11 0.50 -0.31 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 2.64 -0.32 1.61 0.40 -0.68 -2.56 117.98 119.07 1fhq s PHE 692 Ca 0.00 -0.20 -0.12 0.00 -0.60 0.00 0.00 56.93 56.01 1fhq s PHE 692 Cb 0.00 -1.53 -0.02 0.00 0.51 0.00 0.00 43.02 41.98 1fhq s PHE 692 CO 0.00 0.24 0.21 0.21 0.70 0.00 0.00 175.22 176.58 1fhq s LYS 693 N -1.22 3.54 -0.36 0.44 2.20 -0.89 -1.31 119.74 122.14 1fhq s LYS 693 Ca 0.14 -0.60 -0.28 0.00 -0.36 0.00 0.00 55.97 54.87 1fhq s LYS 693 Cb -0.11 -3.72 0.02 0.00 -1.51 0.00 0.00 37.83 32.51 1fhq s LYS 693 CO 0.04 -0.39 1.03 0.08 -0.36 0.00 0.00 175.35 175.75 1fhq s VAL 694 N 1.70 4.49 -0.26 4.02 1.01 -0.04 -1.72 120.40 129.62 1fhq s VAL 694 Ca 0.06 1.47 0.02 0.00 0.00 0.00 0.00 61.98 63.53 1fhq s VAL 694 Cb -0.17 -4.41 0.05 0.00 0.00 0.00 0.00 36.38 31.85 1fhq s VAL 694 CO 0.10 -0.57 -0.10 -0.70 0.00 0.00 0.00 175.10 173.82 1fhq s GLU 695 N 3.70 2.37 -0.51 2.72 2.12 0.22 0.21 118.70 129.54 1fhq s GLU 695 Ca 0.43 -1.26 -0.21 0.00 0.36 0.00 0.00 54.97 54.28 1fhq s GLU 695 Cb -0.11 -2.89 0.05 0.00 0.26 0.00 0.00 34.13 31.43 1fhq s GLU 695 CO 0.19 -0.53 0.76 0.42 -0.54 0.00 0.00 175.26 175.56 1fhq s ILE 696 N 1.15 4.67 -0.13 -3.70 1.01 -1.26 0.11 121.20 123.05 1fhq s ILE 696 Ca -0.07 -0.10 -0.18 0.00 0.00 0.00 0.00 60.65 60.30 1fhq s ILE 696 Cb -0.19 -4.38 -0.25 0.00 0.01 0.00 0.00 42.46 37.64 1fhq s ILE 696 CO -0.05 -0.90 0.51 0.78 0.00 0.00 0.00 174.94 175.28 1fhq h ASN 697 N 9.10 0.26 -3.64 3.58 -0.26 -1.54 -3.46 115.58 119.62 1fhq h ASN 697 Ca -0.27 -0.80 -0.68 0.00 -0.56 0.00 0.00 56.30 53.99 1fhq h ASN 697 Cb 1.09 -0.08 -0.18 0.00 -1.06 0.00 0.00 38.32 38.08 1fhq h ASN 697 CO 1.00 1.52 -0.69 -1.81 -1.06 0.00 0.00 177.43 176.39 1fhq s ASP 698 N -6.90 4.66 -0.49 5.81 1.01 -1.08 -5.06 116.67 114.63 1fhq s ASP 698 Ca -0.22 -0.05 -0.03 0.00 0.71 0.00 0.00 52.55 52.96 1fhq s ASP 698 Cb 0.04 -1.15 0.13 0.00 1.01 0.00 0.00 42.92 42.95 1fhq s ASP 698 CO 0.72 0.34 0.29 0.42 0.21 0.00 0.00 175.17 177.15 1fhq s THR 699 N -0.87 3.47 -0.62 -1.27 -4.23 -1.26 -4.49 115.64 106.37 1fhq s THR 699 Ca 0.14 -2.37 -0.19 0.00 -1.18 0.00 0.00 61.69 58.09 1fhq s THR 699 Cb -0.11 -3.33 -0.17 0.00 1.34 0.00 0.00 72.50 70.23 1fhq s THR 699 CO 0.03 -0.76 1.84 1.07 -0.54 0.00 0.00 174.62 176.26 1fhq n THR 700 N 4.21 1.51 -2.43 3.99 5.66 -1.26 -3.90 114.28 122.06 1fhq n THR 700 Ca 0.01 -1.19 -0.17 0.00 -3.05 0.00 0.00 64.05 59.65 1fhq n THR 700 Cb 0.40 -2.18 -0.00 0.00 -1.55 0.00 0.00 70.33 67.00 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 4.43 -0.32 3.73 1.09 0.00 -1.26 -4.85 105.19 108.01 1fhq n GLY 701 Ca 0.45 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.91 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 -4.99 4.44 0.55 0.99 1.43 -1.25 -4.09 118.68 115.75 1fhq s LEU 702 Ca 0.05 1.96 0.44 0.00 -1.03 0.00 0.00 54.13 55.55 1fhq s LEU 702 Cb -0.02 -3.59 1.64 0.00 0.03 0.00 0.00 46.19 44.25 1fhq s LEU 702 CO 0.06 -0.27 1.68 2.19 0.23 0.00 0.00 176.35 180.24 1fhq h PHE 703 N 5.88 0.03 0.00 0.29 -0.00 -1.92 -3.38 116.94 117.85 1fhq h PHE 703 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.54 1fhq h PHE 703 Cb 1.21 -0.01 0.00 0.00 -0.00 0.00 0.00 35.95 37.15 1fhq h PHE 703 CO 0.65 -0.01 0.00 -1.71 -0.00 0.00 0.00 178.31 177.24 1fhq n ASN 704 N -4.08 -2.14 0.00 -0.68 5.15 -1.26 -4.92 115.26 107.33 1fhq n ASN 704 Ca 0.36 0.55 0.00 0.00 -0.60 0.00 0.00 54.58 54.89 1fhq n ASN 704 Cb 1.66 2.14 0.00 0.00 -0.53 0.00 0.00 39.78 43.05 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 -3.17 0.00 0.00 1.20 0.28 -1.26 -4.99 120.64 112.71 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 0.00 0.35 -1.84 0.00 -1.26 -4.69 105.19 97.74 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 1.04 0.00 0.00 0.00 173.32 174.36 1fhq n LEU 707 N 0.00 1.01 -3.39 0.99 4.32 -1.26 -0.77 117.00 117.90 1fhq n LEU 707 Ca 0.00 -0.49 -0.29 0.00 -0.02 0.00 0.00 56.01 55.21 1fhq n LEU 707 Cb 0.00 -0.11 0.03 0.00 -1.62 0.00 0.00 43.42 41.72 1fhq n LEU 707 CO 0.00 0.24 -0.30 0.61 -1.22 0.00 0.00 177.39 176.73 1fhq n GLY 708 N 0.84 -0.05 3.19 -0.72 0.00 -1.26 -4.93 105.19 102.26 1fhq n GLY 708 Ca 0.08 0.95 -0.37 0.00 0.00 0.00 0.00 46.02 46.68 1fhq n GLY 708 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fhq s MET 709 N -2.18 2.33 -0.31 1.61 -1.94 -1.26 -4.69 119.30 112.86 1fhq s MET 709 Ca 0.30 -1.54 0.01 0.00 -1.71 0.00 0.00 55.69 52.75 1fhq s MET 709 Cb -0.03 -3.55 0.08 0.00 2.01 0.00 0.00 34.83 33.34 1fhq s MET 709 CO 0.71 -0.91 1.09 1.47 -0.01 0.00 0.00 175.02 177.37 1fhq n LEU 710 N 4.72 -1.10 -1.64 -0.03 -0.00 -1.26 -4.95 117.00 112.74 1fhq n LEU 710 Ca -0.08 -1.71 -0.19 0.00 -0.00 0.00 0.00 56.01 54.02 1fhq n LEU 710 Cb 0.42 0.91 -0.07 0.00 -0.00 0.00 0.00 43.42 44.69 1fhq n LEU 710 CO 0.33 1.16 -0.20 0.00 -0.00 0.00 0.00 177.39 178.69 1fhq n GLN 711 N -0.37 -1.39 -4.88 1.47 1.13 -1.26 -4.97 117.38 107.10 1fhq n GLN 711 Ca -0.26 1.14 -0.33 0.00 -1.94 0.00 0.00 57.00 55.62 1fhq n GLN 711 Cb 0.65 -5.52 -0.13 0.00 0.11 0.00 0.00 30.24 25.36 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 -3.91 2.49 -0.43 -1.09 8.01 -1.26 -5.09 118.70 117.42 1fhq s GLU 712 Ca 0.00 -0.70 0.00 0.00 0.01 0.00 0.00 54.97 54.28 1fhq s GLU 712 Cb 0.00 -2.37 0.12 0.00 -4.31 0.00 0.00 34.13 27.56 1fhq s GLU 712 CO 0.00 0.62 0.20 -1.14 0.01 0.00 0.00 175.26 174.95 1fhq s GLN 713 N -0.75 1.92 0.00 1.61 2.00 -1.26 -4.86 119.66 118.32 1fhq s GLN 713 Ca 0.12 -2.06 0.00 0.00 -2.00 0.00 0.00 55.36 51.42 1fhq s GLN 713 Cb -0.11 -3.45 0.00 0.00 0.80 0.00 0.00 33.01 30.25 1fhq s GLN 713 CO 0.01 -1.05 0.00 0.54 -0.50 0.00 0.00 175.29 174.28 1fhq n ARG 714 N 4.12 0.00 -4.86 1.67 5.12 -1.26 -4.92 116.66 116.53 1fhq n ARG 714 Ca 0.02 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.68 1fhq n ARG 714 Cb 0.40 0.00 -0.15 0.00 -1.16 0.00 0.00 32.46 31.55 1fhq n ARG 714 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1fhq s VAL 715 N 0.00 1.67 0.01 1.55 -7.23 -1.26 -4.82 120.40 110.32 1fhq s VAL 715 Ca 0.00 -1.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.84 1fhq s VAL 715 Cb 0.00 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.49 1fhq s VAL 715 CO 0.00 0.35 1.01 -0.69 -0.31 0.00 0.00 175.10 175.46 1fhq s VAL 716 N -0.63 4.74 0.44 1.32 1.01 -1.26 -4.69 120.40 121.34 1fhq s VAL 716 Ca 0.08 1.98 0.07 0.00 0.00 0.00 0.00 61.98 64.11 1fhq s VAL 716 Cb -0.08 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.01 1fhq s VAL 716 CO 0.00 0.16 0.32 -0.76 0.00 0.00 0.00 175.10 174.82 1fhq s LEU 717 N 0.98 3.14 0.12 3.92 1.02 -0.27 -4.95 118.68 122.64 1fhq s LEU 717 Ca 0.53 -0.97 -0.02 0.00 0.02 0.00 0.00 54.13 53.69 1fhq s LEU 717 Cb -0.22 -1.65 -0.05 0.00 0.02 0.00 0.00 46.19 44.29 1fhq s LEU 717 CO 0.28 -0.72 0.31 -0.75 0.02 0.00 0.00 176.35 175.49 1fhq s LYS 718 N -4.09 3.52 0.44 1.70 2.20 -1.26 -0.20 119.74 122.04 1fhq s LYS 718 Ca 0.43 -0.31 -0.03 0.00 -0.36 0.00 0.00 55.97 55.69 1fhq s LYS 718 Cb -0.01 -2.93 -0.04 0.00 -1.51 0.00 0.00 37.83 33.35 1fhq s LYS 718 CO 0.25 0.51 0.71 1.14 -0.36 0.00 0.00 175.35 177.60 1fhq s GLN 719 N -2.77 3.52 0.40 4.03 -2.07 -0.07 -4.58 119.66 118.11 1fhq s GLN 719 Ca 0.38 0.03 0.00 0.00 -1.82 0.00 0.00 55.36 53.95 1fhq s GLN 719 Cb -0.12 -2.47 0.00 0.00 -1.09 0.00 0.00 33.01 29.33 1fhq s GLN 719 CO 0.27 -0.09 0.03 0.25 -1.32 0.00 0.00 175.29 174.43 1fhq n THR 720 N -2.10 0.00 0.01 3.63 -2.24 -1.26 -4.98 114.28 107.33 1fhq n THR 720 Ca -0.01 -1.84 0.21 0.00 -2.27 0.00 0.00 64.05 60.15 1fhq n THR 720 Cb 0.55 0.32 0.72 0.00 -2.10 0.00 0.00 70.33 69.83 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 1.15 2.43 0.11 6.98 0.00 -1.99 -1.20 119.26 126.74 1fhq h ALA 721 Ca -0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1fhq h ALA 721 Cb 0.98 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1fhq h ALA 721 CO 0.53 -0.70 -0.05 0.93 0.00 0.00 0.00 179.25 179.96 1fhq h GLU 722 N 0.00 -0.14 -0.32 0.00 5.08 -1.99 -0.97 114.58 116.23 1fhq h GLU 722 Ca 0.26 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1fhq h GLU 722 Cb 1.10 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 1fhq h GLU 722 CO -0.00 0.06 0.00 0.93 -1.00 0.00 0.00 179.01 179.00 1fhq h GLU 723 N -0.31 0.57 -0.37 2.33 3.07 -1.65 -2.85 114.58 115.36 1fhq h GLU 723 Ca -0.01 -0.18 0.03 0.00 -0.50 0.00 0.00 59.36 58.69 1fhq h GLU 723 Cb 0.26 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1fhq h GLU 723 CO 0.02 0.69 0.25 -0.22 -1.40 0.00 0.00 179.01 178.36 1fhq h LYS 724 N 0.37 0.40 -0.32 2.33 1.63 -1.27 -1.76 116.57 117.95 1fhq h LYS 724 Ca 0.09 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.75 1fhq h LYS 724 Cb 0.44 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.97 1fhq h LYS 724 CO 0.02 0.26 -0.29 0.22 -3.45 0.00 0.00 179.45 176.21 1fhq h ASP 725 N 0.41 0.69 -0.54 4.20 3.58 -0.95 -2.56 116.42 121.25 1fhq h ASP 725 Ca 0.15 -0.27 0.01 0.00 0.42 0.00 0.00 57.03 57.34 1fhq h ASP 725 Cb 0.09 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 40.93 1fhq h ASP 725 CO -0.03 0.94 0.35 -0.07 -2.88 0.00 0.00 179.24 177.55 1fhq h LEU 726 N 0.58 0.61 -1.14 2.28 3.38 -1.13 -2.01 115.31 117.87 1fhq h LEU 726 Ca 0.07 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1fhq h LEU 726 Cb 0.79 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1fhq h LEU 726 CO 0.06 0.44 -0.38 1.62 0.09 0.00 0.00 178.44 180.28 1fhq h VAL 727 N 0.72 1.06 -0.14 1.22 3.04 -1.46 0.21 116.25 120.90 1fhq h VAL 727 Ca 0.20 -1.40 0.04 0.00 -1.01 0.00 0.00 66.70 64.52 1fhq h VAL 727 Cb -0.08 1.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.00 1fhq h VAL 727 CO -0.04 0.37 0.15 0.50 -1.01 0.00 0.00 177.57 177.54 1fhq h LYS 728 N 0.00 0.00 0.00 4.17 3.11 -0.93 -2.68 116.57 120.24 1fhq h LYS 728 Ca -0.00 0.00 -0.12 0.00 -2.81 0.00 0.00 60.65 57.72 1fhq h LYS 728 Cb 0.78 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.98 1fhq h LYS 728 CO 0.05 0.00 -1.57 1.63 -2.81 0.00 0.00 179.45 176.75 1fhq n LYS 729 N -3.90 1.93 -0.57 1.90 5.02 -1.04 -5.11 118.16 116.39 1fhq n LYS 729 Ca 0.01 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1fhq n LYS 729 Cb 0.26 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 1fhq n LYS 729 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16