#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5p n ASP 595 N 0.00 -0.01 0.00 7.83 5.75 -1.26 -5.08 116.55 123.77 1h5p n ASP 595 Ca 0.00 -0.22 -0.00 0.00 -0.01 0.00 0.00 54.79 54.55 1h5p n ASP 595 Cb 0.00 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1h5p n ASP 595 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1h5p n GLU 596 N -0.24 0.02 -0.00 0.11 -0.58 -1.26 -5.00 120.64 113.69 1h5p n GLU 596 Ca 0.00 0.01 -0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1h5p n GLU 596 Cb 0.00 -0.22 -0.00 0.00 -0.57 0.00 0.00 31.44 30.65 1h5p n GLU 596 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1h5p n ASN 597 N -2.62 1.73 -4.25 1.62 2.85 -1.26 -5.04 115.26 108.30 1h5p n ASN 597 Ca -0.00 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.15 1h5p n ASN 597 Cb 0.02 -0.01 -0.16 0.00 1.24 0.00 0.00 39.78 40.86 1h5p n ASN 597 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1h5p s ILE 598 N -2.01 2.28 0.00 -1.44 -1.09 -1.26 -5.10 121.20 112.59 1h5p s ILE 598 Ca -0.00 -0.94 0.00 0.00 -2.23 0.00 0.00 60.65 57.48 1h5p s ILE 598 Cb 0.00 -1.90 0.00 0.00 -1.58 0.00 0.00 42.46 38.99 1h5p s ILE 598 CO 0.01 0.55 0.00 0.59 -1.23 0.00 0.00 174.94 174.86 1h5p n ASN 599 N 3.57 -0.09 0.00 3.58 4.13 -1.26 -4.92 115.26 120.27 1h5p n ASN 599 Ca -0.19 -0.71 0.00 0.00 1.68 0.00 0.00 54.58 55.36 1h5p n ASN 599 Cb 0.53 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.77 1h5p n ASN 599 CO 0.00 0.00 0.00 2.22 0.28 0.00 0.00 177.26 179.76 1h5p n PHE 600 N -1.57 0.00 0.83 3.10 -1.74 -1.26 -4.88 117.46 111.94 1h5p n PHE 600 Ca 0.00 0.00 0.12 0.00 -0.56 0.00 0.00 57.45 57.01 1h5p n PHE 600 Cb 0.00 0.03 0.22 0.00 1.52 0.00 0.00 39.48 41.25 1h5p n PHE 600 CO 0.00 0.00 0.00 1.63 -0.56 0.00 0.00 176.76 177.83 1h5p n LYS 601 N 0.00 2.26 0.00 3.97 4.76 -1.26 -4.21 118.16 123.69 1h5p n LYS 601 Ca 0.00 -1.87 0.09 0.00 -2.87 0.00 0.00 58.31 53.66 1h5p n LYS 601 Cb 0.22 -1.48 0.55 0.00 -1.84 0.00 0.00 35.03 32.48 1h5p n LYS 601 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1h5p n GLN 602 N 1.17 0.78 0.00 1.97 1.13 -1.26 -4.85 117.38 116.32 1h5p n GLN 602 Ca 0.17 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.23 1h5p n GLN 602 Cb 0.55 -1.37 0.00 0.00 0.11 0.00 0.00 30.24 29.53 1h5p n GLN 602 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1h5p n SER 603 N -0.87 0.00 -3.91 1.08 7.64 -1.26 -4.84 113.62 111.46 1h5p n SER 603 Ca 0.14 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.72 1h5p n SER 603 Cb 0.06 -0.04 -0.16 0.00 -1.01 0.00 0.00 64.21 63.07 1h5p n SER 603 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1h5p s GLU 604 N 0.00 1.48 -0.24 1.43 2.02 -1.26 -2.92 118.70 119.21 1h5p s GLU 604 Ca 0.00 -0.83 -0.18 0.00 0.02 0.00 0.00 54.97 53.99 1h5p s GLU 604 Cb 0.00 -2.42 -0.03 0.00 0.10 0.00 0.00 34.13 31.78 1h5p s GLU 604 CO 0.00 -0.57 0.50 -1.17 0.02 0.00 0.00 175.26 174.04 1h5p s LEU 605 N 1.50 4.09 -0.13 1.80 2.96 -0.19 -4.83 118.68 123.87 1h5p s LEU 605 Ca -0.04 0.55 -0.29 0.00 -0.22 0.00 0.00 54.13 54.13 1h5p s LEU 605 Cb -0.18 -2.65 -0.03 0.00 0.50 0.00 0.00 46.19 43.83 1h5p s LEU 605 CO -0.07 -0.24 1.46 -2.16 -1.32 0.00 0.00 176.35 174.03 1h5p s PRO 606 N 2.03 4.15 0.15 0.98 0.04 -1.26 -0.72 135.00 140.37 1h5p s PRO 606 Ca 0.22 1.85 0.09 0.00 0.04 0.00 0.00 61.00 63.19 1h5p s PRO 606 Cb -0.15 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 1h5p s PRO 606 CO 0.09 -0.85 -0.12 0.14 0.04 0.00 0.00 177.00 176.30 1h5p s VAL 607 N 3.95 3.12 -0.28 -0.36 -7.23 -0.50 -1.34 120.40 117.77 1h5p s VAL 607 Ca 0.64 -1.56 -0.02 0.00 -1.81 0.00 0.00 61.98 59.23 1h5p s VAL 607 Cb -0.26 -2.50 0.12 0.00 0.56 0.00 0.00 36.38 34.29 1h5p s VAL 607 CO 0.23 -0.02 0.22 0.42 -0.31 0.00 0.00 175.10 175.64 1h5p s THR 608 N -1.49 -0.27 -0.47 5.32 -4.23 0.50 -0.94 115.64 114.06 1h5p s THR 608 Ca 0.23 -0.52 -0.11 0.00 -1.18 0.00 0.00 61.69 60.10 1h5p s THR 608 Cb -0.10 -0.93 0.10 0.00 1.34 0.00 0.00 72.50 72.92 1h5p s THR 608 CO 0.14 -0.52 0.36 0.00 -0.54 0.00 0.00 174.62 174.06 1h5p n GLY 610 N 5.02 -0.39 3.44 0.00 0.00 -1.18 -1.06 105.19 111.03 1h5p n GLY 610 Ca -0.10 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1h5p n GLY 610 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1h5p n GLU 611 N -4.30 0.00 -2.63 1.61 2.13 -1.26 -4.90 120.64 111.28 1h5p n GLU 611 Ca -0.18 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.21 1h5p n GLU 611 Cb 0.63 -2.83 0.00 0.00 0.27 0.00 0.00 31.44 29.51 1h5p n GLU 611 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1h5p n VAL 612 N -2.00 4.09 -0.63 6.31 0.31 -0.22 -4.99 118.33 121.19 1h5p n VAL 612 Ca 0.00 -4.32 -0.31 0.00 -0.01 0.00 0.00 64.34 59.70 1h5p n VAL 612 Cb 0.00 -2.43 0.19 0.00 -0.91 0.00 0.00 33.84 30.69 1h5p n VAL 612 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1h5p n LYS 613 N 6.41 -1.55 -3.63 5.55 4.81 -1.26 -2.34 118.16 126.15 1h5p n LYS 613 Ca 0.43 -0.42 -0.03 0.00 -0.87 0.00 0.00 58.31 57.42 1h5p n LYS 613 Cb 0.43 -1.93 -0.03 0.00 0.02 0.00 0.00 35.03 33.52 1h5p n LYS 613 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1h5p s GLY 614 N -2.11 -0.14 -0.30 3.14 0.00 -0.12 -4.77 107.32 103.01 1h5p s GLY 614 Ca 0.61 2.09 -0.13 0.00 0.00 0.00 0.00 44.72 47.29 1h5p s GLY 614 CO 0.65 0.74 0.28 -0.51 0.00 0.00 0.00 173.10 174.26 1h5p s THR 615 N -1.84 5.25 -0.13 0.90 -4.23 -0.83 -1.41 115.64 113.35 1h5p s THR 615 Ca 0.10 0.16 -0.19 0.00 -1.18 0.00 0.00 61.69 60.57 1h5p s THR 615 Cb -0.01 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 1h5p s THR 615 CO -0.04 0.11 0.54 -0.22 -0.54 0.00 0.00 174.62 174.47 1h5p s LEU 616 N 1.87 4.25 -0.16 4.79 0.20 0.10 -0.42 118.68 129.31 1h5p s LEU 616 Ca 0.10 0.87 -0.17 0.00 0.69 0.00 0.00 54.13 55.62 1h5p s LEU 616 Cb -0.16 -2.79 -0.04 0.00 -0.43 0.00 0.00 46.19 42.77 1h5p s LEU 616 CO 0.11 -0.07 0.43 -0.31 -0.29 0.00 0.00 176.35 176.21 1h5p s TYR 617 N 0.92 3.44 0.29 5.38 1.51 0.76 -1.02 117.35 128.63 1h5p s TYR 617 Ca 0.28 0.74 0.03 0.00 -1.01 0.00 0.00 57.07 57.11 1h5p s TYR 617 Cb -0.16 -2.52 0.45 0.00 -0.11 0.00 0.00 41.96 39.62 1h5p s TYR 617 CO 0.12 0.09 1.74 0.87 -1.11 0.00 0.00 175.55 177.26 1h5p h LYS 618 N 7.00 0.45 -0.00 -0.62 6.56 -1.88 0.92 116.57 129.00 1h5p h LYS 618 Ca -0.39 -0.16 0.00 0.00 -1.06 0.00 0.00 60.65 59.04 1h5p h LYS 618 Cb 1.17 -0.03 -0.00 0.00 -0.57 0.00 0.00 32.23 32.80 1h5p h LYS 618 CO 0.74 0.66 0.21 0.93 -2.06 0.00 0.00 179.45 179.93 1h5p h GLU 619 N 0.40 0.00 0.00 3.15 5.08 -1.93 -1.71 114.58 119.57 1h5p h GLU 619 Ca 0.06 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1h5p h GLU 619 Cb 0.64 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1h5p h GLU 619 CO 0.05 0.00 -1.22 0.54 -1.00 0.00 0.00 179.01 177.38 1h5p n ARG 620 N -2.98 1.37 0.23 2.33 3.00 -1.01 -4.59 116.66 115.01 1h5p n ARG 620 Ca -0.02 -0.02 0.17 0.00 -0.01 0.00 0.00 57.85 57.96 1h5p n ARG 620 Cb 0.26 -1.10 0.85 0.00 0.00 0.00 0.00 32.46 32.48 1h5p n ARG 620 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 1h5p h PHE 621 N 0.00 0.00 0.00 -1.55 3.57 0.12 -0.31 116.94 118.78 1h5p h PHE 621 Ca -0.04 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.46 1h5p h PHE 621 Cb 0.59 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1h5p h PHE 621 CO 0.00 0.00 0.02 0.36 -2.23 0.00 0.00 178.31 176.46 1h5p n LYS 622 N -3.78 0.12 -0.00 1.11 2.85 -1.12 -1.00 118.16 116.33 1h5p n LYS 622 Ca 0.01 0.61 0.03 0.00 -1.05 0.00 0.00 58.31 57.90 1h5p n LYS 622 Cb 0.27 -1.90 -0.04 0.00 -0.65 0.00 0.00 35.03 32.72 1h5p n LYS 622 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1h5p n GLN 623 N -2.13 2.34 0.00 -1.58 1.13 -0.14 -4.91 117.38 112.09 1h5p n GLN 623 Ca -0.01 -0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.02 1h5p n GLN 623 Cb 0.04 -0.97 0.00 0.00 0.11 0.00 0.00 30.24 29.42 1h5p n GLN 623 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1h5p n GLY 624 N 1.72 3.80 0.00 1.08 0.00 -0.17 -1.86 105.19 109.77 1h5p n GLY 624 Ca -0.00 -0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 1.83 1.35 2.61 5.66 -1.26 -1.14 114.28 123.33 1h5p n THR 625 Ca 0.00 0.47 0.13 0.00 -3.05 0.00 0.00 64.05 61.59 1h5p n THR 625 Cb 0.00 -1.43 0.45 0.00 -1.55 0.00 0.00 70.33 67.80 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 -1.51 1.66 -3.65 1.09 2.88 -0.78 -4.74 113.62 108.57 1h5p n SER 626 Ca 0.01 -1.61 -0.07 0.00 -1.33 0.00 0.00 58.87 55.87 1h5p n SER 626 Cb 0.03 -0.05 -0.07 0.00 -0.75 0.00 0.00 64.21 63.37 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 -1.91 0.63 0.32 -1.46 -0.14 -0.29 -5.00 119.74 111.89 1h5p s LYS 627 Ca 0.36 1.18 -0.29 0.00 -1.36 0.00 0.00 55.97 55.86 1h5p s LYS 627 Cb 0.20 0.21 -0.10 0.00 -1.68 0.00 0.00 37.83 36.46 1h5p s LYS 627 CO 0.31 -0.16 1.22 -1.59 -0.76 0.00 0.00 175.35 174.36 1h5p s LYS 628 N 1.78 4.44 0.00 1.68 0.00 -1.26 -4.51 119.74 121.87 1h5p s LYS 628 Ca -0.09 2.03 0.00 0.00 0.00 0.00 0.00 55.97 57.91 1h5p s LYS 628 Cb -0.07 -3.09 0.00 0.00 0.00 0.00 0.00 37.83 34.68 1h5p s LYS 628 CO -0.19 -0.04 0.05 0.00 0.00 0.00 0.00 175.35 175.18 1h5p s ILE 630 N 0.00 5.05 -0.36 0.00 1.09 -1.07 -0.17 121.20 125.73 1h5p s ILE 630 Ca 0.00 0.01 -0.18 0.00 -1.10 0.00 0.00 60.65 59.38 1h5p s ILE 630 Cb 0.00 -3.99 0.00 0.00 -1.06 0.00 0.00 42.46 37.41 1h5p s ILE 630 CO 0.00 -0.31 0.49 -1.58 -0.10 0.00 0.00 174.94 173.44 1h5p s GLN 631 N 2.28 3.52 0.31 2.79 0.74 0.43 -0.60 119.66 129.14 1h5p s GLN 631 Ca 0.15 -0.28 0.05 0.00 0.05 0.00 0.00 55.36 55.33 1h5p s GLN 631 Cb -0.16 -3.84 -0.06 0.00 1.10 0.00 0.00 33.01 30.05 1h5p s GLN 631 CO 0.14 -0.68 0.02 0.45 -0.55 0.00 0.00 175.29 174.66 1h5p s SER 632 N 1.78 2.59 0.00 6.67 0.15 -0.09 -1.97 113.70 122.83 1h5p s SER 632 Ca 0.17 -1.31 0.00 0.00 0.70 0.00 0.00 55.95 55.51 1h5p s SER 632 Cb -0.16 -0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 1h5p s SER 632 CO 0.14 -0.51 0.00 -0.62 1.20 0.00 0.00 173.24 173.44 1h5p n GLU 633 N -0.67 0.00 0.00 5.44 1.02 -1.26 -1.80 120.64 123.37 1h5p n GLU 633 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1h5p n GLU 633 Cb 0.66 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.08 1h5p n GLU 633 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1h5p n ASP 634 N 2.30 0.00 -0.14 1.62 2.03 -1.26 -4.98 116.55 116.13 1h5p n ASP 634 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1h5p n ASP 634 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1h5p n ASP 634 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1h5p n LYS 635 N 0.00 0.00 -3.49 -0.67 3.00 -1.15 -5.11 118.16 110.75 1h5p n LYS 635 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.89 1h5p n LYS 635 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 34.93 1h5p n LYS 635 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1h5p s LYS 636 N 0.00 3.19 0.01 1.64 -0.14 -0.75 -4.92 119.74 118.77 1h5p s LYS 636 Ca 0.00 -0.85 -0.19 0.00 -1.36 0.00 0.00 55.97 53.56 1h5p s LYS 636 Cb 0.00 -3.91 -0.06 0.00 -1.68 0.00 0.00 37.83 32.19 1h5p s LYS 636 CO 0.00 -0.62 0.55 -1.58 -0.76 0.00 0.00 175.35 172.94 1h5p s TRP 637 N 1.71 3.71 0.17 3.18 0.52 -1.25 -0.91 118.94 126.07 1h5p s TRP 637 Ca 0.06 1.16 0.05 0.00 0.02 0.00 0.00 56.10 57.39 1h5p s TRP 637 Cb -0.18 -2.53 -0.05 0.00 -1.15 0.00 0.00 33.47 29.57 1h5p s TRP 637 CO 0.10 0.44 -0.10 -0.06 0.02 0.00 0.00 176.95 177.36 1h5p s PHE 638 N -0.51 1.40 0.30 -1.98 0.40 0.23 -4.93 117.98 112.89 1h5p s PHE 638 Ca 0.29 -0.74 -0.02 0.00 -0.60 0.00 0.00 56.93 55.86 1h5p s PHE 638 Cb -0.18 -0.71 -0.04 0.00 0.51 0.00 0.00 43.02 42.60 1h5p s PHE 638 CO 0.17 0.12 0.53 0.95 0.70 0.00 0.00 175.22 177.69 1h5p s THR 639 N -3.26 5.08 0.65 0.64 -4.23 -1.26 -2.59 115.64 110.66 1h5p s THR 639 Ca 0.19 -0.20 0.19 0.00 -1.18 0.00 0.00 61.69 60.69 1h5p s THR 639 Cb 0.02 -3.78 0.21 0.00 1.34 0.00 0.00 72.50 70.29 1h5p s THR 639 CO 0.03 -0.40 1.53 -0.65 -0.54 0.00 0.00 174.62 174.59 1h5p h PRO 640 N 1.35 0.00 0.00 3.99 0.11 -1.85 0.28 132.00 135.88 1h5p h PRO 640 Ca -0.48 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.39 1h5p h PRO 640 Cb 1.20 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1h5p h PRO 640 CO 0.65 0.00 -1.32 -2.13 -0.21 0.00 0.00 178.00 174.98 1h5p n ARG 641 N -2.88 0.56 0.27 1.05 0.63 -1.26 -3.28 116.66 111.76 1h5p n ARG 641 Ca 0.02 0.56 0.15 0.00 -0.92 0.00 0.00 57.85 57.66 1h5p n ARG 641 Cb 0.75 -1.73 0.76 0.00 0.45 0.00 0.00 32.46 32.69 1h5p n ARG 641 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1h5p h GLU 642 N -1.00 0.00 0.11 -0.14 4.81 -1.45 -2.10 114.58 114.81 1h5p h GLU 642 Ca -0.36 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.60 1h5p h GLU 642 Cb 1.31 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.70 1h5p h GLU 642 CO -0.22 0.09 -1.19 0.35 -0.73 0.00 0.00 179.01 177.31 1h5p h PHE 643 N 0.00 0.59 -0.45 0.92 3.57 -0.70 -3.16 116.94 117.71 1h5p h PHE 643 Ca -0.00 -0.40 -0.06 0.00 3.53 0.00 0.00 57.97 61.04 1h5p h PHE 643 Cb 0.36 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1h5p h PHE 643 CO 0.00 1.28 0.03 1.49 -2.23 0.00 0.00 178.31 178.88 1h5p h GLU 644 N 0.13 0.71 -0.80 1.11 4.22 -1.37 0.38 114.58 118.95 1h5p h GLU 644 Ca -0.14 -0.17 -0.05 0.00 0.08 0.00 0.00 59.36 59.09 1h5p h GLU 644 Cb 1.89 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 31.01 1h5p h GLU 644 CO 0.20 0.71 0.31 0.82 -2.18 0.00 0.00 179.01 178.87 1h5p h ILE 645 N 0.67 1.26 0.00 2.32 2.04 -1.49 0.15 117.51 122.47 1h5p h ILE 645 Ca 0.14 -0.84 -0.21 0.00 1.00 0.00 0.00 64.86 64.96 1h5p h ILE 645 Cb 0.38 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1h5p h ILE 645 CO 0.01 0.34 -1.19 -0.08 0.00 0.00 0.00 178.15 177.23 1h5p h GLU 646 N 1.17 0.00 -0.02 2.37 4.81 -1.43 -2.60 114.58 118.88 1h5p h GLU 646 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1h5p h GLU 646 Cb 0.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1h5p h GLU 646 CO -0.02 0.62 -0.03 0.41 -0.73 0.00 0.00 179.01 179.26 1h5p n GLY 647 N 1.39 0.05 0.35 1.92 0.00 0.13 -4.79 105.19 104.25 1h5p n GLY 647 Ca -0.06 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 0.22 0.00 0.00 1.61 2.03 0.51 -3.13 116.55 117.80 1h5p n ASP 648 Ca 0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.49 1h5p n ASP 648 Cb 0.38 0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.81 1h5p n ASP 648 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1h5p n ARG 649 N -1.27 0.00 0.00 -0.67 3.00 -0.98 -5.00 116.66 111.75 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 -1.15 1.24 0.19 5.14 0.00 -1.26 -4.70 105.19 104.66 1h5p n GLY 650 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1h5p n GLY 650 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h5p h ALA 651 N 0.00 1.00 -0.90 4.61 0.00 -1.95 -3.39 119.26 118.63 1h5p h ALA 651 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 1h5p h ALA 651 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.71 1h5p h ALA 651 CO 0.00 0.00 1.75 -1.12 0.00 0.00 0.00 179.25 179.88 1h5p s SER 652 N -4.92 6.43 0.52 0.00 0.01 -1.26 -4.79 113.70 109.69 1h5p s SER 652 Ca 0.04 -1.90 0.21 0.00 1.31 0.00 0.00 55.95 55.61 1h5p s SER 652 Cb 0.09 -2.58 1.33 0.00 0.21 0.00 0.00 66.02 65.08 1h5p s SER 652 CO 0.49 -1.59 2.06 0.50 0.41 0.00 0.00 173.24 175.11 1h5p h LYS 653 N 8.81 0.01 -5.71 12.44 3.64 -2.02 -3.33 116.57 130.42 1h5p h LYS 653 Ca 0.32 -0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 59.18 1h5p h LYS 653 Cb 0.93 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.69 1h5p h LYS 653 CO 1.41 0.01 1.64 -0.80 -2.27 0.00 0.00 179.45 179.44 1h5p s ASN 654 N -6.60 6.02 0.51 4.20 -0.87 -1.26 -4.72 114.94 112.22 1h5p s ASN 654 Ca -0.05 -2.00 0.29 0.00 -1.57 0.00 0.00 52.86 49.54 1h5p s ASN 654 Cb 0.18 -2.58 1.27 0.00 -0.02 0.00 0.00 41.25 40.10 1h5p s ASN 654 CO 0.70 -2.03 1.96 4.11 -2.57 0.00 0.00 177.10 179.28 1h5p h TRP 655 N 8.74 0.00 0.00 2.20 5.08 -1.86 -0.11 115.95 130.00 1h5p h TRP 655 Ca 0.33 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.30 1h5p h TRP 655 Cb 0.91 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.07 1h5p h TRP 655 CO 1.32 0.11 0.00 1.57 -1.28 0.00 0.00 178.44 180.16 1h5p h LYS 656 N 0.00 0.00 0.00 0.12 2.10 -1.88 -3.04 116.57 113.88 1h5p h LYS 656 Ca -0.00 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.43 1h5p h LYS 656 Cb 0.54 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.83 1h5p h LYS 656 CO 0.01 0.00 -2.07 1.28 -2.00 0.00 0.00 179.45 176.68 1h5p n LEU 657 N -2.87 0.00 0.12 7.07 4.77 -0.88 -1.19 117.00 124.03 1h5p n LEU 657 Ca 0.04 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.99 1h5p n LEU 657 Cb 0.47 0.30 0.14 0.00 -2.33 0.00 0.00 43.42 42.00 1h5p n LEU 657 CO 0.32 0.30 0.46 0.77 -1.33 0.00 0.00 177.39 177.91 1h5p h SER 658 N 0.00 0.06 -3.34 -1.43 4.64 -1.09 -3.44 113.55 108.96 1h5p h SER 658 Ca -0.33 -0.04 -0.68 0.00 -0.47 0.00 0.00 61.79 60.27 1h5p h SER 658 Cb 1.70 -0.02 -0.15 0.00 -0.31 0.00 0.00 62.40 63.62 1h5p h SER 658 CO 0.02 0.69 -0.63 -0.63 -0.87 0.00 0.00 176.83 175.41 1h5p s ILE 659 N -3.57 4.27 0.38 0.95 1.01 -1.15 -3.99 121.20 119.10 1h5p s ILE 659 Ca -0.02 -0.26 0.08 0.00 0.00 0.00 0.00 60.65 60.45 1h5p s ILE 659 Cb 0.12 -2.79 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 1h5p s ILE 659 CO 0.78 0.60 0.27 -0.13 0.00 0.00 0.00 174.94 176.46 1h5p s ARG 660 N -0.84 2.48 -0.32 2.79 0.52 -0.22 -3.15 118.95 120.20 1h5p s ARG 660 Ca 0.13 -1.54 -0.02 0.00 -0.52 0.00 0.00 55.73 53.77 1h5p s ARG 660 Cb -0.11 -2.28 0.11 0.00 0.52 0.00 0.00 34.95 33.19 1h5p s ARG 660 CO 0.02 -0.05 0.15 0.00 0.02 0.00 0.00 175.30 175.45 1h5p n GLY 662 N 4.78 0.34 0.00 0.00 0.00 -0.45 -2.65 105.19 107.21 1h5p n GLY 662 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.42 1.34 3.85 -0.02 0.00 -1.26 -4.84 105.19 104.68 1h5p n GLY 663 Ca -0.04 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 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 3.67 1.04 1.61 2.02 -1.08 -4.98 117.35 119.63 1h5p s TYR 664 Ca 0.00 0.81 -0.14 0.00 -0.37 0.00 0.00 57.07 57.36 1h5p s TYR 664 Cb 0.00 -2.15 0.21 0.00 -0.40 0.00 0.00 41.96 39.62 1h5p s TYR 664 CO 0.00 0.68 1.12 0.95 -1.57 0.00 0.00 175.55 176.72 1h5p s THR 665 N -1.03 1.89 0.51 -0.71 -4.23 -1.26 -0.16 115.64 110.64 1h5p s THR 665 Ca 0.20 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 60.86 1h5p s THR 665 Cb -0.15 -2.56 0.27 0.00 1.34 0.00 0.00 72.50 71.40 1h5p s THR 665 CO 0.10 0.00 2.14 -0.07 -0.54 0.00 0.00 174.62 176.24 1h5p h LEU 666 N -2.01 0.06 -1.00 4.79 -0.00 -1.34 0.16 115.31 115.98 1h5p h LEU 666 Ca -0.51 -0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.40 1h5p h LEU 666 Cb 1.32 -0.02 -0.06 0.00 -0.00 0.00 0.00 40.66 41.91 1h5p h LEU 666 CO 0.51 0.04 0.65 0.50 -0.00 0.00 0.00 178.44 180.15 1h5p h LYS 667 N 0.07 1.23 0.12 1.13 3.64 -1.46 0.11 116.57 121.42 1h5p h LYS 667 Ca 0.02 -0.07 -0.30 0.00 -1.27 0.00 0.00 60.65 59.03 1h5p h LYS 667 Cb 0.01 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.54 1h5p h LYS 667 CO -0.00 0.82 -1.48 0.28 -2.27 0.00 0.00 179.45 176.79 1h5p h VAL 668 N 1.27 1.21 0.00 2.00 2.07 -1.46 -2.92 116.25 118.42 1h5p h VAL 668 Ca 0.39 -2.84 -0.03 0.00 0.82 0.00 0.00 66.70 65.04 1h5p h VAL 668 Cb -0.02 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1h5p h VAL 668 CO -0.12 0.83 -0.16 -0.07 0.02 0.00 0.00 177.57 178.07 1h5p h LEU 669 N 0.07 0.00 0.00 2.57 4.07 -0.31 0.34 115.31 122.05 1h5p h LEU 669 Ca -0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.74 1h5p h LEU 669 Cb 2.01 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.75 1h5p h LEU 669 CO 0.17 0.16 -0.56 1.15 -1.08 0.00 0.00 178.44 178.28 1h5p n MET 670 N -4.34 0.20 0.05 1.13 0.00 0.34 -1.84 117.12 112.66 1h5p n MET 670 Ca -0.03 0.06 0.06 0.00 0.00 0.00 0.00 57.70 57.79 1h5p n MET 670 Cb 0.23 -1.63 -0.07 0.00 0.00 0.00 0.00 33.22 31.76 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 -1.91 0.62 0.00 3.17 2.13 -0.10 -4.62 120.64 119.94 1h5p n GLU 671 Ca 0.04 0.10 0.00 0.00 0.66 0.00 0.00 57.16 57.96 1h5p n GLU 671 Cb 0.41 -1.75 0.00 0.00 0.27 0.00 0.00 31.44 30.36 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 -2.69 0.00 0.00 4.31 3.02 0.99 -4.94 115.26 115.95 1h5p n ASN 672 Ca -0.06 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1h5p n ASN 672 Cb 0.69 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 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 -1.06 0.00 -0.00 3.52 2.85 -1.22 -5.01 118.16 117.23 1h5p n LYS 673 Ca 0.00 0.00 0.04 0.00 -1.05 0.00 0.00 58.31 57.30 1h5p n LYS 673 Cb 0.00 0.00 -0.06 0.00 -0.65 0.00 0.00 35.03 34.32 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 0.00 -4.52 5.58 3.72 -0.76 -4.99 117.46 116.49 1h5p n PHE 674 Ca 0.00 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.06 1h5p n PHE 674 Cb 0.00 -0.15 -0.11 0.00 -0.94 0.00 0.00 39.48 38.27 1h5p n PHE 674 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1h5p s LEU 675 N -3.35 3.24 0.44 4.37 0.20 -0.95 -4.96 118.68 117.66 1h5p s LEU 675 Ca -0.02 -0.05 0.30 0.00 0.69 0.00 0.00 54.13 55.05 1h5p s LEU 675 Cb 0.05 -1.74 1.57 0.00 -0.43 0.00 0.00 46.19 45.65 1h5p s LEU 675 CO 0.33 0.28 1.92 -0.65 -0.29 0.00 0.00 176.35 177.94 1h5p h PRO 676 N 5.84 0.00 -5.80 0.98 0.11 -1.91 -3.43 132.00 127.79 1h5p h PRO 676 Ca -0.41 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.10 1h5p h PRO 676 Cb 1.18 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1h5p h PRO 676 CO 0.57 0.00 1.52 0.39 -0.21 0.00 0.00 178.00 180.26 1h5p n GLU 677 N -2.57 1.12 -0.01 1.05 1.02 -1.26 -4.87 120.64 115.12 1h5p n GLU 677 Ca -0.01 0.24 -0.10 0.00 -0.02 0.00 0.00 57.16 57.27 1h5p n GLU 677 Cb 0.08 -2.72 -0.04 0.00 -0.02 0.00 0.00 31.44 28.74 1h5p n GLU 677 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1h5p h PRO 678 N 14.44 -0.00 -6.31 3.49 0.11 -1.90 -3.42 132.00 138.40 1h5p h PRO 678 Ca -0.27 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.29 1h5p h PRO 678 Cb 1.29 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 1h5p h PRO 678 CO 1.08 -0.00 0.58 -2.14 -0.21 0.00 0.00 178.00 177.31 1h5p s PRO 679 N -6.20 4.42 -0.31 1.05 0.02 -1.26 -4.97 135.00 127.76 1h5p s PRO 679 Ca -0.13 1.51 -0.13 0.00 0.02 0.00 0.00 61.00 62.27 1h5p s PRO 679 Cb 0.09 -3.52 0.19 0.00 0.02 0.00 0.00 34.50 31.27 1h5p s PRO 679 CO 0.68 -0.32 1.11 0.45 -0.33 0.00 0.00 177.00 178.59 1h5p s SER 680 N 1.21 -0.19 0.45 2.53 0.15 -1.26 -4.91 113.70 111.67 1h5p s SER 680 Ca 0.52 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 57.13 1h5p s SER 680 Cb -0.21 0.66 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 1h5p s SER 680 CO 0.21 -0.03 0.00 0.35 1.20 0.00 0.00 173.24 174.97 1h5p n THR 681 N 4.30 0.00 -3.48 6.45 -2.24 -1.26 -4.70 114.28 113.36 1h5p n THR 681 Ca 0.07 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.60 1h5p n THR 681 Cb 0.61 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.87 1h5p n THR 681 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1h5p n ARG 682 N -3.40 -5.22 0.00 -0.78 0.63 -1.26 -4.66 116.66 101.97 1h5p n ARG 682 Ca 0.00 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.63 1h5p n ARG 682 Cb 0.00 -5.56 0.00 0.00 0.45 0.00 0.00 32.46 27.35 1h5p n ARG 682 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1h5p n LYS 683 N -4.32 0.00 -3.08 -0.14 4.76 -1.26 -3.82 118.16 110.29 1h5p n LYS 683 Ca -0.02 0.00 -0.44 0.00 -2.87 0.00 0.00 58.31 54.98 1h5p n LYS 683 Cb 0.56 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.75 1h5p n LYS 683 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1h5p s LYS 684 N 0.00 4.06 0.00 1.97 1.02 -1.26 -4.51 119.74 121.02 1h5p s LYS 684 Ca 0.00 -2.70 0.00 0.00 0.02 0.00 0.00 55.97 53.29 1h5p s LYS 684 Cb 0.00 -4.86 0.00 0.00 -0.52 0.00 0.00 37.83 32.45 1h5p s LYS 684 CO 0.00 -1.58 0.00 0.28 -0.92 0.00 0.00 175.35 173.13 1h5p n VAL 685 N 4.07 0.00 -2.44 3.17 0.31 -1.25 -5.01 118.33 117.18 1h5p n VAL 685 Ca 0.31 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.21 1h5p n VAL 685 Cb 0.42 -0.52 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 1h5p n VAL 685 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1h5p s THR 686 N -1.68 3.97 -0.10 2.52 2.01 -1.26 -4.89 115.64 116.22 1h5p s THR 686 Ca 0.00 0.96 -0.07 0.00 0.31 0.00 0.00 61.69 62.88 1h5p s THR 686 Cb 0.00 -4.39 -0.02 0.00 0.01 0.00 0.00 72.50 68.09 1h5p s THR 686 CO 0.00 -0.94 -0.14 -0.38 -0.69 0.00 0.00 174.62 172.46 1h5p n ILE 687 N 6.96 0.97 -0.06 1.82 -0.00 -1.26 -5.16 119.36 122.62 1h5p n ILE 687 Ca 0.14 0.30 0.00 0.00 -0.00 0.00 0.00 62.75 63.19 1h5p n ILE 687 Cb 0.49 -2.10 0.00 0.00 -0.00 0.00 0.00 39.64 38.03 1h5p n ILE 687 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84