#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 3.08 -0.22 3.49 -1.94 -1.26 -4.75 119.30 117.71 1o91 s MET 614 Ca 0.00 -0.73 -0.29 0.00 -1.71 0.00 0.00 55.69 52.96 1o91 s MET 614 Cb 0.00 -2.78 -0.02 0.00 2.01 0.00 0.00 34.83 34.05 1o91 s MET 614 CO 0.00 0.52 1.44 -2.14 -0.01 0.00 0.00 175.02 174.83 1o91 s PRO 615 N -2.96 3.97 -0.28 2.03 0.02 -1.26 -4.21 135.00 132.31 1o91 s PRO 615 Ca 0.32 1.58 -0.24 0.00 0.02 0.00 0.00 61.00 62.68 1o91 s PRO 615 Cb -0.11 -3.92 0.11 0.00 0.02 0.00 0.00 34.50 30.60 1o91 s PRO 615 CO 0.25 -1.06 0.96 0.00 -0.33 0.00 0.00 177.00 176.81 1o91 s ALA 616 N 4.43 -1.95 0.17 -1.55 0.00 -1.24 -1.17 121.76 120.46 1o91 s ALA 616 Ca 0.63 1.94 -0.18 0.00 0.00 0.00 0.00 51.96 54.35 1o91 s ALA 616 Cb -0.22 -1.40 0.04 0.00 0.00 0.00 0.00 23.12 21.53 1o91 s ALA 616 CO 0.24 -0.27 0.50 -0.59 0.00 0.00 0.00 175.76 175.64 1o91 s PHE 617 N 0.36 -0.21 -0.14 0.00 -0.12 0.38 -0.34 117.98 117.90 1o91 s PHE 617 Ca 0.02 -0.10 -0.06 0.00 -0.05 0.00 0.00 56.93 56.73 1o91 s PHE 617 Cb -0.05 0.38 0.06 0.00 -0.63 0.00 0.00 43.02 42.78 1o91 s PHE 617 CO -0.06 -0.84 0.31 0.99 -0.05 0.00 0.00 175.22 175.58 1o91 s THR 618 N -3.83 -0.24 -0.00 -4.49 2.01 -1.00 -1.61 115.64 106.48 1o91 s THR 618 Ca 0.06 0.18 0.04 0.00 0.31 0.00 0.00 61.69 62.27 1o91 s THR 618 Cb -0.00 -0.49 -0.01 0.00 0.01 0.00 0.00 72.50 72.01 1o91 s THR 618 CO -0.07 0.07 -0.11 0.00 -0.69 0.00 0.00 174.62 173.82 1o91 s ALA 619 N 1.84 0.93 0.15 7.40 0.00 -0.11 -1.19 121.76 130.79 1o91 s ALA 619 Ca -0.05 -0.52 0.09 0.00 0.00 0.00 0.00 51.96 51.48 1o91 s ALA 619 Cb -0.11 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1o91 s ALA 619 CO -0.10 0.21 -0.14 -1.21 0.00 0.00 0.00 175.76 174.52 1o91 s GLU 620 N -0.40 1.90 -0.12 0.00 2.02 0.74 -1.39 118.70 121.44 1o91 s GLU 620 Ca 0.03 -1.25 -0.04 0.00 0.02 0.00 0.00 54.97 53.74 1o91 s GLU 620 Cb -0.05 -2.12 -0.03 0.00 0.10 0.00 0.00 34.13 32.03 1o91 s GLU 620 CO -0.00 0.45 0.02 -1.17 0.02 0.00 0.00 175.26 174.58 1o91 s LEU 621 N -2.52 3.65 0.00 1.80 2.96 0.41 -1.53 118.68 123.45 1o91 s LEU 621 Ca 0.22 0.11 0.00 0.00 -0.22 0.00 0.00 54.13 54.24 1o91 s LEU 621 Cb -0.09 -1.87 0.00 0.00 0.50 0.00 0.00 46.19 44.73 1o91 s LEU 621 CO 0.13 0.30 0.63 0.35 -1.32 0.00 0.00 176.35 176.43 1o91 n THR 622 N 2.70 0.36 -4.75 3.68 -2.24 -1.26 -3.14 114.28 109.64 1o91 n THR 622 Ca -0.18 -0.59 -0.26 0.00 -2.27 0.00 0.00 64.05 60.75 1o91 n THR 622 Cb 0.53 0.92 -0.17 0.00 -2.10 0.00 0.00 70.33 69.52 1o91 n THR 622 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1o91 s VAL 623 N -0.36 1.36 0.66 2.28 1.01 -1.26 -3.02 120.40 121.07 1o91 s VAL 623 Ca 0.00 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.24 1o91 s VAL 623 Cb 0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 1o91 s VAL 623 CO 0.00 0.40 1.05 -2.16 0.00 0.00 0.00 175.10 174.39 1o91 s PRO 624 N 0.51 3.15 -0.99 2.72 0.04 -1.07 -4.46 135.00 134.90 1o91 s PRO 624 Ca -0.14 0.95 -0.05 0.00 0.04 0.00 0.00 61.00 61.79 1o91 s PRO 624 Cb -0.16 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.31 1o91 s PRO 624 CO 0.05 -0.93 0.88 1.19 0.04 0.00 0.00 177.00 178.23 1o91 n PHE 625 N -2.86 -2.51 -1.38 0.56 0.99 0.42 -4.91 117.46 107.76 1o91 n PHE 625 Ca 0.07 0.89 -0.29 0.00 -0.00 0.00 0.00 57.45 58.12 1o91 n PHE 625 Cb 0.54 -4.11 0.14 0.00 -1.00 0.00 0.00 39.48 35.05 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 -4.18 1.00 0.44 -1.08 0.04 -1.26 -4.97 135.00 125.00 1o91 s PRO 626 Ca 0.39 0.45 -0.24 0.00 0.04 0.00 0.00 61.00 61.64 1o91 s PRO 626 Cb -0.05 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.59 1o91 s PRO 626 CO 0.73 -2.33 1.16 -2.30 0.04 0.00 0.00 177.00 174.31 1o91 n PRO 627 N -3.88 1.63 -3.43 0.56 -0.02 -1.26 -4.99 135.00 123.61 1o91 n PRO 627 Ca 0.06 0.58 -0.33 0.00 -2.02 0.00 0.00 63.50 61.79 1o91 n PRO 627 Cb 0.58 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.74 1o91 n PRO 627 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1o91 s VAL 628 N -1.26 4.93 -0.16 -1.45 1.01 -1.26 -4.25 120.40 117.96 1o91 s VAL 628 Ca 0.64 0.58 0.00 0.00 0.00 0.00 0.00 61.98 63.20 1o91 s VAL 628 Cb -0.51 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1o91 s VAL 628 CO 0.56 0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.36 1o91 n GLY 629 N 0.35 0.52 3.17 4.51 0.00 0.28 -5.00 105.19 109.02 1o91 n GLY 629 Ca -0.03 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.00 -0.32 0.31 4.61 0.00 -1.26 -5.03 121.76 118.09 1o91 s ALA 630 Ca 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 51.96 51.36 1o91 s ALA 630 Cb 0.00 0.27 -0.13 0.00 0.00 0.00 0.00 23.12 23.26 1o91 s ALA 630 CO 0.00 -0.35 1.33 -2.30 0.00 0.00 0.00 175.76 174.44 1o91 n PRO 631 N 0.73 2.13 -2.39 0.00 -0.02 -1.26 -4.49 135.00 129.70 1o91 n PRO 631 Ca -0.19 0.75 -0.43 0.00 -2.02 0.00 0.00 63.50 61.61 1o91 n PRO 631 Cb 0.59 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 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 -0.79 4.21 -1.42 -1.45 1.01 -0.38 -4.80 120.40 116.79 1o91 s VAL 632 Ca 0.59 1.48 -0.15 0.00 0.00 0.00 0.00 61.98 63.90 1o91 s VAL 632 Cb -0.58 -3.95 0.04 0.00 0.00 0.00 0.00 36.38 31.88 1o91 s VAL 632 CO 0.59 -0.11 2.15 0.29 0.00 0.00 0.00 175.10 178.01 1o91 n LYS 633 N 6.43 2.86 -1.85 2.72 5.02 -1.26 -4.42 118.16 127.66 1o91 n LYS 633 Ca 0.14 -2.68 -0.42 0.00 -2.02 0.00 0.00 58.31 53.32 1o91 n LYS 633 Cb 0.45 -3.31 -0.03 0.00 -0.02 0.00 0.00 35.03 32.12 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 3.44 1.65 -0.35 2.13 0.40 -1.26 -4.85 117.98 119.14 1o91 s PHE 634 Ca 0.48 -0.09 0.03 0.00 -0.60 0.00 0.00 56.93 56.75 1o91 s PHE 634 Cb 0.12 -4.07 0.01 0.00 0.51 0.00 0.00 43.02 39.60 1o91 s PHE 634 CO -0.06 -4.62 0.51 -0.40 0.70 0.00 0.00 175.22 171.35 1o91 n ASP 635 N 7.41 1.06 -4.36 1.36 3.85 -0.84 -4.56 116.55 120.47 1o91 n ASP 635 Ca 0.19 -1.03 -0.45 0.00 -0.71 0.00 0.00 54.79 52.79 1o91 n ASP 635 Cb 0.42 0.19 -0.06 0.00 -1.35 0.00 0.00 41.12 40.32 1o91 n ASP 635 CO 0.00 0.00 0.00 -0.75 -1.01 0.00 0.00 177.20 175.44 1o91 s LYS 636 N -0.46 3.00 0.11 0.11 2.20 -0.58 -4.89 119.74 119.24 1o91 s LYS 636 Ca 0.03 -1.45 -0.24 0.00 -0.36 0.00 0.00 55.97 53.96 1o91 s LYS 636 Cb 0.03 -4.21 -0.07 0.00 -1.51 0.00 0.00 37.83 32.06 1o91 s LYS 636 CO 0.05 -1.23 0.71 -0.51 -0.36 0.00 0.00 175.35 174.02 1o91 s LEU 637 N 1.84 4.54 -0.17 5.43 1.43 -1.26 -0.19 118.68 130.31 1o91 s LEU 637 Ca 0.06 1.48 0.11 0.00 -1.03 0.00 0.00 54.13 54.75 1o91 s LEU 637 Cb -0.26 -3.16 -0.18 0.00 0.03 0.00 0.00 46.19 42.62 1o91 s LEU 637 CO 0.06 0.18 -0.01 0.18 0.23 0.00 0.00 176.35 176.99 1o91 n LEU 638 N 1.94 0.83 -3.51 1.79 4.32 -0.33 -5.00 117.00 117.03 1o91 n LEU 638 Ca -0.06 -0.03 -0.13 0.00 -0.02 0.00 0.00 56.01 55.77 1o91 n LEU 638 Cb 0.50 0.08 -0.04 0.00 -1.62 0.00 0.00 43.42 42.34 1o91 n LEU 638 CO 0.45 0.51 0.56 -0.47 -1.22 0.00 0.00 177.39 177.23 1o91 s TYR 639 N -2.39 -0.50 -0.47 -1.77 5.04 -1.24 -4.96 117.35 111.05 1o91 s TYR 639 Ca -0.13 0.67 0.06 0.00 -2.44 0.00 0.00 57.07 55.22 1o91 s TYR 639 Cb 0.05 0.48 0.27 0.00 0.35 0.00 0.00 41.96 43.11 1o91 s TYR 639 CO 0.60 -0.58 1.00 -1.71 -1.34 0.00 0.00 175.55 173.51 1o91 n ASN 640 N 0.38 -2.63 -4.69 4.32 5.15 -1.22 -2.36 115.26 114.20 1o91 n ASN 640 Ca -0.14 -3.44 -0.44 0.00 -0.60 0.00 0.00 54.58 49.95 1o91 n ASN 640 Cb 0.60 1.86 -0.04 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 1.09 1.28 3.53 8.20 0.00 0.54 -1.12 105.19 118.71 1o91 n GLY 641 Ca 0.07 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.73 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 3.58 -0.02 -3.86 1.61 1.74 -1.26 -3.66 116.66 114.79 1o91 n ARG 642 Ca 0.16 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.95 1o91 n ARG 642 Cb 0.31 -3.60 0.02 0.00 -1.02 0.00 0.00 32.46 28.17 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 -1.98 -5.32 0.11 5.56 6.02 -0.28 -4.86 117.38 116.64 1o91 n GLN 643 Ca 0.00 0.59 0.13 0.00 -0.01 0.00 0.00 57.00 57.71 1o91 n GLN 643 Cb 0.00 -5.47 0.41 0.00 1.02 0.00 0.00 30.24 26.21 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 -2.78 0.82 -4.80 1.08 3.02 -1.24 -4.71 115.26 106.65 1o91 n ASN 644 Ca 0.04 0.59 -0.36 0.00 -0.03 0.00 0.00 54.58 54.82 1o91 n ASN 644 Cb 0.53 -0.81 -0.07 0.00 -0.61 0.00 0.00 39.78 38.81 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 -3.14 3.45 -0.30 3.10 5.04 -1.26 -0.97 117.35 123.26 1o91 s TYR 645 Ca 0.09 0.39 -0.02 0.00 -2.44 0.00 0.00 57.07 55.09 1o91 s TYR 645 Cb 0.12 -1.94 0.05 0.00 0.35 0.00 0.00 41.96 40.54 1o91 s TYR 645 CO 0.57 0.58 0.01 1.21 -1.34 0.00 0.00 175.55 176.57 1o91 s ASN 646 N -0.74 4.92 0.42 4.32 3.84 -0.47 -4.97 114.94 122.26 1o91 s ASN 646 Ca 0.13 -1.27 0.29 0.00 0.21 0.00 0.00 52.86 52.22 1o91 s ASN 646 Cb -0.12 -1.72 1.42 0.00 -0.55 0.00 0.00 41.25 40.29 1o91 s ASN 646 CO 0.03 -0.27 1.88 1.55 -2.79 0.00 0.00 177.10 177.50 1o91 h PRO 647 N 8.01 0.00 0.00 0.43 0.13 -1.89 0.34 132.00 139.03 1o91 h PRO 647 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1o91 h PRO 647 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1o91 h PRO 647 CO 0.54 0.00 -0.21 1.04 -0.23 0.00 0.00 178.00 179.14 1o91 n GLN 648 N -2.57 0.09 0.00 0.86 6.02 -1.26 -4.14 117.38 116.38 1o91 n GLN 648 Ca -0.00 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1o91 n GLN 648 Cb 0.14 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 29.82 1o91 n GLN 648 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1o91 n THR 649 N -1.74 0.00 -1.05 5.09 -2.24 -0.72 -5.02 114.28 108.61 1o91 n THR 649 Ca 0.06 -0.04 -0.02 0.00 -2.27 0.00 0.00 64.05 61.78 1o91 n THR 649 Cb 0.37 0.39 -0.01 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.23 0.53 3.55 3.38 0.00 0.11 -4.61 105.19 109.38 1o91 n GLY 650 Ca 0.00 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.98 3.60 -0.24 -0.61 1.01 -1.22 -4.56 121.20 117.21 1o91 s ILE 651 Ca 0.00 -0.51 -0.09 0.00 0.00 0.00 0.00 60.65 60.05 1o91 s ILE 651 Cb 0.00 -2.48 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 1o91 s ILE 651 CO 0.00 0.58 0.11 0.12 0.00 0.00 0.00 174.94 175.76 1o91 s PHE 652 N -0.61 3.19 -0.20 3.97 5.36 -0.23 -1.36 117.98 128.10 1o91 s PHE 652 Ca 0.09 -0.06 -0.05 0.00 -0.96 0.00 0.00 56.93 55.95 1o91 s PHE 652 Cb -0.12 -2.24 -0.03 0.00 -0.34 0.00 0.00 43.02 40.29 1o91 s PHE 652 CO 0.02 -0.12 0.00 0.99 -1.46 0.00 0.00 175.22 174.65 1o91 s THR 653 N 1.28 4.01 -0.05 0.12 2.01 -0.14 -0.87 115.64 122.00 1o91 s THR 653 Ca 0.06 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 61.46 1o91 s THR 653 Cb -0.14 -2.81 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 1o91 s THR 653 CO 0.05 0.43 1.47 0.00 -0.69 0.00 0.00 174.62 175.89 1o91 n GLU 655 N 6.21 0.39 -3.50 0.00 2.13 -1.26 -0.88 120.64 123.72 1o91 n GLU 655 Ca 0.15 0.13 -0.40 0.00 0.66 0.00 0.00 57.16 57.70 1o91 n GLU 655 Cb 0.43 -1.22 -0.10 0.00 0.27 0.00 0.00 31.44 30.82 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 -2.33 5.26 0.37 6.31 1.01 -1.26 -4.83 120.40 124.94 1o91 s VAL 656 Ca -0.24 -0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.29 1o91 s VAL 656 Cb 0.08 -3.74 -0.11 0.00 0.00 0.00 0.00 36.38 32.61 1o91 s VAL 656 CO 0.34 -0.03 1.48 -2.84 0.00 0.00 0.00 175.10 174.05 1o91 s PRO 657 N 1.78 4.12 0.00 2.72 0.02 -1.26 -4.91 135.00 137.47 1o91 s PRO 657 Ca 0.07 2.56 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1o91 s PRO 657 Cb -0.17 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1o91 s PRO 657 CO 0.11 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 176.66 1o91 n GLY 658 N 0.53 -0.80 3.72 0.52 0.00 -0.98 -0.75 105.19 107.43 1o91 n GLY 658 Ca 0.01 -1.40 -0.38 0.00 0.00 0.00 0.00 46.02 44.26 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 -2.75 5.20 0.30 1.61 1.01 -0.04 -0.24 120.40 125.49 1o91 s VAL 659 Ca 0.00 0.87 0.09 0.00 0.00 0.00 0.00 61.98 62.94 1o91 s VAL 659 Cb 0.00 -3.78 -0.06 0.00 0.00 0.00 0.00 36.38 32.54 1o91 s VAL 659 CO 0.00 0.32 -0.11 -0.31 0.00 0.00 0.00 175.10 175.01 1o91 s TYR 660 N 0.71 2.16 -0.08 5.22 1.51 0.10 0.21 117.35 127.19 1o91 s TYR 660 Ca 0.24 -0.54 0.02 0.00 -1.01 0.00 0.00 57.07 55.78 1o91 s TYR 660 Cb -0.15 -1.17 0.01 0.00 -0.11 0.00 0.00 41.96 40.55 1o91 s TYR 660 CO 0.09 0.48 -0.14 -0.47 -1.11 0.00 0.00 175.55 174.41 1o91 s TYR 661 N -2.76 1.66 0.11 2.71 5.04 -0.59 -0.48 117.35 123.04 1o91 s TYR 661 Ca 0.30 -0.66 0.10 0.00 -2.44 0.00 0.00 57.07 54.37 1o91 s TYR 661 Cb 0.01 -1.20 -0.04 0.00 0.35 0.00 0.00 41.96 41.08 1o91 s TYR 661 CO 0.14 -0.33 -0.24 -0.06 -1.34 0.00 0.00 175.55 173.71 1o91 s PHE 662 N 0.72 2.06 0.01 4.97 0.40 0.01 -1.42 117.98 124.74 1o91 s PHE 662 Ca -0.13 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 55.76 1o91 s PHE 662 Cb -0.16 -1.13 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 1o91 s PHE 662 CO 0.03 0.27 0.07 0.00 0.70 0.00 0.00 175.22 176.29 1o91 s ALA 663 N -1.09 -0.15 -0.01 5.36 0.00 0.03 -0.77 121.76 125.13 1o91 s ALA 663 Ca 0.10 -0.30 -0.14 0.00 0.00 0.00 0.00 51.96 51.62 1o91 s ALA 663 Cb -0.10 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.16 1o91 s ALA 663 CO 0.05 -0.18 0.30 1.52 0.00 0.00 0.00 175.76 177.44 1o91 s TYR 664 N -1.35 -0.16 -0.05 0.00 -0.85 -0.11 -0.65 117.35 114.17 1o91 s TYR 664 Ca -0.15 0.24 -0.02 0.00 -0.52 0.00 0.00 57.07 56.63 1o91 s TYR 664 Cb -0.08 0.09 0.03 0.00 0.38 0.00 0.00 41.96 42.37 1o91 s TYR 664 CO 0.01 -0.38 0.05 -1.01 -1.52 0.00 0.00 175.55 172.69 1o91 s HIS 665 N -1.31 0.22 -0.05 -3.49 3.76 -0.59 -1.41 115.29 112.42 1o91 s HIS 665 Ca -0.13 0.13 0.04 0.00 -0.15 0.00 0.00 55.06 54.95 1o91 s HIS 665 Cb -0.05 -0.57 -0.00 0.00 1.11 0.00 0.00 32.58 33.07 1o91 s HIS 665 CO 0.04 -0.23 -0.18 0.14 -0.85 0.00 0.00 174.74 173.66 1o91 s VAL 666 N 2.12 1.50 0.46 -0.90 -7.23 -0.18 -0.54 120.40 115.63 1o91 s VAL 666 Ca 0.05 -0.74 -0.07 0.00 -1.81 0.00 0.00 61.98 59.41 1o91 s VAL 666 Cb -0.12 -1.30 -0.05 0.00 0.56 0.00 0.00 36.38 35.47 1o91 s VAL 666 CO -0.04 0.43 0.79 -1.00 -0.31 0.00 0.00 175.10 174.98 1o91 s HIS 667 N 0.16 3.54 -0.04 2.82 3.76 -1.23 -1.23 115.29 123.07 1o91 s HIS 667 Ca -0.07 0.91 0.02 0.00 -0.15 0.00 0.00 55.06 55.77 1o91 s HIS 667 Cb -0.13 -2.37 0.01 0.00 1.11 0.00 0.00 32.58 31.20 1o91 s HIS 667 CO 0.03 -0.24 -0.08 0.00 -0.85 0.00 0.00 174.74 173.61 1o91 s LYS 669 N 0.56 0.62 0.00 0.00 2.20 -0.99 -1.29 119.74 120.84 1o91 s LYS 669 Ca -0.09 0.57 0.00 0.00 -0.36 0.00 0.00 55.97 56.09 1o91 s LYS 669 Cb -0.12 0.30 0.00 0.00 -1.51 0.00 0.00 37.83 36.50 1o91 s LYS 669 CO 0.01 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 1o91 n GLY 670 N 1.94 2.86 3.56 5.54 0.00 -1.26 -4.71 105.19 113.12 1o91 n GLY 670 Ca -0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.81 -0.41 0.79 -0.02 0.00 -1.26 -4.99 107.32 100.62 1o91 s GLY 671 Ca 0.00 0.90 -0.12 0.00 0.00 0.00 0.00 44.72 45.50 1o91 s GLY 671 CO 0.00 0.29 1.14 -1.31 0.00 0.00 0.00 173.10 173.22 1o91 s ASN 672 N -2.55 4.00 -0.04 1.64 0.02 -1.26 -3.91 114.94 112.83 1o91 s ASN 672 Ca 0.07 2.10 0.01 0.00 -1.02 0.00 0.00 52.86 54.01 1o91 s ASN 672 Cb -0.01 -2.56 0.02 0.00 0.02 0.00 0.00 41.25 38.73 1o91 s ASN 672 CO -0.06 -2.38 -0.03 0.54 0.02 0.00 0.00 177.10 175.18 1o91 s VAL 673 N -2.52 0.45 -0.15 1.60 0.11 0.04 -0.77 120.40 119.15 1o91 s VAL 673 Ca 0.67 -0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.67 1o91 s VAL 673 Cb -0.22 -0.50 0.02 0.00 -1.53 0.00 0.00 36.38 34.15 1o91 s VAL 673 CO 0.52 0.21 -0.14 0.86 -3.33 0.00 0.00 175.10 173.22 1o91 s TRP 674 N 1.07 2.20 0.17 1.54 -0.00 -1.02 -1.18 118.94 121.72 1o91 s TRP 674 Ca -0.09 -1.25 0.08 0.00 -0.00 0.00 0.00 56.10 54.84 1o91 s TRP 674 Cb -0.14 -1.61 -0.04 0.00 -0.00 0.00 0.00 33.47 31.68 1o91 s TRP 674 CO -0.01 -0.68 -0.16 0.14 -0.00 0.00 0.00 176.95 176.24 1o91 s VAL 675 N 1.48 1.69 0.00 5.86 -7.23 -0.24 -3.96 120.40 118.00 1o91 s VAL 675 Ca 0.05 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.23 1o91 s VAL 675 Cb -0.13 -1.86 -0.00 0.00 0.56 0.00 0.00 36.38 34.94 1o91 s VAL 675 CO -0.11 -0.45 -0.03 0.00 -0.31 0.00 0.00 175.10 174.20 1o91 s ALA 676 N -2.44 0.28 -0.37 1.32 0.00 -0.40 -1.10 121.76 119.04 1o91 s ALA 676 Ca 0.17 -0.20 -0.20 0.00 0.00 0.00 0.00 51.96 51.73 1o91 s ALA 676 Cb -0.04 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.04 1o91 s ALA 676 CO 0.06 0.05 0.60 -1.17 0.00 0.00 0.00 175.76 175.30 1o91 s LEU 677 N -0.25 4.34 0.07 0.00 2.96 -0.16 -1.70 118.68 123.94 1o91 s LEU 677 Ca -0.00 -0.01 -0.03 0.00 -0.22 0.00 0.00 54.13 53.87 1o91 s LEU 677 Cb -0.02 -2.71 -0.05 0.00 0.50 0.00 0.00 46.19 43.91 1o91 s LEU 677 CO -0.00 -0.60 0.27 -0.36 -1.32 0.00 0.00 176.35 174.35 1o91 s PHE 678 N 2.63 3.52 -0.34 5.38 0.40 0.77 -0.68 117.98 129.66 1o91 s PHE 678 Ca 0.22 0.42 0.03 0.00 -0.60 0.00 0.00 56.93 57.00 1o91 s PHE 678 Cb -0.15 -1.89 0.10 0.00 0.51 0.00 0.00 43.02 41.60 1o91 s PHE 678 CO 0.15 0.55 0.06 0.21 0.70 0.00 0.00 175.22 176.89 1o91 s LYS 679 N -2.38 1.31 7.83 0.44 2.20 -0.48 -2.22 119.74 126.43 1o91 s LYS 679 Ca 0.35 -1.71 0.00 0.00 -0.36 0.00 0.00 55.97 54.25 1o91 s LYS 679 Cb -0.13 -2.93 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 1o91 s LYS 679 CO 0.24 -0.95 0.00 0.09 -0.36 0.00 0.00 175.35 174.37 1o91 n ASN 680 N 4.37 0.00 -0.07 1.43 3.02 0.20 -1.83 115.26 122.38 1o91 n ASN 680 Ca 0.03 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.70 1o91 n ASN 680 Cb 0.42 0.00 0.34 0.00 -0.61 0.00 0.00 39.78 39.93 1o91 n ASN 680 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1o91 n ASN 681 N 6.70 0.58 -4.67 6.41 0.23 -1.26 -4.90 115.26 118.35 1o91 n ASN 681 Ca 0.00 -0.36 -0.41 0.00 -0.53 0.00 0.00 54.58 53.28 1o91 n ASN 681 Cb 0.00 0.13 -0.05 0.00 -2.08 0.00 0.00 39.78 37.78 1o91 n ASN 681 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1o91 s GLU 682 N -2.84 4.27 -0.37 -3.83 2.12 -0.76 -5.02 118.70 112.27 1o91 s GLU 682 Ca 0.16 0.85 -0.29 0.00 0.36 0.00 0.00 54.97 56.05 1o91 s GLU 682 Cb 0.18 -3.57 0.01 0.00 0.26 0.00 0.00 34.13 31.02 1o91 s GLU 682 CO 0.62 -0.27 1.29 -2.14 -0.54 0.00 0.00 175.26 174.23 1o91 s PRO 683 N 1.96 3.78 -0.03 4.30 0.02 -1.26 -1.38 135.00 142.38 1o91 s PRO 683 Ca 0.35 1.01 0.04 0.00 0.02 0.00 0.00 61.00 62.41 1o91 s PRO 683 Cb -0.16 -3.92 -0.25 0.00 0.02 0.00 0.00 34.50 30.19 1o91 s PRO 683 CO 0.12 -1.30 0.72 0.52 -0.33 0.00 0.00 177.00 176.72 1o91 h MET 684 N 9.66 0.12 -2.87 5.54 2.86 -1.26 -3.48 114.93 125.50 1o91 h MET 684 Ca -0.26 -0.20 -0.14 0.00 -2.06 0.00 0.00 59.70 57.05 1o91 h MET 684 Cb 1.09 0.07 -0.25 0.00 0.06 0.00 0.00 31.60 32.57 1o91 h MET 684 CO 1.07 0.84 -0.31 1.41 1.06 0.00 0.00 176.91 180.98 1o91 s MET 685 N -2.61 0.40 -0.05 1.72 -2.45 -1.21 -4.98 119.30 110.13 1o91 s MET 685 Ca -0.09 0.51 0.03 0.00 -1.25 0.00 0.00 55.69 54.90 1o91 s MET 685 Cb 0.08 0.17 -0.03 0.00 1.25 0.00 0.00 34.83 36.30 1o91 s MET 685 CO 0.82 -0.06 -0.13 0.71 1.05 0.00 0.00 175.02 177.42 1o91 s TYR 686 N 0.31 2.75 -0.05 4.11 4.12 -1.26 -0.99 117.35 126.34 1o91 s TYR 686 Ca -0.01 -0.12 0.00 0.00 0.02 0.00 0.00 57.07 56.97 1o91 s TYR 686 Cb -0.03 -1.64 0.02 0.00 -1.52 0.00 0.00 41.96 38.79 1o91 s TYR 686 CO -0.01 0.23 -0.03 0.99 0.02 0.00 0.00 175.55 176.75 1o91 s THR 687 N -0.76 0.46 0.00 -0.71 2.01 -0.26 -5.01 115.64 111.37 1o91 s THR 687 Ca 0.12 -0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.15 1o91 s THR 687 Cb -0.11 -0.54 -0.02 0.00 0.01 0.00 0.00 72.50 71.85 1o91 s THR 687 CO 0.01 0.23 -0.19 -0.47 -0.69 0.00 0.00 174.62 173.52 1o91 s TYR 688 N 1.25 1.65 -0.05 4.92 5.04 -1.26 -1.08 117.35 127.82 1o91 s TYR 688 Ca -0.06 -0.33 -0.03 0.00 -2.44 0.00 0.00 57.07 54.21 1o91 s TYR 688 Cb -0.14 -1.03 0.02 0.00 0.35 0.00 0.00 41.96 41.16 1o91 s TYR 688 CO -0.02 0.01 0.11 0.34 -1.34 0.00 0.00 175.55 174.65 1o91 s ASP 689 N -0.67 -0.09 -0.19 4.32 2.15 -0.32 -5.01 116.67 116.85 1o91 s ASP 689 Ca 0.07 0.23 -0.11 0.00 0.43 0.00 0.00 52.55 53.16 1o91 s ASP 689 Cb -0.08 0.18 -0.05 0.00 -0.30 0.00 0.00 42.92 42.67 1o91 s ASP 689 CO 0.00 -0.09 0.18 -1.61 -0.17 0.00 0.00 175.17 173.48 1o91 s GLU 690 N 0.58 4.20 0.32 4.34 2.02 -1.26 -0.78 118.70 128.12 1o91 s GLU 690 Ca -0.04 -0.13 -0.29 0.00 0.02 0.00 0.00 54.97 54.52 1o91 s GLU 690 Cb -0.06 -3.43 -0.11 0.00 0.10 0.00 0.00 34.13 30.63 1o91 s GLU 690 CO -0.02 0.26 1.50 1.52 0.02 0.00 0.00 175.26 178.53 1o91 s TYR 691 N 0.47 2.76 -0.70 1.61 -0.85 -1.26 -4.93 117.35 114.45 1o91 s TYR 691 Ca 0.10 1.04 -0.19 0.00 -0.52 0.00 0.00 57.07 57.50 1o91 s TYR 691 Cb -0.12 -3.97 0.11 0.00 0.38 0.00 0.00 41.96 38.36 1o91 s TYR 691 CO 0.00 -3.03 0.86 0.15 -1.52 0.00 0.00 175.55 172.02 1o91 s LYS 692 N -1.24 3.22 0.00 -3.49 -0.14 -1.26 -4.94 119.74 111.89 1o91 s LYS 692 Ca 0.57 -1.38 0.00 0.00 -1.36 0.00 0.00 55.97 53.80 1o91 s LYS 692 Cb -0.45 -4.41 0.00 0.00 -1.68 0.00 0.00 37.83 31.29 1o91 s LYS 692 CO 0.54 -1.64 0.00 1.17 -0.76 0.00 0.00 175.35 174.65 1o91 n LYS 693 N 6.54 0.00 -0.39 1.68 3.00 -1.26 0.72 118.16 128.44 1o91 n LYS 693 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1o91 n LYS 693 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.48 1o91 n LYS 693 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1o91 n GLY 694 N 0.00 2.13 3.51 3.14 0.00 -1.26 -5.02 105.19 107.69 1o91 n GLY 694 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.36 2.37 0.11 1.61 0.40 0.22 -5.08 117.98 114.24 1o91 s PHE 695 Ca 0.00 -0.36 -0.15 0.00 -0.60 0.00 0.00 56.93 55.81 1o91 s PHE 695 Cb 0.00 -1.12 -0.07 0.00 0.51 0.00 0.00 43.02 42.34 1o91 s PHE 695 CO 0.00 0.67 0.54 -1.17 0.70 0.00 0.00 175.22 175.96 1o91 s LEU 696 N -3.56 4.40 0.00 -0.37 2.96 -1.26 -4.31 118.68 116.54 1o91 s LEU 696 Ca 0.31 1.11 0.06 0.00 -0.22 0.00 0.00 54.13 55.39 1o91 s LEU 696 Cb -0.03 -3.11 -0.02 0.00 0.50 0.00 0.00 46.19 43.53 1o91 s LEU 696 CO 0.16 0.17 0.22 -0.67 -1.32 0.00 0.00 176.35 174.90 1o91 n ASP 697 N 1.12 -0.40 -3.58 3.68 4.64 -0.41 -4.98 116.55 116.63 1o91 n ASP 697 Ca -0.07 -2.77 -0.16 0.00 -1.38 0.00 0.00 54.79 50.41 1o91 n ASP 697 Cb 0.52 1.30 -0.06 0.00 -1.04 0.00 0.00 41.12 41.83 1o91 n ASP 697 CO 0.00 0.00 0.00 -1.58 -0.82 0.00 0.00 177.20 174.80 1o91 s GLN 698 N -3.11 0.98 0.02 -0.67 0.74 -1.26 -0.74 119.66 115.62 1o91 s GLN 698 Ca 0.31 0.10 0.00 0.00 0.05 0.00 0.00 55.36 55.82 1o91 s GLN 698 Cb 0.01 0.45 -0.02 0.00 1.10 0.00 0.00 33.01 34.56 1o91 s GLN 698 CO 0.22 -0.31 -0.03 0.00 -0.55 0.00 0.00 175.29 174.62 1o91 s ALA 699 N -1.39 0.12 0.25 1.58 0.00 -0.36 -4.96 121.76 117.01 1o91 s ALA 699 Ca -0.11 -0.59 0.01 0.00 0.00 0.00 0.00 51.96 51.27 1o91 s ALA 699 Cb -0.01 0.15 -0.05 0.00 0.00 0.00 0.00 23.12 23.21 1o91 s ALA 699 CO 0.07 -0.16 0.10 -1.12 0.00 0.00 0.00 175.76 174.65 1o91 s SER 700 N -1.46 1.07 0.13 0.00 0.01 -1.26 -1.02 113.70 111.18 1o91 s SER 700 Ca -0.16 -1.39 -0.24 0.00 1.31 0.00 0.00 55.95 55.47 1o91 s SER 700 Cb -0.10 0.20 0.07 0.00 0.21 0.00 0.00 66.02 66.40 1o91 s SER 700 CO -0.01 -0.75 0.69 -0.83 0.41 0.00 0.00 173.24 172.75 1o91 s GLY 701 N -3.30 -0.52 0.01 3.44 0.00 -0.50 -5.00 107.32 101.45 1o91 s GLY 701 Ca 0.38 0.52 -0.27 0.00 0.00 0.00 0.00 44.72 45.35 1o91 s GLY 701 CO 0.14 0.17 0.63 -1.35 0.00 0.00 0.00 173.10 172.68 1o91 s SER 702 N -2.71 -0.59 -0.11 1.64 1.04 -1.26 -0.93 113.70 110.78 1o91 s SER 702 Ca 0.03 0.47 -0.30 0.00 0.48 0.00 0.00 55.95 56.63 1o91 s SER 702 Cb -0.01 0.54 0.08 0.00 0.10 0.00 0.00 66.02 66.72 1o91 s SER 702 CO -0.10 -0.69 0.75 0.00 0.98 0.00 0.00 173.24 174.18 1o91 s ALA 703 N -1.89 -1.81 -0.19 5.32 0.00 0.05 -4.98 121.76 118.26 1o91 s ALA 703 Ca -0.08 1.49 -0.14 0.00 0.00 0.00 0.00 51.96 53.23 1o91 s ALA 703 Cb -0.01 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 1o91 s ALA 703 CO 0.03 -0.35 0.29 0.08 0.00 0.00 0.00 175.76 175.81 1o91 s VAL 704 N -0.90 5.29 -0.00 0.00 1.01 -1.26 -0.81 120.40 123.74 1o91 s VAL 704 Ca -0.07 0.50 0.02 0.00 0.00 0.00 0.00 61.98 62.43 1o91 s VAL 704 Cb -0.01 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 1o91 s VAL 704 CO 0.07 0.35 -0.07 -0.76 0.00 0.00 0.00 175.10 174.69 1o91 s LEU 705 N 0.80 2.02 -0.27 3.92 1.43 0.37 -4.96 118.68 122.00 1o91 s LEU 705 Ca 0.15 -0.13 -0.20 0.00 -1.03 0.00 0.00 54.13 52.92 1o91 s LEU 705 Cb -0.13 -0.34 -0.02 0.00 0.03 0.00 0.00 46.19 45.73 1o91 s LEU 705 CO 0.05 0.08 0.63 -0.22 0.23 0.00 0.00 176.35 177.11 1o91 s LEU 706 N -0.19 4.08 -0.01 1.79 2.96 -1.26 0.00 118.68 126.05 1o91 s LEU 706 Ca 0.02 0.64 0.02 0.00 -0.22 0.00 0.00 54.13 54.59 1o91 s LEU 706 Cb -0.03 -2.84 -0.03 0.00 0.50 0.00 0.00 46.19 43.78 1o91 s LEU 706 CO -0.00 -0.40 -0.06 -0.76 -1.32 0.00 0.00 176.35 173.81 1o91 s LEU 707 N 2.54 3.21 0.12 -0.68 1.43 0.66 -4.99 118.68 120.97 1o91 s LEU 707 Ca 0.26 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1o91 s LEU 707 Cb -0.15 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1o91 s LEU 707 CO 0.09 0.30 0.17 -0.13 0.23 0.00 0.00 176.35 177.01 1o91 s ARG 708 N -1.31 3.12 0.06 1.70 0.52 -1.26 -2.33 118.95 119.45 1o91 s ARG 708 Ca 0.16 -0.68 -0.34 0.00 -0.52 0.00 0.00 55.73 54.36 1o91 s ARG 708 Cb -0.11 -2.82 -0.13 0.00 0.52 0.00 0.00 34.95 32.41 1o91 s ARG 708 CO 0.07 0.54 1.71 -2.30 0.02 0.00 0.00 175.30 175.33 1o91 n PRO 709 N -0.05 2.18 0.00 3.54 -0.02 -1.26 -1.38 135.00 138.01 1o91 n PRO 709 Ca -0.07 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1o91 n PRO 709 Cb 0.53 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 3.84 3.09 3.75 -1.23 0.00 -0.06 -5.00 105.19 109.59 1o91 n GLY 710 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 3.31 -4.21 1.61 8.00 -0.48 -4.63 116.55 120.14 1o91 n ASP 711 Ca 0.00 1.15 -0.34 0.00 0.71 0.00 0.00 54.79 56.31 1o91 n ASP 711 Cb 0.00 -1.59 -0.15 0.00 -0.02 0.00 0.00 41.12 39.36 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 -2.32 3.16 -0.08 -1.24 -0.21 -1.26 -0.95 119.66 116.76 1o91 s GLN 712 Ca 0.59 -0.75 0.02 0.00 0.02 0.00 0.00 55.36 55.24 1o91 s GLN 712 Cb -0.47 -2.72 -0.02 0.00 1.00 0.00 0.00 33.01 30.80 1o91 s GLN 712 CO 0.59 -0.16 -0.14 0.08 -2.12 0.00 0.00 175.29 173.55 1o91 s VAL 713 N 1.25 3.08 0.21 1.09 1.01 -0.05 0.60 120.40 127.59 1o91 s VAL 713 Ca 0.03 -0.69 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1o91 s VAL 713 Cb -0.14 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 34.04 1o91 s VAL 713 CO -0.07 0.56 0.83 0.72 0.00 0.00 0.00 175.10 177.15 1o91 s PHE 714 N -0.29 -0.17 -0.04 5.22 -0.12 -0.94 -1.07 117.98 120.56 1o91 s PHE 714 Ca 0.02 -0.20 -0.00 0.00 -0.05 0.00 0.00 56.93 56.70 1o91 s PHE 714 Cb -0.13 0.67 -0.03 0.00 -0.63 0.00 0.00 43.02 42.90 1o91 s PHE 714 CO 0.03 -1.02 0.00 -1.17 -0.05 0.00 0.00 175.22 173.01 1o91 s LEU 715 N -2.92 3.56 -0.12 -1.99 2.96 -1.26 -0.16 118.68 118.74 1o91 s LEU 715 Ca 0.11 0.07 -0.23 0.00 -0.22 0.00 0.00 54.13 53.87 1o91 s LEU 715 Cb -0.04 -1.93 0.05 0.00 0.50 0.00 0.00 46.19 44.78 1o91 s LEU 715 CO 0.04 0.33 0.56 -1.58 -1.32 0.00 0.00 176.35 174.38 1o91 s GLN 716 N -1.22 0.81 -0.29 1.98 0.74 -0.69 -1.25 119.66 119.73 1o91 s GLN 716 Ca 0.17 0.43 -0.18 0.00 0.05 0.00 0.00 55.36 55.83 1o91 s GLN 716 Cb -0.11 0.38 -0.02 0.00 1.10 0.00 0.00 33.01 34.36 1o91 s GLN 716 CO 0.06 -0.18 0.51 -1.64 -0.55 0.00 0.00 175.29 173.49 1o91 s MET 717 N -0.51 3.91 0.41 1.67 -1.94 -1.26 -1.28 119.30 120.31 1o91 s MET 717 Ca -0.06 0.14 0.22 0.00 -1.71 0.00 0.00 55.69 54.28 1o91 s MET 717 Cb -0.03 -3.71 0.29 0.00 2.01 0.00 0.00 34.83 33.39 1o91 s MET 717 CO 0.05 -0.45 1.57 -1.35 -0.01 0.00 0.00 175.02 174.82 1o91 h PRO 718 N 8.19 0.00 -5.87 2.03 0.11 -1.92 0.83 132.00 135.37 1o91 h PRO 718 Ca -0.29 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.15 1o91 h PRO 718 Cb 1.14 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.93 1o91 h PRO 718 CO 0.73 0.08 -0.88 0.45 -0.21 0.00 0.00 178.00 178.17 1o91 s SER 719 N -6.24 2.92 0.47 -2.05 0.15 -1.26 -4.77 113.70 102.93 1o91 s SER 719 Ca 0.06 -0.49 0.31 0.00 0.70 0.00 0.00 55.95 56.54 1o91 s SER 719 Cb 0.05 -0.83 1.29 0.00 -1.71 0.00 0.00 66.02 64.82 1o91 s SER 719 CO 0.68 0.23 1.92 -0.33 1.20 0.00 0.00 173.24 176.94 1o91 h GLU 720 N 6.13 0.00 0.00 5.44 4.39 -1.97 -2.57 114.58 125.99 1o91 h GLU 720 Ca -0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1o91 h GLU 720 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1o91 h GLU 720 CO 0.47 0.00 -0.08 1.04 -1.16 0.00 0.00 179.01 179.28 1o91 n GLN 721 N -2.84 0.03 -3.20 2.33 6.02 -1.26 -4.17 117.38 114.30 1o91 n GLN 721 Ca 0.01 0.02 -0.24 0.00 -0.01 0.00 0.00 57.00 56.78 1o91 n GLN 721 Cb 0.27 -1.53 -0.07 0.00 1.02 0.00 0.00 30.24 29.93 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 -1.53 2.51 -0.60 -1.58 0.00 -0.97 -4.66 120.51 113.67 1o91 n ALA 722 Ca 0.07 -3.48 0.07 0.00 0.00 0.00 0.00 53.44 50.10 1o91 n ALA 722 Cb 0.35 -0.82 0.23 0.00 0.00 0.00 0.00 19.45 19.21 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 1.33 2.69 -0.10 0.00 0.00 -0.96 -2.44 120.51 121.04 1o91 n ALA 723 Ca 0.22 -1.72 0.00 0.00 0.00 0.00 0.00 53.44 51.94 1o91 n ALA 723 Cb 0.53 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 0.18 1.42 3.62 0.00 0.00 0.05 -4.76 105.19 105.69 1o91 n GLY 724 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 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 3.76 0.17 0.99 0.20 -1.26 -2.35 118.68 120.19 1o91 s LEU 725 Ca 0.00 1.12 0.04 0.00 0.69 0.00 0.00 54.13 55.98 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 -1.25 0.25 -0.47 -0.29 0.00 0.00 176.35 174.59 1o91 s TYR 726 N 4.95 3.38 0.02 5.38 5.04 0.25 -0.44 117.35 135.93 1o91 s TYR 726 Ca 0.61 0.06 -0.29 0.00 -2.44 0.00 0.00 57.07 55.01 1o91 s TYR 726 Cb -0.17 -1.61 0.10 0.00 0.35 0.00 0.00 41.96 40.63 1o91 s TYR 726 CO 0.28 0.51 0.98 0.00 -1.34 0.00 0.00 175.55 175.98 1o91 s ALA 727 N -1.79 -1.84 0.29 3.97 0.00 -1.26 -3.57 121.76 117.57 1o91 s ALA 727 Ca 0.33 0.80 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 1o91 s ALA 727 Cb -0.10 0.41 0.05 0.00 0.00 0.00 0.00 23.12 23.48 1o91 s ALA 727 CO 0.27 -0.81 0.85 0.20 0.00 0.00 0.00 175.76 176.27 1o91 s GLY 728 N -2.62 0.13 0.43 0.00 0.00 0.90 -2.60 107.32 103.57 1o91 s GLY 728 Ca 0.08 -0.44 0.13 0.00 0.00 0.00 0.00 44.72 44.49 1o91 s GLY 728 CO -0.05 0.33 2.00 1.46 0.00 0.00 0.00 173.10 176.83 1o91 h GLN 729 N 2.00 0.40 0.00 2.90 4.20 -1.89 -2.61 115.11 120.11 1o91 h GLN 729 Ca -0.27 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.41 1o91 h GLN 729 Cb 1.24 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.91 1o91 h GLN 729 CO 0.33 0.26 -0.27 0.66 -0.67 0.00 0.00 178.83 179.15 1o91 n TYR 730 N -4.47 0.00 -3.42 2.96 4.02 -1.26 -4.85 117.16 110.13 1o91 n TYR 730 Ca 0.08 -1.12 -0.24 0.00 -0.01 0.00 0.00 57.90 56.62 1o91 n TYR 730 Cb 0.32 -0.18 -0.10 0.00 -0.02 0.00 0.00 39.34 39.36 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 -2.73 -0.05 -0.13 -0.72 1.01 -0.98 -5.13 120.40 111.67 1o91 s VAL 731 Ca 0.33 -1.43 -0.24 0.00 0.00 0.00 0.00 61.98 60.64 1o91 s VAL 731 Cb 0.30 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 1o91 s VAL 731 CO -0.02 -0.83 0.76 -1.00 0.00 0.00 0.00 175.10 174.01 1o91 s HIS 732 N 1.21 3.49 0.08 5.22 3.76 -1.26 -0.07 115.29 127.72 1o91 s HIS 732 Ca 0.18 1.23 -0.04 0.00 -0.15 0.00 0.00 55.06 56.27 1o91 s HIS 732 Cb -0.20 -2.91 -0.05 0.00 1.11 0.00 0.00 32.58 30.53 1o91 s HIS 732 CO -0.01 -0.10 0.31 -1.12 -0.85 0.00 0.00 174.74 172.97 1o91 s SER 733 N 1.02 6.47 0.23 1.40 0.01 -1.19 -4.89 113.70 116.75 1o91 s SER 733 Ca 0.37 0.52 -0.05 0.00 1.31 0.00 0.00 55.95 58.10 1o91 s SER 733 Cb -0.17 -2.06 -0.02 0.00 0.21 0.00 0.00 66.02 63.97 1o91 s SER 733 CO 0.15 0.15 0.28 -0.94 0.41 0.00 0.00 173.24 173.29 1o91 s SER 734 N -2.20 0.12 -0.11 2.44 1.04 0.30 -0.45 113.70 114.85 1o91 s SER 734 Ca 0.35 -1.23 -0.05 0.00 0.48 0.00 0.00 55.95 55.50 1o91 s SER 734 Cb -0.13 0.47 0.05 0.00 0.10 0.00 0.00 66.02 66.52 1o91 s SER 734 CO 0.22 -0.98 0.25 0.12 0.98 0.00 0.00 173.24 173.83 1o91 s PHE 735 N -4.05 -0.35 0.09 5.02 5.36 -0.49 -1.55 117.98 122.02 1o91 s PHE 735 Ca 0.32 0.84 0.03 0.00 -0.96 0.00 0.00 56.93 57.17 1o91 s PHE 735 Cb 0.04 0.00 -0.04 0.00 -0.34 0.00 0.00 43.02 42.69 1o91 s PHE 735 CO 0.12 -0.28 -0.10 -1.12 -1.46 0.00 0.00 175.22 172.38 1o91 s SER 736 N 1.70 1.38 -0.11 6.13 0.01 0.18 -0.93 113.70 122.05 1o91 s SER 736 Ca -0.05 -0.81 -0.30 0.00 1.31 0.00 0.00 55.95 56.10 1o91 s SER 736 Cb -0.11 0.02 0.09 0.00 0.21 0.00 0.00 66.02 66.23 1o91 s SER 736 CO -0.08 -0.28 0.81 -0.83 0.41 0.00 0.00 173.24 173.27 1o91 s GLY 737 N -2.43 -0.44 0.00 3.44 0.00 -0.64 -0.79 107.32 106.47 1o91 s GLY 737 Ca 0.05 1.68 -0.28 0.00 0.00 0.00 0.00 44.72 46.16 1o91 s GLY 737 CO -0.00 1.06 0.72 -2.52 0.00 0.00 0.00 173.10 172.35 1o91 s TYR 738 N -1.02 -0.56 0.09 1.90 -0.85 -0.51 -0.47 117.35 115.94 1o91 s TYR 738 Ca -0.06 0.74 -0.31 0.00 -0.52 0.00 0.00 57.07 56.92 1o91 s TYR 738 Cb -0.01 0.47 -0.06 0.00 0.38 0.00 0.00 41.96 42.74 1o91 s TYR 738 CO 0.06 -0.64 1.22 -1.17 -1.52 0.00 0.00 175.55 173.50 1o91 s LEU 739 N -1.76 4.39 -0.19 -3.49 2.96 -0.31 -1.54 118.68 118.73 1o91 s LEU 739 Ca -0.05 2.10 -0.16 0.00 -0.22 0.00 0.00 54.13 55.80 1o91 s LEU 739 Cb -0.00 -3.59 -0.07 0.00 0.50 0.00 0.00 46.19 43.03 1o91 s LEU 739 CO 0.00 -0.47 -0.30 0.18 -1.32 0.00 0.00 176.35 174.44 1o91 n LEU 740 N 3.64 1.92 -3.76 -0.68 4.77 0.13 -4.94 117.00 118.09 1o91 n LEU 740 Ca 0.08 0.39 -0.22 0.00 -0.03 0.00 0.00 56.01 56.23 1o91 n LEU 740 Cb 0.45 -0.78 -0.18 0.00 -2.33 0.00 0.00 43.42 40.59 1o91 n LEU 740 CO 0.56 -0.16 -0.38 -0.31 -1.33 0.00 0.00 177.39 175.77 1o91 s TYR 741 N -2.72 0.55 0.24 -1.77 1.51 -1.01 -4.99 117.35 109.16 1o91 s TYR 741 Ca -0.28 -0.09 -0.30 0.00 -1.01 0.00 0.00 57.07 55.39 1o91 s TYR 741 Cb 0.05 -0.72 -0.09 0.00 -0.11 0.00 0.00 41.96 41.09 1o91 s TYR 741 CO 0.41 -0.29 1.35 -2.14 -1.11 0.00 0.00 175.55 173.77 1o91 s PRO 742 N 1.91 4.35 0.00 -1.71 0.02 -1.26 -0.86 135.00 137.45 1o91 s PRO 742 Ca 0.04 2.16 0.04 0.00 0.02 0.00 0.00 61.00 63.25 1o91 s PRO 742 Cb -0.12 -3.14 0.03 0.00 0.02 0.00 0.00 34.50 31.29 1o91 s PRO 742 CO -0.04 -0.28 0.63 -1.33 -0.33 0.00 0.00 177.00 175.65