#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 -8.59 0.00 7.83 8.00 -1.26 -4.92 116.55 117.61 1h5p n ASP 595 Ca 0.00 0.82 0.00 0.00 0.71 0.00 0.00 54.79 56.32 1h5p n ASP 595 Cb 0.00 -4.53 0.00 0.00 -0.02 0.00 0.00 41.12 36.57 1h5p n ASP 595 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1h5p n GLU 596 N -4.25 0.50 0.00 -1.24 -0.58 -1.26 -5.04 120.64 108.77 1h5p n GLU 596 Ca -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1h5p n GLU 596 Cb 0.68 -0.75 0.00 0.00 -0.57 0.00 0.00 31.44 30.79 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 -1.83 0.00 -4.39 1.62 2.85 -1.26 -5.07 115.26 107.18 1h5p n ASN 597 Ca 0.00 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 54.03 1h5p n ASN 597 Cb 0.25 0.35 -0.05 0.00 1.24 0.00 0.00 39.78 41.57 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 -1.94 4.83 -0.26 -1.44 -1.09 -1.26 -5.01 121.20 115.03 1h5p s ILE 598 Ca 0.00 -0.90 -0.28 0.00 -2.23 0.00 0.00 60.65 57.24 1h5p s ILE 598 Cb 0.00 -4.45 -0.05 0.00 -1.58 0.00 0.00 42.46 36.38 1h5p s ILE 598 CO 0.00 -1.07 2.16 0.20 -1.23 0.00 0.00 174.94 175.00 1h5p s ASN 599 N 3.46 5.44 0.00 3.58 0.01 -1.26 -4.81 114.94 121.36 1h5p s ASN 599 Ca 0.12 1.71 0.30 0.00 -0.71 0.00 0.00 52.86 54.28 1h5p s ASN 599 Cb -0.23 -2.51 1.43 0.00 0.41 0.00 0.00 41.25 40.34 1h5p s ASN 599 CO 0.07 -2.00 1.96 2.22 -1.51 0.00 0.00 177.10 177.85 1h5p n PHE 600 N 11.80 0.00 1.82 2.20 -1.74 -1.26 -3.58 117.46 126.70 1h5p n PHE 600 Ca 0.29 0.00 0.13 0.00 -0.56 0.00 0.00 57.45 57.31 1h5p n PHE 600 Cb 0.46 -0.06 0.74 0.00 1.52 0.00 0.00 39.48 42.15 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 -0.62 0.91 -2.99 3.97 4.76 -1.26 -4.82 118.16 118.12 1h5p n LYS 601 Ca 0.19 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.33 1h5p n LYS 601 Cb 0.24 -1.43 -0.03 0.00 -1.84 0.00 0.00 35.03 31.97 1h5p n LYS 601 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1h5p s GLN 602 N -2.00 3.76 0.32 1.97 -1.52 -1.24 -4.97 119.66 115.98 1h5p s GLN 602 Ca 0.38 0.38 0.26 0.00 -1.95 0.00 0.00 55.36 54.42 1h5p s GLN 602 Cb 0.17 -2.45 1.03 0.00 -0.22 0.00 0.00 33.01 31.54 1h5p s GLN 602 CO 0.29 0.04 1.77 0.77 -0.25 0.00 0.00 175.29 177.91 1h5p h SER 603 N 1.44 0.00 -3.28 5.90 0.02 -1.94 -3.42 113.55 112.27 1h5p h SER 603 Ca -0.47 0.00 -0.39 0.00 -0.84 0.00 0.00 61.79 60.08 1h5p h SER 603 Cb 1.19 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 63.34 1h5p h SER 603 CO 0.64 0.00 -0.75 -1.61 -1.14 0.00 0.00 176.83 173.98 1h5p s GLU 604 N -3.37 0.10 -0.13 3.45 2.02 -1.26 -1.39 118.70 118.12 1h5p s GLU 604 Ca 0.04 0.27 -0.04 0.00 0.02 0.00 0.00 54.97 55.26 1h5p s GLU 604 Cb 0.09 -0.74 -0.04 0.00 0.10 0.00 0.00 34.13 33.55 1h5p s GLU 604 CO 0.45 -0.35 0.03 -1.17 0.02 0.00 0.00 175.26 174.24 1h5p s LEU 605 N 2.12 3.70 0.26 1.80 2.96 0.35 -4.90 118.68 124.97 1h5p s LEU 605 Ca 0.05 0.12 -0.30 0.00 -0.22 0.00 0.00 54.13 53.78 1h5p s LEU 605 Cb -0.12 -1.89 -0.09 0.00 0.50 0.00 0.00 46.19 44.59 1h5p s LEU 605 CO -0.04 0.29 1.05 -2.16 -1.32 0.00 0.00 176.35 174.17 1h5p s PRO 606 N -0.33 4.71 0.06 0.98 0.04 -1.26 -0.37 135.00 138.82 1h5p s PRO 606 Ca 0.08 1.70 0.03 0.00 0.04 0.00 0.00 61.00 62.84 1h5p s PRO 606 Cb -0.12 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 1h5p s PRO 606 CO 0.02 0.30 -0.09 0.14 0.04 0.00 0.00 177.00 177.41 1h5p s VAL 607 N -1.10 0.70 -0.24 -0.36 -7.23 -0.77 -1.51 120.40 109.89 1h5p s VAL 607 Ca 0.44 -1.28 -0.03 0.00 -1.81 0.00 0.00 61.98 59.30 1h5p s VAL 607 Cb -0.30 -0.89 0.10 0.00 0.56 0.00 0.00 36.38 35.85 1h5p s VAL 607 CO 0.38 -0.43 0.21 0.42 -0.31 0.00 0.00 175.10 175.37 1h5p s THR 608 N -1.74 -0.27 -0.43 5.32 -4.23 -0.02 -1.00 115.64 113.26 1h5p s THR 608 Ca -0.04 -0.37 -0.09 0.00 -1.18 0.00 0.00 61.69 60.00 1h5p s THR 608 Cb -0.07 -0.83 0.09 0.00 1.34 0.00 0.00 72.50 73.03 1h5p s THR 608 CO 0.00 -0.40 0.29 0.00 -0.54 0.00 0.00 174.62 173.96 1h5p n GLY 610 N 4.92 -1.00 3.79 0.00 0.00 -1.24 -1.33 105.19 110.34 1h5p n GLY 610 Ca -0.10 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -3.62 0.00 -3.12 1.61 1.02 -1.26 -4.82 120.64 110.44 1h5p n GLU 611 Ca -0.11 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.58 1h5p n GLU 611 Cb 0.62 -3.57 -0.03 0.00 -0.02 0.00 0.00 31.44 28.43 1h5p n GLU 611 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1h5p s VAL 612 N -2.02 5.01 0.61 2.62 1.01 -0.44 -5.04 120.40 122.15 1h5p s VAL 612 Ca 0.00 -1.55 -0.13 0.00 0.00 0.00 0.00 61.98 60.31 1h5p s VAL 612 Cb 0.00 -4.56 -0.04 0.00 0.00 0.00 0.00 36.38 31.78 1h5p s VAL 612 CO 0.00 -1.20 1.03 -0.75 0.00 0.00 0.00 175.10 174.18 1h5p s LYS 613 N 2.00 3.48 0.11 2.72 2.20 -1.26 -0.58 119.74 128.41 1h5p s LYS 613 Ca 0.19 0.91 -0.26 0.00 -0.36 0.00 0.00 55.97 56.44 1h5p s LYS 613 Cb -0.15 -2.06 0.08 0.00 -1.51 0.00 0.00 37.83 34.18 1h5p s LYS 613 CO -0.02 -0.66 0.88 0.20 -0.36 0.00 0.00 175.35 175.39 1h5p s GLY 614 N -3.65 -0.35 -0.29 5.54 0.00 -0.18 -4.76 107.32 103.64 1h5p s GLY 614 Ca 0.58 0.46 -0.09 0.00 0.00 0.00 0.00 44.72 45.66 1h5p s GLY 614 CO 0.47 0.13 0.13 -1.59 0.00 0.00 0.00 173.10 172.24 1h5p s THR 615 N -3.32 4.59 -0.12 0.90 2.01 -0.94 -1.84 115.64 116.93 1h5p s THR 615 Ca 0.08 -0.26 -0.20 0.00 0.31 0.00 0.00 61.69 61.62 1h5p s THR 615 Cb -0.02 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 1h5p s THR 615 CO -0.03 0.18 0.58 -0.22 -0.69 0.00 0.00 174.62 174.44 1h5p s LEU 616 N 1.63 4.25 -0.19 4.42 0.20 0.50 -1.25 118.68 128.25 1h5p s LEU 616 Ca 0.05 0.93 -0.19 0.00 0.69 0.00 0.00 54.13 55.62 1h5p s LEU 616 Cb -0.16 -2.86 -0.03 0.00 -0.43 0.00 0.00 46.19 42.71 1h5p s LEU 616 CO 0.06 -0.10 0.53 -0.31 -0.29 0.00 0.00 176.35 176.23 1h5p s TYR 617 N 1.00 3.38 0.31 5.38 1.51 0.67 -0.49 117.35 129.11 1h5p s TYR 617 Ca 0.30 0.79 0.05 0.00 -1.01 0.00 0.00 57.07 57.20 1h5p s TYR 617 Cb -0.16 -2.68 0.50 0.00 -0.11 0.00 0.00 41.96 39.52 1h5p s TYR 617 CO 0.13 -0.09 1.76 -0.22 -1.11 0.00 0.00 175.55 176.02 1h5p h LYS 618 N 7.42 0.38 0.00 -0.62 3.64 -1.50 0.73 116.57 126.62 1h5p h LYS 618 Ca -0.34 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1h5p h LYS 618 Cb 1.15 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1h5p h LYS 618 CO 0.74 0.61 0.21 1.05 -2.27 0.00 0.00 179.45 179.79 1h5p h GLU 619 N 0.34 0.00 0.00 1.90 4.11 -1.93 -1.96 114.58 117.03 1h5p h GLU 619 Ca 0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.45 1h5p h GLU 619 Cb 0.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1h5p h GLU 619 CO 0.05 0.00 -1.19 0.54 0.07 0.00 0.00 179.01 178.47 1h5p n ARG 620 N -2.94 1.94 0.31 1.06 1.74 -1.00 -4.59 116.66 113.17 1h5p n ARG 620 Ca -0.02 -0.02 0.19 0.00 -0.77 0.00 0.00 57.85 57.23 1h5p n ARG 620 Cb 0.26 -1.08 0.98 0.00 -1.02 0.00 0.00 32.46 31.60 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 -0.07 -1.81 116.94 117.09 1h5p h PHE 621 Ca -0.05 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.45 1h5p h PHE 621 Cb 0.73 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.47 1h5p h PHE 621 CO 0.00 0.00 0.25 1.57 -2.23 0.00 0.00 178.31 177.90 1h5p h LYS 622 N 0.00 0.00 0.00 1.11 2.10 -1.77 0.19 116.57 118.20 1h5p h LYS 622 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1h5p h LYS 622 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 1h5p h LYS 622 CO -0.00 0.00 -0.58 1.04 -2.00 0.00 0.00 179.45 177.91 1h5p n GLN 623 N -2.14 3.38 0.00 0.07 1.13 -0.68 -4.93 117.38 114.21 1h5p n GLN 623 Ca -0.01 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1h5p n GLN 623 Cb 0.27 -0.82 0.00 0.00 0.11 0.00 0.00 30.24 29.80 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 1.66 2.97 1.60 1.08 0.00 0.67 -3.44 105.19 109.73 1h5p n GLY 624 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 1.44 -0.86 2.61 5.66 -1.26 -2.71 114.28 119.16 1h5p n THR 625 Ca 0.00 -0.35 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 1h5p n THR 625 Cb 0.00 -1.35 0.00 0.00 -1.55 0.00 0.00 70.33 67.43 1h5p n THR 625 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1h5p n SER 626 N 1.59 0.16 -3.68 1.09 7.64 -1.22 -4.89 113.62 114.30 1h5p n SER 626 Ca 0.00 -1.02 -0.10 0.00 1.01 0.00 0.00 58.87 58.77 1h5p n SER 626 Cb 0.37 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.47 1h5p n SER 626 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1h5p s LYS 627 N -0.02 0.40 -0.50 1.43 1.02 -1.10 -5.02 119.74 115.95 1h5p s LYS 627 Ca 0.00 0.88 -0.28 0.00 0.02 0.00 0.00 55.97 56.59 1h5p s LYS 627 Cb 0.00 0.07 -0.01 0.00 -0.52 0.00 0.00 37.83 37.37 1h5p s LYS 627 CO 0.00 -0.18 1.69 -1.59 -0.92 0.00 0.00 175.35 174.35 1h5p s LYS 628 N 1.68 3.08 0.00 1.68 0.00 -1.26 -4.71 119.74 120.21 1h5p s LYS 628 Ca -0.08 0.82 0.00 0.00 0.00 0.00 0.00 55.97 56.71 1h5p s LYS 628 Cb -0.09 -4.24 0.00 0.00 0.00 0.00 0.00 37.83 33.51 1h5p s LYS 628 CO -0.13 -2.18 0.55 0.00 0.00 0.00 0.00 175.35 173.58 1h5p s ILE 630 N -0.22 5.06 -0.31 0.00 1.01 -1.10 -0.24 121.20 125.41 1h5p s ILE 630 Ca 0.00 -0.44 -0.17 0.00 0.00 0.00 0.00 60.65 60.04 1h5p s ILE 630 Cb 0.00 -4.10 -0.02 0.00 0.01 0.00 0.00 42.46 38.35 1h5p s ILE 630 CO 0.00 -0.52 0.45 -1.58 0.00 0.00 0.00 174.94 173.30 1h5p s GLN 631 N 2.19 3.83 0.26 2.79 0.74 -0.38 -1.26 119.66 127.83 1h5p s GLN 631 Ca 0.12 -0.03 0.02 0.00 0.05 0.00 0.00 55.36 55.52 1h5p s GLN 631 Cb -0.18 -3.73 -0.04 0.00 1.10 0.00 0.00 33.01 30.16 1h5p s GLN 631 CO 0.13 -0.46 0.14 -1.12 -0.55 0.00 0.00 175.29 173.42 1h5p s SER 632 N 1.68 1.08 0.00 6.67 0.01 -0.38 -2.20 113.70 120.55 1h5p s SER 632 Ca 0.17 -1.46 0.00 0.00 1.31 0.00 0.00 55.95 55.97 1h5p s SER 632 Cb -0.16 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.39 1h5p s SER 632 CO 0.11 -0.83 0.00 1.21 0.41 0.00 0.00 173.24 174.14 1h5p n GLU 633 N -0.47 0.00 0.00 12.44 0.00 -1.26 -2.23 120.64 129.13 1h5p n GLU 633 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1h5p n GLU 633 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.10 1h5p n GLU 633 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1h5p n ASP 634 N 2.68 0.00 -0.05 4.31 5.75 -1.26 -4.98 116.55 123.00 1h5p n ASP 634 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1h5p n ASP 634 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1h5p n ASP 634 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1h5p n LYS 635 N 0.00 0.00 -3.57 0.11 3.00 -1.18 -5.13 118.16 111.40 1h5p n LYS 635 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 57.93 1h5p n LYS 635 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 34.92 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 3.92 -0.14 1.64 -0.14 -0.94 -4.93 119.74 119.15 1h5p s LYS 636 Ca 0.00 -0.31 -0.09 0.00 -1.36 0.00 0.00 55.97 54.20 1h5p s LYS 636 Cb 0.00 -3.67 -0.05 0.00 -1.68 0.00 0.00 37.83 32.43 1h5p s LYS 636 CO 0.00 -0.21 0.17 -1.58 -0.76 0.00 0.00 175.35 172.97 1h5p s TRP 637 N 1.78 3.54 0.29 3.18 0.52 -1.25 -1.25 118.94 125.74 1h5p s TRP 637 Ca 0.08 0.51 0.02 0.00 0.02 0.00 0.00 56.10 56.73 1h5p s TRP 637 Cb -0.16 -2.07 -0.05 0.00 -1.15 0.00 0.00 33.47 30.03 1h5p s TRP 637 CO 0.11 0.54 0.10 -0.06 0.02 0.00 0.00 176.95 177.66 1h5p s PHE 638 N -0.46 1.67 0.32 -1.98 0.08 -0.39 -4.92 117.98 112.31 1h5p s PHE 638 Ca 0.14 -1.16 0.06 0.00 0.12 0.00 0.00 56.93 56.09 1h5p s PHE 638 Cb -0.12 -1.01 -0.01 0.00 -0.57 0.00 0.00 43.02 41.31 1h5p s PHE 638 CO 0.03 -0.27 0.46 0.95 -0.10 0.00 0.00 175.22 176.29 1h5p s THR 639 N -3.59 4.24 0.45 0.64 -4.23 -1.26 -2.69 115.64 109.20 1h5p s THR 639 Ca 0.36 -0.98 0.11 0.00 -1.18 0.00 0.00 61.69 60.00 1h5p s THR 639 Cb 0.07 -3.48 0.11 0.00 1.34 0.00 0.00 72.50 70.54 1h5p s THR 639 CO 0.15 -0.19 1.25 -0.65 -0.54 0.00 0.00 174.62 174.64 1h5p h PRO 640 N 0.92 0.00 0.00 3.99 0.11 -1.87 0.20 132.00 135.35 1h5p h PRO 640 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1h5p h PRO 640 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1h5p h PRO 640 CO 0.54 0.00 -0.32 -0.09 -0.21 0.00 0.00 178.00 177.92 1h5p h ARG 641 N 0.00 0.00 -0.08 1.05 9.65 -1.93 -3.15 114.38 119.93 1h5p h ARG 641 Ca 0.00 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 58.90 1h5p h ARG 641 Cb 1.23 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.81 1h5p h ARG 641 CO 0.00 0.00 0.10 0.93 2.80 0.00 0.00 179.97 183.80 1h5p h GLU 642 N -0.67 0.00 0.17 0.20 5.08 -1.68 -0.88 114.58 116.79 1h5p h GLU 642 Ca 0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 1h5p h GLU 642 Cb 0.32 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.60 1h5p h GLU 642 CO 0.00 0.00 -1.34 0.35 -1.00 0.00 0.00 179.01 177.02 1h5p h PHE 643 N 0.00 0.93 -0.42 4.33 3.57 -0.83 -3.16 116.94 121.36 1h5p h PHE 643 Ca 0.04 -0.63 0.01 0.00 3.53 0.00 0.00 57.97 60.92 1h5p h PHE 643 Cb 0.24 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1h5p h PHE 643 CO 0.00 1.48 0.28 1.49 -2.23 0.00 0.00 178.31 179.33 1h5p h GLU 644 N 0.20 0.51 -0.58 1.11 4.81 -1.12 -1.48 114.58 118.02 1h5p h GLU 644 Ca -0.21 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 58.91 1h5p h GLU 644 Cb 2.02 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 31.26 1h5p h GLU 644 CO 0.25 0.34 0.05 0.82 -0.73 0.00 0.00 179.01 179.73 1h5p h ILE 645 N 0.52 1.26 0.00 2.32 2.04 -1.46 0.25 117.51 122.44 1h5p h ILE 645 Ca 0.16 -1.06 -0.07 0.00 1.00 0.00 0.00 64.86 64.90 1h5p h ILE 645 Cb 0.01 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1h5p h ILE 645 CO -0.04 0.38 -0.31 -0.08 0.00 0.00 0.00 178.15 178.11 1h5p h GLU 646 N 0.89 0.00 -0.00 2.37 4.81 -1.26 -0.11 114.58 121.27 1h5p h GLU 646 Ca 0.17 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1h5p h GLU 646 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1h5p h GLU 646 CO 0.02 0.31 -0.60 0.41 -0.73 0.00 0.00 179.01 178.42 1h5p n GLY 647 N -0.43 -0.92 0.32 1.92 0.00 -0.85 -4.84 105.19 100.38 1h5p n GLY 647 Ca -0.02 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1h5p n GLY 647 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h5p n ASP 648 N -1.18 0.00 0.00 1.61 8.00 0.05 -4.26 116.55 120.77 1h5p n ASP 648 Ca 0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1h5p n ASP 648 Cb 0.35 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 1h5p n ASP 648 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1h5p n ARG 649 N -1.24 0.00 0.00 -1.24 3.00 -0.09 -4.97 116.66 112.12 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 1.20 0.06 5.14 0.00 -1.26 -4.64 105.19 105.68 1h5p n GLY 650 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 0.00 1.84 0.02 4.61 0.00 -1.26 -3.02 120.51 122.70 1h5p n ALA 651 Ca 0.00 -0.01 0.19 0.00 0.00 0.00 0.00 53.44 53.62 1h5p n ALA 651 Cb 0.00 -1.35 0.67 0.00 0.00 0.00 0.00 19.45 18.77 1h5p n ALA 651 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1h5p h SER 652 N 0.00 0.02 0.00 0.00 0.87 -1.93 -3.45 113.55 109.07 1h5p h SER 652 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1h5p h SER 652 Cb 0.39 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1h5p h SER 652 CO 0.00 0.01 0.00 1.17 -0.53 0.00 0.00 176.83 177.48 1h5p n LYS 653 N -4.40 0.00 -1.89 2.24 3.00 -1.17 -4.66 118.16 111.27 1h5p n LYS 653 Ca 0.09 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.10 1h5p n LYS 653 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.53 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 -4.00 4.87 0.51 3.14 2.47 -1.26 -4.77 114.94 115.90 1h5p s ASN 654 Ca 0.00 0.05 0.30 0.00 0.42 0.00 0.00 52.86 53.62 1h5p s ASN 654 Cb 0.00 -2.54 1.11 0.00 -1.45 0.00 0.00 41.25 38.37 1h5p s ASN 654 CO 0.00 -2.83 1.89 4.11 -3.72 0.00 0.00 177.10 176.55 1h5p h TRP 655 N 14.02 0.00 0.00 0.43 5.08 -1.86 -2.60 115.95 131.02 1h5p h TRP 655 Ca -0.09 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.88 1h5p h TRP 655 Cb 1.10 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.26 1h5p h TRP 655 CO 1.11 0.07 0.00 0.87 -1.28 0.00 0.00 178.44 179.21 1h5p h LYS 656 N 0.00 0.00 0.00 0.12 1.57 -1.88 -2.33 116.57 114.05 1h5p h LYS 656 Ca -0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1h5p h LYS 656 Cb 0.64 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1h5p h LYS 656 CO 0.01 0.00 -1.46 1.28 -0.57 0.00 0.00 179.45 178.71 1h5p n LEU 657 N -2.67 0.00 0.14 2.94 4.77 -1.05 -0.48 117.00 120.64 1h5p n LEU 657 Ca -0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1h5p n LEU 657 Cb 0.17 0.11 0.16 0.00 -2.33 0.00 0.00 43.42 41.53 1h5p n LEU 657 CO 0.19 0.11 0.49 0.28 -1.33 0.00 0.00 177.39 177.13 1h5p h SER 658 N 0.00 0.00 -3.66 -1.43 0.02 -1.27 -3.44 113.55 103.76 1h5p h SER 658 Ca -0.12 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.15 1h5p h SER 658 Cb 0.99 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.35 1h5p h SER 658 CO 0.01 0.61 -0.71 -0.63 -1.14 0.00 0.00 176.83 174.96 1h5p s ILE 659 N -3.47 3.58 0.35 3.27 1.01 -0.89 -3.61 121.20 121.43 1h5p s ILE 659 Ca -0.00 -0.74 0.08 0.00 0.00 0.00 0.00 60.65 59.99 1h5p s ILE 659 Cb 0.12 -2.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.02 1h5p s ILE 659 CO 0.75 0.44 0.11 -0.13 0.00 0.00 0.00 174.94 176.12 1h5p s ARG 660 N -1.26 2.29 -0.30 2.79 0.52 -0.05 -3.28 118.95 119.65 1h5p s ARG 660 Ca 0.16 -1.62 -0.03 0.00 -0.52 0.00 0.00 55.73 53.71 1h5p s ARG 660 Cb -0.11 -2.10 0.11 0.00 0.52 0.00 0.00 34.95 33.37 1h5p s ARG 660 CO 0.06 0.10 0.14 0.00 0.02 0.00 0.00 175.30 175.61 1h5p n GLY 662 N 5.00 0.38 0.00 0.00 0.00 -0.57 -3.10 105.19 106.89 1h5p n GLY 662 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.00 0.03 3.86 -0.02 0.00 -1.26 -4.92 105.19 100.88 1h5p n GLY 663 Ca 0.00 0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 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 3.64 0.95 1.61 2.02 -1.18 -4.96 117.35 119.43 1h5p s TYR 664 Ca 0.00 0.72 -0.12 0.00 -0.37 0.00 0.00 57.07 57.30 1h5p s TYR 664 Cb 0.00 -2.08 0.16 0.00 -0.40 0.00 0.00 41.96 39.63 1h5p s TYR 664 CO 0.00 0.68 1.09 0.95 -1.57 0.00 0.00 175.55 176.70 1h5p s THR 665 N -1.11 2.39 0.58 -0.71 -4.23 -1.26 -0.73 115.64 110.57 1h5p s THR 665 Ca 0.21 0.13 0.28 0.00 -1.18 0.00 0.00 61.69 61.12 1h5p s THR 665 Cb -0.14 -2.60 0.37 0.00 1.34 0.00 0.00 72.50 71.47 1h5p s THR 665 CO 0.10 -0.17 2.03 -0.07 -0.54 0.00 0.00 174.62 175.97 1h5p h LEU 666 N -1.72 0.00 0.20 4.79 -0.00 -1.48 0.18 115.31 117.27 1h5p h LEU 666 Ca -0.52 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.37 1h5p h LEU 666 Cb 1.30 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.94 1h5p h LEU 666 CO 0.56 0.00 -0.22 0.50 -0.00 0.00 0.00 178.44 179.28 1h5p h LYS 667 N 0.00 -0.44 0.11 1.13 3.11 -1.09 0.46 116.57 119.85 1h5p h LYS 667 Ca 0.15 0.03 -0.27 0.00 -2.81 0.00 0.00 60.65 57.75 1h5p h LYS 667 Cb 0.75 0.10 0.01 0.00 -1.00 0.00 0.00 32.23 32.09 1h5p h LYS 667 CO -0.00 -0.30 -1.19 0.28 -2.81 0.00 0.00 179.45 175.44 1h5p h VAL 668 N -0.46 1.43 0.00 2.00 2.07 -1.56 -3.04 116.25 116.69 1h5p h VAL 668 Ca 0.00 -2.80 -0.03 0.00 0.82 0.00 0.00 66.70 64.69 1h5p h VAL 668 Cb 0.44 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.99 1h5p h VAL 668 CO -0.07 0.83 -0.16 0.25 0.02 0.00 0.00 177.57 178.45 1h5p h LEU 669 N 0.14 0.00 0.00 2.57 5.85 -0.54 0.25 115.31 123.59 1h5p h LEU 669 Ca -0.14 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1h5p h LEU 669 Cb 1.88 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.91 1h5p h LEU 669 CO 0.20 0.16 -0.40 1.15 -0.34 0.00 0.00 178.44 179.21 1h5p n MET 670 N -4.17 0.24 0.03 1.25 0.00 0.16 -3.01 117.12 111.63 1h5p n MET 670 Ca -0.02 0.11 0.08 0.00 0.00 0.00 0.00 57.70 57.87 1h5p n MET 670 Cb 0.23 -1.70 -0.10 0.00 0.00 0.00 0.00 33.22 31.66 1h5p n MET 670 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1h5p n GLU 671 N -2.08 0.64 0.00 3.17 1.02 -0.22 -4.41 120.64 118.76 1h5p n GLU 671 Ca 0.04 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1h5p n GLU 671 Cb 0.42 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1h5p n GLU 671 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1h5p n ASN 672 N -2.55 0.00 0.00 1.62 3.02 0.73 -4.15 115.26 113.94 1h5p n ASN 672 Ca -0.06 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 1h5p n ASN 672 Cb 0.66 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 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 -1.15 0.00 -0.29 3.52 0.00 -1.21 -4.80 118.16 114.23 1h5p n LYS 673 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 58.31 58.42 1h5p n LYS 673 Cb 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 35.03 35.30 1h5p n LYS 673 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.40 178.14 1h5p h PHE 674 N 0.00 0.45 -4.22 5.58 0.04 -1.92 -3.41 116.94 113.46 1h5p h PHE 674 Ca 0.00 0.04 -0.49 0.00 2.80 0.00 0.00 57.97 60.32 1h5p h PHE 674 Cb 0.00 -0.07 0.04 0.00 2.20 0.00 0.00 35.95 38.12 1h5p h PHE 674 CO 0.00 -0.12 0.37 -1.17 -0.60 0.00 0.00 178.31 176.80 1h5p s LEU 675 N -10.57 3.46 0.24 1.54 0.20 -1.16 -4.90 118.68 107.49 1h5p s LEU 675 Ca -0.12 1.46 -0.01 0.00 0.69 0.00 0.00 54.13 56.14 1h5p s LEU 675 Cb 0.25 -4.44 0.27 0.00 -0.43 0.00 0.00 46.19 41.83 1h5p s LEU 675 CO 0.77 -0.70 1.65 1.55 -0.29 0.00 0.00 176.35 179.33 1h5p h PRO 676 N 0.37 0.63 -6.88 0.98 0.13 -1.89 -3.46 132.00 121.89 1h5p h PRO 676 Ca -0.46 -0.26 -0.54 0.00 -0.87 0.00 0.00 66.00 63.88 1h5p h PRO 676 Cb 1.19 -0.03 0.20 0.00 0.13 0.00 0.00 31.00 32.50 1h5p h PRO 676 CO 0.62 0.84 -0.31 -1.91 -0.23 0.00 0.00 178.00 177.00 1h5p n GLU 677 N -4.10 -0.14 -1.65 0.86 2.13 -1.26 -4.78 120.64 111.70 1h5p n GLU 677 Ca -0.00 0.01 -0.61 0.00 0.66 0.00 0.00 57.16 57.22 1h5p n GLU 677 Cb 0.44 -2.00 -0.08 0.00 0.27 0.00 0.00 31.44 30.07 1h5p n GLU 677 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1h5p n PRO 678 N -2.07 0.44 0.00 5.31 -0.04 -1.26 -4.79 135.00 132.59 1h5p n PRO 678 Ca 0.09 0.16 0.04 0.00 -0.04 0.00 0.00 63.50 63.76 1h5p n PRO 678 Cb 0.52 -1.73 0.24 0.00 -0.04 0.00 0.00 33.50 32.50 1h5p n PRO 678 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1h5p n PRO 679 N 3.46 0.19 0.00 0.54 -0.04 -1.26 -4.77 135.00 133.12 1h5p n PRO 679 Ca 0.25 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.84 1h5p n PRO 679 Cb 0.06 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1h5p n PRO 679 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1h5p n SER 680 N -1.18 0.00 -2.43 3.54 2.88 -1.26 -4.30 113.62 110.86 1h5p n SER 680 Ca 0.05 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.56 1h5p n SER 680 Cb 0.06 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.49 1h5p n SER 680 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1h5p n THR 681 N 0.00-11.04 0.00 2.46 -1.04 -1.26 -5.07 114.28 98.33 1h5p n THR 681 Ca 0.00 2.12 0.00 0.00 -2.04 0.00 0.00 64.05 64.13 1h5p n THR 681 Cb 0.00 -6.16 0.00 0.00 -1.82 0.00 0.00 70.33 62.35 1h5p n THR 681 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1h5p n ARG 682 N 1.19 0.00 0.01 -2.82 1.74 -1.26 -5.12 116.66 110.40 1h5p n ARG 682 Ca -0.26 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.82 1h5p n ARG 682 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.84 1h5p n ARG 682 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1h5p n LYS 683 N -0.42 0.00 -4.55 5.56 4.81 -1.26 -5.13 118.16 117.17 1h5p n LYS 683 Ca 0.00 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.16 1h5p n LYS 683 Cb 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 34.88 1h5p n LYS 683 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1h5p s LYS 684 N -1.09 2.13 0.70 1.64 -0.14 -1.26 -5.12 119.74 116.60 1h5p s LYS 684 Ca 0.00 -0.54 -0.16 0.00 -1.36 0.00 0.00 55.97 53.91 1h5p s LYS 684 Cb 0.00 -1.78 0.01 0.00 -1.68 0.00 0.00 37.83 34.38 1h5p s LYS 684 CO 0.00 -0.02 1.07 1.55 -0.76 0.00 0.00 175.35 177.19 1h5p n VAL 685 N 4.05 3.33 -4.41 3.17 3.14 -1.26 -5.02 118.33 121.34 1h5p n VAL 685 Ca -0.20 -0.40 -0.28 0.00 -2.96 0.00 0.00 64.34 60.50 1h5p n VAL 685 Cb 0.51 -1.21 -0.17 0.00 -1.06 0.00 0.00 33.84 31.92 1h5p n VAL 685 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1h5p s THR 686 N -1.72 1.48 -1.02 1.55 -4.23 -1.26 -4.79 115.64 105.64 1h5p s THR 686 Ca 0.76 -0.62 -0.13 0.00 -1.18 0.00 0.00 61.69 60.52 1h5p s THR 686 Cb -0.35 -1.35 0.13 0.00 1.34 0.00 0.00 72.50 72.26 1h5p s THR 686 CO 0.48 0.44 0.33 0.00 -0.54 0.00 0.00 174.62 175.32 1h5p n ILE 687 N 4.25 -0.04 -0.41 2.99 3.06 -1.26 -5.24 119.36 122.71 1h5p n ILE 687 Ca -0.19 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.06 1h5p n ILE 687 Cb 0.51 -0.33 0.00 0.00 0.54 0.00 0.00 39.64 40.36 1h5p n ILE 687 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34