#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5p s ASP 595 N 0.00 -0.80 0.00 6.12 1.47 -1.26 -4.94 116.67 117.26 1h5p s ASP 595 Ca 0.00 0.75 0.00 0.00 1.18 0.00 0.00 52.55 54.48 1h5p s ASP 595 Cb 0.00 1.77 0.00 0.00 -0.34 0.00 0.00 42.92 44.35 1h5p s ASP 595 CO 0.00 -0.15 0.00 -0.62 0.68 0.00 0.00 175.17 175.08 1h5p n GLU 596 N 5.29 0.00 0.18 2.11 -0.58 -1.26 -5.03 120.64 121.36 1h5p n GLU 596 Ca -0.07 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.54 1h5p n GLU 596 Cb 0.52 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.32 1h5p n GLU 596 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 1h5p h ASN 597 N 0.00 -1.05 -2.61 1.62 -0.73 -2.00 -3.36 115.58 107.44 1h5p h ASN 597 Ca 0.00 0.09 -0.58 0.00 1.87 0.00 0.00 56.30 57.68 1h5p h ASN 597 Cb 0.00 0.36 -0.11 0.00 0.27 0.00 0.00 38.32 38.84 1h5p h ASN 597 CO 0.00 -0.47 0.81 -0.63 -0.37 0.00 0.00 177.43 176.77 1h5p s ILE 598 N -5.05 4.03 0.00 2.57 -1.09 -1.26 -5.00 121.20 115.40 1h5p s ILE 598 Ca -0.13 0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 1h5p s ILE 598 Cb 0.03 -4.78 0.00 0.00 -1.58 0.00 0.00 42.46 36.13 1h5p s ILE 598 CO 0.44 -1.60 0.00 -0.46 -1.23 0.00 0.00 174.94 172.09 1h5p n ASN 599 N 8.50 0.00 0.00 3.58 6.94 -1.26 -5.01 115.26 128.00 1h5p n ASN 599 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.57 1h5p n ASN 599 Cb 0.47 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.89 1h5p n ASN 599 CO 0.00 0.00 0.00 2.22 -1.03 0.00 0.00 177.26 178.45 1h5p n PHE 600 N 0.00 0.00 1.33 -2.53 -1.74 -1.26 -4.85 117.46 108.41 1h5p n PHE 600 Ca 0.00 0.00 0.13 0.00 -0.56 0.00 0.00 57.45 57.02 1h5p n PHE 600 Cb 0.00 0.02 0.40 0.00 1.52 0.00 0.00 39.48 41.42 1h5p n PHE 600 CO 0.00 0.00 0.00 0.36 -0.56 0.00 0.00 176.76 176.56 1h5p n LYS 601 N 0.00 1.44 -2.62 3.97 2.85 -1.26 -4.90 118.16 117.63 1h5p n LYS 601 Ca 0.00 -0.91 -0.41 0.00 -1.05 0.00 0.00 58.31 55.94 1h5p n LYS 601 Cb 0.22 -1.48 -0.04 0.00 -0.65 0.00 0.00 35.03 33.08 1h5p n LYS 601 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 1h5p s GLN 602 N -2.19 4.66 0.01 -1.58 -1.52 -1.26 -4.90 119.66 112.87 1h5p s GLN 602 Ca 0.31 1.59 0.03 0.00 -1.95 0.00 0.00 55.36 55.34 1h5p s GLN 602 Cb 0.20 -3.32 0.13 0.00 -0.22 0.00 0.00 33.01 29.80 1h5p s GLN 602 CO 0.41 0.17 1.09 -1.13 -0.25 0.00 0.00 175.29 175.58 1h5p n SER 603 N 2.49 0.02 -3.59 5.90 3.41 -1.26 -4.15 113.62 116.43 1h5p n SER 603 Ca 0.02 0.51 -0.27 0.00 -0.26 0.00 0.00 58.87 58.87 1h5p n SER 603 Cb 0.47 -0.51 -0.16 0.00 -0.26 0.00 0.00 64.21 63.75 1h5p n SER 603 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1h5p s GLU 604 N -3.01 0.13 -0.41 4.33 2.02 -1.25 -3.71 118.70 116.79 1h5p s GLU 604 Ca 0.01 -0.26 -0.14 0.00 0.02 0.00 0.00 54.97 54.60 1h5p s GLU 604 Cb 0.02 -1.60 0.03 0.00 0.10 0.00 0.00 34.13 32.68 1h5p s GLU 604 CO 0.05 -0.80 0.28 -1.17 0.02 0.00 0.00 175.26 173.64 1h5p s LEU 605 N 2.11 5.05 0.05 1.80 2.96 -0.12 -4.86 118.68 125.67 1h5p s LEU 605 Ca 0.05 -0.95 -0.30 0.00 -0.22 0.00 0.00 54.13 52.70 1h5p s LEU 605 Cb -0.16 -2.13 -0.09 0.00 0.50 0.00 0.00 46.19 44.31 1h5p s LEU 605 CO -0.19 -0.45 1.91 -2.16 -1.32 0.00 0.00 176.35 174.14 1h5p s PRO 606 N 1.65 4.15 0.17 0.98 0.04 -1.26 -1.65 135.00 139.07 1h5p s PRO 606 Ca 0.04 2.57 0.11 0.00 0.04 0.00 0.00 61.00 63.75 1h5p s PRO 606 Cb -0.19 -4.03 -0.04 0.00 0.04 0.00 0.00 34.50 30.28 1h5p s PRO 606 CO 0.09 -0.92 -0.21 0.14 0.04 0.00 0.00 177.00 176.14 1h5p s VAL 607 N 4.05 2.55 -0.24 -0.36 -7.23 -0.54 -0.11 120.40 118.52 1h5p s VAL 607 Ca 0.85 -1.84 -0.04 0.00 -1.81 0.00 0.00 61.98 59.15 1h5p s VAL 607 Cb -0.42 -2.20 0.10 0.00 0.56 0.00 0.00 36.38 34.41 1h5p s VAL 607 CO 0.39 -0.04 0.18 0.42 -0.31 0.00 0.00 175.10 175.74 1h5p s THR 608 N -1.48 -0.21 -0.38 5.32 -4.23 0.11 -1.02 115.64 113.76 1h5p s THR 608 Ca 0.20 -0.39 -0.06 0.00 -1.18 0.00 0.00 61.69 60.26 1h5p s THR 608 Cb -0.09 -0.80 0.08 0.00 1.34 0.00 0.00 72.50 73.02 1h5p s THR 608 CO 0.10 -0.43 0.17 0.00 -0.54 0.00 0.00 174.62 173.92 1h5p n GLY 610 N 4.75 -0.89 3.73 0.00 0.00 -1.25 -1.64 105.19 109.89 1h5p n GLY 610 Ca -0.09 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1h5p n GLY 610 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h5p n GLU 611 N -3.57 0.00 -3.18 1.61 -0.58 -1.26 -4.79 120.64 108.87 1h5p n GLU 611 Ca -0.15 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.14 1h5p n GLU 611 Cb 0.64 -3.70 -0.04 0.00 -0.57 0.00 0.00 31.44 27.77 1h5p n GLU 611 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1h5p s VAL 612 N -2.02 5.07 0.91 2.62 1.01 -0.65 -5.05 120.40 122.29 1h5p s VAL 612 Ca 0.00 -1.50 -0.12 0.00 0.00 0.00 0.00 61.98 60.36 1h5p s VAL 612 Cb 0.00 -4.48 0.14 0.00 0.00 0.00 0.00 36.38 32.03 1h5p s VAL 612 CO 0.00 -1.09 1.12 -0.75 0.00 0.00 0.00 175.10 174.38 1h5p s LYS 613 N 1.89 1.12 -0.21 2.72 2.20 -1.26 -0.73 119.74 125.47 1h5p s LYS 613 Ca 0.13 0.39 -0.36 0.00 -0.36 0.00 0.00 55.97 55.78 1h5p s LYS 613 Cb -0.20 -1.83 0.15 0.00 -1.51 0.00 0.00 37.83 34.44 1h5p s LYS 613 CO 0.00 -2.23 1.32 0.20 -0.36 0.00 0.00 175.35 174.28 1h5p s GLY 614 N -3.88 -0.29 -0.29 5.54 0.00 -0.19 -4.82 107.32 103.39 1h5p s GLY 614 Ca 0.64 1.58 -0.10 0.00 0.00 0.00 0.00 44.72 46.83 1h5p s GLY 614 CO 0.54 0.50 0.15 -1.59 0.00 0.00 0.00 173.10 172.70 1h5p s THR 615 N -2.21 4.78 -0.20 0.90 2.01 -1.06 -1.46 115.64 118.39 1h5p s THR 615 Ca 0.12 -0.21 -0.19 0.00 0.31 0.00 0.00 61.69 61.72 1h5p s THR 615 Cb 0.01 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 1h5p s THR 615 CO -0.04 0.16 0.55 -0.22 -0.69 0.00 0.00 174.62 174.38 1h5p s LEU 616 N 1.66 4.14 -0.14 4.42 0.20 -0.66 -0.95 118.68 127.35 1h5p s LEU 616 Ca 0.06 0.71 -0.14 0.00 0.69 0.00 0.00 54.13 55.45 1h5p s LEU 616 Cb -0.16 -2.76 -0.05 0.00 -0.43 0.00 0.00 46.19 42.79 1h5p s LEU 616 CO 0.07 -0.22 0.30 -0.31 -0.29 0.00 0.00 176.35 175.91 1h5p s TYR 617 N 1.76 3.50 0.32 5.38 1.51 0.25 -0.95 117.35 129.13 1h5p s TYR 617 Ca 0.25 0.64 0.07 0.00 -1.01 0.00 0.00 57.07 57.03 1h5p s TYR 617 Cb -0.16 -2.32 0.55 0.00 -0.11 0.00 0.00 41.96 39.93 1h5p s TYR 617 CO 0.10 0.31 1.77 0.87 -1.11 0.00 0.00 175.55 177.48 1h5p h LYS 618 N 6.37 0.25 0.00 -0.62 1.79 -1.82 0.17 116.57 122.70 1h5p h LYS 618 Ca -0.43 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 57.94 1h5p h LYS 618 Cb 1.17 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 1h5p h LYS 618 CO 0.73 0.54 0.30 1.05 -1.08 0.00 0.00 179.45 180.99 1h5p h GLU 619 N 0.22 0.00 0.00 3.15 4.11 -1.94 -2.26 114.58 117.86 1h5p h GLU 619 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1h5p h GLU 619 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1h5p h GLU 619 CO 0.05 0.00 -0.82 0.54 0.07 0.00 0.00 179.01 178.85 1h5p n ARG 620 N -2.81 2.40 0.33 1.06 1.74 -1.05 -4.66 116.66 113.67 1h5p n ARG 620 Ca -0.02 0.00 0.21 0.00 -0.77 0.00 0.00 57.85 57.27 1h5p n ARG 620 Cb 0.34 -0.91 1.10 0.00 -1.02 0.00 0.00 32.46 31.97 1h5p n ARG 620 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1h5p h PHE 621 N 0.00 0.00 0.00 -1.55 3.57 -0.08 -2.36 116.94 116.51 1h5p h PHE 621 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1h5p h PHE 621 Cb 0.49 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.23 1h5p h PHE 621 CO 0.00 0.00 0.41 0.87 -2.23 0.00 0.00 178.31 177.36 1h5p h LYS 622 N 0.00 0.00 0.00 1.11 1.57 -1.75 0.18 116.57 117.68 1h5p h LYS 622 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1h5p h LYS 622 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1h5p h LYS 622 CO -0.00 0.00 -0.37 0.00 -0.57 0.00 0.00 179.45 178.51 1h5p n GLN 623 N -2.08 3.35 0.00 3.15 10.64 -0.89 -4.89 117.38 126.66 1h5p n GLN 623 Ca -0.01 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.16 1h5p n GLN 623 Cb 0.43 -0.61 0.00 0.00 -0.86 0.00 0.00 30.24 29.19 1h5p n GLN 623 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1h5p n GLY 624 N 1.27 2.36 0.66 2.61 0.00 0.63 -3.46 105.19 109.27 1h5p n GLY 624 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1h5p n GLY 624 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1h5p n THR 625 N 0.00 0.14 -0.18 2.61 5.66 -1.26 -2.04 114.28 119.21 1h5p n THR 625 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1h5p n THR 625 Cb 0.00 -0.39 0.00 0.00 -1.55 0.00 0.00 70.33 68.39 1h5p n THR 625 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1h5p n SER 626 N 0.42 1.00 -3.66 1.09 2.88 -1.22 -4.84 113.62 109.30 1h5p n SER 626 Ca 0.00 -1.19 -0.06 0.00 -1.33 0.00 0.00 58.87 56.30 1h5p n SER 626 Cb 0.15 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.54 1h5p n SER 626 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1h5p s LYS 627 N -0.19 0.48 -0.51 -1.46 -0.14 -0.87 -5.00 119.74 112.05 1h5p s LYS 627 Ca 0.00 1.19 -0.27 0.00 -1.36 0.00 0.00 55.97 55.53 1h5p s LYS 627 Cb 0.00 0.48 -0.02 0.00 -1.68 0.00 0.00 37.83 36.61 1h5p s LYS 627 CO 0.00 -0.21 1.80 -1.59 -0.76 0.00 0.00 175.35 174.59 1h5p s LYS 628 N 2.47 2.91 0.00 1.68 -2.85 -1.26 -4.65 119.74 118.04 1h5p s LYS 628 Ca -0.05 0.87 0.03 0.00 -1.00 0.00 0.00 55.97 55.82 1h5p s LYS 628 Cb -0.11 -4.30 0.04 0.00 -2.06 0.00 0.00 37.83 31.40 1h5p s LYS 628 CO -0.16 -2.38 0.75 0.00 0.10 0.00 0.00 175.35 173.66 1h5p s ILE 630 N -0.49 4.91 -0.26 0.00 1.01 -1.10 -0.58 121.20 124.69 1h5p s ILE 630 Ca 0.04 -0.30 -0.21 0.00 0.00 0.00 0.00 60.65 60.19 1h5p s ILE 630 Cb 0.03 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 38.27 1h5p s ILE 630 CO 0.04 -0.66 0.65 -1.58 0.00 0.00 0.00 174.94 173.39 1h5p s GLN 631 N 2.56 4.10 0.50 2.79 0.74 -0.13 -0.32 119.66 129.90 1h5p s GLN 631 Ca 0.16 0.57 0.02 0.00 0.05 0.00 0.00 55.36 56.16 1h5p s GLN 631 Cb -0.17 -3.66 0.02 0.00 1.10 0.00 0.00 33.01 30.30 1h5p s GLN 631 CO 0.14 -0.44 0.71 0.45 -0.55 0.00 0.00 175.29 175.60 1h5p s SER 632 N 1.47 5.49 0.53 6.67 0.15 -0.13 -2.56 113.70 125.33 1h5p s SER 632 Ca 0.27 0.01 0.29 0.00 0.70 0.00 0.00 55.95 57.22 1h5p s SER 632 Cb -0.15 -1.03 1.58 0.00 -1.71 0.00 0.00 66.02 64.70 1h5p s SER 632 CO 0.09 -0.95 1.87 -0.33 1.20 0.00 0.00 173.24 175.11 1h5p h GLU 633 N 0.26 0.00 -0.76 5.44 5.08 -1.88 0.70 114.58 123.42 1h5p h GLU 633 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1h5p h GLU 633 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1h5p h GLU 633 CO 0.53 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 178.29 1h5p n ASP 634 N -2.65 1.95 -3.65 1.42 8.00 -1.26 -4.85 116.55 115.51 1h5p n ASP 634 Ca -0.02 -2.19 -0.27 0.00 0.71 0.00 0.00 54.79 53.02 1h5p n ASP 634 Cb 0.22 -0.47 0.01 0.00 -0.02 0.00 0.00 41.12 40.86 1h5p n ASP 634 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1h5p n LYS 635 N 0.13 -4.34 -4.30 -1.24 4.81 0.24 -4.95 118.16 108.51 1h5p n LYS 635 Ca 0.07 0.55 -0.18 0.00 -0.87 0.00 0.00 58.31 57.88 1h5p n LYS 635 Cb 0.42 -5.35 -0.15 0.00 0.02 0.00 0.00 35.03 29.97 1h5p n LYS 635 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1h5p s LYS 636 N -6.33 0.71 -0.04 1.64 2.47 -1.23 -4.95 119.74 112.00 1h5p s LYS 636 Ca 0.54 -0.26 -0.17 0.00 -1.56 0.00 0.00 55.97 54.52 1h5p s LYS 636 Cb -0.28 -0.69 -0.05 0.00 -1.46 0.00 0.00 37.83 35.36 1h5p s LYS 636 CO 0.66 0.13 0.45 -1.58 0.16 0.00 0.00 175.35 175.17 1h5p s TRP 637 N 0.02 3.65 0.28 4.03 0.52 -1.26 -0.96 118.94 125.22 1h5p s TRP 637 Ca 0.00 0.98 0.11 0.00 0.02 0.00 0.00 56.10 57.21 1h5p s TRP 637 Cb -0.05 -2.42 -0.05 0.00 -1.15 0.00 0.00 33.47 29.79 1h5p s TRP 637 CO -0.00 0.44 -0.19 -0.06 0.02 0.00 0.00 176.95 177.16 1h5p s PHE 638 N -0.36 2.24 0.23 -1.98 0.40 0.56 -4.91 117.98 114.17 1h5p s PHE 638 Ca 0.25 -0.36 -0.01 0.00 -0.60 0.00 0.00 56.93 56.21 1h5p s PHE 638 Cb -0.16 -0.99 -0.04 0.00 0.51 0.00 0.00 43.02 42.33 1h5p s PHE 638 CO 0.13 0.68 0.43 0.95 0.70 0.00 0.00 175.22 178.11 1h5p s THR 639 N -2.56 5.16 0.43 0.64 -4.23 -1.26 -2.71 115.64 111.12 1h5p s THR 639 Ca 0.29 -0.30 0.13 0.00 -1.18 0.00 0.00 61.69 60.64 1h5p s THR 639 Cb -0.04 -3.74 0.13 0.00 1.34 0.00 0.00 72.50 70.18 1h5p s THR 639 CO 0.14 -0.23 1.32 -0.65 -0.54 0.00 0.00 174.62 174.66 1h5p h PRO 640 N 1.84 0.00 0.00 3.99 0.11 -1.85 0.26 132.00 136.34 1h5p h PRO 640 Ca -0.48 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 1h5p h PRO 640 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1h5p h PRO 640 CO 0.67 0.00 -0.69 -2.13 -0.21 0.00 0.00 178.00 175.64 1h5p n ARG 641 N -2.36 0.48 0.30 1.05 3.00 -1.26 -3.32 116.66 114.55 1h5p n ARG 641 Ca -0.01 0.54 0.18 0.00 -0.00 0.00 0.00 57.85 58.56 1h5p n ARG 641 Cb 0.58 -1.70 1.01 0.00 0.00 0.00 0.00 32.46 32.35 1h5p n ARG 641 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 1h5p h GLU 642 N -1.00 0.00 -0.00 -0.14 4.81 -1.57 -0.28 114.58 116.39 1h5p h GLU 642 Ca -0.08 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.90 1h5p h GLU 642 Cb 0.69 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.09 1h5p h GLU 642 CO -0.05 0.00 -1.01 0.35 -0.73 0.00 0.00 179.01 177.57 1h5p h PHE 643 N 0.00 0.92 -0.35 0.92 3.57 -0.71 -2.23 116.94 119.05 1h5p h PHE 643 Ca 0.01 -0.50 0.00 0.00 3.53 0.00 0.00 57.97 61.02 1h5p h PHE 643 Cb 0.07 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 1h5p h PHE 643 CO 0.00 1.33 0.23 1.49 -2.23 0.00 0.00 178.31 179.13 1h5p h GLU 644 N 0.35 0.46 -0.15 1.11 4.22 -1.05 0.13 114.58 119.66 1h5p h GLU 644 Ca -0.11 -0.03 -0.21 0.00 0.08 0.00 0.00 59.36 59.09 1h5p h GLU 644 Cb 1.65 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.81 1h5p h GLU 644 CO 0.19 0.31 -0.75 0.82 -2.18 0.00 0.00 179.01 177.40 1h5p h ILE 645 N 0.48 1.30 -0.02 2.32 2.04 -1.38 0.19 117.51 122.44 1h5p h ILE 645 Ca 0.13 -1.99 -0.12 0.00 1.00 0.00 0.00 64.86 63.88 1h5p h ILE 645 Cb -0.05 1.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 1h5p h ILE 645 CO -0.03 0.63 -0.54 -0.08 0.00 0.00 0.00 178.15 178.13 1h5p h GLU 646 N 0.49 0.07 0.00 2.37 4.81 -0.62 -2.91 114.58 118.79 1h5p h GLU 646 Ca -0.04 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1h5p h GLU 646 Cb 1.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.75 1h5p h GLU 646 CO 0.15 0.59 -0.43 0.41 -0.73 0.00 0.00 179.01 179.00 1h5p n GLY 647 N 0.05 -0.81 0.00 1.92 0.00 0.36 -4.81 105.19 101.90 1h5p n GLY 647 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1h5p n GLY 647 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h5p n ASP 648 N -4.02 0.00 0.00 1.61 -0.08 0.66 -4.65 116.55 110.07 1h5p n ASP 648 Ca -0.06 0.43 0.00 0.00 -1.51 0.00 0.00 54.79 53.65 1h5p n ASP 648 Cb 0.22 -0.19 0.00 0.00 2.34 0.00 0.00 41.12 43.50 1h5p n ASP 648 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1h5p n ARG 649 N -1.06 0.00 0.00 -0.67 3.00 -1.10 -4.98 116.66 111.85 1h5p n ARG 649 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1h5p n ARG 649 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1h5p n ARG 649 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1h5p n GLY 650 N 0.00 1.06 0.06 5.14 0.00 -1.26 -4.78 105.19 105.42 1h5p n GLY 650 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1h5p n GLY 650 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h5p n ALA 651 N -0.01 1.38 -1.00 4.61 0.00 -1.26 -4.60 120.51 119.63 1h5p n ALA 651 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1h5p n ALA 651 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1h5p n ALA 651 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1h5p n SER 652 N -1.80 0.00 0.01 0.00 7.64 -1.26 -5.06 113.62 113.15 1h5p n SER 652 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1h5p n SER 652 Cb 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1h5p n SER 652 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1h5p n LYS 653 N 0.00 0.00 -2.12 1.43 3.00 -1.26 -5.08 118.16 114.12 1h5p n LYS 653 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.94 1h5p n LYS 653 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 1h5p n LYS 653 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 1h5p s ASN 654 N -2.00 5.40 0.46 3.14 3.84 -1.26 -4.80 114.94 119.72 1h5p s ASN 654 Ca 0.00 -0.02 0.26 0.00 0.21 0.00 0.00 52.86 53.31 1h5p s ASN 654 Cb 0.00 -2.54 0.87 0.00 -0.55 0.00 0.00 41.25 39.03 1h5p s ASN 654 CO 0.00 -2.35 1.80 4.11 -2.79 0.00 0.00 177.10 177.87 1h5p h TRP 655 N 13.45 0.00 0.00 0.43 5.08 -1.98 -1.97 115.95 130.96 1h5p h TRP 655 Ca -0.18 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.79 1h5p h TRP 655 Cb 1.11 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.27 1h5p h TRP 655 CO 1.10 0.14 -0.02 0.87 -1.28 0.00 0.00 178.44 179.24 1h5p h LYS 656 N 0.00 0.00 0.00 0.12 1.57 -1.87 -2.24 116.57 114.15 1h5p h LYS 656 Ca -0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 1h5p h LYS 656 Cb 0.78 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 1h5p h LYS 656 CO 0.02 0.02 -1.56 1.28 -0.57 0.00 0.00 179.45 178.64 1h5p n LEU 657 N -3.15 0.00 0.12 2.94 4.77 -1.12 0.08 117.00 120.64 1h5p n LEU 657 Ca -0.01 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.95 1h5p n LEU 657 Cb 0.24 0.15 0.12 0.00 -2.33 0.00 0.00 43.42 41.59 1h5p n LEU 657 CO 0.26 0.15 0.43 -1.28 -1.33 0.00 0.00 177.39 175.62 1h5p h SER 658 N 0.00 0.00 -3.46 -1.43 0.87 -1.28 -3.44 113.55 104.80 1h5p h SER 658 Ca -0.16 0.00 -0.68 0.00 -1.23 0.00 0.00 61.79 59.72 1h5p h SER 658 Cb 1.19 0.00 -0.16 0.00 -0.44 0.00 0.00 62.40 62.99 1h5p h SER 658 CO 0.01 0.68 -0.66 -0.63 -0.53 0.00 0.00 176.83 175.70 1h5p s ILE 659 N -3.40 4.01 0.37 2.23 1.01 -0.85 -3.97 121.20 120.60 1h5p s ILE 659 Ca -0.01 -0.51 0.08 0.00 0.00 0.00 0.00 60.65 60.21 1h5p s ILE 659 Cb 0.12 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 1h5p s ILE 659 CO 0.77 0.49 0.21 -0.13 0.00 0.00 0.00 174.94 176.27 1h5p s ARG 660 N -1.19 2.39 -0.31 2.79 0.52 0.06 -3.23 118.95 119.98 1h5p s ARG 660 Ca 0.16 -1.60 -0.03 0.00 -0.52 0.00 0.00 55.73 53.74 1h5p s ARG 660 Cb -0.11 -2.18 0.11 0.00 0.52 0.00 0.00 34.95 33.28 1h5p s ARG 660 CO 0.06 -0.01 0.14 0.00 0.02 0.00 0.00 175.30 175.51 1h5p n GLY 662 N 4.92 0.03 0.00 0.00 0.00 0.84 -2.68 105.19 108.30 1h5p n GLY 662 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1h5p n GLY 662 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h5p n GLY 663 N 0.79 1.86 3.86 -0.02 0.00 -1.26 -4.90 105.19 105.52 1h5p n GLY 663 Ca -0.00 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 1h5p n GLY 663 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h5p s TYR 664 N 0.00 3.65 1.03 1.61 1.51 -1.09 -4.95 117.35 119.11 1h5p s TYR 664 Ca 0.00 0.79 -0.14 0.00 -1.01 0.00 0.00 57.07 56.71 1h5p s TYR 664 Cb 0.00 -2.14 0.20 0.00 -0.11 0.00 0.00 41.96 39.92 1h5p s TYR 664 CO 0.00 0.64 1.11 0.95 -1.11 0.00 0.00 175.55 177.15 1h5p s THR 665 N -1.15 1.92 0.48 -0.71 -4.23 -1.26 0.35 115.64 111.04 1h5p s THR 665 Ca 0.24 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.89 1h5p s THR 665 Cb -0.15 -2.56 0.24 0.00 1.34 0.00 0.00 72.50 71.38 1h5p s THR 665 CO 0.12 0.00 2.09 -0.07 -0.54 0.00 0.00 174.62 176.23 1h5p h LEU 666 N -1.98 0.06 -0.80 4.79 -0.00 -1.42 0.21 115.31 116.19 1h5p h LEU 666 Ca -0.52 -0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.30 1h5p h LEU 666 Cb 1.32 -0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 41.93 1h5p h LEU 666 CO 0.53 0.10 0.25 0.50 -0.00 0.00 0.00 178.44 179.82 1h5p h LYS 667 N 0.07 1.14 0.09 1.13 1.63 -0.66 0.90 116.57 120.87 1h5p h LYS 667 Ca 0.02 -0.23 -0.27 0.00 -0.85 0.00 0.00 60.65 59.32 1h5p h LYS 667 Cb 0.08 -0.17 0.01 0.00 -0.60 0.00 0.00 32.23 31.55 1h5p h LYS 667 CO 0.00 0.96 -1.15 0.28 -3.45 0.00 0.00 179.45 176.09 1h5p h VAL 668 N 1.10 1.40 -0.18 2.00 2.07 -1.37 -2.78 116.25 118.49 1h5p h VAL 668 Ca 0.24 -2.68 -0.07 0.00 0.82 0.00 0.00 66.70 65.02 1h5p h VAL 668 Cb 0.28 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 1h5p h VAL 668 CO -0.01 0.80 -0.19 -0.07 0.02 0.00 0.00 177.57 178.12 1h5p h LEU 669 N 0.18 0.30 -0.00 2.57 4.07 -0.40 0.60 115.31 122.64 1h5p h LEU 669 Ca -0.14 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.75 1h5p h LEU 669 Cb 1.83 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 43.49 1h5p h LEU 669 CO 0.20 0.51 -0.02 1.15 -1.08 0.00 0.00 178.44 179.20 1h5p n MET 670 N -4.20 0.03 -0.04 1.13 0.00 0.29 0.50 117.12 114.83 1h5p n MET 670 Ca -0.01 -0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.72 1h5p n MET 670 Cb 0.33 -1.50 -0.15 0.00 0.00 0.00 0.00 33.22 31.90 1h5p n MET 670 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1h5p n GLU 671 N -1.48 0.73 0.00 3.17 2.13 -0.11 -4.70 120.64 120.38 1h5p n GLU 671 Ca 0.07 -0.12 0.00 0.00 0.66 0.00 0.00 57.16 57.77 1h5p n GLU 671 Cb 0.33 -1.48 0.00 0.00 0.27 0.00 0.00 31.44 30.56 1h5p n GLU 671 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1h5p n ASN 672 N -2.38 0.00 0.00 4.31 3.02 0.19 -4.52 115.26 115.88 1h5p n ASN 672 Ca -0.13 0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1h5p n ASN 672 Cb 0.74 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 1h5p n ASN 672 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1h5p n LYS 673 N -1.20 0.00 -1.89 3.52 2.85 -1.02 -4.68 118.16 115.73 1h5p n LYS 673 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 1h5p n LYS 673 Cb 0.00 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.41 1h5p n LYS 673 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1h5p n PHE 674 N 0.00 2.90 -1.38 5.58 3.72 0.18 -4.92 117.46 123.54 1h5p n PHE 674 Ca 0.00 -2.46 -0.38 0.00 -0.05 0.00 0.00 57.45 54.56 1h5p n PHE 674 Cb 0.24 -0.59 0.04 0.00 -0.94 0.00 0.00 39.48 38.23 1h5p n PHE 674 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1h5p n LEU 675 N -0.74 -0.31 -0.06 4.37 4.32 -0.36 -4.25 117.00 119.97 1h5p n LEU 675 Ca 0.48 0.69 -0.03 0.00 -0.02 0.00 0.00 56.01 57.13 1h5p n LEU 675 Cb 0.87 -1.10 -0.01 0.00 -1.62 0.00 0.00 43.42 41.56 1h5p n LEU 675 CO 0.49 -3.50 -0.18 1.55 -1.22 0.00 0.00 177.39 174.53 1h5p h PRO 676 N 0.08 0.00 0.00 3.23 0.14 -1.87 -3.45 132.00 130.13 1h5p h PRO 676 Ca -0.45 0.00 -0.17 0.00 0.14 0.00 0.00 66.00 65.53 1h5p h PRO 676 Cb 1.40 0.00 -0.03 0.00 0.14 0.00 0.00 31.00 32.52 1h5p h PRO 676 CO 0.45 0.03 -1.48 0.39 0.14 0.00 0.00 178.00 177.53 1h5p n GLU 677 N -4.69 0.54 -1.77 0.86 1.02 -1.26 -4.61 120.64 110.74 1h5p n GLU 677 Ca -0.04 0.28 -0.31 0.00 -0.02 0.00 0.00 57.16 57.07 1h5p n GLU 677 Cb 0.15 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.10 1h5p n GLU 677 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1h5p s PRO 678 N -2.68 3.31 0.71 3.49 0.04 -1.26 -5.06 135.00 133.54 1h5p s PRO 678 Ca -0.31 0.87 -0.06 0.00 0.04 0.00 0.00 61.00 61.55 1h5p s PRO 678 Cb 0.08 -2.04 0.15 0.00 0.04 0.00 0.00 34.50 32.73 1h5p s PRO 678 CO 0.44 -0.81 0.97 -0.35 0.04 0.00 0.00 177.00 177.29 1h5p n PRO 679 N -2.84 -0.44 -3.89 0.56 -0.04 -1.26 -4.61 135.00 122.49 1h5p n PRO 679 Ca 0.07 -2.10 -0.11 0.00 -0.04 0.00 0.00 63.50 61.31 1h5p n PRO 679 Cb 0.54 -0.80 -0.12 0.00 -0.04 0.00 0.00 33.50 33.07 1h5p n PRO 679 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1h5p s SER 680 N -4.74 0.03 0.00 3.54 0.15 -1.26 -4.96 113.70 106.45 1h5p s SER 680 Ca 0.60 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1h5p s SER 680 Cb -0.03 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.43 1h5p s SER 680 CO 0.41 -0.17 0.15 0.35 1.20 0.00 0.00 173.24 175.17 1h5p n THR 681 N 2.33 0.00 -2.00 6.45 -2.24 -1.26 -4.94 114.28 112.62 1h5p n THR 681 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1h5p n THR 681 Cb 0.57 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 1h5p n THR 681 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1h5p n ARG 682 N 0.00 0.00 -3.43 -0.78 1.74 -1.26 -5.04 116.66 107.89 1h5p n ARG 682 Ca 0.00 -0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.88 1h5p n ARG 682 Cb 0.31 -0.00 0.06 0.00 -1.02 0.00 0.00 32.46 31.81 1h5p n ARG 682 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1h5p n LYS 683 N 0.00 -2.59 -1.66 5.56 4.01 -1.26 -4.85 118.16 117.37 1h5p n LYS 683 Ca 0.00 0.73 -0.43 0.00 -0.51 0.00 0.00 58.31 58.10 1h5p n LYS 683 Cb 0.34 -5.31 -0.03 0.00 -0.51 0.00 0.00 35.03 29.52 1h5p n LYS 683 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1h5p n LYS 684 N -3.66 2.71 -1.38 1.97 4.01 -1.26 -4.49 118.16 116.05 1h5p n LYS 684 Ca -0.12 0.99 0.00 0.00 -0.51 0.00 0.00 58.31 58.67 1h5p n LYS 684 Cb 0.62 -2.95 0.00 0.00 -0.51 0.00 0.00 35.03 32.19 1h5p n LYS 684 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1h5p n VAL 685 N 5.56 -4.57 -3.86 -0.18 0.31 -1.26 -4.71 118.33 109.61 1h5p n VAL 685 Ca 0.21 1.96 -0.11 0.00 -0.01 0.00 0.00 64.34 66.39 1h5p n VAL 685 Cb 0.39 -2.83 -0.11 0.00 -0.91 0.00 0.00 33.84 30.38 1h5p n VAL 685 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1h5p s THR 686 N -1.73 0.06 -0.20 2.52 -4.23 -1.26 -4.61 115.64 106.19 1h5p s THR 686 Ca 0.00 -0.49 -0.12 0.00 -1.18 0.00 0.00 61.69 59.90 1h5p s THR 686 Cb 0.00 -0.36 0.05 0.00 1.34 0.00 0.00 72.50 73.53 1h5p s THR 686 CO 0.00 -0.27 0.24 -0.38 -0.54 0.00 0.00 174.62 173.67 1h5p n ILE 687 N 1.94-13.01 0.00 2.99 -0.00 -1.26 -5.17 119.36 104.85 1h5p n ILE 687 Ca -0.20 2.76 0.00 0.00 -0.00 0.00 0.00 62.75 65.32 1h5p n ILE 687 Cb 0.57 -6.63 0.00 0.00 -0.00 0.00 0.00 39.64 33.57 1h5p n ILE 687 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84