#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f1g s GLN 622 N 0.00 1.50 0.15 5.55 -0.21 -1.26 -1.12 119.66 124.26 1f1g s GLN 622 Ca 0.00 -1.21 -0.02 0.00 0.02 0.00 0.00 55.36 54.15 1f1g s GLN 622 Cb 0.00 -1.83 -0.04 0.00 1.00 0.00 0.00 33.01 32.14 1f1g s GLN 622 CO 0.00 0.45 0.09 0.00 -2.12 0.00 0.00 175.29 173.71 1f1g s ALA 623 N -0.96 0.82 -0.06 6.09 0.00 -0.17 -1.46 121.76 126.02 1f1g s ALA 623 Ca 0.12 -1.45 -0.20 0.00 0.00 0.00 0.00 51.96 50.43 1f1g s ALA 623 Cb -0.10 0.95 0.04 0.00 0.00 0.00 0.00 23.12 24.01 1f1g s ALA 623 CO 0.04 -0.52 0.45 0.54 0.00 0.00 0.00 175.76 176.27 1f1g s VAL 624 N -4.06 0.03 -0.06 0.00 0.11 0.30 -0.86 120.40 115.86 1f1g s VAL 624 Ca 0.26 -0.24 0.03 0.00 -2.93 0.00 0.00 61.98 59.10 1f1g s VAL 624 Cb 0.07 -0.74 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 1f1g s VAL 624 CO 0.03 -0.13 -0.14 0.00 -3.33 0.00 0.00 175.10 171.54 1f1g s ALA 625 N -0.94 1.35 -0.35 1.54 0.00 0.21 -0.78 121.76 122.79 1f1g s ALA 625 Ca -0.10 -0.50 -0.12 0.00 0.00 0.00 0.00 51.96 51.24 1f1g s ALA 625 Cb -0.03 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 1f1g s ALA 625 CO 0.05 0.16 0.23 0.08 0.00 0.00 0.00 175.76 176.28 1f1g s VAL 626 N 0.51 5.10 -0.13 0.00 1.01 -1.26 -0.52 120.40 125.11 1f1g s VAL 626 Ca -0.13 -0.38 -0.25 0.00 0.00 0.00 0.00 61.98 61.22 1f1g s VAL 626 Cb -0.15 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 1f1g s VAL 626 CO 0.04 -0.06 0.80 -0.76 0.00 0.00 0.00 175.10 175.12 1f1g s LEU 627 N 1.68 4.23 0.07 3.92 1.43 0.40 -3.97 118.68 126.44 1f1g s LEU 627 Ca 0.05 1.20 0.01 0.00 -1.03 0.00 0.00 54.13 54.37 1f1g s LEU 627 Cb -0.18 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.79 1f1g s LEU 627 CO 0.09 -0.31 -0.05 -0.54 0.23 0.00 0.00 176.35 175.77 1f1g s LYS 628 N 1.70 0.69 -0.00 1.70 1.02 -0.41 -1.46 119.74 122.98 1f1g s LYS 628 Ca 0.39 -1.17 -0.03 0.00 0.02 0.00 0.00 55.97 55.17 1f1g s LYS 628 Cb -0.17 -0.06 0.01 0.00 -0.52 0.00 0.00 37.83 37.09 1f1g s LYS 628 CO 0.15 -0.04 0.14 0.41 -0.92 0.00 0.00 175.35 175.08 1f1g n GLY 629 N 0.31 0.64 0.80 -3.33 0.00 -1.25 -1.67 105.19 100.69 1f1g n GLY 629 Ca -0.15 -0.86 0.07 0.00 0.00 0.00 0.00 46.02 45.08 1f1g n GLY 629 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f1g n ASP 630 N -0.28 3.10 -1.06 1.61 8.00 -1.26 -4.57 116.55 122.09 1f1g n ASP 630 Ca 0.00 -1.96 0.09 0.00 0.71 0.00 0.00 54.79 53.63 1f1g n ASP 630 Cb 0.06 -0.27 0.25 0.00 -0.02 0.00 0.00 41.12 41.15 1f1g n ASP 630 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f1g n ALA 631 N 0.80 2.38 -0.29 2.24 0.00 -1.26 -4.94 120.51 119.45 1f1g n ALA 631 Ca 0.14 -1.30 0.00 0.00 0.00 0.00 0.00 53.44 52.28 1f1g n ALA 631 Cb 0.47 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1f1g n ALA 631 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f1g n GLY 632 N 1.05 1.29 3.80 0.00 0.00 -1.26 -5.03 105.19 105.05 1f1g n GLY 632 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1f1g n GLY 632 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f1g s VAL 633 N -2.88 5.40 0.16 1.61 1.01 -1.26 -4.19 120.40 120.25 1f1g s VAL 633 Ca 0.00 0.32 -0.19 0.00 0.00 0.00 0.00 61.98 62.11 1f1g s VAL 633 Cb 0.00 -3.49 0.04 0.00 0.00 0.00 0.00 36.38 32.93 1f1g s VAL 633 CO 0.00 0.52 0.51 -0.94 0.00 0.00 0.00 175.10 175.19 1f1g s SER 634 N -0.34 -0.35 0.00 3.32 1.04 -0.80 -3.80 113.70 112.78 1f1g s SER 634 Ca 0.14 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.30 1f1g s SER 634 Cb -0.12 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1f1g s SER 634 CO 0.03 -0.96 0.00 0.61 0.98 0.00 0.00 173.24 173.90 1f1g n GLY 635 N -0.31 -1.29 2.88 7.32 0.00 -0.54 -0.38 105.19 112.87 1f1g n GLY 635 Ca -0.14 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.83 1f1g n GLY 635 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f1g s VAL 636 N -2.88 -0.04 -0.13 1.61 1.01 -0.08 -0.45 120.40 119.44 1f1g s VAL 636 Ca 0.00 0.14 0.02 0.00 0.00 0.00 0.00 61.98 62.14 1f1g s VAL 636 Cb 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.24 1f1g s VAL 636 CO 0.00 0.06 -0.18 -0.69 0.00 0.00 0.00 175.10 174.29 1f1g s VAL 637 N 0.84 1.75 0.04 2.92 1.01 0.32 -1.63 120.40 125.66 1f1g s VAL 637 Ca -0.07 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1f1g s VAL 637 Cb -0.09 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1f1g s VAL 637 CO -0.03 0.49 -0.04 -0.54 0.00 0.00 0.00 175.10 174.98 1f1g s LYS 638 N 0.98 2.54 -0.00 2.72 1.02 0.70 -0.62 119.74 127.08 1f1g s LYS 638 Ca -0.05 -0.78 0.03 0.00 0.02 0.00 0.00 55.97 55.20 1f1g s LYS 638 Cb -0.15 -2.52 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 1f1g s LYS 638 CO -0.03 0.58 -0.11 -0.06 -0.92 0.00 0.00 175.35 174.81 1f1g s PHE 639 N -1.14 0.98 -0.09 3.18 0.40 -0.04 -0.88 117.98 120.39 1f1g s PHE 639 Ca 0.21 -0.21 -0.06 0.00 -0.60 0.00 0.00 56.93 56.27 1f1g s PHE 639 Cb -0.11 -0.62 0.03 0.00 0.51 0.00 0.00 43.02 42.83 1f1g s PHE 639 CO 0.12 -0.01 0.22 -2.00 0.70 0.00 0.00 175.22 174.25 1f1g s GLU 640 N -0.39 0.21 -0.09 0.44 2.12 -0.38 -1.00 118.70 119.62 1f1g s GLU 640 Ca 0.03 0.42 -0.04 0.00 0.36 0.00 0.00 54.97 55.74 1f1g s GLU 640 Cb -0.05 -0.03 0.05 0.00 0.26 0.00 0.00 34.13 34.36 1f1g s GLU 640 CO -0.00 -0.11 0.18 -1.14 -0.54 0.00 0.00 175.26 173.65 1f1g s GLN 641 N 0.77 0.09 0.03 4.30 0.74 -0.28 -0.36 119.66 124.96 1f1g s GLN 641 Ca -0.05 0.51 -0.17 0.00 0.05 0.00 0.00 55.36 55.70 1f1g s GLN 641 Cb -0.07 -0.19 -0.27 0.00 1.10 0.00 0.00 33.01 33.59 1f1g s GLN 641 CO -0.05 -0.23 1.09 0.00 -0.55 0.00 0.00 175.29 175.55 1f1g h ALA 642 N 7.79 0.03 -2.76 1.58 0.00 -1.84 0.15 119.26 124.21 1f1g h ALA 642 Ca -0.28 -0.69 -0.05 0.00 0.00 0.00 0.00 54.91 53.89 1f1g h ALA 642 Cb 1.13 0.08 -0.12 0.00 0.00 0.00 0.00 17.79 18.88 1f1g h ALA 642 CO 0.28 0.54 -0.10 -1.54 0.00 0.00 0.00 179.25 178.43 1f1g s SER 643 N -7.14 -0.17 0.32 0.00 1.04 -1.26 -4.50 113.70 101.98 1f1g s SER 643 Ca -0.11 -0.48 0.05 0.00 0.48 0.00 0.00 55.95 55.88 1f1g s SER 643 Cb 0.05 0.49 0.68 0.00 0.10 0.00 0.00 66.02 67.33 1f1g s SER 643 CO 0.89 -0.92 1.88 -0.08 0.98 0.00 0.00 173.24 175.99 1f1g h GLU 644 N 2.37 0.83 0.00 4.02 4.81 -1.92 -1.31 114.58 123.38 1f1g h GLU 644 Ca -0.32 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1f1g h GLU 644 Cb 1.25 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.44 1f1g h GLU 644 CO 0.45 0.55 -0.28 -1.13 -0.73 0.00 0.00 179.01 177.87 1f1g n SER 645 N -4.55 0.32 -4.90 1.04 3.41 -1.26 -4.88 113.62 102.80 1f1g n SER 645 Ca 0.16 0.13 -0.28 0.00 -0.26 0.00 0.00 58.87 58.62 1f1g n SER 645 Cb 0.35 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 1f1g n SER 645 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1f1g s GLU 646 N -3.02 3.55 0.61 4.33 0.41 -0.50 -5.04 118.70 119.04 1f1g s GLU 646 Ca 0.12 0.31 -0.18 0.00 -0.41 0.00 0.00 54.97 54.81 1f1g s GLU 646 Cb 0.18 -2.31 -0.03 0.00 -1.78 0.00 0.00 34.13 30.18 1f1g s GLU 646 CO 0.63 -0.29 1.18 -2.14 -0.49 0.00 0.00 175.26 174.15 1f1g s PRO 647 N -4.84 2.93 -0.08 0.39 0.02 -1.26 -4.83 135.00 127.34 1f1g s PRO 647 Ca 0.49 1.73 -0.17 0.00 0.02 0.00 0.00 61.00 63.07 1f1g s PRO 647 Cb -0.10 -1.93 -0.05 0.00 0.02 0.00 0.00 34.50 32.43 1f1g s PRO 647 CO 0.47 -1.21 0.46 0.99 -0.33 0.00 0.00 177.00 177.38 1f1g s THR 648 N -1.75 5.12 -0.21 0.99 2.01 0.19 -4.54 115.64 117.45 1f1g s THR 648 Ca 0.75 0.94 -0.19 0.00 0.31 0.00 0.00 61.69 63.50 1f1g s THR 648 Cb -0.28 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 1f1g s THR 648 CO 0.34 0.40 0.56 -0.89 -0.69 0.00 0.00 174.62 174.34 1f1g s THR 649 N 0.11 5.07 -0.19 -0.82 2.01 0.52 -0.88 115.64 121.46 1f1g s THR 649 Ca 0.25 1.02 -0.05 0.00 0.31 0.00 0.00 61.69 63.23 1f1g s THR 649 Cb -0.16 -3.87 -0.02 0.00 0.01 0.00 0.00 72.50 68.46 1f1g s THR 649 CO 0.11 0.13 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.47 1f1g s VAL 650 N 1.89 3.87 0.06 3.82 1.01 0.35 -1.25 120.40 130.15 1f1g s VAL 650 Ca 0.25 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 61.93 1f1g s VAL 650 Cb -0.16 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1f1g s VAL 650 CO 0.10 0.44 -0.14 -0.94 0.00 0.00 0.00 175.10 174.56 1f1g s SER 651 N 0.89 1.59 0.03 3.32 1.04 -0.06 -0.91 113.70 119.60 1f1g s SER 651 Ca 0.00 -0.57 -0.08 0.00 0.48 0.00 0.00 55.95 55.79 1f1g s SER 651 Cb -0.14 -0.06 -0.00 0.00 0.10 0.00 0.00 66.02 65.92 1f1g s SER 651 CO 0.02 -0.06 0.15 -0.72 0.98 0.00 0.00 173.24 173.61 1f1g s TYR 652 N -1.17 0.10 -0.07 5.02 -0.85 -0.17 -0.21 117.35 120.00 1f1g s TYR 652 Ca -0.02 -0.33 -0.02 0.00 -0.52 0.00 0.00 57.07 56.18 1f1g s TYR 652 Cb -0.09 -0.07 0.03 0.00 0.38 0.00 0.00 41.96 42.21 1f1g s TYR 652 CO 0.02 -0.39 0.03 -1.21 -1.52 0.00 0.00 175.55 172.48 1f1g s GLU 653 N -2.40 0.29 -0.05 -3.49 2.02 -0.64 -1.87 118.70 112.55 1f1g s GLU 653 Ca -0.06 0.20 0.00 0.00 0.02 0.00 0.00 54.97 55.13 1f1g s GLU 653 Cb -0.02 -0.86 0.02 0.00 0.10 0.00 0.00 34.13 33.37 1f1g s GLU 653 CO -0.03 -0.35 -0.03 0.42 0.02 0.00 0.00 175.26 175.29 1f1g s ILE 654 N 2.06 0.45 0.18 -1.63 1.01 0.63 -0.90 121.20 123.01 1f1g s ILE 654 Ca 0.05 -0.04 0.07 0.00 0.00 0.00 0.00 60.65 60.72 1f1g s ILE 654 Cb -0.13 -0.52 -0.04 0.00 0.01 0.00 0.00 42.46 41.79 1f1g s ILE 654 CO -0.05 0.22 0.06 0.00 0.00 0.00 0.00 174.94 175.17 1f1g s ALA 655 N 1.15 3.34 0.00 9.38 0.00 0.48 -0.39 121.76 135.72 1f1g s ALA 655 Ca -0.07 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1f1g s ALA 655 Cb -0.14 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 21.87 1f1g s ALA 655 CO -0.01 0.45 0.00 0.41 0.00 0.00 0.00 175.76 176.61 1f1g n GLY 656 N -0.34 0.75 3.78 0.00 0.00 -1.16 -1.90 105.19 106.32 1f1g n GLY 656 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1f1g n GLY 656 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1f1g s ASN 657 N -2.20 4.01 0.47 1.61 0.01 -0.82 -4.38 114.94 113.64 1f1g s ASN 657 Ca 0.00 1.25 -0.24 0.00 -0.71 0.00 0.00 52.86 53.16 1f1g s ASN 657 Cb 0.00 -1.93 -0.08 0.00 0.41 0.00 0.00 41.25 39.64 1f1g s ASN 657 CO 0.00 -2.27 1.20 -1.20 -1.51 0.00 0.00 177.10 173.33 1f1g n SER 658 N -3.62 2.12 -4.85 -1.22 7.64 -1.26 -4.33 113.62 108.10 1f1g n SER 658 Ca 0.07 1.03 -0.32 0.00 1.01 0.00 0.00 58.87 60.66 1f1g n SER 658 Cb 0.57 -1.48 -0.03 0.00 -1.01 0.00 0.00 64.21 62.26 1f1g n SER 658 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1f1g s PRO 659 N -2.39 3.89 -1.38 1.43 0.04 -1.26 -4.26 135.00 131.07 1f1g s PRO 659 Ca 0.65 0.85 -0.06 0.00 0.04 0.00 0.00 61.00 62.49 1f1g s PRO 659 Cb -0.48 -2.18 0.03 0.00 0.04 0.00 0.00 34.50 31.91 1f1g s PRO 659 CO 0.55 -0.25 0.89 0.09 0.04 0.00 0.00 177.00 178.32 1f1g n ASN 660 N -1.62 -3.15 -3.55 6.66 3.02 -0.28 -4.94 115.26 111.40 1f1g n ASN 660 Ca 0.06 -0.75 -0.22 0.00 -0.03 0.00 0.00 54.58 53.64 1f1g n ASN 660 Cb 0.54 -4.26 -0.08 0.00 -0.61 0.00 0.00 39.78 35.37 1f1g n ASN 660 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1f1g s ALA 661 N -3.47 2.31 -0.06 5.41 0.00 -1.18 -4.94 121.76 119.84 1f1g s ALA 661 Ca 0.30 -1.76 0.04 0.00 0.00 0.00 0.00 51.96 50.54 1f1g s ALA 661 Cb -0.14 1.24 0.00 0.00 0.00 0.00 0.00 23.12 24.22 1f1g s ALA 661 CO 0.80 -0.56 -0.16 -1.21 0.00 0.00 0.00 175.76 174.63 1f1g s GLU 662 N -3.48 1.89 -0.05 0.00 0.41 -1.26 -0.68 118.70 115.52 1f1g s GLU 662 Ca 0.34 -0.57 0.02 0.00 -0.41 0.00 0.00 54.97 54.36 1f1g s GLU 662 Cb 0.02 -1.57 0.01 0.00 -1.78 0.00 0.00 34.13 30.80 1f1g s GLU 662 CO 0.24 0.16 -0.11 1.03 -0.49 0.00 0.00 175.26 176.09 1f1g s ARG 663 N 0.28 1.38 0.55 1.61 1.81 -0.29 -3.34 118.95 120.96 1f1g s ARG 663 Ca -0.09 -0.36 -0.21 0.00 -1.72 0.00 0.00 55.73 53.35 1f1g s ARG 663 Cb -0.14 -1.20 -0.04 0.00 -0.45 0.00 0.00 34.95 33.12 1f1g s ARG 663 CO 0.03 0.06 1.28 0.20 -0.68 0.00 0.00 175.30 176.19 1f1g s GLY 664 N 0.51 2.83 -0.21 -3.53 0.00 0.10 -0.82 107.32 106.20 1f1g s GLY 664 Ca -0.10 1.17 -0.04 0.00 0.00 0.00 0.00 44.72 45.75 1f1g s GLY 664 CO 0.02 1.64 0.30 -0.12 0.00 0.00 0.00 173.10 174.93 1f1g s PHE 665 N -1.43 -0.53 0.06 1.90 5.36 -0.13 -0.87 117.98 122.34 1f1g s PHE 665 Ca 0.73 0.61 -0.06 0.00 -0.96 0.00 0.00 56.93 57.24 1f1g s PHE 665 Cb -0.36 -0.15 -0.01 0.00 -0.34 0.00 0.00 43.02 42.17 1f1g s PHE 665 CO 0.41 -0.61 0.11 -1.01 -1.46 0.00 0.00 175.22 172.66 1f1g s HIS 666 N 2.44 0.24 -0.19 10.12 3.76 -0.88 -1.50 115.29 129.27 1f1g s HIS 666 Ca 0.08 -0.64 -0.23 0.00 -0.15 0.00 0.00 55.06 54.12 1f1g s HIS 666 Cb -0.15 -0.15 -0.02 0.00 1.11 0.00 0.00 32.58 33.37 1f1g s HIS 666 CO -0.13 -0.44 0.74 0.42 -0.85 0.00 0.00 174.74 174.48 1f1g s ILE 667 N -3.38 4.94 0.28 0.60 -1.09 0.33 -1.03 121.20 121.84 1f1g s ILE 667 Ca 0.02 1.43 0.06 0.00 -2.23 0.00 0.00 60.65 59.93 1f1g s ILE 667 Cb 0.03 -4.05 -0.02 0.00 -1.58 0.00 0.00 42.46 36.84 1f1g s ILE 667 CO -0.08 0.06 0.39 -1.00 -1.23 0.00 0.00 174.94 173.07 1f1g s HIS 668 N 2.09 3.26 0.21 3.97 3.76 0.75 -1.09 115.29 128.24 1f1g s HIS 668 Ca 0.34 -0.12 -0.10 0.00 -0.15 0.00 0.00 55.06 55.03 1f1g s HIS 668 Cb -0.16 -1.74 0.15 0.00 1.11 0.00 0.00 32.58 31.93 1f1g s HIS 668 CO 0.11 0.25 1.82 1.49 -0.85 0.00 0.00 174.74 177.56 1f1g h GLU 669 N 1.08 1.06 -6.43 1.40 4.81 -0.74 -2.83 114.58 112.93 1f1g h GLU 669 Ca -0.49 -0.13 -0.69 0.00 -0.13 0.00 0.00 59.36 57.92 1f1g h GLU 669 Cb 1.24 -0.21 -0.24 0.00 0.63 0.00 0.00 28.75 30.18 1f1g h GLU 669 CO 0.57 0.79 -0.80 -0.06 -0.73 0.00 0.00 179.01 178.79 1f1g s PHE 670 N -5.82 2.61 -0.35 0.92 0.08 -0.33 -4.66 117.98 110.42 1f1g s PHE 670 Ca -0.13 -0.22 -0.04 0.00 0.12 0.00 0.00 56.93 56.66 1f1g s PHE 670 Cb 0.15 -1.57 0.04 0.00 -0.57 0.00 0.00 43.02 41.07 1f1g s PHE 670 CO 0.80 0.17 2.74 0.41 -0.10 0.00 0.00 175.22 179.25 1f1g n GLY 671 N 2.11 4.06 3.21 4.36 0.00 -0.90 -3.60 105.19 114.42 1f1g n GLY 671 Ca -0.17 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 43.91 1f1g n GLY 671 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f1g s ASP 672 N 0.60 4.78 -0.23 1.61 -1.08 -1.26 -4.93 116.67 116.16 1f1g s ASP 672 Ca 0.53 -1.08 0.14 0.00 -0.52 0.00 0.00 52.55 51.62 1f1g s ASP 672 Cb 0.34 -1.73 0.71 0.00 -1.46 0.00 0.00 42.92 40.79 1f1g s ASP 672 CO -0.14 -0.22 1.64 0.00 0.52 0.00 0.00 175.17 176.97 1f1g n ALA 673 N 4.68 3.66 0.35 3.66 0.00 -1.26 -3.08 120.51 128.52 1f1g n ALA 673 Ca -0.14 -2.12 0.14 0.00 0.00 0.00 0.00 53.44 51.31 1f1g n ALA 673 Cb 0.45 -0.99 0.44 0.00 0.00 0.00 0.00 19.45 19.35 1f1g n ALA 673 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1f1g h THR 674 N 3.09 0.00 -2.33 0.00 1.35 -1.93 -3.35 112.91 109.74 1f1g h THR 674 Ca 0.03 -0.59 -0.59 0.00 -0.55 0.00 0.00 66.41 64.71 1f1g h THR 674 Cb 1.83 1.54 -0.39 0.00 -1.73 0.00 0.00 68.15 69.41 1f1g h THR 674 CO 0.42 0.00 -0.96 -3.20 -0.25 0.00 0.00 175.52 171.54 1f1g n ASN 675 N -2.76 0.20 0.00 5.36 5.15 -1.26 -5.04 115.26 116.90 1f1g n ASN 675 Ca 0.03 -2.58 0.00 0.00 -0.60 0.00 0.00 54.58 51.43 1f1g n ASN 675 Cb 0.38 -0.60 0.00 0.00 -0.53 0.00 0.00 39.78 39.03 1f1g n ASN 675 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1f1g n GLY 676 N 2.31 3.20 0.61 8.20 0.00 -1.26 -1.17 105.19 117.08 1f1g n GLY 676 Ca 0.27 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.35 1f1g n GLY 676 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f1g h VAL 678 N 3.00 1.26 0.00 0.00 2.07 -1.49 -3.16 116.25 117.92 1f1g h VAL 678 Ca 0.00 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1f1g h VAL 678 Cb 0.82 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1f1g h VAL 678 CO 0.00 0.36 0.00 -1.54 0.02 0.00 0.00 177.57 176.41 1f1g n SER 679 N -4.34 0.00 0.24 0.57 3.41 -1.05 -1.60 113.62 110.86 1f1g n SER 679 Ca 0.02 -0.40 0.17 0.00 -0.26 0.00 0.00 58.87 58.39 1f1g n SER 679 Cb 0.29 -0.16 0.78 0.00 -0.26 0.00 0.00 64.21 64.86 1f1g n SER 679 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f1g h ALA 680 N 3.38 1.00 -0.10 7.33 0.00 -1.50 -3.38 119.26 125.98 1f1g h ALA 680 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1f1g h ALA 680 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1f1g h ALA 680 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1f1g n GLY 681 N -0.51 -1.50 3.83 0.00 0.00 -0.63 -1.19 105.19 105.21 1f1g n GLY 681 Ca -0.00 -1.31 -0.27 0.00 0.00 0.00 0.00 46.02 44.44 1f1g n GLY 681 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1f1g n PRO 682 N -0.04 -0.94 -1.78 1.61 -0.04 -1.26 -4.65 135.00 127.89 1f1g n PRO 682 Ca 0.00 -2.23 -0.41 0.00 -0.04 0.00 0.00 63.50 60.82 1f1g n PRO 682 Cb 0.00 -1.15 -0.00 0.00 -0.04 0.00 0.00 33.50 32.30 1f1g n PRO 682 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1f1g s HIS 683 N -3.65 2.60 -0.03 0.54 3.76 -1.26 -0.65 115.29 116.61 1f1g s HIS 683 Ca 0.72 1.07 -0.30 0.00 -0.15 0.00 0.00 55.06 56.41 1f1g s HIS 683 Cb -0.02 -4.05 -0.07 0.00 1.11 0.00 0.00 32.58 29.54 1f1g s HIS 683 CO 0.50 -3.17 1.91 0.12 -0.85 0.00 0.00 174.74 173.25 1f1g s PHE 684 N -0.88 1.46 -0.41 1.40 5.36 -0.25 -4.52 117.98 120.14 1f1g s PHE 684 Ca 0.55 -0.14 0.09 0.00 -0.96 0.00 0.00 56.93 56.47 1f1g s PHE 684 Cb -0.47 -4.12 0.33 0.00 -0.34 0.00 0.00 43.02 38.42 1f1g s PHE 684 CO 0.60 -4.88 0.89 -1.71 -1.46 0.00 0.00 175.22 168.67 1f1g n ASN 685 N 8.02 -0.52 0.24 6.13 5.15 -1.26 -1.35 115.26 131.67 1f1g n ASN 685 Ca 0.20 -3.29 0.09 0.00 -0.60 0.00 0.00 54.58 50.98 1f1g n ASN 685 Cb 0.42 0.46 0.62 0.00 -0.53 0.00 0.00 39.78 40.75 1f1g n ASN 685 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1f1g h PRO 686 N 3.03 0.00 -0.19 1.20 0.13 -1.98 -2.05 132.00 132.13 1f1g h PRO 686 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1f1g h PRO 686 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1f1g h PRO 686 CO 0.35 0.16 0.00 1.19 -0.23 0.00 0.00 178.00 179.46 1f1g n PHE 687 N -3.95 0.24 -3.57 1.56 3.72 -1.26 -4.95 117.46 109.26 1f1g n PHE 687 Ca -0.02 -0.12 -0.19 0.00 -0.05 0.00 0.00 57.45 57.07 1f1g n PHE 687 Cb 0.24 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.84 1f1g n PHE 687 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1f1g n LYS 688 N 0.53 -5.60 -3.12 -1.08 5.02 -0.77 -5.00 118.16 108.14 1f1g n LYS 688 Ca 0.17 0.73 -0.18 0.00 -2.02 0.00 0.00 58.31 57.01 1f1g n LYS 688 Cb 0.38 -5.49 0.00 0.00 -0.02 0.00 0.00 35.03 29.90 1f1g n LYS 688 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1f1g s LYS 689 N -5.66 2.84 0.58 1.97 1.02 -1.26 -5.12 119.74 114.11 1f1g s LYS 689 Ca 0.01 -1.24 -0.08 0.00 0.02 0.00 0.00 55.97 54.69 1f1g s LYS 689 Cb -0.00 -2.73 -0.02 0.00 -0.52 0.00 0.00 37.83 34.55 1f1g s LYS 689 CO 0.77 -0.22 0.93 0.95 -0.92 0.00 0.00 175.35 176.87 1f1g s THR 690 N -2.34 4.40 0.25 2.17 -4.23 -1.26 -4.68 115.64 109.95 1f1g s THR 690 Ca 0.53 0.42 -0.30 0.00 -1.18 0.00 0.00 61.69 61.16 1f1g s THR 690 Cb -0.09 -3.73 -0.10 0.00 1.34 0.00 0.00 72.50 69.92 1f1g s THR 690 CO 0.32 -0.84 1.40 -2.28 -0.54 0.00 0.00 174.62 172.69 1f1g s HIS 691 N -3.02 3.05 0.00 3.99 2.46 -0.19 -2.78 115.29 118.81 1f1g s HIS 691 Ca 0.53 1.11 0.00 0.00 0.47 0.00 0.00 55.06 57.16 1f1g s HIS 691 Cb -0.11 -3.77 0.00 0.00 -0.13 0.00 0.00 32.58 28.57 1f1g s HIS 691 CO 0.49 -2.45 0.00 0.41 -2.47 0.00 0.00 174.74 170.72 1f1g n GLY 692 N 2.02 3.18 3.83 1.59 0.00 -1.26 -4.10 105.19 110.46 1f1g n GLY 692 Ca 0.06 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.44 1f1g n GLY 692 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f1g s ALA 693 N -1.51 3.07 0.35 4.61 0.00 -1.23 -4.74 121.76 122.31 1f1g s ALA 693 Ca 0.00 0.30 0.12 0.00 0.00 0.00 0.00 51.96 52.38 1f1g s ALA 693 Cb 0.00 -3.12 0.91 0.00 0.00 0.00 0.00 23.12 20.91 1f1g s ALA 693 CO 0.00 0.01 1.80 -1.35 0.00 0.00 0.00 175.76 176.22 1f1g h PRO 694 N 1.57 0.57 -0.03 0.00 0.11 -1.90 -0.81 132.00 131.51 1f1g h PRO 694 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1f1g h PRO 694 Cb 1.18 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1f1g h PRO 694 CO 0.61 0.38 0.00 0.25 -0.21 0.00 0.00 178.00 179.03 1f1g n THR 695 N -4.67 0.03 -2.69 -1.15 -2.24 -1.26 -4.83 114.28 97.47 1f1g n THR 695 Ca 0.23 -0.18 -0.37 0.00 -2.27 0.00 0.00 64.05 61.45 1f1g n THR 695 Cb 0.67 0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 69.02 1f1g n THR 695 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1f1g s ASP 696 N -1.92 7.23 0.23 3.42 1.01 -0.31 -4.95 116.67 121.37 1f1g s ASP 696 Ca 0.39 1.94 -0.04 0.00 0.71 0.00 0.00 52.55 55.54 1f1g s ASP 696 Cb 0.20 -2.59 0.24 0.00 1.01 0.00 0.00 42.92 41.79 1f1g s ASP 696 CO 0.33 -0.15 1.72 -0.08 0.21 0.00 0.00 175.17 177.19 1f1g h GLU 697 N 3.16 0.89 -4.69 8.23 4.81 -1.88 -3.38 114.58 121.73 1f1g h GLU 697 Ca -0.47 -0.26 -0.71 0.00 -0.13 0.00 0.00 59.36 57.80 1f1g h GLU 697 Cb 1.20 -0.10 -0.20 0.00 0.63 0.00 0.00 28.75 30.29 1f1g h GLU 697 CO 0.65 0.89 -0.09 0.08 -0.73 0.00 0.00 179.01 179.80 1f1g s VAL 698 N -5.00 5.01 0.21 0.32 1.01 -1.26 -4.99 120.40 115.71 1f1g s VAL 698 Ca -0.10 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 60.95 1f1g s VAL 698 Cb 0.14 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 32.31 1f1g s VAL 698 CO 0.83 -0.74 0.56 0.00 0.00 0.00 0.00 175.10 175.75 1f1g s ARG 699 N 2.25 1.44 0.43 2.72 1.70 -1.23 -4.19 118.95 122.08 1f1g s ARG 699 Ca 0.11 -0.87 -0.24 0.00 -0.47 0.00 0.00 55.73 54.25 1f1g s ARG 699 Cb -0.21 0.54 -0.08 0.00 -0.57 0.00 0.00 34.95 34.62 1f1g s ARG 699 CO 0.10 -0.62 1.19 -1.01 -1.08 0.00 0.00 175.30 173.87 1f1g s HIS 700 N -3.88 2.93 0.33 5.89 3.76 -1.12 -4.71 115.29 118.50 1f1g s HIS 700 Ca 0.10 1.53 0.11 0.00 -0.15 0.00 0.00 55.06 56.64 1f1g s HIS 700 Cb -0.02 -3.43 0.90 0.00 1.11 0.00 0.00 32.58 31.15 1f1g s HIS 700 CO -0.02 -1.53 1.75 0.28 -0.85 0.00 0.00 174.74 174.38 1f1g h VAL 701 N 2.11 0.58 -0.01 -0.90 2.07 -1.87 -1.80 116.25 116.43 1f1g h VAL 701 Ca -0.49 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1f1g h VAL 701 Cb 1.24 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1f1g h VAL 701 CO 0.61 0.11 0.00 0.61 0.02 0.00 0.00 177.57 178.92 1f1g n GLY 702 N -1.36 -0.83 3.63 2.17 0.00 -0.46 -4.46 105.19 103.87 1f1g n GLY 702 Ca 0.26 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1f1g n GLY 702 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1f1g s ASP 703 N -1.81 6.55 -0.12 1.61 1.01 -0.68 -0.52 116.67 122.72 1f1g s ASP 703 Ca 0.38 1.24 0.15 0.00 0.71 0.00 0.00 52.55 55.03 1f1g s ASP 703 Cb 0.18 -2.54 0.38 0.00 1.01 0.00 0.00 42.92 41.95 1f1g s ASP 703 CO 0.30 -1.18 1.28 0.23 0.21 0.00 0.00 175.17 176.02 1f1g n MET 704 N 7.51 2.49 0.00 8.23 2.81 -0.56 -4.31 117.12 133.28 1f1g n MET 704 Ca 0.16 -2.51 0.00 0.00 -1.81 0.00 0.00 57.70 53.54 1f1g n MET 704 Cb 0.46 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 31.40 1f1g n MET 704 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1f1g n GLY 705 N -0.59 0.85 3.75 3.03 0.00 -1.20 -4.72 105.19 106.31 1f1g n GLY 705 Ca 0.16 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 1f1g n GLY 705 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1f1g s ASN 706 N -4.00 5.46 -0.08 1.61 0.01 -1.26 -0.96 114.94 115.73 1f1g s ASN 706 Ca 0.00 0.07 -0.04 0.00 -0.71 0.00 0.00 52.86 52.18 1f1g s ASN 706 Cb 0.00 -1.51 -0.04 0.00 0.41 0.00 0.00 41.25 40.11 1f1g s ASN 706 CO 0.00 0.26 0.09 0.68 -1.51 0.00 0.00 177.10 176.62 1f1g s VAL 707 N -1.18 5.00 0.09 1.60 -7.23 -0.00 -4.84 120.40 113.84 1f1g s VAL 707 Ca 0.22 -0.08 -0.24 0.00 -1.81 0.00 0.00 61.98 60.07 1f1g s VAL 707 Cb -0.12 -3.20 -0.07 0.00 0.56 0.00 0.00 36.38 33.56 1f1g s VAL 707 CO 0.14 0.53 0.73 -0.54 -0.31 0.00 0.00 175.10 175.65 1f1g s LYS 708 N -1.22 4.48 0.03 4.82 1.02 -1.26 -1.14 119.74 126.47 1f1g s LYS 708 Ca 0.17 1.04 0.03 0.00 0.02 0.00 0.00 55.97 57.23 1f1g s LYS 708 Cb -0.12 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.85 1f1g s LYS 708 CO 0.07 0.44 -0.03 0.95 -0.92 0.00 0.00 175.35 175.86 1f1g s THR 709 N -0.60 3.91 0.00 2.17 -4.23 0.15 -4.26 115.64 112.77 1f1g s THR 709 Ca 0.36 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 60.09 1f1g s THR 709 Cb -0.21 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 70.87 1f1g s THR 709 CO 0.23 0.31 0.00 -0.90 -0.54 0.00 0.00 174.62 173.73 1f1g n ASP 710 N 1.23 0.00 0.14 3.99 5.68 -0.02 -2.46 116.55 125.11 1f1g n ASP 710 Ca -0.14 -0.72 0.12 0.00 -0.50 0.00 0.00 54.79 53.56 1f1g n ASP 710 Cb 0.52 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 41.01 1f1g n ASP 710 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1f1g h GLU 711 N 0.00 0.00 -0.40 0.11 9.09 -1.93 -0.46 114.58 120.99 1f1g h GLU 711 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1f1g h GLU 711 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1f1g h GLU 711 CO 0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 1f1g n ASN 712 N -2.30 3.45 0.00 3.06 5.03 -1.26 -4.78 115.26 118.45 1f1g n ASN 712 Ca 0.02 -1.98 0.00 0.00 0.87 0.00 0.00 54.58 53.49 1f1g n ASN 712 Cb 0.24 -0.26 0.00 0.00 -1.02 0.00 0.00 39.78 38.74 1f1g n ASN 712 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1f1g n GLY 713 N 1.45 0.57 3.76 7.41 0.00 -0.62 -4.65 105.19 113.12 1f1g n GLY 713 Ca 0.19 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 1f1g n GLY 713 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f1g s VAL 714 N -2.00 5.41 -0.18 1.61 1.01 -1.26 -1.94 120.40 123.04 1f1g s VAL 714 Ca 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 1f1g s VAL 714 Cb 0.00 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.87 1f1g s VAL 714 CO 0.00 0.47 -0.03 0.00 0.00 0.00 0.00 175.10 175.54 1f1g s ALA 715 N 0.05 2.95 -0.08 5.51 0.00 0.47 -0.84 121.76 129.82 1f1g s ALA 715 Ca 0.11 -0.95 -0.04 0.00 0.00 0.00 0.00 51.96 51.08 1f1g s ALA 715 Cb -0.12 -1.64 0.04 0.00 0.00 0.00 0.00 23.12 21.40 1f1g s ALA 715 CO 0.00 -0.04 0.18 0.21 0.00 0.00 0.00 175.76 176.11 1f1g s LYS 716 N 0.80 0.13 0.00 0.00 2.20 -1.26 -0.27 119.74 121.34 1f1g s LYS 716 Ca -0.01 0.42 0.00 0.00 -0.36 0.00 0.00 55.97 56.02 1f1g s LYS 716 Cb -0.14 -0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.01 1f1g s LYS 716 CO 0.02 -0.16 0.00 0.41 -0.36 0.00 0.00 175.35 175.25 1f1g n GLY 717 N 4.21 -1.23 3.44 5.54 0.00 -0.78 -5.00 105.19 111.37 1f1g n GLY 717 Ca -0.26 -0.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 1f1g n GLY 717 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f1g s SER 718 N -1.22 -0.53 0.19 1.61 1.04 -1.26 -1.00 113.70 112.53 1f1g s SER 718 Ca 0.00 0.43 -0.18 0.00 0.48 0.00 0.00 55.95 56.68 1f1g s SER 718 Cb 0.00 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.66 1f1g s SER 718 CO 0.00 -0.65 0.52 0.72 0.98 0.00 0.00 173.24 174.81 1f1g s PHE 719 N -1.80 -0.16 0.03 5.02 -0.12 -0.09 -4.99 117.98 115.87 1f1g s PHE 719 Ca -0.09 -0.17 0.02 0.00 -0.05 0.00 0.00 56.93 56.64 1f1g s PHE 719 Cb -0.01 0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 42.74 1f1g s PHE 719 CO 0.04 -0.90 0.04 0.15 -0.05 0.00 0.00 175.22 174.50 1f1g s LYS 720 N -3.86 2.85 -0.03 1.99 1.02 -1.26 -0.50 119.74 119.95 1f1g s LYS 720 Ca 0.08 -0.62 -0.03 0.00 0.02 0.00 0.00 55.97 55.42 1f1g s LYS 720 Cb -0.01 -2.72 0.01 0.00 -0.52 0.00 0.00 37.83 34.60 1f1g s LYS 720 CO -0.04 0.61 0.09 0.34 -0.92 0.00 0.00 175.35 175.42 1f1g s ASP 721 N -1.90 -0.08 0.00 2.83 2.15 -0.06 -4.96 116.67 114.66 1f1g s ASP 721 Ca 0.23 0.18 0.18 0.00 0.43 0.00 0.00 52.55 53.57 1f1g s ASP 721 Cb -0.12 0.17 0.16 0.00 -0.30 0.00 0.00 42.92 42.82 1f1g s ASP 721 CO 0.15 -0.05 1.08 -1.20 -0.17 0.00 0.00 175.17 174.98 1f1g n SER 722 N 3.19 2.53 -0.05 -0.34 7.64 -1.26 -0.63 113.62 124.70 1f1g n SER 722 Ca -0.14 -1.75 -0.13 0.00 1.01 0.00 0.00 58.87 57.86 1f1g n SER 722 Cb 0.58 -0.02 -0.14 0.00 -1.01 0.00 0.00 64.21 63.62 1f1g n SER 722 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1f1g n LEU 723 N 1.01 1.26 -4.69 -3.43 4.77 -1.26 -4.89 117.00 109.77 1f1g n LEU 723 Ca 0.11 0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.88 1f1g n LEU 723 Cb 0.45 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1f1g n LEU 723 CO 0.11 0.57 0.94 -0.63 -1.33 0.00 0.00 177.39 177.05 1f1g s ILE 724 N -2.56 4.27 0.06 -0.08 1.01 -1.26 -4.99 121.20 117.65 1f1g s ILE 724 Ca -0.13 1.60 0.03 0.00 0.00 0.00 0.00 60.65 62.14 1f1g s ILE 724 Cb 0.07 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1f1g s ILE 724 CO 0.79 0.01 -0.09 -0.54 0.00 0.00 0.00 174.94 175.11 1f1g s LYS 725 N 2.12 0.64 0.00 2.79 1.02 -1.26 -3.95 119.74 121.09 1f1g s LYS 725 Ca 0.56 -0.88 0.17 0.00 0.02 0.00 0.00 55.97 55.84 1f1g s LYS 725 Cb -0.25 -0.40 0.36 0.00 -0.52 0.00 0.00 37.83 37.02 1f1g s LYS 725 CO 0.22 0.07 1.28 1.28 -0.92 0.00 0.00 175.35 177.28 1f1g n LEU 726 N 1.21 3.10 -3.82 3.17 4.77 -1.26 -0.84 117.00 123.33 1f1g n LEU 726 Ca -0.21 -1.63 -0.14 0.00 -0.03 0.00 0.00 56.01 53.99 1f1g n LEU 726 Cb 0.55 -0.23 -0.15 0.00 -2.33 0.00 0.00 43.42 41.26 1f1g n LEU 726 CO 0.22 0.71 -0.36 -0.63 -1.33 0.00 0.00 177.39 176.00 1f1g s ILE 727 N -1.17 0.01 0.00 -0.08 1.01 -1.26 -4.79 121.20 114.92 1f1g s ILE 727 Ca 0.31 0.10 0.00 0.00 0.00 0.00 0.00 60.65 61.06 1f1g s ILE 727 Cb 0.17 -0.09 0.00 0.00 0.01 0.00 0.00 42.46 42.55 1f1g s ILE 727 CO 0.24 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.85 1f1g n GLY 728 N 3.73 -3.62 0.22 6.18 0.00 -1.26 -4.31 105.19 106.13 1f1g n GLY 728 Ca -0.22 -2.07 0.15 0.00 0.00 0.00 0.00 46.02 43.89 1f1g n GLY 728 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f1g h PRO 729 N 0.00 0.00 -0.53 1.61 0.13 -2.00 -1.10 132.00 130.11 1f1g h PRO 729 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1f1g h PRO 729 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1f1g h PRO 729 CO 0.00 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.02 1f1g n THR 730 N -2.66 2.20 -1.62 1.56 -2.24 -1.26 -5.02 114.28 105.24 1f1g n THR 730 Ca 0.00 -1.40 -0.44 0.00 -2.27 0.00 0.00 64.05 59.94 1f1g n THR 730 Cb 0.21 -0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.36 1f1g n THR 730 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1f1g n SER 731 N 0.59 1.78 -0.62 3.42 2.88 -0.42 -4.54 113.62 116.71 1f1g n SER 731 Ca 0.25 1.18 0.13 0.00 -1.33 0.00 0.00 58.87 59.10 1f1g n SER 731 Cb 0.97 -1.34 0.40 0.00 -0.75 0.00 0.00 64.21 63.49 1f1g n SER 731 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1f1g n VAL 732 N 0.51 0.07 -1.72 2.46 0.24 -0.02 -4.88 118.33 114.98 1f1g n VAL 732 Ca 0.09 -0.34 -0.42 0.00 -2.04 0.00 0.00 64.34 61.63 1f1g n VAL 732 Cb 0.32 0.68 -0.03 0.00 -1.47 0.00 0.00 33.84 33.35 1f1g n VAL 732 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1f1g n VAL 733 N 0.49 0.21 -0.69 3.34 0.31 -1.26 -1.26 118.33 119.46 1f1g n VAL 733 Ca 0.18 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1f1g n VAL 733 Cb 0.41 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.36 1f1g n VAL 733 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1f1g n GLY 734 N 3.60 0.80 0.00 2.92 0.00 0.75 -5.01 105.19 108.24 1f1g n GLY 734 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1f1g n GLY 734 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f1g n ARG 735 N -2.17 2.87 -4.23 1.61 1.74 -0.39 -2.12 116.66 113.98 1f1g n ARG 735 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 1f1g n ARG 735 Cb 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.33 1f1g n ARG 735 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1f1g s SER 736 N -0.81 1.93 -0.14 0.55 0.01 -1.07 -0.29 113.70 113.88 1f1g s SER 736 Ca 0.00 -0.78 -0.06 0.00 1.31 0.00 0.00 55.95 56.43 1f1g s SER 736 Cb 0.00 -0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.13 1f1g s SER 736 CO 0.00 -0.14 0.06 -0.69 0.41 0.00 0.00 173.24 172.89 1f1g s VAL 737 N -2.00 4.83 -0.07 3.43 1.01 0.27 -0.18 120.40 127.70 1f1g s VAL 737 Ca 0.07 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.06 1f1g s VAL 737 Cb -0.06 -3.11 -0.00 0.00 0.00 0.00 0.00 36.38 33.21 1f1g s VAL 737 CO 0.03 0.55 -0.20 -0.69 0.00 0.00 0.00 175.10 174.78 1f1g s VAL 738 N -0.39 1.72 -0.17 2.92 1.01 -0.20 -1.34 120.40 123.96 1f1g s VAL 738 Ca 0.09 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 61.16 1f1g s VAL 738 Cb -0.12 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1f1g s VAL 738 CO 0.02 0.49 0.03 -0.51 0.00 0.00 0.00 175.10 175.12 1f1g s ILE 739 N 0.16 4.47 0.33 2.22 1.10 -0.80 -2.08 121.20 126.60 1f1g s ILE 739 Ca -0.09 -0.15 0.03 0.00 -0.51 0.00 0.00 60.65 59.93 1f1g s ILE 739 Cb -0.15 -2.99 -0.02 0.00 0.15 0.00 0.00 42.46 39.45 1f1g s ILE 739 CO 0.05 0.48 0.49 -1.00 -2.11 0.00 0.00 174.94 172.85 1f1g s HIS 740 N 0.33 3.35 -0.74 3.50 3.76 -0.05 -3.21 115.29 122.24 1f1g s HIS 740 Ca 0.01 0.09 0.25 0.00 -0.15 0.00 0.00 55.06 55.26 1f1g s HIS 740 Cb -0.13 -1.88 0.59 0.00 1.11 0.00 0.00 32.58 32.26 1f1g s HIS 740 CO 0.01 0.11 1.53 0.00 -0.85 0.00 0.00 174.74 175.54 1f1g n ALA 741 N -1.69 2.73 -2.65 -1.40 0.00 -0.12 -4.39 120.51 112.99 1f1g n ALA 741 Ca -0.04 -0.17 -0.29 0.00 0.00 0.00 0.00 53.44 52.93 1f1g n ALA 741 Cb 0.57 -1.29 -0.09 0.00 0.00 0.00 0.00 19.45 18.64 1f1g n ALA 741 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1f1g s GLY 742 N -3.51 2.71 0.20 0.00 0.00 -0.15 -4.94 107.32 101.63 1f1g s GLY 742 Ca 0.09 -1.25 -0.29 0.00 0.00 0.00 0.00 44.72 43.26 1f1g s GLY 742 CO 0.66 -2.08 0.93 1.62 0.00 0.00 0.00 173.10 174.23 1f1g s GLN 743 N -3.81 4.79 -0.06 2.90 0.74 -1.21 -0.72 119.66 122.29 1f1g s GLN 743 Ca 0.20 1.44 -0.29 0.00 0.05 0.00 0.00 55.36 56.76 1f1g s GLN 743 Cb 0.05 -3.30 -0.02 0.00 1.10 0.00 0.00 33.01 30.84 1f1g s GLN 743 CO 0.10 0.45 0.96 0.34 -0.55 0.00 0.00 175.29 176.60 1f1g s ASP 744 N -0.89 7.27 0.00 6.67 -1.08 -1.26 -3.87 116.67 123.51 1f1g s ASP 744 Ca 0.42 1.55 0.13 0.00 -0.52 0.00 0.00 52.55 54.13 1f1g s ASP 744 Cb -0.25 -2.55 0.45 0.00 -1.46 0.00 0.00 42.92 39.11 1f1g s ASP 744 CO 0.31 -0.33 1.34 -0.90 0.52 0.00 0.00 175.17 176.11 1f1g n ASP 745 N 4.40 1.56 -1.49 -0.34 5.68 0.46 -4.86 116.55 121.96 1f1g n ASP 745 Ca 0.07 -1.89 -0.18 0.00 -0.50 0.00 0.00 54.79 52.29 1f1g n ASP 745 Cb 0.50 -0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 40.25 1f1g n ASP 745 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1f1g n LEU 746 N 0.31 -1.39 -0.00 -2.12 4.77 -1.26 -1.71 117.00 115.59 1f1g n LEU 746 Ca 0.12 0.33 -0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1f1g n LEU 746 Cb 0.27 -2.50 -0.00 0.00 -2.33 0.00 0.00 43.42 38.85 1f1g n LEU 746 CO 0.09 -0.76 -0.00 0.61 -1.33 0.00 0.00 177.39 176.00 1f1g n GLY 747 N -0.86 0.48 1.10 -0.72 0.00 -1.25 -3.49 105.19 100.45 1f1g n GLY 747 Ca -0.18 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 45.82 1f1g n GLY 747 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1f1g n LYS 748 N -2.92 2.96 -1.73 1.61 4.76 -0.69 -4.66 118.16 117.49 1f1g n LYS 748 Ca -0.00 -2.48 -0.22 0.00 -2.87 0.00 0.00 58.31 52.74 1f1g n LYS 748 Cb 0.01 -1.52 0.14 0.00 -1.84 0.00 0.00 35.03 31.82 1f1g n LYS 748 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1f1g n GLY 749 N 1.03 -0.79 1.08 0.72 0.00 -1.26 -4.96 105.19 101.00 1f1g n GLY 749 Ca 0.20 -1.80 0.02 0.00 0.00 0.00 0.00 46.02 44.44 1f1g n GLY 749 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f1g n ASP 750 N -3.46 2.88 -4.15 1.61 10.43 -1.26 -4.89 116.55 117.72 1f1g n ASP 750 Ca 0.13 -2.38 -0.18 0.00 2.57 0.00 0.00 54.79 54.94 1f1g n ASP 750 Cb 0.47 -0.58 -0.12 0.00 1.84 0.00 0.00 41.12 42.73 1f1g n ASP 750 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1f1g s THR 751 N -1.65 1.00 0.28 -3.53 -4.23 -1.26 -4.98 115.64 101.27 1f1g s THR 751 Ca 0.21 -1.21 0.01 0.00 -1.18 0.00 0.00 61.69 59.52 1f1g s THR 751 Cb 0.16 -0.97 0.28 0.00 1.34 0.00 0.00 72.50 73.31 1f1g s THR 751 CO 0.06 -0.22 1.86 1.05 -0.54 0.00 0.00 174.62 176.83 1f1g h GLU 752 N 4.44 1.01 -0.40 3.99 9.09 -2.01 -1.02 114.58 129.68 1f1g h GLU 752 Ca -0.39 -0.06 0.02 0.00 0.05 0.00 0.00 59.36 58.97 1f1g h GLU 752 Cb 1.19 -0.23 -0.02 0.00 -1.65 0.00 0.00 28.75 28.04 1f1g h GLU 752 CO 0.41 0.67 0.27 0.93 0.05 0.00 0.00 179.01 181.33 1f1g h GLU 753 N 1.04 0.48 -0.99 1.06 4.39 -1.98 -1.37 114.58 117.21 1f1g h GLU 753 Ca 0.46 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 60.18 1f1g h GLU 753 Cb 0.37 -0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 28.85 1f1g h GLU 753 CO -0.22 0.31 0.65 1.03 -1.16 0.00 0.00 179.01 179.62 1f1g h SER 754 N 0.49 1.07 0.38 1.42 0.87 -1.52 -0.06 113.55 116.20 1f1g h SER 754 Ca 0.15 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1f1g h SER 754 Cb 0.02 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 1f1g h SER 754 CO -0.04 0.72 0.00 0.18 -0.53 0.00 0.00 176.83 177.16 1f1g n LEU 755 N -4.47 0.00 -0.10 2.23 4.77 -0.53 -1.47 117.00 117.43 1f1g n LEU 755 Ca 0.14 0.22 -0.22 0.00 -0.03 0.00 0.00 56.01 56.12 1f1g n LEU 755 Cb 0.12 -0.22 -0.08 0.00 -2.33 0.00 0.00 43.42 40.91 1f1g n LEU 755 CO 0.34 -0.03 -1.21 0.29 -1.33 0.00 0.00 177.39 175.44 1f1g n LYS 756 N -1.22 0.44 0.00 3.23 4.01 -0.49 -1.02 118.16 123.11 1f1g n LYS 756 Ca 0.14 0.19 0.00 0.00 -0.51 0.00 0.00 58.31 58.13 1f1g n LYS 756 Cb 0.18 -1.24 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 1f1g n LYS 756 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1f1g n THR 757 N -3.90 0.00 -1.01 -0.18 -2.24 -0.15 -4.72 114.28 102.08 1f1g n THR 757 Ca -0.41 -0.34 -0.00 0.00 -2.27 0.00 0.00 64.05 61.03 1f1g n THR 757 Cb 0.79 1.15 -0.00 0.00 -2.10 0.00 0.00 70.33 70.18 1f1g n THR 757 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f1g n GLY 758 N 0.35 0.23 2.57 3.38 0.00 -0.54 -3.22 105.19 107.96 1f1g n GLY 758 Ca 0.00 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1f1g n GLY 758 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f1g n ASN 759 N -0.58 -5.72 0.00 1.61 3.02 -1.26 -0.40 115.26 111.93 1f1g n ASN 759 Ca -0.00 -0.07 0.14 0.00 -0.03 0.00 0.00 54.58 54.62 1f1g n ASN 759 Cb 0.30 -4.73 0.73 0.00 -0.61 0.00 0.00 39.78 35.47 1f1g n ASN 759 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1f1g n ALA 760 N -2.43 2.41 -0.27 5.41 0.00 -1.20 -4.67 120.51 119.76 1f1g n ALA 760 Ca -0.20 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1f1g n ALA 760 Cb 0.66 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1f1g n ALA 760 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f1g n GLY 761 N 0.98 -0.54 3.48 0.00 0.00 -1.26 -0.97 105.19 106.87 1f1g n GLY 761 Ca 0.15 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 1f1g n GLY 761 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1f1g n PRO 762 N 0.00 -1.31 -3.63 1.61 -0.02 -1.26 -4.67 135.00 125.72 1f1g n PRO 762 Ca 0.00 -0.34 -0.31 0.00 -2.02 0.00 0.00 63.50 60.83 1f1g n PRO 762 Cb 0.00 -2.08 -0.09 0.00 -0.02 0.00 0.00 33.50 31.32 1f1g n PRO 762 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1f1g n ARG 763 N -3.57 2.43 0.27 -0.52 1.74 -1.26 -0.94 116.66 114.81 1f1g n ARG 763 Ca 0.06 -4.56 0.15 0.00 -0.77 0.00 0.00 57.85 52.73 1f1g n ARG 763 Cb 0.55 -2.32 0.77 0.00 -1.02 0.00 0.00 32.46 30.44 1f1g n ARG 763 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1f1g h PRO 764 N 5.14 0.00 -2.97 5.56 0.13 -1.87 -3.44 132.00 134.55 1f1g h PRO 764 Ca 0.17 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.24 1f1g h PRO 764 Cb 0.73 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.70 1f1g h PRO 764 CO 0.83 0.09 -0.04 0.00 -0.23 0.00 0.00 178.00 178.65 1f1g s ALA 765 N -4.01 -1.13 0.19 -0.56 0.00 -1.22 -4.04 121.76 110.98 1f1g s ALA 765 Ca -0.02 0.39 -0.23 0.00 0.00 0.00 0.00 51.96 52.10 1f1g s ALA 765 Cb 0.12 0.41 0.05 0.00 0.00 0.00 0.00 23.12 23.70 1f1g s ALA 765 CO 0.55 -0.50 0.74 0.00 0.00 0.00 0.00 175.76 176.55 1f1g s GLY 767 N -2.82 -0.55 0.25 0.00 0.00 -0.45 -1.29 107.32 102.47 1f1g s GLY 767 Ca 0.07 1.44 -0.30 0.00 0.00 0.00 0.00 44.72 45.93 1f1g s GLY 767 CO -0.02 1.11 1.03 0.14 0.00 0.00 0.00 173.10 175.36 1f1g s VAL 768 N -0.81 3.76 -0.28 1.40 1.01 -1.26 -0.56 120.40 123.65 1f1g s VAL 768 Ca -0.08 1.75 -0.26 0.00 0.00 0.00 0.00 61.98 63.38 1f1g s VAL 768 Cb -0.01 -4.11 0.01 0.00 0.00 0.00 0.00 36.38 32.26 1f1g s VAL 768 CO 0.08 0.41 0.92 -0.63 0.00 0.00 0.00 175.10 175.88 1f1g s ILE 769 N -1.09 4.70 0.16 2.22 1.01 0.60 -4.33 121.20 124.47 1f1g s ILE 769 Ca 0.43 1.57 0.08 0.00 0.00 0.00 0.00 60.65 62.74 1f1g s ILE 769 Cb -0.29 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 37.89 1f1g s ILE 769 CO 0.37 -0.27 -0.09 -0.83 0.00 0.00 0.00 174.94 174.12 1f1g s GLY 770 N 1.50 1.74 0.36 6.18 0.00 0.04 -0.18 107.32 116.96 1f1g s GLY 770 Ca 0.39 -1.40 -0.27 0.00 0.00 0.00 0.00 44.72 43.43 1f1g s GLY 770 CO 0.11 -1.41 1.21 1.08 0.00 0.00 0.00 173.10 174.09 1f1g s LEU 771 N -2.66 4.33 0.00 0.66 1.43 -1.26 -0.54 118.68 120.64 1f1g s LEU 771 Ca 0.24 2.46 0.00 0.00 -1.03 0.00 0.00 54.13 55.80 1f1g s LEU 771 Cb -0.09 -3.83 0.00 0.00 0.03 0.00 0.00 46.19 42.30 1f1g s LEU 771 CO 0.15 -0.55 0.00 1.07 0.23 0.00 0.00 176.35 177.25 1f1g n THR 772 N 0.50 0.00 -1.18 5.49 5.66 -0.54 -4.84 114.28 119.38 1f1g n THR 772 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 1f1g n THR 772 Cb 0.45 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.23 1f1g n THR 772 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56