#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o91 s MET 614 N 0.00 3.85 -0.26 5.31 -1.94 -1.26 -4.77 119.30 120.23 1o91 s MET 614 Ca 0.00 0.31 -0.29 0.00 -1.71 0.00 0.00 55.69 54.00 1o91 s MET 614 Cb 0.00 -2.90 -0.01 0.00 2.01 0.00 0.00 34.83 33.93 1o91 s MET 614 CO 0.00 0.48 1.41 -2.14 -0.01 0.00 0.00 175.02 174.76 1o91 s PRO 615 N -2.12 3.90 -0.20 2.03 0.02 -1.26 -4.21 135.00 133.16 1o91 s PRO 615 Ca 0.38 1.43 -0.27 0.00 0.02 0.00 0.00 61.00 62.56 1o91 s PRO 615 Cb -0.14 -3.93 0.09 0.00 0.02 0.00 0.00 34.50 30.55 1o91 s PRO 615 CO 0.19 -1.15 0.83 0.00 -0.33 0.00 0.00 177.00 176.55 1o91 s ALA 616 N 4.59 -1.85 0.18 -1.55 0.00 -1.19 -1.60 121.76 120.34 1o91 s ALA 616 Ca 0.62 1.76 -0.23 0.00 0.00 0.00 0.00 51.96 54.10 1o91 s ALA 616 Cb -0.20 -0.89 0.06 0.00 0.00 0.00 0.00 23.12 22.08 1o91 s ALA 616 CO 0.25 -0.32 0.66 -0.59 0.00 0.00 0.00 175.76 175.76 1o91 s PHE 617 N -0.25 -0.42 -0.13 0.00 -0.12 0.11 -0.49 117.98 116.69 1o91 s PHE 617 Ca -0.02 0.14 -0.05 0.00 -0.05 0.00 0.00 56.93 56.95 1o91 s PHE 617 Cb -0.03 0.60 0.06 0.00 -0.63 0.00 0.00 43.02 43.02 1o91 s PHE 617 CO 0.01 -0.93 0.26 0.99 -0.05 0.00 0.00 175.22 175.50 1o91 s THR 618 N -3.74 -0.36 -0.04 -4.49 2.01 -0.89 -1.71 115.64 106.43 1o91 s THR 618 Ca 0.04 0.26 0.05 0.00 0.31 0.00 0.00 61.69 62.35 1o91 s THR 618 Cb -0.02 -0.44 -0.01 0.00 0.01 0.00 0.00 72.50 72.04 1o91 s THR 618 CO -0.07 0.11 -0.19 0.00 -0.69 0.00 0.00 174.62 173.78 1o91 s ALA 619 N 2.25 1.63 0.03 7.40 0.00 -0.14 -1.27 121.76 131.67 1o91 s ALA 619 Ca -0.00 -0.78 0.06 0.00 0.00 0.00 0.00 51.96 51.23 1o91 s ALA 619 Cb -0.12 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 1o91 s ALA 619 CO -0.09 0.33 -0.13 -1.21 0.00 0.00 0.00 175.76 174.67 1o91 s GLU 620 N -0.16 2.27 -0.15 0.00 2.02 0.17 -1.35 118.70 121.51 1o91 s GLU 620 Ca 0.00 -0.88 -0.15 0.00 0.02 0.00 0.00 54.97 53.96 1o91 s GLU 620 Cb -0.10 -2.33 -0.05 0.00 0.10 0.00 0.00 34.13 31.76 1o91 s GLU 620 CO 0.01 0.56 0.34 -1.17 0.02 0.00 0.00 175.26 175.02 1o91 s LEU 621 N -1.50 4.25 0.00 1.80 2.96 0.88 -0.65 118.68 126.42 1o91 s LEU 621 Ca 0.16 0.58 0.06 0.00 -0.22 0.00 0.00 54.13 54.71 1o91 s LEU 621 Cb -0.11 -2.45 -0.01 0.00 0.50 0.00 0.00 46.19 44.12 1o91 s LEU 621 CO 0.07 0.08 0.46 0.35 -1.32 0.00 0.00 176.35 175.99 1o91 n THR 622 N 3.60 0.00 -5.19 3.68 -2.24 -1.26 -3.34 114.28 109.51 1o91 n THR 622 Ca -0.11 -0.42 -0.32 0.00 -2.27 0.00 0.00 64.05 60.93 1o91 n THR 622 Cb 0.52 1.06 -0.17 0.00 -2.10 0.00 0.00 70.33 69.65 1o91 n THR 622 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1o91 s VAL 623 N -1.10 2.13 0.77 2.28 -7.23 -1.26 -3.81 120.40 112.18 1o91 s VAL 623 Ca 0.05 -1.00 -0.11 0.00 -1.81 0.00 0.00 61.98 59.11 1o91 s VAL 623 Cb 0.05 -1.81 0.05 0.00 0.56 0.00 0.00 36.38 35.23 1o91 s VAL 623 CO 0.17 0.56 1.09 -2.16 -0.31 0.00 0.00 175.10 174.45 1o91 s PRO 624 N 0.26 2.29 -0.69 4.82 0.04 -1.16 -4.54 135.00 136.02 1o91 s PRO 624 Ca -0.16 0.77 -0.08 0.00 0.04 0.00 0.00 61.00 61.57 1o91 s PRO 624 Cb -0.17 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1o91 s PRO 624 CO 0.08 -1.51 0.65 1.19 0.04 0.00 0.00 177.00 177.45 1o91 n PHE 625 N -3.38 -2.65 -1.79 0.56 0.99 -0.06 -4.91 117.46 106.21 1o91 n PHE 625 Ca 0.07 1.06 -0.30 0.00 -0.00 0.00 0.00 57.45 58.28 1o91 n PHE 625 Cb 0.55 -3.27 0.06 0.00 -1.00 0.00 0.00 39.48 35.83 1o91 n PHE 625 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1o91 s PRO 626 N -3.62 2.58 0.56 -1.08 0.04 -1.26 -5.01 135.00 127.21 1o91 s PRO 626 Ca 0.09 0.49 -0.21 0.00 0.04 0.00 0.00 61.00 61.41 1o91 s PRO 626 Cb -0.01 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 1o91 s PRO 626 CO 0.83 -1.23 1.27 -2.14 0.04 0.00 0.00 177.00 175.76 1o91 s PRO 627 N -5.32 3.14 0.41 0.56 0.02 -1.26 -4.98 135.00 127.57 1o91 s PRO 627 Ca 0.59 2.00 -0.12 0.00 0.02 0.00 0.00 61.00 63.50 1o91 s PRO 627 Cb -0.12 -2.14 -0.07 0.00 0.02 0.00 0.00 34.50 32.19 1o91 s PRO 627 CO 0.52 -1.12 0.79 0.08 -0.33 0.00 0.00 177.00 176.94 1o91 s VAL 628 N -1.45 4.75 -0.27 3.83 1.01 -1.26 -4.16 120.40 122.85 1o91 s VAL 628 Ca 0.73 0.72 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1o91 s VAL 628 Cb -0.35 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1o91 s VAL 628 CO 0.40 -0.51 0.00 0.61 0.00 0.00 0.00 175.10 175.60 1o91 n GLY 629 N -1.25 0.57 3.23 4.51 0.00 0.58 -4.99 105.19 107.84 1o91 n GLY 629 Ca 0.03 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 1o91 n GLY 629 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o91 s ALA 630 N -1.95 -0.58 0.29 4.61 0.00 -1.26 -5.03 121.76 117.83 1o91 s ALA 630 Ca 0.00 -0.07 -0.29 0.00 0.00 0.00 0.00 51.96 51.60 1o91 s ALA 630 Cb 0.00 0.29 -0.13 0.00 0.00 0.00 0.00 23.12 23.28 1o91 s ALA 630 CO 0.00 -0.39 1.27 -2.30 0.00 0.00 0.00 175.76 174.34 1o91 n PRO 631 N 0.65 1.90 -2.45 0.00 -0.02 -1.26 -4.48 135.00 129.34 1o91 n PRO 631 Ca -0.19 0.67 -0.43 0.00 -2.02 0.00 0.00 63.50 61.54 1o91 n PRO 631 Cb 0.59 -2.23 -0.02 0.00 -0.02 0.00 0.00 33.50 31.82 1o91 n PRO 631 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1o91 s VAL 632 N -0.71 4.27 -1.23 -1.45 1.01 0.35 -4.79 120.40 117.84 1o91 s VAL 632 Ca 0.61 1.57 -0.14 0.00 0.00 0.00 0.00 61.98 64.02 1o91 s VAL 632 Cb -0.63 -4.01 0.15 0.00 0.00 0.00 0.00 36.38 31.89 1o91 s VAL 632 CO 0.57 -0.06 1.51 0.29 0.00 0.00 0.00 175.10 177.42 1o91 n LYS 633 N 5.75 3.34 -1.88 2.72 5.02 -1.26 -4.44 118.16 127.42 1o91 n LYS 633 Ca 0.12 -3.73 -0.42 0.00 -2.02 0.00 0.00 58.31 52.26 1o91 n LYS 633 Cb 0.46 -3.12 -0.03 0.00 -0.02 0.00 0.00 35.03 32.32 1o91 n LYS 633 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1o91 s PHE 634 N 2.01 1.69 -0.06 2.13 0.40 -1.26 -4.88 117.98 118.01 1o91 s PHE 634 Ca 0.45 0.10 0.02 0.00 -0.60 0.00 0.00 56.93 56.90 1o91 s PHE 634 Cb -0.01 -4.03 -0.25 0.00 0.51 0.00 0.00 43.02 39.24 1o91 s PHE 634 CO 0.02 -4.23 0.61 0.38 0.70 0.00 0.00 175.22 172.69 1o91 h ASP 635 N 10.73 0.23 -3.55 1.36 3.04 -1.70 -3.41 116.42 123.12 1o91 h ASP 635 Ca -0.41 -0.46 -0.63 0.00 -3.24 0.00 0.00 57.03 52.29 1o91 h ASP 635 Cb 1.20 -0.08 -0.13 0.00 -1.04 0.00 0.00 39.33 39.28 1o91 h ASP 635 CO 0.96 1.41 0.16 -0.75 -2.04 0.00 0.00 179.24 178.98 1o91 s LYS 636 N -2.59 3.76 -0.09 4.15 2.20 0.18 -4.88 119.74 122.46 1o91 s LYS 636 Ca -0.12 0.16 -0.17 0.00 -0.36 0.00 0.00 55.97 55.48 1o91 s LYS 636 Cb 0.07 -3.78 -0.05 0.00 -1.51 0.00 0.00 37.83 32.57 1o91 s LYS 636 CO 0.81 -0.69 0.44 -0.51 -0.36 0.00 0.00 175.35 175.04 1o91 s LEU 637 N 2.70 4.32 -0.17 5.43 1.43 -1.26 0.42 118.68 131.55 1o91 s LEU 637 Ca 0.25 0.82 0.18 0.00 -1.03 0.00 0.00 54.13 54.35 1o91 s LEU 637 Cb -0.15 -2.64 -0.25 0.00 0.03 0.00 0.00 46.19 43.19 1o91 s LEU 637 CO 0.14 0.09 0.11 0.18 0.23 0.00 0.00 176.35 177.10 1o91 n LEU 638 N 3.19 0.00 -3.55 1.79 4.77 -0.39 -5.00 117.00 117.81 1o91 n LEU 638 Ca -0.09 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.74 1o91 n LEU 638 Cb 0.52 0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 41.98 1o91 n LEU 638 CO 0.41 0.43 0.60 -0.47 -1.33 0.00 0.00 177.39 177.03 1o91 s TYR 639 N -2.59 -0.53 -0.46 -1.77 5.04 -1.24 -4.96 117.35 110.84 1o91 s TYR 639 Ca -0.09 0.92 0.06 0.00 -2.44 0.00 0.00 57.07 55.51 1o91 s TYR 639 Cb 0.07 0.42 0.30 0.00 0.35 0.00 0.00 41.96 43.10 1o91 s TYR 639 CO 0.81 -0.48 1.07 -1.71 -1.34 0.00 0.00 175.55 173.91 1o91 n ASN 640 N 0.89 -2.44 -4.71 4.32 5.15 -1.24 -2.10 115.26 115.13 1o91 n ASN 640 Ca -0.15 -3.53 -0.43 0.00 -0.60 0.00 0.00 54.58 49.88 1o91 n ASN 640 Cb 0.57 1.88 -0.03 0.00 -0.53 0.00 0.00 39.78 41.67 1o91 n ASN 640 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1o91 n GLY 641 N 0.69 1.47 3.57 8.20 0.00 0.36 -0.57 105.19 118.92 1o91 n GLY 641 Ca 0.06 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.70 1o91 n GLY 641 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o91 n ARG 642 N 3.78 0.00 -3.99 1.61 1.74 -1.26 -3.18 116.66 115.35 1o91 n ARG 642 Ca 0.16 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.94 1o91 n ARG 642 Cb 0.34 -2.77 0.00 0.00 -1.02 0.00 0.00 32.46 29.01 1o91 n ARG 642 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1o91 n GLN 643 N -2.00 -4.26 0.00 5.56 6.02 0.27 -4.86 117.38 118.11 1o91 n GLN 643 Ca 0.00 0.49 0.14 0.00 -0.01 0.00 0.00 57.00 57.62 1o91 n GLN 643 Cb 0.00 -5.13 0.57 0.00 1.02 0.00 0.00 30.24 26.70 1o91 n GLN 643 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1o91 n ASN 644 N -2.84 0.09 -4.68 1.08 3.02 -1.26 -4.66 115.26 106.01 1o91 n ASN 644 Ca -0.07 0.32 -0.35 0.00 -0.03 0.00 0.00 54.58 54.45 1o91 n ASN 644 Cb 0.57 -0.36 -0.09 0.00 -0.61 0.00 0.00 39.78 39.29 1o91 n ASN 644 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1o91 s TYR 645 N -2.96 3.31 -0.24 3.10 5.04 -1.26 -0.78 117.35 123.56 1o91 s TYR 645 Ca 0.15 0.18 -0.01 0.00 -2.44 0.00 0.00 57.07 54.95 1o91 s TYR 645 Cb 0.19 -2.05 0.03 0.00 0.35 0.00 0.00 41.96 40.47 1o91 s TYR 645 CO 0.55 0.27 -0.09 1.21 -1.34 0.00 0.00 175.55 176.16 1o91 s ASN 646 N 0.11 4.15 0.56 4.32 3.84 -0.87 -4.98 114.94 122.07 1o91 s ASN 646 Ca 0.06 -0.86 0.26 0.00 0.21 0.00 0.00 52.86 52.53 1o91 s ASN 646 Cb -0.12 -1.63 1.56 0.00 -0.55 0.00 0.00 41.25 40.51 1o91 s ASN 646 CO 0.00 -0.11 2.12 -0.65 -2.79 0.00 0.00 177.10 175.67 1o91 h PRO 647 N 7.98 0.00 0.00 0.43 0.11 -1.90 0.39 132.00 139.01 1o91 h PRO 647 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1o91 h PRO 647 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1o91 h PRO 647 CO 0.58 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 180.33 1o91 h GLN 648 N 0.00 0.00 0.00 1.05 1.08 -1.93 -3.34 115.11 111.97 1o91 h GLN 648 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1o91 h GLN 648 Cb 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1o91 h GLN 648 CO -0.00 0.00 -0.90 0.25 -0.95 0.00 0.00 178.83 177.23 1o91 n THR 649 N -2.66 0.00 -1.01 -0.54 -2.24 -0.46 -5.01 114.28 102.36 1o91 n THR 649 Ca 0.03 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1o91 n THR 649 Cb 0.39 0.29 -0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1o91 n THR 649 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1o91 n GLY 650 N 2.31 0.42 3.67 3.38 0.00 0.12 -4.61 105.19 110.48 1o91 n GLY 650 Ca 0.00 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1o91 n GLY 650 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o91 s ILE 651 N -1.83 4.28 -0.26 -0.61 1.01 -1.24 -4.55 121.20 118.01 1o91 s ILE 651 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 1o91 s ILE 651 Cb 0.00 -2.81 -0.05 0.00 0.01 0.00 0.00 42.46 39.62 1o91 s ILE 651 CO 0.00 0.59 0.16 0.12 0.00 0.00 0.00 174.94 175.82 1o91 s PHE 652 N -0.76 3.25 -0.20 3.97 5.36 -0.07 -2.05 117.98 127.48 1o91 s PHE 652 Ca 0.12 0.12 -0.06 0.00 -0.96 0.00 0.00 56.93 56.15 1o91 s PHE 652 Cb -0.12 -2.31 -0.03 0.00 -0.34 0.00 0.00 43.02 40.23 1o91 s PHE 652 CO 0.02 -0.06 0.02 0.99 -1.46 0.00 0.00 175.22 174.73 1o91 s THR 653 N 1.38 4.20 0.00 0.12 2.01 0.04 -0.90 115.64 122.50 1o91 s THR 653 Ca 0.07 -0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.54 1o91 s THR 653 Cb -0.15 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.41 1o91 s THR 653 CO 0.07 0.43 1.37 0.00 -0.69 0.00 0.00 174.62 175.79 1o91 n GLU 655 N 5.22 0.22 -3.60 0.00 2.13 -1.26 -0.92 120.64 122.43 1o91 n GLU 655 Ca 0.13 0.06 -0.39 0.00 0.66 0.00 0.00 57.16 57.61 1o91 n GLU 655 Cb 0.44 -1.09 -0.11 0.00 0.27 0.00 0.00 31.44 30.95 1o91 n GLU 655 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1o91 s VAL 656 N -2.18 4.87 0.51 6.31 1.01 -1.26 -4.74 120.40 124.93 1o91 s VAL 656 Ca -0.12 -0.35 -0.23 0.00 0.00 0.00 0.00 61.98 61.27 1o91 s VAL 656 Cb 0.04 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.85 1o91 s VAL 656 CO 0.20 0.03 1.34 -2.65 0.00 0.00 0.00 175.10 174.02 1o91 n PRO 657 N 5.03 1.82 -2.19 2.72 -0.02 -1.26 -4.89 135.00 136.21 1o91 n PRO 657 Ca -0.13 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1o91 n PRO 657 Cb 0.49 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1o91 n PRO 657 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o91 n GLY 658 N 0.75 -0.63 3.71 -1.23 0.00 -0.64 -1.24 105.19 105.92 1o91 n GLY 658 Ca 0.09 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 1o91 n GLY 658 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1o91 s VAL 659 N -2.16 5.12 0.26 1.61 1.01 -0.09 -0.41 120.40 125.74 1o91 s VAL 659 Ca 0.00 1.16 0.11 0.00 0.00 0.00 0.00 61.98 63.25 1o91 s VAL 659 Cb 0.00 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1o91 s VAL 659 CO 0.00 0.28 -0.19 -0.31 0.00 0.00 0.00 175.10 174.88 1o91 s TYR 660 N 0.81 2.16 -0.06 5.22 1.51 0.49 0.39 117.35 127.87 1o91 s TYR 660 Ca 0.30 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 56.02 1o91 s TYR 660 Cb -0.16 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.74 1o91 s TYR 660 CO 0.13 0.63 -0.17 -0.47 -1.11 0.00 0.00 175.55 174.57 1o91 s TYR 661 N -2.58 1.81 0.05 2.71 5.04 -0.61 -0.70 117.35 123.07 1o91 s TYR 661 Ca 0.28 -0.63 0.07 0.00 -2.44 0.00 0.00 57.07 54.36 1o91 s TYR 661 Cb -0.04 -1.25 -0.03 0.00 0.35 0.00 0.00 41.96 41.00 1o91 s TYR 661 CO 0.13 -0.26 -0.21 -0.06 -1.34 0.00 0.00 175.55 173.81 1o91 s PHE 662 N 0.32 1.83 0.01 4.97 0.40 0.08 -1.49 117.98 124.10 1o91 s PHE 662 Ca -0.11 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 1o91 s PHE 662 Cb -0.14 -1.08 -0.01 0.00 0.51 0.00 0.00 43.02 42.30 1o91 s PHE 662 CO 0.04 0.10 -0.02 0.00 0.70 0.00 0.00 175.22 176.05 1o91 s ALA 663 N -0.83 0.11 0.00 5.36 0.00 -0.22 -0.50 121.76 125.68 1o91 s ALA 663 Ca 0.08 -0.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.73 1o91 s ALA 663 Cb -0.09 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.06 1o91 s ALA 663 CO 0.02 -0.03 0.19 1.52 0.00 0.00 0.00 175.76 177.46 1o91 s TYR 664 N -0.43 -0.01 -0.05 0.00 -0.85 -0.02 0.06 117.35 116.04 1o91 s TYR 664 Ca -0.04 -0.05 -0.01 0.00 -0.52 0.00 0.00 57.07 56.45 1o91 s TYR 664 Cb -0.03 -0.01 0.03 0.00 0.38 0.00 0.00 41.96 42.33 1o91 s TYR 664 CO -0.00 -0.33 0.02 -1.01 -1.52 0.00 0.00 175.55 172.71 1o91 s HIS 665 N -1.52 0.39 -0.07 -3.49 3.76 -0.50 -1.50 115.29 112.36 1o91 s HIS 665 Ca -0.13 0.02 0.04 0.00 -0.15 0.00 0.00 55.06 54.84 1o91 s HIS 665 Cb -0.06 -0.63 -0.00 0.00 1.11 0.00 0.00 32.58 33.00 1o91 s HIS 665 CO 0.02 -0.25 -0.20 0.14 -0.85 0.00 0.00 174.74 173.60 1o91 s VAL 666 N 1.95 1.70 0.32 -0.90 -7.23 -0.06 -0.44 120.40 115.74 1o91 s VAL 666 Ca 0.03 -0.84 -0.13 0.00 -1.81 0.00 0.00 61.98 59.23 1o91 s VAL 666 Cb -0.12 -1.47 -0.08 0.00 0.56 0.00 0.00 36.38 35.26 1o91 s VAL 666 CO -0.04 0.48 0.71 -1.00 -0.31 0.00 0.00 175.10 174.94 1o91 s HIS 667 N 0.24 3.39 -0.12 2.82 3.76 -1.25 -1.16 115.29 122.98 1o91 s HIS 667 Ca -0.11 1.13 0.02 0.00 -0.15 0.00 0.00 55.06 55.95 1o91 s HIS 667 Cb -0.15 -2.47 0.01 0.00 1.11 0.00 0.00 32.58 31.08 1o91 s HIS 667 CO 0.05 0.09 -0.18 0.00 -0.85 0.00 0.00 174.74 173.85 1o91 s LYS 669 N 0.89 0.83 0.00 0.00 2.20 -0.98 -1.72 119.74 120.96 1o91 s LYS 669 Ca -0.07 0.77 0.00 0.00 -0.36 0.00 0.00 55.97 56.30 1o91 s LYS 669 Cb -0.15 0.40 0.00 0.00 -1.51 0.00 0.00 37.83 36.57 1o91 s LYS 669 CO -0.01 -0.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.25 1o91 n GLY 670 N 2.20 2.73 3.62 5.54 0.00 -1.26 -4.70 105.19 113.32 1o91 n GLY 670 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 1o91 n GLY 670 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o91 s GLY 671 N -0.85 -0.36 0.69 -0.02 0.00 -1.26 -5.00 107.32 100.53 1o91 s GLY 671 Ca 0.00 0.95 -0.15 0.00 0.00 0.00 0.00 44.72 45.52 1o91 s GLY 671 CO 0.00 0.26 1.18 -1.31 0.00 0.00 0.00 173.10 173.23 1o91 s ASN 672 N -2.66 4.57 -0.07 1.64 0.02 -1.26 -4.04 114.94 113.13 1o91 s ASN 672 Ca 0.11 2.26 0.01 0.00 -1.02 0.00 0.00 52.86 54.22 1o91 s ASN 672 Cb 0.02 -2.58 0.02 0.00 0.02 0.00 0.00 41.25 38.73 1o91 s ASN 672 CO -0.04 -2.01 -0.07 0.54 0.02 0.00 0.00 177.10 175.55 1o91 s VAL 673 N -2.03 0.80 -0.18 1.60 0.11 -0.21 -0.79 120.40 119.70 1o91 s VAL 673 Ca 0.73 -0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.56 1o91 s VAL 673 Cb -0.27 -0.81 0.04 0.00 -1.53 0.00 0.00 36.38 33.81 1o91 s VAL 673 CO 0.43 0.30 -0.10 0.86 -3.33 0.00 0.00 175.10 173.26 1o91 s TRP 674 N 1.22 2.18 0.13 1.54 -0.00 -0.62 -1.31 118.94 122.09 1o91 s TRP 674 Ca -0.05 -1.38 0.05 0.00 -0.00 0.00 0.00 56.10 54.72 1o91 s TRP 674 Cb -0.14 -1.55 -0.04 0.00 -0.00 0.00 0.00 33.47 31.74 1o91 s TRP 674 CO -0.02 -0.69 -0.12 0.14 -0.00 0.00 0.00 176.95 176.25 1o91 s VAL 675 N 1.48 1.27 0.02 5.86 -7.23 -0.37 -3.98 120.40 117.46 1o91 s VAL 675 Ca 0.01 -1.84 0.02 0.00 -1.81 0.00 0.00 61.98 58.35 1o91 s VAL 675 Cb -0.15 -1.64 -0.01 0.00 0.56 0.00 0.00 36.38 35.13 1o91 s VAL 675 CO -0.09 -0.54 -0.07 0.00 -0.31 0.00 0.00 175.10 174.09 1o91 s ALA 676 N -2.57 0.56 -0.28 1.32 0.00 -0.35 -0.78 121.76 119.65 1o91 s ALA 676 Ca 0.12 -0.51 -0.19 0.00 0.00 0.00 0.00 51.96 51.38 1o91 s ALA 676 Cb -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 1o91 s ALA 676 CO 0.02 0.06 0.56 -1.17 0.00 0.00 0.00 175.76 175.23 1o91 s LEU 677 N -0.83 4.12 0.08 0.00 2.96 0.03 -1.60 118.68 123.43 1o91 s LEU 677 Ca -0.03 0.44 0.02 0.00 -0.22 0.00 0.00 54.13 54.33 1o91 s LEU 677 Cb -0.06 -2.71 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1o91 s LEU 677 CO 0.00 -0.37 0.15 -0.36 -1.32 0.00 0.00 176.35 174.45 1o91 s PHE 678 N 2.42 3.35 -0.27 5.38 0.40 0.62 -0.12 117.98 129.76 1o91 s PHE 678 Ca 0.22 0.15 0.02 0.00 -0.60 0.00 0.00 56.93 56.72 1o91 s PHE 678 Cb -0.15 -1.68 0.07 0.00 0.51 0.00 0.00 43.02 41.77 1o91 s PHE 678 CO 0.10 0.55 -0.04 0.21 0.70 0.00 0.00 175.22 176.74 1o91 s LYS 679 N -2.55 1.75 7.52 0.44 2.20 -0.30 -2.49 119.74 126.32 1o91 s LYS 679 Ca 0.32 -1.30 0.00 0.00 -0.36 0.00 0.00 55.97 54.63 1o91 s LYS 679 Cb -0.12 -2.78 0.00 0.00 -1.51 0.00 0.00 37.83 33.42 1o91 s LYS 679 CO 0.25 -0.68 0.00 0.09 -0.36 0.00 0.00 175.35 174.65 1o91 n ASN 680 N 4.51 0.00 -1.01 1.43 3.02 0.21 -1.33 115.26 122.09 1o91 n ASN 680 Ca -0.09 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.55 1o91 n ASN 680 Cb 0.43 0.00 0.23 0.00 -0.61 0.00 0.00 39.78 39.83 1o91 n ASN 680 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1o91 n ASN 681 N 9.70 3.41 -4.53 6.41 4.13 -1.26 -4.94 115.26 128.17 1o91 n ASN 681 Ca 0.00 -1.97 -0.36 0.00 1.68 0.00 0.00 54.58 53.93 1o91 n ASN 681 Cb 0.00 -0.34 -0.11 0.00 -1.54 0.00 0.00 39.78 37.79 1o91 n ASN 681 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1o91 s GLU 682 N -1.06 3.80 -0.25 3.52 2.12 -0.44 -5.06 118.70 121.32 1o91 s GLU 682 Ca 0.36 -0.42 -0.29 0.00 0.36 0.00 0.00 54.97 54.98 1o91 s GLU 682 Cb 0.19 -3.27 -0.01 0.00 0.26 0.00 0.00 34.13 31.31 1o91 s GLU 682 CO 0.26 0.03 1.39 -2.14 -0.54 0.00 0.00 175.26 174.26 1o91 s PRO 683 N 1.02 3.93 -0.09 4.30 0.02 -1.26 -1.15 135.00 141.78 1o91 s PRO 683 Ca 0.04 1.44 0.06 0.00 0.02 0.00 0.00 61.00 62.56 1o91 s PRO 683 Cb -0.14 -3.91 -0.24 0.00 0.02 0.00 0.00 34.50 30.23 1o91 s PRO 683 CO 0.03 -1.10 0.47 -1.33 -0.33 0.00 0.00 177.00 174.74 1o91 n MET 684 N 7.31 0.68 -3.77 5.54 2.81 0.83 -4.95 117.12 125.57 1o91 n MET 684 Ca 0.16 0.26 -0.13 0.00 -1.81 0.00 0.00 57.70 56.18 1o91 n MET 684 Cb 0.46 -1.73 -0.13 0.00 -0.71 0.00 0.00 33.22 31.11 1o91 n MET 684 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1o91 s MET 685 N -2.57 0.21 -0.12 0.03 -2.45 -1.14 -4.98 119.30 108.28 1o91 s MET 685 Ca -0.13 0.37 -0.02 0.00 -1.25 0.00 0.00 55.69 54.67 1o91 s MET 685 Cb 0.07 0.01 -0.03 0.00 1.25 0.00 0.00 34.83 36.13 1o91 s MET 685 CO 0.80 -0.09 -0.06 0.71 1.05 0.00 0.00 175.02 177.42 1o91 s TYR 686 N 0.59 2.96 -0.07 4.11 1.51 -1.26 -0.79 117.35 124.40 1o91 s TYR 686 Ca -0.04 -0.25 0.02 0.00 -1.01 0.00 0.00 57.07 55.79 1o91 s TYR 686 Cb -0.05 -1.85 0.01 0.00 -0.11 0.00 0.00 41.96 39.95 1o91 s TYR 686 CO -0.03 0.06 -0.13 0.99 -1.11 0.00 0.00 175.55 175.32 1o91 s THR 687 N -0.04 1.23 0.02 -0.71 2.01 0.04 -5.02 115.64 113.18 1o91 s THR 687 Ca 0.00 -0.53 0.04 0.00 0.31 0.00 0.00 61.69 61.51 1o91 s THR 687 Cb -0.13 -1.11 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 1o91 s THR 687 CO 0.03 0.37 -0.12 -0.47 -0.69 0.00 0.00 174.62 173.75 1o91 s TYR 688 N 0.62 1.05 -0.10 4.92 5.04 -1.26 -1.23 117.35 126.38 1o91 s TYR 688 Ca -0.15 -0.30 -0.09 0.00 -2.44 0.00 0.00 57.07 54.09 1o91 s TYR 688 Cb -0.16 -0.64 0.03 0.00 0.35 0.00 0.00 41.96 41.54 1o91 s TYR 688 CO 0.04 0.00 0.26 0.34 -1.34 0.00 0.00 175.55 174.86 1o91 s ASP 689 N -0.85 -0.28 -0.16 4.32 2.15 -0.42 -5.02 116.67 116.41 1o91 s ASP 689 Ca 0.01 0.53 -0.08 0.00 0.43 0.00 0.00 52.55 53.45 1o91 s ASP 689 Cb -0.07 0.54 -0.04 0.00 -0.30 0.00 0.00 42.92 43.05 1o91 s ASP 689 CO 0.01 -0.09 0.11 -1.61 -0.17 0.00 0.00 175.17 173.42 1o91 s GLU 690 N 0.17 3.80 0.12 4.34 2.02 -1.26 -1.05 118.70 126.85 1o91 s GLU 690 Ca -0.00 -0.22 -0.32 0.00 0.02 0.00 0.00 54.97 54.45 1o91 s GLU 690 Cb -0.02 -3.26 -0.11 0.00 0.10 0.00 0.00 34.13 30.84 1o91 s GLU 690 CO 0.00 0.50 1.82 0.98 0.02 0.00 0.00 175.26 178.58 1o91 n TYR 691 N 2.86 2.60 -2.83 1.61 9.36 -1.26 -4.91 117.16 124.59 1o91 n TYR 691 Ca -0.18 -0.10 -0.43 0.00 3.32 0.00 0.00 57.90 60.51 1o91 n TYR 691 Cb 0.53 -2.71 -0.03 0.00 -0.63 0.00 0.00 39.34 36.50 1o91 n TYR 691 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1o91 s LYS 692 N 2.57 3.32 0.00 2.98 -0.14 -1.26 -4.85 119.74 122.36 1o91 s LYS 692 Ca 0.82 -1.12 0.00 0.00 -1.36 0.00 0.00 55.97 54.30 1o91 s LYS 692 Cb -0.51 -4.56 0.00 0.00 -1.68 0.00 0.00 37.83 31.08 1o91 s LYS 692 CO 0.38 -1.87 0.00 1.17 -0.76 0.00 0.00 175.35 174.27 1o91 n LYS 693 N 7.57 0.00 -1.36 1.68 4.81 -1.26 0.14 118.16 129.74 1o91 n LYS 693 Ca 0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.51 1o91 n LYS 693 Cb 0.47 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.52 1o91 n LYS 693 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1o91 n GLY 694 N 0.00 0.48 2.91 3.14 0.00 -1.26 -5.05 105.19 105.41 1o91 n GLY 694 Ca 0.00 -0.92 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 1o91 n GLY 694 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1o91 s PHE 695 N -2.10 0.78 0.36 1.61 0.40 0.37 -5.12 117.98 114.29 1o91 s PHE 695 Ca 0.00 -0.22 -0.28 0.00 -0.60 0.00 0.00 56.93 55.83 1o91 s PHE 695 Cb 0.00 -0.66 -0.11 0.00 0.51 0.00 0.00 43.02 42.76 1o91 s PHE 695 CO 0.00 -0.17 1.41 -1.17 0.70 0.00 0.00 175.22 175.99 1o91 s LEU 696 N 0.76 4.37 0.27 -0.37 2.96 -1.26 -4.10 118.68 121.30 1o91 s LEU 696 Ca -0.11 2.89 0.03 0.00 -0.22 0.00 0.00 54.13 56.73 1o91 s LEU 696 Cb -0.13 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 42.86 1o91 s LEU 696 CO 0.01 -0.72 0.20 -0.62 -1.32 0.00 0.00 176.35 173.89 1o91 s ASP 697 N -0.29 1.04 -0.02 3.68 3.68 -0.70 -4.99 116.67 119.07 1o91 s ASP 697 Ca 0.51 -1.59 -0.14 0.00 2.13 0.00 0.00 52.55 53.46 1o91 s ASP 697 Cb -0.44 0.46 0.02 0.00 -1.45 0.00 0.00 42.92 41.52 1o91 s ASP 697 CO 0.59 -0.95 0.30 -1.58 0.13 0.00 0.00 175.17 173.66 1o91 s GLN 698 N -3.78 0.65 0.03 4.34 0.74 -1.26 -0.26 119.66 120.12 1o91 s GLN 698 Ca 0.39 -0.17 0.02 0.00 0.05 0.00 0.00 55.36 55.65 1o91 s GLN 698 Cb 0.05 0.29 -0.02 0.00 1.10 0.00 0.00 33.01 34.42 1o91 s GLN 698 CO 0.20 -0.17 -0.06 0.00 -0.55 0.00 0.00 175.29 174.70 1o91 s ALA 699 N -1.25 0.44 0.31 1.58 0.00 -0.30 -4.96 121.76 117.58 1o91 s ALA 699 Ca -0.13 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 51.20 1o91 s ALA 699 Cb -0.05 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1o91 s ALA 699 CO 0.04 -0.04 0.15 -1.12 0.00 0.00 0.00 175.76 174.79 1o91 s SER 700 N -1.39 1.66 0.08 0.00 0.01 -1.26 -0.88 113.70 111.93 1o91 s SER 700 Ca -0.10 -1.55 -0.26 0.00 1.31 0.00 0.00 55.95 55.35 1o91 s SER 700 Cb -0.09 0.36 0.08 0.00 0.21 0.00 0.00 66.02 66.58 1o91 s SER 700 CO 0.00 -0.87 0.88 -0.83 0.41 0.00 0.00 173.24 172.83 1o91 s GLY 701 N -3.40 -0.38 -0.07 3.44 0.00 -0.56 -4.99 107.32 101.37 1o91 s GLY 701 Ca 0.35 0.56 -0.30 0.00 0.00 0.00 0.00 44.72 45.33 1o91 s GLY 701 CO 0.17 0.17 0.75 -1.35 0.00 0.00 0.00 173.10 172.84 1o91 s SER 702 N -2.70 -0.59 -0.06 1.64 1.04 -1.26 -0.84 113.70 110.92 1o91 s SER 702 Ca 0.08 0.61 -0.29 0.00 0.48 0.00 0.00 55.95 56.82 1o91 s SER 702 Cb -0.01 0.49 0.07 0.00 0.10 0.00 0.00 66.02 66.66 1o91 s SER 702 CO -0.04 -0.56 0.65 0.00 0.98 0.00 0.00 173.24 174.26 1o91 s ALA 703 N -1.30 -1.68 -0.20 5.32 0.00 0.34 -4.97 121.76 119.26 1o91 s ALA 703 Ca -0.08 1.29 -0.11 0.00 0.00 0.00 0.00 51.96 53.06 1o91 s ALA 703 Cb -0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.98 1o91 s ALA 703 CO 0.07 -0.36 0.16 0.08 0.00 0.00 0.00 175.76 175.71 1o91 s VAL 704 N -1.08 5.39 -0.00 0.00 1.01 -1.26 -0.74 120.40 123.72 1o91 s VAL 704 Ca -0.10 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1o91 s VAL 704 Cb -0.01 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.88 1o91 s VAL 704 CO 0.09 0.42 -0.00 -0.76 0.00 0.00 0.00 175.10 174.85 1o91 s LEU 705 N 0.45 1.82 -0.19 3.92 1.43 0.12 -4.98 118.68 121.25 1o91 s LEU 705 Ca 0.09 -0.00 -0.22 0.00 -1.03 0.00 0.00 54.13 52.96 1o91 s LEU 705 Cb -0.12 -0.05 -0.02 0.00 0.03 0.00 0.00 46.19 46.03 1o91 s LEU 705 CO -0.01 -0.02 0.70 -0.22 0.23 0.00 0.00 176.35 177.04 1o91 s LEU 706 N 0.21 4.16 0.11 1.79 2.96 -1.26 -0.38 118.68 126.26 1o91 s LEU 706 Ca -0.02 0.96 0.10 0.00 -0.22 0.00 0.00 54.13 54.95 1o91 s LEU 706 Cb -0.03 -3.01 -0.04 0.00 0.50 0.00 0.00 46.19 43.61 1o91 s LEU 706 CO -0.01 -0.32 -0.24 -0.76 -1.32 0.00 0.00 176.35 173.71 1o91 s LEU 707 N 1.99 2.43 0.23 -0.68 1.43 0.45 -4.98 118.68 119.55 1o91 s LEU 707 Ca 0.32 -0.66 0.11 0.00 -1.03 0.00 0.00 54.13 52.87 1o91 s LEU 707 Cb -0.16 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 1o91 s LEU 707 CO 0.11 0.19 -0.15 -0.13 0.23 0.00 0.00 176.35 176.61 1o91 s ARG 708 N -1.96 1.85 0.12 1.70 0.52 -1.26 -1.61 118.95 118.31 1o91 s ARG 708 Ca 0.15 -1.52 -0.35 0.00 -0.52 0.00 0.00 55.73 53.49 1o91 s ARG 708 Cb -0.10 -1.96 -0.16 0.00 0.52 0.00 0.00 34.95 33.24 1o91 s ARG 708 CO 0.07 0.38 1.26 -2.30 0.02 0.00 0.00 175.30 174.73 1o91 n PRO 709 N -0.28 1.15 0.00 3.54 -0.02 -1.26 -1.17 135.00 136.96 1o91 n PRO 709 Ca -0.09 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1o91 n PRO 709 Cb 0.58 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1o91 n PRO 709 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1o91 n GLY 710 N 2.30 3.14 3.68 -1.23 0.00 -0.10 -4.99 105.19 107.99 1o91 n GLY 710 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1o91 n GLY 710 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1o91 n ASP 711 N 0.10 2.22 -4.24 1.61 8.00 -0.32 -4.65 116.55 119.28 1o91 n ASP 711 Ca 0.00 1.07 -0.32 0.00 0.71 0.00 0.00 54.79 56.26 1o91 n ASP 711 Cb 0.00 -1.47 -0.17 0.00 -0.02 0.00 0.00 41.12 39.46 1o91 n ASP 711 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1o91 s GLN 712 N -2.23 2.88 -0.07 -1.24 -0.21 -1.26 -0.84 119.66 116.70 1o91 s GLN 712 Ca 0.63 -0.89 0.04 0.00 0.02 0.00 0.00 55.36 55.16 1o91 s GLN 712 Cb -0.51 -2.25 0.00 0.00 1.00 0.00 0.00 33.01 31.25 1o91 s GLN 712 CO 0.57 0.25 -0.19 0.08 -2.12 0.00 0.00 175.29 173.88 1o91 s VAL 713 N 0.17 1.62 0.27 1.09 1.01 -0.07 0.65 120.40 125.13 1o91 s VAL 713 Ca -0.14 -0.79 -0.21 0.00 0.00 0.00 0.00 61.98 60.85 1o91 s VAL 713 Cb -0.17 -1.41 0.04 0.00 0.00 0.00 0.00 36.38 34.84 1o91 s VAL 713 CO 0.07 0.46 0.79 0.72 0.00 0.00 0.00 175.10 177.14 1o91 s PHE 714 N 0.29 -0.12 -0.07 5.22 -0.12 -1.04 -0.90 117.98 121.24 1o91 s PHE 714 Ca -0.12 -0.34 -0.01 0.00 -0.05 0.00 0.00 56.93 56.42 1o91 s PHE 714 Cb -0.15 0.72 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 1o91 s PHE 714 CO 0.05 -1.20 -0.03 -0.51 -0.05 0.00 0.00 175.22 173.48 1o91 s LEU 715 N -2.97 3.40 -0.18 -1.99 1.43 -1.26 -0.28 118.68 116.85 1o91 s LEU 715 Ca 0.12 0.07 -0.16 0.00 -1.03 0.00 0.00 54.13 53.13 1o91 s LEU 715 Cb -0.05 -1.77 0.05 0.00 0.03 0.00 0.00 46.19 44.44 1o91 s LEU 715 CO 0.07 0.37 0.47 -1.58 0.23 0.00 0.00 176.35 175.90 1o91 s GLN 716 N -0.89 0.54 -0.22 1.70 0.74 -0.63 -0.50 119.66 120.41 1o91 s GLN 716 Ca 0.13 0.66 -0.17 0.00 0.05 0.00 0.00 55.36 56.03 1o91 s GLN 716 Cb -0.11 0.25 -0.04 0.00 1.10 0.00 0.00 33.01 34.22 1o91 s GLN 716 CO 0.02 -0.07 0.45 -1.64 -0.55 0.00 0.00 175.29 173.50 1o91 s MET 717 N 0.30 4.15 0.42 1.67 -1.94 -1.26 -1.22 119.30 121.42 1o91 s MET 717 Ca -0.00 0.27 0.23 0.00 -1.71 0.00 0.00 55.69 54.47 1o91 s MET 717 Cb -0.03 -3.57 0.31 0.00 2.01 0.00 0.00 34.83 33.54 1o91 s MET 717 CO -0.00 -0.14 1.57 -1.35 -0.01 0.00 0.00 175.02 175.09 1o91 h PRO 718 N 7.57 0.00 -5.28 2.03 0.11 -1.91 0.17 132.00 134.68 1o91 h PRO 718 Ca -0.34 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.30 1o91 h PRO 718 Cb 1.16 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.99 1o91 h PRO 718 CO 0.72 0.02 -0.81 0.45 -0.21 0.00 0.00 178.00 178.17 1o91 s SER 719 N -6.17 1.64 0.55 -2.05 0.15 -1.26 -4.71 113.70 101.85 1o91 s SER 719 Ca 0.06 -0.31 0.34 0.00 0.70 0.00 0.00 55.95 56.75 1o91 s SER 719 Cb 0.05 -0.16 1.37 0.00 -1.71 0.00 0.00 66.02 65.57 1o91 s SER 719 CO 0.68 0.13 1.99 -0.33 1.20 0.00 0.00 173.24 176.91 1o91 h GLU 720 N 5.57 0.00 0.00 5.44 4.39 -1.98 -2.54 114.58 125.46 1o91 h GLU 720 Ca -0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.35 1o91 h GLU 720 Cb 1.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1o91 h GLU 720 CO 0.48 0.00 0.00 1.04 -1.16 0.00 0.00 179.01 179.37 1o91 n GLN 721 N -3.09 0.15 -2.93 2.33 6.02 -1.26 -4.00 117.38 114.61 1o91 n GLN 721 Ca 0.01 0.10 -0.14 0.00 -0.01 0.00 0.00 57.00 56.95 1o91 n GLN 721 Cb 0.31 -1.50 0.01 0.00 1.02 0.00 0.00 30.24 30.07 1o91 n GLN 721 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1o91 n ALA 722 N -1.40 0.18 -1.20 -1.58 0.00 -0.96 -4.66 120.51 110.89 1o91 n ALA 722 Ca 0.08 -2.22 0.07 0.00 0.00 0.00 0.00 53.44 51.37 1o91 n ALA 722 Cb 0.22 -1.11 0.19 0.00 0.00 0.00 0.00 19.45 18.75 1o91 n ALA 722 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o91 n ALA 723 N 1.34 2.94 -0.32 0.00 0.00 -0.82 -1.58 120.51 122.07 1o91 n ALA 723 Ca 0.14 -2.74 0.00 0.00 0.00 0.00 0.00 53.44 50.84 1o91 n ALA 723 Cb 0.61 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1o91 n ALA 723 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o91 n GLY 724 N -1.13 2.02 3.62 0.00 0.00 0.03 -4.75 105.19 104.97 1o91 n GLY 724 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1o91 n GLY 724 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1o91 s LEU 725 N 0.00 3.77 0.12 0.99 0.20 -1.26 -2.33 118.68 120.17 1o91 s LEU 725 Ca 0.00 1.26 0.02 0.00 0.69 0.00 0.00 54.13 56.10 1o91 s LEU 725 Cb 0.00 -3.54 -0.04 0.00 -0.43 0.00 0.00 46.19 42.19 1o91 s LEU 725 CO 0.00 -1.30 0.22 -0.47 -0.29 0.00 0.00 176.35 174.51 1o91 s TYR 726 N 5.20 3.41 -0.01 5.38 5.04 0.24 -0.88 117.35 135.73 1o91 s TYR 726 Ca 0.65 0.12 -0.28 0.00 -2.44 0.00 0.00 57.07 55.12 1o91 s TYR 726 Cb -0.19 -1.66 0.09 0.00 0.35 0.00 0.00 41.96 40.55 1o91 s TYR 726 CO 0.29 0.54 0.76 0.00 -1.34 0.00 0.00 175.55 175.79 1o91 s ALA 727 N -1.65 -1.77 0.30 3.97 0.00 -1.26 -3.84 121.76 117.51 1o91 s ALA 727 Ca 0.34 1.10 -0.18 0.00 0.00 0.00 0.00 51.96 53.22 1o91 s ALA 727 Cb -0.11 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.20 1o91 s ALA 727 CO 0.27 -0.52 0.69 0.20 0.00 0.00 0.00 175.76 176.40 1o91 s GLY 728 N -1.82 0.14 0.40 0.00 0.00 0.15 -3.01 107.32 103.19 1o91 s GLY 728 Ca -0.03 -0.52 0.12 0.00 0.00 0.00 0.00 44.72 44.29 1o91 s GLY 728 CO -0.01 -0.24 1.93 1.46 0.00 0.00 0.00 173.10 176.24 1o91 h GLN 729 N 2.04 0.52 -0.08 2.90 4.20 -1.92 -1.81 115.11 120.96 1o91 h GLN 729 Ca -0.23 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1o91 h GLN 729 Cb 1.25 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.91 1o91 h GLN 729 CO 0.29 0.34 0.00 0.66 -0.67 0.00 0.00 178.83 179.45 1o91 n TYR 730 N -4.49 0.27 -3.45 2.96 4.02 -1.26 -4.81 117.16 110.40 1o91 n TYR 730 Ca 0.13 -0.90 -0.29 0.00 -0.01 0.00 0.00 57.90 56.84 1o91 n TYR 730 Cb 0.43 -0.18 -0.12 0.00 -0.02 0.00 0.00 39.34 39.45 1o91 n TYR 730 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1o91 s VAL 731 N -2.61 0.16 -0.08 -0.72 1.01 -0.68 -5.13 120.40 112.36 1o91 s VAL 731 Ca 0.31 -1.85 -0.24 0.00 0.00 0.00 0.00 61.98 60.21 1o91 s VAL 731 Cb 0.26 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 1o91 s VAL 731 CO 0.05 -1.03 0.72 -1.00 0.00 0.00 0.00 175.10 173.84 1o91 s HIS 732 N 0.92 3.56 0.02 5.22 3.76 -1.25 0.35 115.29 127.87 1o91 s HIS 732 Ca 0.20 1.25 -0.02 0.00 -0.15 0.00 0.00 55.06 56.34 1o91 s HIS 732 Cb -0.19 -2.84 -0.04 0.00 1.11 0.00 0.00 32.58 30.62 1o91 s HIS 732 CO -0.02 0.04 0.21 -1.12 -0.85 0.00 0.00 174.74 173.00 1o91 s SER 733 N 0.86 6.38 0.22 1.40 0.01 -1.21 -4.86 113.70 116.49 1o91 s SER 733 Ca 0.38 0.35 -0.06 0.00 1.31 0.00 0.00 55.95 57.93 1o91 s SER 733 Cb -0.18 -2.00 -0.02 0.00 0.21 0.00 0.00 66.02 64.03 1o91 s SER 733 CO 0.18 0.22 0.28 -0.94 0.41 0.00 0.00 173.24 173.38 1o91 s SER 734 N -2.14 0.05 -0.15 2.44 1.04 0.42 -0.09 113.70 115.27 1o91 s SER 734 Ca 0.31 -1.17 -0.07 0.00 0.48 0.00 0.00 55.95 55.50 1o91 s SER 734 Cb -0.13 0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.52 1o91 s SER 734 CO 0.22 -0.96 0.34 0.12 0.98 0.00 0.00 173.24 173.94 1o91 s PHE 735 N -4.09 -0.55 0.14 5.02 5.36 -0.45 -1.41 117.98 122.00 1o91 s PHE 735 Ca 0.31 1.17 0.05 0.00 -0.96 0.00 0.00 56.93 57.49 1o91 s PHE 735 Cb 0.04 0.15 -0.04 0.00 -0.34 0.00 0.00 43.02 42.83 1o91 s PHE 735 CO 0.10 -0.36 -0.11 -1.12 -1.46 0.00 0.00 175.22 172.26 1o91 s SER 736 N 1.97 1.89 -0.15 6.13 0.01 0.11 -0.96 113.70 122.70 1o91 s SER 736 Ca -0.04 -0.95 -0.30 0.00 1.31 0.00 0.00 55.95 55.97 1o91 s SER 736 Cb -0.11 -0.04 0.12 0.00 0.21 0.00 0.00 66.02 66.20 1o91 s SER 736 CO -0.11 -0.26 0.94 -0.83 0.41 0.00 0.00 173.24 173.39 1o91 s GLY 737 N -2.95 -0.31 0.04 3.44 0.00 -0.69 -1.06 107.32 105.78 1o91 s GLY 737 Ca 0.14 1.97 -0.27 0.00 0.00 0.00 0.00 44.72 46.56 1o91 s GLY 737 CO 0.02 1.10 0.66 -2.52 0.00 0.00 0.00 173.10 172.36 1o91 s TYR 738 N -0.98 -0.59 0.09 1.90 -0.85 -0.55 -0.71 117.35 115.66 1o91 s TYR 738 Ca -0.03 0.74 -0.30 0.00 -0.52 0.00 0.00 57.07 56.96 1o91 s TYR 738 Cb -0.01 0.48 -0.06 0.00 0.38 0.00 0.00 41.96 42.75 1o91 s TYR 738 CO 0.02 -0.70 1.17 -1.17 -1.52 0.00 0.00 175.55 173.36 1o91 s LEU 739 N -1.89 4.40 -0.21 -3.49 2.96 -0.63 -1.57 118.68 118.25 1o91 s LEU 739 Ca -0.05 2.04 -0.16 0.00 -0.22 0.00 0.00 54.13 55.74 1o91 s LEU 739 Cb -0.00 -3.59 -0.08 0.00 0.50 0.00 0.00 46.19 43.02 1o91 s LEU 739 CO -0.01 -0.41 -0.31 0.18 -1.32 0.00 0.00 176.35 174.48 1o91 n LEU 740 N 3.50 1.93 -3.76 -0.68 4.77 0.16 -4.94 117.00 117.98 1o91 n LEU 740 Ca 0.07 0.37 -0.22 0.00 -0.03 0.00 0.00 56.01 56.20 1o91 n LEU 740 Cb 0.46 -0.79 -0.18 0.00 -2.33 0.00 0.00 43.42 40.59 1o91 n LEU 740 CO 0.55 -0.02 -0.37 -0.31 -1.33 0.00 0.00 177.39 175.91 1o91 s TYR 741 N -2.71 0.53 0.20 -1.77 1.51 -1.06 -4.99 117.35 109.07 1o91 s TYR 741 Ca -0.31 -0.07 -0.31 0.00 -1.01 0.00 0.00 57.07 55.38 1o91 s TYR 741 Cb 0.07 -0.71 -0.10 0.00 -0.11 0.00 0.00 41.96 41.11 1o91 s TYR 741 CO 0.44 -0.29 1.44 -2.14 -1.11 0.00 0.00 175.55 173.89 1o91 s PRO 742 N 1.94 4.28 0.00 -1.71 0.02 -1.26 -0.92 135.00 137.35 1o91 s PRO 742 Ca 0.04 2.25 0.08 0.00 0.02 0.00 0.00 61.00 63.39 1o91 s PRO 742 Cb -0.12 -3.15 0.06 0.00 0.02 0.00 0.00 34.50 31.31 1o91 s PRO 742 CO -0.04 -0.44 0.75 -1.33 -0.33 0.00 0.00 177.00 175.60