#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 0.30 0.00 7.83 5.75 -1.26 -5.09 116.55 124.08 1h5p n ASP 595 Ca 0.00 -1.41 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 1h5p n ASP 595 Cb 0.00 0.27 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 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 -0.14 0.00 0.00 0.11 -0.58 -1.26 -5.02 120.64 113.75 1h5p n GLU 596 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1h5p n GLU 596 Cb 0.11 -0.64 0.00 0.00 -0.57 0.00 0.00 31.44 30.35 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 -2.66 0.00 -4.10 1.62 5.15 -1.26 -5.11 115.26 108.89 1h5p n ASN 597 Ca 0.00 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.69 1h5p n ASN 597 Cb 0.42 0.00 -0.17 0.00 -0.53 0.00 0.00 39.78 39.50 1h5p n ASN 597 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1h5p s ILE 598 N -0.97 1.63 0.00 -1.44 -1.09 -1.26 -5.11 121.20 112.95 1h5p s ILE 598 Ca 0.00 -0.74 0.00 0.00 -2.23 0.00 0.00 60.65 57.68 1h5p s ILE 598 Cb 0.00 -1.45 0.00 0.00 -1.58 0.00 0.00 42.46 39.43 1h5p s ILE 598 CO 0.00 0.47 0.00 0.59 -1.23 0.00 0.00 174.94 174.77 1h5p n ASN 599 N 3.93 -0.19 0.00 3.58 3.02 -1.26 -4.94 115.26 119.40 1h5p n ASN 599 Ca -0.20 -0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.22 1h5p n ASN 599 Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 1h5p n ASN 599 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1h5p n PHE 600 N -0.88 0.00 -0.14 3.10 -1.74 -1.26 -4.91 117.46 111.63 1h5p n PHE 600 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1h5p n PHE 600 Cb 0.00 0.04 0.00 0.00 1.52 0.00 0.00 39.48 41.04 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 0.82 0.00 3.97 -0.00 -1.26 -4.71 118.16 116.98 1h5p n LYS 601 Ca 0.00 -0.89 0.01 0.00 -0.00 0.00 0.00 58.31 57.43 1h5p n LYS 601 Cb 0.22 -0.93 0.05 0.00 -0.00 0.00 0.00 35.03 34.37 1h5p n LYS 601 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1h5p n GLN 602 N -0.21 0.34 0.00 -1.58 1.13 -1.26 -4.79 117.38 111.01 1h5p n GLN 602 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1h5p n GLN 602 Cb 0.16 -1.08 0.00 0.00 0.11 0.00 0.00 30.24 29.43 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 -0.58 0.00 -3.67 1.08 7.64 -1.26 -4.81 113.62 112.02 1h5p n SER 603 Ca 0.01 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.63 1h5p n SER 603 Cb 0.01 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.04 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 0.34 -0.17 1.43 2.02 -1.25 -1.74 118.70 119.32 1h5p s GLU 604 Ca 0.00 -0.22 -0.05 0.00 0.02 0.00 0.00 54.97 54.73 1h5p s GLU 604 Cb 0.00 -1.90 -0.03 0.00 0.10 0.00 0.00 34.13 32.30 1h5p s GLU 604 CO 0.00 -0.64 -0.01 -1.17 0.02 0.00 0.00 175.26 173.46 1h5p s LEU 605 N 2.01 3.35 -0.05 1.80 2.96 -0.37 -4.88 118.68 123.51 1h5p s LEU 605 Ca 0.01 -0.11 -0.30 0.00 -0.22 0.00 0.00 54.13 53.51 1h5p s LEU 605 Cb -0.16 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.65 1h5p s LEU 605 CO -0.08 0.14 1.47 -2.16 -1.32 0.00 0.00 176.35 174.39 1h5p s PRO 606 N 0.57 4.24 0.18 0.98 0.04 -1.26 -1.26 135.00 138.48 1h5p s PRO 606 Ca -0.01 2.00 0.10 0.00 0.04 0.00 0.00 61.00 63.12 1h5p s PRO 606 Cb -0.14 -3.74 -0.04 0.00 0.04 0.00 0.00 34.50 30.61 1h5p s PRO 606 CO 0.02 -0.70 -0.14 0.14 0.04 0.00 0.00 177.00 176.36 1h5p s VAL 607 N 3.15 2.92 -0.24 -0.36 -7.23 -1.06 -1.06 120.40 116.52 1h5p s VAL 607 Ca 0.66 -1.75 -0.03 0.00 -1.81 0.00 0.00 61.98 59.04 1h5p s VAL 607 Cb -0.30 -2.43 0.10 0.00 0.56 0.00 0.00 36.38 34.31 1h5p s VAL 607 CO 0.25 -0.09 0.20 0.42 -0.31 0.00 0.00 175.10 175.57 1h5p s THR 608 N -1.64 -0.25 -0.46 5.32 -4.23 -0.08 -1.41 115.64 112.89 1h5p s THR 608 Ca 0.23 -0.36 -0.09 0.00 -1.18 0.00 0.00 61.69 60.29 1h5p s THR 608 Cb -0.09 -0.81 0.11 0.00 1.34 0.00 0.00 72.50 73.06 1h5p s THR 608 CO 0.13 -0.40 0.33 0.00 -0.54 0.00 0.00 174.62 174.14 1h5p n GLY 610 N 4.89 -0.38 3.43 0.00 0.00 -1.25 -1.12 105.19 110.76 1h5p n GLY 610 Ca -0.08 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -4.27 0.00 -2.62 1.61 4.07 -1.26 -4.90 120.64 113.28 1h5p n GLU 611 Ca -0.19 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.47 1h5p n GLU 611 Cb 0.63 -2.75 0.00 0.00 -0.06 0.00 0.00 31.44 29.26 1h5p n GLU 611 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1h5p n VAL 612 N -2.00 4.07 -1.19 6.31 0.31 -0.27 -4.99 118.33 120.57 1h5p n VAL 612 Ca 0.00 -4.29 -0.31 0.00 -0.01 0.00 0.00 64.34 59.73 1h5p n VAL 612 Cb 0.00 -2.42 0.10 0.00 -0.91 0.00 0.00 33.84 30.61 1h5p n VAL 612 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1h5p s LYS 613 N 2.57 2.03 0.18 5.55 2.20 -1.26 -2.21 119.74 128.79 1h5p s LYS 613 Ca 0.47 1.30 -0.20 0.00 -0.36 0.00 0.00 55.97 57.18 1h5p s LYS 613 Cb 0.03 -1.86 0.07 0.00 -1.51 0.00 0.00 37.83 34.56 1h5p s LYS 613 CO 0.02 -1.84 0.96 0.41 -0.36 0.00 0.00 175.35 174.55 1h5p n GLY 614 N -0.76 0.65 3.31 5.54 0.00 -0.50 -4.82 105.19 108.61 1h5p n GLY 614 Ca 0.10 -1.14 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 1h5p n GLY 614 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h5p s THR 615 N -2.09 3.53 -0.15 2.61 -4.23 -0.93 -2.57 115.64 111.82 1h5p s THR 615 Ca 0.21 -0.64 -0.20 0.00 -1.18 0.00 0.00 61.69 59.89 1h5p s THR 615 Cb -0.03 -2.72 -0.03 0.00 1.34 0.00 0.00 72.50 71.06 1h5p s THR 615 CO 0.05 0.26 0.57 -0.22 -0.54 0.00 0.00 174.62 174.74 1h5p s LEU 616 N 1.46 4.22 -0.18 4.79 2.96 -0.39 -0.50 118.68 131.04 1h5p s LEU 616 Ca 0.04 0.86 -0.15 0.00 -0.22 0.00 0.00 54.13 54.65 1h5p s LEU 616 Cb -0.16 -2.82 -0.04 0.00 0.50 0.00 0.00 46.19 43.67 1h5p s LEU 616 CO -0.01 -0.13 0.36 -0.31 -1.32 0.00 0.00 176.35 174.94 1h5p s TYR 617 N 1.22 3.41 0.28 5.38 1.51 0.14 -1.23 117.35 128.06 1h5p s TYR 617 Ca 0.28 0.62 0.08 0.00 -1.01 0.00 0.00 57.07 57.04 1h5p s TYR 617 Cb -0.16 -2.46 0.41 0.00 -0.11 0.00 0.00 41.96 39.65 1h5p s TYR 617 CO 0.11 0.10 1.66 0.87 -1.11 0.00 0.00 175.55 177.18 1h5p h LYS 618 N 7.08 0.15 -0.01 -0.62 6.56 -1.68 0.53 116.57 128.58 1h5p h LYS 618 Ca -0.38 -0.09 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 1h5p h LYS 618 Cb 1.16 0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 32.83 1h5p h LYS 618 CO 0.73 0.63 0.18 1.05 -2.06 0.00 0.00 179.45 179.98 1h5p h GLU 619 N 0.12 0.00 0.00 3.15 4.11 -1.93 -2.60 114.58 117.42 1h5p h GLU 619 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1h5p h GLU 619 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1h5p h GLU 619 CO 0.07 0.00 -0.99 0.54 0.07 0.00 0.00 179.01 178.70 1h5p n ARG 620 N -3.02 2.77 0.27 1.06 1.74 -1.10 -4.63 116.66 113.75 1h5p n ARG 620 Ca -0.02 0.00 0.18 0.00 -0.77 0.00 0.00 57.85 57.24 1h5p n ARG 620 Cb 0.24 -1.00 0.89 0.00 -1.02 0.00 0.00 32.46 31.57 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 -0.55 -2.89 116.94 115.53 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 0.69 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1h5p h PHE 621 CO 0.00 0.00 0.42 0.87 -2.23 0.00 0.00 178.31 177.37 1h5p h LYS 622 N 0.00 0.00 0.00 1.11 1.57 -1.74 0.34 116.57 117.85 1h5p h LYS 622 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h5p h LYS 622 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1h5p h LYS 622 CO 0.00 0.00 -0.65 1.04 -0.57 0.00 0.00 179.45 179.27 1h5p n GLN 623 N -2.21 2.60 0.00 3.15 1.13 -1.09 -4.80 117.38 116.17 1h5p n GLN 623 Ca -0.01 -0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.05 1h5p n GLN 623 Cb 0.44 -0.83 0.00 0.00 0.11 0.00 0.00 30.24 29.96 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 1.91 1.35 0.40 1.08 0.00 0.12 -3.95 105.19 106.10 1h5p n GLY 624 Ca -0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 0.00 0.98 2.61 5.66 -1.26 -2.69 114.28 119.58 1h5p n THR 625 Ca 0.00 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.12 1h5p n THR 625 Cb 0.00 -0.27 0.09 0.00 -1.55 0.00 0.00 70.33 68.61 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 0.08 2.92 -3.53 1.09 7.64 -1.25 -4.81 113.62 115.75 1h5p n SER 626 Ca 0.00 -1.96 -0.16 0.00 1.01 0.00 0.00 58.87 57.76 1h5p n SER 626 Cb 0.11 0.02 -0.06 0.00 -1.01 0.00 0.00 64.21 63.27 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 -1.98 1.06 -0.59 1.43 1.02 -1.10 -5.05 119.74 114.54 1h5p s LYS 627 Ca 0.27 0.06 -0.21 0.00 0.02 0.00 0.00 55.97 56.11 1h5p s LYS 627 Cb 0.20 0.49 0.08 0.00 -0.52 0.00 0.00 37.83 38.07 1h5p s LYS 627 CO 0.30 -0.36 0.79 -1.59 -0.92 0.00 0.00 175.35 173.58 1h5p s LYS 628 N -1.73 3.12 0.00 1.68 0.00 -1.26 -4.58 119.74 116.97 1h5p s LYS 628 Ca -0.09 -0.95 0.09 0.00 0.00 0.00 0.00 55.97 55.02 1h5p s LYS 628 Cb -0.01 -4.19 0.11 0.00 0.00 0.00 0.00 37.83 33.74 1h5p s LYS 628 CO 0.05 -1.54 0.87 0.00 0.00 0.00 0.00 175.35 174.73 1h5p s ILE 630 N -0.78 5.07 -0.37 0.00 1.01 -1.18 0.26 121.20 125.20 1h5p s ILE 630 Ca 0.12 -0.06 -0.17 0.00 0.00 0.00 0.00 60.65 60.54 1h5p s ILE 630 Cb 0.08 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.57 1h5p s ILE 630 CO 0.11 -0.31 0.47 -1.58 0.00 0.00 0.00 174.94 173.64 1h5p s GLN 631 N 2.22 3.46 0.36 2.79 0.74 0.34 -0.64 119.66 128.93 1h5p s GLN 631 Ca 0.14 -0.37 0.04 0.00 0.05 0.00 0.00 55.36 55.22 1h5p s GLN 631 Cb -0.16 -3.85 -0.05 0.00 1.10 0.00 0.00 33.01 30.04 1h5p s GLN 631 CO 0.13 -0.69 0.07 -1.12 -0.55 0.00 0.00 175.29 173.14 1h5p s SER 632 N 1.79 2.62 0.00 6.67 0.01 -0.15 -2.18 113.70 122.46 1h5p s SER 632 Ca 0.16 -1.48 0.00 0.00 1.31 0.00 0.00 55.95 55.94 1h5p s SER 632 Cb -0.16 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.19 1h5p s SER 632 CO 0.13 -0.72 0.00 1.21 0.41 0.00 0.00 173.24 174.28 1h5p n GLU 633 N -0.79 0.00 0.00 12.44 4.07 -1.26 -2.17 120.64 132.93 1h5p n GLU 633 Ca -0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.06 1h5p n GLU 633 Cb 0.66 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 32.04 1h5p n GLU 633 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1h5p n ASP 634 N 2.47 0.00 -0.06 4.31 5.68 -1.26 -4.98 116.55 122.71 1h5p n ASP 634 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1h5p n ASP 634 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1h5p n ASP 634 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1h5p n LYS 635 N 0.00 0.00 -3.60 0.11 3.00 -1.16 -5.13 118.16 111.38 1h5p n LYS 635 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.94 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 4.01 -0.03 1.64 -0.14 -0.92 -4.92 119.74 119.38 1h5p s LYS 636 Ca 0.00 -0.26 -0.16 0.00 -1.36 0.00 0.00 55.97 54.19 1h5p s LYS 636 Cb 0.00 -3.61 -0.05 0.00 -1.68 0.00 0.00 37.83 32.49 1h5p s LYS 636 CO 0.00 -0.08 0.45 -1.58 -0.76 0.00 0.00 175.35 173.38 1h5p s TRP 637 N 1.48 3.67 0.13 3.18 0.52 -1.26 -0.98 118.94 125.68 1h5p s TRP 637 Ca 0.08 0.99 0.07 0.00 0.02 0.00 0.00 56.10 57.26 1h5p s TRP 637 Cb -0.15 -2.40 -0.04 0.00 -1.15 0.00 0.00 33.47 29.73 1h5p s TRP 637 CO 0.08 0.47 -0.15 -0.06 0.02 0.00 0.00 176.95 177.31 1h5p s PHE 638 N -0.50 1.51 0.35 -1.98 0.40 0.18 -4.94 117.98 113.00 1h5p s PHE 638 Ca 0.25 -0.52 -0.07 0.00 -0.60 0.00 0.00 56.93 55.99 1h5p s PHE 638 Cb -0.17 -0.79 -0.06 0.00 0.51 0.00 0.00 43.02 42.52 1h5p s PHE 638 CO 0.13 0.19 0.66 0.95 0.70 0.00 0.00 175.22 177.84 1h5p s THR 639 N -2.02 4.92 0.66 0.64 -4.23 -1.26 -3.13 115.64 111.23 1h5p s THR 639 Ca 0.10 0.28 0.19 0.00 -1.18 0.00 0.00 61.69 61.08 1h5p s THR 639 Cb -0.06 -3.74 0.19 0.00 1.34 0.00 0.00 72.50 70.23 1h5p s THR 639 CO 0.04 -0.44 1.57 -0.65 -0.54 0.00 0.00 174.62 174.59 1h5p h PRO 640 N 1.39 0.00 0.00 3.99 0.11 -1.86 0.29 132.00 135.92 1h5p h PRO 640 Ca -0.47 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 1h5p h PRO 640 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1h5p h PRO 640 CO 0.65 0.00 -0.52 -0.09 -0.21 0.00 0.00 178.00 177.83 1h5p h ARG 641 N 0.00 0.00 0.00 1.05 9.65 -1.92 -2.88 114.38 120.28 1h5p h ARG 641 Ca 0.00 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1h5p h ARG 641 Cb 1.17 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.74 1h5p h ARG 641 CO 0.00 0.85 -0.13 0.93 2.80 0.00 0.00 179.97 184.42 1h5p h GLU 642 N -1.00 0.00 0.08 0.20 5.08 -1.35 -2.29 114.58 115.29 1h5p h GLU 642 Ca -0.14 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 57.96 1h5p h GLU 642 Cb 1.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.27 1h5p h GLU 642 CO -0.08 0.13 -1.13 0.35 -1.00 0.00 0.00 179.01 177.27 1h5p h PHE 643 N 0.00 0.77 -0.09 4.33 3.57 -0.66 -2.58 116.94 122.28 1h5p h PHE 643 Ca -0.00 -0.48 -0.08 0.00 3.53 0.00 0.00 57.97 60.94 1h5p h PHE 643 Cb 0.49 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 1h5p h PHE 643 CO 0.00 1.32 -0.31 1.49 -2.23 0.00 0.00 178.31 178.58 1h5p h GLU 644 N 0.23 0.17 -0.21 1.11 4.22 -1.22 0.28 114.58 119.17 1h5p h GLU 644 Ca -0.14 -0.06 -0.13 0.00 0.08 0.00 0.00 59.36 59.11 1h5p h GLU 644 Cb 1.80 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.04 1h5p h GLU 644 CO 0.20 0.48 -0.38 0.82 -2.18 0.00 0.00 179.01 177.95 1h5p h ILE 645 N 0.15 1.33 0.00 2.32 2.04 -1.39 -0.63 117.51 121.33 1h5p h ILE 645 Ca 0.02 -1.61 -0.21 0.00 1.00 0.00 0.00 64.86 64.06 1h5p h ILE 645 Cb 0.64 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 1h5p h ILE 645 CO 0.05 0.50 -1.04 -0.08 0.00 0.00 0.00 178.15 177.58 1h5p h GLU 646 N 0.31 0.00 0.10 2.37 4.57 -1.29 -1.63 114.58 119.02 1h5p h GLU 646 Ca 0.01 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.92 1h5p h GLU 646 Cb 0.98 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.58 1h5p h GLU 646 CO 0.09 0.94 -1.18 0.78 -1.18 0.00 0.00 179.01 178.45 1h5p h GLY 647 N 3.06 0.43 0.00 1.92 0.00 -0.49 -3.42 103.07 104.58 1h5p h GLY 647 Ca -0.03 -0.96 0.00 0.00 0.00 0.00 0.00 47.33 46.33 1h5p h GLY 647 CO 0.12 0.85 0.00 1.34 0.00 0.00 0.00 176.54 178.85 1h5p n ASP 648 N -3.65 0.00 0.00 0.19 -0.08 -0.25 -4.13 116.55 108.64 1h5p n ASP 648 Ca -0.09 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.19 1h5p n ASP 648 Cb 0.97 -0.24 0.00 0.00 2.34 0.00 0.00 41.12 44.19 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 -1.96 0.00 0.00 -0.67 3.00 -0.65 -5.01 116.66 111.37 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 -0.16 1.54 0.00 5.14 0.00 -1.00 -4.79 105.19 105.92 1h5p n GLY 650 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.14 2.34 -1.00 4.61 0.00 -1.26 -4.74 120.51 120.32 1h5p n ALA 651 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1h5p n ALA 651 Cb 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 -1.17 0.00 0.00 0.00 7.64 -1.26 -5.05 113.62 113.79 1h5p n SER 652 Ca 0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.03 1h5p n SER 652 Cb 0.15 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 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 -2.52 1.43 0.00 -1.26 -5.09 118.16 110.72 1h5p n LYS 653 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 58.31 57.90 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 6.21 0.39 3.14 3.84 -1.26 -4.84 114.94 120.42 1h5p s ASN 654 Ca 0.00 -0.16 0.21 0.00 0.21 0.00 0.00 52.86 53.11 1h5p s ASN 654 Cb 0.00 -2.56 0.26 0.00 -0.55 0.00 0.00 41.25 38.41 1h5p s ASN 654 CO 0.00 -1.74 1.56 4.11 -2.79 0.00 0.00 177.10 178.24 1h5p h TRP 655 N 10.20 0.00 0.00 0.43 5.08 -1.97 -2.61 115.95 127.09 1h5p h TRP 655 Ca -0.27 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.70 1h5p h TRP 655 Cb 1.06 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.22 1h5p h TRP 655 CO 1.09 0.15 -0.01 0.87 -1.28 0.00 0.00 178.44 179.26 1h5p h LYS 656 N 0.00 0.00 0.00 0.12 1.57 -1.88 -2.54 116.57 113.84 1h5p h LYS 656 Ca -0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1h5p h LYS 656 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 1h5p h LYS 656 CO 0.02 0.01 -1.37 1.28 -0.57 0.00 0.00 179.45 178.82 1h5p n LEU 657 N -3.16 0.00 0.18 2.94 4.77 -1.22 0.03 117.00 120.53 1h5p n LEU 657 Ca -0.02 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.98 1h5p n LEU 657 Cb 0.15 0.09 0.32 0.00 -2.33 0.00 0.00 43.42 41.66 1h5p n LEU 657 CO 0.23 0.09 0.68 -1.28 -1.33 0.00 0.00 177.39 175.78 1h5p h SER 658 N 0.00 0.00 -3.80 -1.43 0.87 -1.30 -3.43 113.55 104.46 1h5p h SER 658 Ca -0.10 0.00 -0.69 0.00 -1.23 0.00 0.00 61.79 59.77 1h5p h SER 658 Cb 0.97 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 62.73 1h5p h SER 658 CO 0.01 0.42 -0.73 -0.63 -0.53 0.00 0.00 176.83 175.37 1h5p s ILE 659 N -4.07 3.41 0.33 2.23 1.01 -0.97 -3.95 121.20 119.20 1h5p s ILE 659 Ca -0.02 -0.67 0.08 0.00 0.00 0.00 0.00 60.65 60.03 1h5p s ILE 659 Cb 0.14 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1h5p s ILE 659 CO 0.73 0.54 0.21 -0.13 0.00 0.00 0.00 174.94 176.29 1h5p s ARG 660 N -0.96 2.54 -0.29 2.79 0.52 -0.14 -3.40 118.95 120.02 1h5p s ARG 660 Ca 0.13 -1.42 -0.03 0.00 -0.52 0.00 0.00 55.73 53.89 1h5p s ARG 660 Cb -0.11 -2.32 0.10 0.00 0.52 0.00 0.00 34.95 33.14 1h5p s ARG 660 CO 0.03 0.12 0.13 0.00 0.02 0.00 0.00 175.30 175.59 1h5p n GLY 662 N 5.16 0.15 0.00 0.00 0.00 -0.23 -2.67 105.19 107.60 1h5p n GLY 662 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 0.78 2.55 3.85 -0.02 0.00 -1.26 -4.84 105.19 106.26 1h5p n GLY 663 Ca -0.02 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 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 3.69 0.81 1.61 2.02 -1.09 -4.95 117.35 119.45 1h5p s TYR 664 Ca 0.00 0.88 -0.14 0.00 -0.37 0.00 0.00 57.07 57.44 1h5p s TYR 664 Cb 0.00 -2.20 0.20 0.00 -0.40 0.00 0.00 41.96 39.56 1h5p s TYR 664 CO 0.00 0.66 0.74 0.25 -1.57 0.00 0.00 175.55 175.64 1h5p n THR 665 N 1.82 0.00 0.16 -0.71 -2.24 -1.26 -0.09 114.28 111.97 1h5p n THR 665 Ca -0.15 -0.34 0.02 0.00 -2.27 0.00 0.00 64.05 61.30 1h5p n THR 665 Cb 0.53 -1.19 0.26 0.00 -2.10 0.00 0.00 70.33 67.84 1h5p n THR 665 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1h5p h LEU 666 N 0.00 0.00 -0.65 3.22 -0.00 -1.37 0.17 115.31 116.68 1h5p h LEU 666 Ca -0.28 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.58 1h5p h LEU 666 Cb 0.84 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.47 1h5p h LEU 666 CO 0.18 0.49 0.33 0.50 -0.00 0.00 0.00 178.44 179.95 1h5p h LYS 667 N 0.00 0.93 0.11 1.13 1.63 -0.72 0.20 116.57 119.85 1h5p h LYS 667 Ca -0.00 -0.13 -0.27 0.00 -0.85 0.00 0.00 60.65 59.40 1h5p h LYS 667 Cb 0.96 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 32.41 1h5p h LYS 667 CO 0.06 0.73 -1.24 0.28 -3.45 0.00 0.00 179.45 175.84 1h5p h VAL 668 N 0.90 1.50 -0.11 2.00 2.07 -1.76 -3.00 116.25 117.85 1h5p h VAL 668 Ca 0.23 -3.09 -0.04 0.00 0.82 0.00 0.00 66.70 64.61 1h5p h VAL 668 Cb 0.09 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1h5p h VAL 668 CO -0.03 0.90 -0.13 -0.07 0.02 0.00 0.00 177.57 178.25 1h5p h LEU 669 N 0.06 0.16 0.00 2.57 4.07 -0.31 0.21 115.31 122.07 1h5p h LEU 669 Ca -0.13 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.81 1h5p h LEU 669 Cb 1.95 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.65 1h5p h LEU 669 CO 0.19 0.31 -0.23 1.15 -1.08 0.00 0.00 178.44 178.78 1h5p n MET 670 N -4.30 0.18 0.03 1.13 0.00 0.69 -2.34 117.12 112.50 1h5p n MET 670 Ca -0.01 0.11 0.01 0.00 0.00 0.00 0.00 57.70 57.81 1h5p n MET 670 Cb 0.25 -1.67 -0.08 0.00 0.00 0.00 0.00 33.22 31.72 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 -1.97 0.63 0.00 3.17 0.00 -0.07 -3.83 120.64 118.57 1h5p n GLU 671 Ca 0.05 0.17 0.00 0.00 0.00 0.00 0.00 57.16 57.38 1h5p n GLU 671 Cb 0.40 -1.77 0.00 0.00 0.00 0.00 0.00 31.44 30.07 1h5p n GLU 671 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1h5p n ASN 672 N -2.82 0.00 0.00 4.31 3.02 0.54 -4.73 115.26 115.59 1h5p n ASN 672 Ca -0.10 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1h5p n ASN 672 Cb 0.81 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.79 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 -1.38 0.00 0.18 3.52 0.00 -1.02 -4.99 118.16 114.47 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 0.61 0.00 -0.00 0.00 0.00 35.03 35.64 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 0.00 -3.22 5.58 0.04 -1.87 -3.41 116.94 114.06 1h5p h PHE 674 Ca 0.00 0.00 -0.59 0.00 2.80 0.00 0.00 57.97 60.18 1h5p h PHE 674 Cb 0.00 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.06 1h5p h PHE 674 CO 0.00 0.00 -0.27 -1.17 -0.60 0.00 0.00 178.31 176.27 1h5p s LEU 675 N -4.60 4.29 0.33 1.54 0.20 -0.99 -4.78 118.68 114.67 1h5p s LEU 675 Ca -0.02 0.64 0.01 0.00 0.69 0.00 0.00 54.13 55.45 1h5p s LEU 675 Cb 0.06 -2.46 0.56 0.00 -0.43 0.00 0.00 46.19 43.93 1h5p s LEU 675 CO 0.20 0.13 1.99 -0.65 -0.29 0.00 0.00 176.35 177.73 1h5p h PRO 676 N 6.28 0.94 -2.69 0.98 0.11 -1.89 -3.27 132.00 132.46 1h5p h PRO 676 Ca -0.43 -0.06 -0.64 0.00 0.11 0.00 0.00 66.00 64.98 1h5p h PRO 676 Cb 1.18 -0.21 -0.40 0.00 0.11 0.00 0.00 31.00 31.68 1h5p h PRO 676 CO 0.72 0.62 -0.42 -0.85 -0.21 0.00 0.00 178.00 177.86 1h5p n GLU 677 N -4.43 2.46 -2.85 1.05 0.28 -1.26 -5.05 120.64 110.84 1h5p n GLU 677 Ca 0.08 -4.58 -0.43 0.00 -0.16 0.00 0.00 57.16 52.07 1h5p n GLU 677 Cb 0.05 -2.31 -0.04 0.00 1.43 0.00 0.00 31.44 30.58 1h5p n GLU 677 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1h5p s PRO 678 N -2.03 3.26 0.00 3.44 0.04 -1.24 -4.89 135.00 133.58 1h5p s PRO 678 Ca 0.33 -0.45 0.07 0.00 0.04 0.00 0.00 61.00 60.99 1h5p s PRO 678 Cb 0.05 -4.11 0.32 0.00 0.04 0.00 0.00 34.50 30.81 1h5p s PRO 678 CO -0.07 -1.58 1.23 -0.35 0.04 0.00 0.00 177.00 176.26 1h5p n PRO 679 N 7.53 1.26 0.00 0.56 -0.04 -1.26 -4.63 135.00 138.42 1h5p n PRO 679 Ca -0.00 -0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 1h5p n PRO 679 Cb 0.47 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 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 -0.23 0.00 -1.57 3.54 2.88 -1.25 -4.76 113.62 112.23 1h5p n SER 680 Ca 0.07 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.45 1h5p n SER 680 Cb 0.11 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.51 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 -0.09 -3.57 2.46 -1.04 -1.26 -4.86 114.28 105.92 1h5p n THR 681 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1h5p n THR 681 Cb 0.00 -1.57 -0.00 0.00 -1.82 0.00 0.00 70.33 66.94 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 -2.13 0.39 0.02 -2.82 1.74 -1.26 -5.06 116.66 107.53 1h5p n ARG 682 Ca -0.16 -1.09 -0.16 0.00 -0.77 0.00 0.00 57.85 55.67 1h5p n ARG 682 Cb 0.53 1.17 -0.06 0.00 -1.02 0.00 0.00 32.46 33.08 1h5p n ARG 682 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1h5p h LYS 683 N 0.00 0.66 -5.60 5.56 1.57 -1.92 -3.49 116.57 113.35 1h5p h LYS 683 Ca -0.13 -0.59 -0.10 0.00 -1.87 0.00 0.00 60.65 57.96 1h5p h LYS 683 Cb 0.52 0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1h5p h LYS 683 CO 0.17 1.20 -0.57 1.17 -0.57 0.00 0.00 179.45 180.86 1h5p n LYS 684 N -3.88 -2.06 0.00 3.15 3.00 -1.26 -4.08 118.16 113.03 1h5p n LYS 684 Ca -0.08 1.81 0.00 0.00 -0.00 0.00 0.00 58.31 60.05 1h5p n LYS 684 Cb 0.78 -4.88 0.00 0.00 0.00 0.00 0.00 35.03 30.94 1h5p n LYS 684 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1h5p n VAL 685 N -0.68 0.00 -0.38 3.15 0.31 -1.26 -2.16 118.33 117.30 1h5p n VAL 685 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 1h5p n VAL 685 Cb 0.52 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 1h5p n VAL 685 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1h5p n THR 686 N 0.00 0.00 -1.78 2.52 5.66 -1.26 -5.11 114.28 114.32 1h5p n THR 686 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 1h5p n THR 686 Cb 0.00 0.24 -0.03 0.00 -1.55 0.00 0.00 70.33 68.99 1h5p n THR 686 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1h5p s ILE 687 N 0.00 2.18 0.00 1.09 -1.09 -0.92 -5.14 121.20 117.32 1h5p s ILE 687 Ca 0.00 0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.54 1h5p s ILE 687 Cb 0.00 -3.08 0.00 0.00 -1.58 0.00 0.00 42.46 37.80 1h5p s ILE 687 CO 0.00 0.01 0.00 2.29 -1.23 0.00 0.00 174.94 176.01