#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qrv n ALA 624 N 0.00 0.00 -2.93 3.55 0.00 -1.26 -5.11 120.51 114.76 2qrv n ALA 624 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2qrv n ALA 624 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 2qrv n ALA 624 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qrv n GLU 625 N 0.00 0.95 -1.67 0.00 4.71 -1.26 -5.13 120.64 118.24 2qrv n GLU 625 Ca 0.00 -2.52 -0.45 0.00 -0.01 0.00 0.00 57.16 54.18 2qrv n GLU 625 Cb 0.00 -1.33 -0.03 0.00 -1.01 0.00 0.00 31.44 29.07 2qrv n GLU 625 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2qrv n LYS 626 N 0.55 2.11 -1.58 3.49 4.76 -1.26 -4.90 118.16 121.33 2qrv n LYS 626 Ca 0.14 0.76 -0.39 0.00 -2.87 0.00 0.00 58.31 55.95 2qrv n LYS 626 Cb 0.67 -2.47 0.04 0.00 -1.84 0.00 0.00 35.03 31.42 2qrv n LYS 626 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qrv n ARG 627 N 2.71 0.92 -4.09 1.97 1.74 -1.26 -4.98 116.66 113.67 2qrv n ARG 627 Ca 0.14 0.35 -0.26 0.00 -0.77 0.00 0.00 57.85 57.31 2qrv n ARG 627 Cb 0.30 -2.04 -0.05 0.00 -1.02 0.00 0.00 32.46 29.66 2qrv n ARG 627 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2qrv s LYS 628 N -2.44 2.26 0.54 5.56 3.01 -1.26 -4.31 119.74 123.10 2qrv s LYS 628 Ca 0.71 -1.96 -0.20 0.00 -1.01 0.00 0.00 55.97 53.51 2qrv s LYS 628 Cb -0.45 -1.99 -0.06 0.00 -1.01 0.00 0.00 37.83 34.32 2qrv s LYS 628 CO 0.51 -0.34 1.13 -2.14 0.51 0.00 0.00 175.35 175.03 2qrv s PRO 629 N -4.05 3.37 0.16 -1.68 0.02 -1.26 -0.48 135.00 131.07 2qrv s PRO 629 Ca 0.34 1.63 -0.30 0.00 0.02 0.00 0.00 61.00 62.69 2qrv s PRO 629 Cb 0.01 -2.03 -0.07 0.00 0.02 0.00 0.00 34.50 32.43 2qrv s PRO 629 CO 0.20 -0.84 1.04 -1.50 -0.33 0.00 0.00 177.00 175.57 2qrv s ILE 630 N -1.75 4.09 -0.34 2.83 2.07 -0.26 -4.52 121.20 123.32 2qrv s ILE 630 Ca 0.72 1.80 -0.03 0.00 -1.41 0.00 0.00 60.65 61.74 2qrv s ILE 630 Cb -0.24 -4.15 0.07 0.00 0.13 0.00 0.00 42.46 38.26 2qrv s ILE 630 CO 0.28 0.31 0.08 -0.13 -1.91 0.00 0.00 174.94 173.56 2qrv s ARG 631 N -0.31 2.32 0.14 3.50 0.52 -1.26 -0.35 118.95 123.52 2qrv s ARG 631 Ca 0.48 -1.42 0.05 0.00 -0.52 0.00 0.00 55.73 54.32 2qrv s ARG 631 Cb -0.27 -3.35 -0.04 0.00 0.52 0.00 0.00 34.95 31.81 2qrv s ARG 631 CO 0.33 -0.77 0.10 0.08 0.02 0.00 0.00 175.30 175.07 2qrv s VAL 632 N 1.24 4.38 -0.18 3.52 1.01 0.19 0.10 120.40 130.67 2qrv s VAL 632 Ca -0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 2qrv s VAL 632 Cb -0.21 -3.20 0.05 0.00 0.00 0.00 0.00 36.38 33.02 2qrv s VAL 632 CO -0.01 -0.05 -0.02 -0.22 0.00 0.00 0.00 175.10 174.80 2qrv s LEU 633 N -2.90 1.54 -0.23 3.92 2.96 0.15 -1.78 118.68 122.34 2qrv s LEU 633 Ca 0.30 -0.75 -0.07 0.00 -0.22 0.00 0.00 54.13 53.39 2qrv s LEU 633 Cb -0.10 -0.81 -0.03 0.00 0.50 0.00 0.00 46.19 45.75 2qrv s LEU 633 CO 0.22 -0.23 0.05 -0.55 -1.32 0.00 0.00 176.35 174.51 2qrv s SER 634 N 1.70 5.04 -0.16 3.68 0.15 0.12 -0.84 113.70 123.38 2qrv s SER 634 Ca -0.01 -0.20 -0.03 0.00 0.70 0.00 0.00 55.95 56.42 2qrv s SER 634 Cb -0.16 -1.89 -0.02 0.00 -1.71 0.00 0.00 66.02 62.24 2qrv s SER 634 CO -0.07 0.00 -0.06 -0.76 1.20 0.00 0.00 173.24 173.56 2qrv s LEU 635 N 1.37 3.08 -0.87 3.45 1.43 -0.71 -0.60 118.68 125.83 2qrv s LEU 635 Ca 0.05 -0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 52.90 2qrv s LEU 635 Cb -0.15 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.34 2qrv s LEU 635 CO 0.03 0.13 0.41 0.49 0.23 0.00 0.00 176.35 177.64 2qrv n PHE 636 N 3.76 -1.22 0.17 0.29 3.01 0.30 -3.22 117.46 120.55 2qrv n PHE 636 Ca -0.18 0.35 0.12 0.00 1.01 0.00 0.00 57.45 58.75 2qrv n PHE 636 Cb 0.52 -3.06 0.33 0.00 -0.01 0.00 0.00 39.48 37.26 2qrv n PHE 636 CO 0.00 0.00 0.00 0.22 1.01 0.00 0.00 176.76 177.99 2qrv h ASP 637 N -0.94 0.00 0.00 4.37 3.58 -1.72 -3.43 116.42 118.28 2qrv h ASP 637 Ca -0.31 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.14 2qrv h ASP 637 Cb 1.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.26 2qrv h ASP 637 CO 0.32 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 177.29 2qrv n GLY 638 N -1.50 3.67 2.08 -0.78 0.00 -1.26 -1.94 105.19 105.47 2qrv n GLY 638 Ca 0.06 0.16 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 2qrv n GLY 638 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qrv n ILE 639 N 0.00 2.95 -1.76 -0.61 -5.35 -1.26 -4.37 119.36 108.97 2qrv n ILE 639 Ca 0.00 -1.69 -0.10 0.00 -0.27 0.00 0.00 62.75 60.69 2qrv n ILE 639 Cb 0.00 -0.51 -0.02 0.00 -1.74 0.00 0.00 39.64 37.37 2qrv n ILE 639 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qrv n ALA 640 N -0.89 -0.22 -0.26 -1.28 0.00 -0.82 -4.62 120.51 112.43 2qrv n ALA 640 Ca 0.52 0.12 0.04 0.00 0.00 0.00 0.00 53.44 54.11 2qrv n ALA 640 Cb 1.53 -1.26 0.17 0.00 0.00 0.00 0.00 19.45 19.89 2qrv n ALA 640 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2qrv h THR 641 N 0.00 0.78 0.03 0.00 2.02 -1.91 0.65 112.91 114.48 2qrv h THR 641 Ca -0.22 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 66.80 2qrv h THR 641 Cb 0.92 0.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 2qrv h THR 641 CO 0.28 0.10 -0.34 1.23 0.37 0.00 0.00 175.52 177.16 2qrv h GLY 642 N 0.57 -0.61 1.44 2.16 0.00 -1.91 0.81 103.07 105.53 2qrv h GLY 642 Ca 0.39 0.41 -0.06 0.00 0.00 0.00 0.00 47.33 48.08 2qrv h GLY 642 CO -0.32 -0.24 0.05 -2.00 0.00 0.00 0.00 176.54 174.02 2qrv h LEU 643 N -0.52 0.66 0.29 3.11 5.85 -1.80 0.68 115.31 123.58 2qrv h LEU 643 Ca 0.05 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2qrv h LEU 643 Cb 0.59 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 2qrv h LEU 643 CO -0.26 0.70 -0.33 0.25 -0.34 0.00 0.00 178.44 178.46 2qrv h LEU 644 N 0.67 -0.91 -0.54 2.25 6.46 -0.16 -0.57 115.31 122.51 2qrv h LEU 644 Ca 0.14 0.08 -0.05 0.00 -0.12 0.00 0.00 57.88 57.93 2qrv h LEU 644 Cb 0.35 0.32 -0.02 0.00 -0.73 0.00 0.00 40.66 40.57 2qrv h LEU 644 CO 0.01 -0.46 0.13 0.58 -0.62 0.00 0.00 178.44 178.08 2qrv h VAL 645 N -0.67 1.24 -0.92 1.05 2.07 -0.57 -1.47 116.25 116.98 2qrv h VAL 645 Ca -0.01 -0.87 0.14 0.00 0.82 0.00 0.00 66.70 66.78 2qrv h VAL 645 Cb 0.62 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 31.08 2qrv h VAL 645 CO -0.09 0.32 0.54 -0.07 0.02 0.00 0.00 177.57 178.29 2qrv h LEU 646 N 0.77 0.73 -0.33 2.57 3.38 -0.53 0.39 115.31 122.29 2qrv h LEU 646 Ca 0.17 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.15 2qrv h LEU 646 Cb 0.34 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2qrv h LEU 646 CO 0.00 0.34 -0.04 0.11 0.09 0.00 0.00 178.44 178.94 2qrv h LYS 647 N 0.79 0.60 -0.68 1.13 1.57 -0.82 -2.80 116.57 116.37 2qrv h LYS 647 Ca 0.49 -0.21 0.13 0.00 -1.87 0.00 0.00 60.65 59.18 2qrv h LYS 647 Cb 0.60 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.78 2qrv h LYS 647 CO -0.32 0.76 0.22 -0.44 -0.57 0.00 0.00 179.45 179.09 2qrv h ASP 648 N 0.39 0.15 0.05 0.86 5.19 0.11 0.11 116.42 123.28 2qrv h ASP 648 Ca 0.09 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 2qrv h ASP 648 Cb 0.51 0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.14 2qrv h ASP 648 CO 0.02 0.06 0.00 0.18 -3.12 0.00 0.00 179.24 176.39 2qrv n LEU 649 N -5.06 0.00 -0.72 1.55 4.77 -0.53 -4.88 117.00 112.13 2qrv n LEU 649 Ca 0.11 0.04 -0.06 0.00 -0.03 0.00 0.00 56.01 56.07 2qrv n LEU 649 Cb 0.36 -0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.41 2qrv n LEU 649 CO 0.18 -0.01 -0.08 0.61 -1.33 0.00 0.00 177.39 176.76 2qrv n GLY 650 N 0.45 0.11 3.63 -0.72 0.00 0.36 -4.96 105.19 104.07 2qrv n GLY 650 Ca 0.16 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.18 2qrv n GLY 650 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qrv s ILE 651 N -2.32 5.24 0.27 -0.61 1.01 -1.06 -0.24 121.20 123.49 2qrv s ILE 651 Ca 0.00 0.48 -0.30 0.00 0.00 0.00 0.00 60.65 60.82 2qrv s ILE 651 Cb 0.00 -3.64 -0.11 0.00 0.01 0.00 0.00 42.46 38.72 2qrv s ILE 651 CO 0.00 0.24 1.56 -1.10 0.00 0.00 0.00 174.94 175.64 2qrv s GLN 652 N 1.59 4.16 -0.28 2.79 -0.21 -0.98 -4.57 119.66 122.16 2qrv s GLN 652 Ca 0.14 2.50 -0.01 0.00 0.02 0.00 0.00 55.36 58.01 2qrv s GLN 652 Cb -0.15 -3.05 0.05 0.00 1.00 0.00 0.00 33.01 30.86 2qrv s GLN 652 CO 0.08 -0.59 -0.03 0.08 -2.12 0.00 0.00 175.29 172.72 2qrv s VAL 653 N 0.09 2.80 0.06 1.09 1.01 -1.26 -1.10 120.40 123.08 2qrv s VAL 653 Ca 0.63 -1.39 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 2qrv s VAL 653 Cb -0.46 -2.59 -0.13 0.00 0.00 0.00 0.00 36.38 33.20 2qrv s VAL 653 CO 0.45 -0.05 1.51 -0.78 0.00 0.00 0.00 175.10 176.23 2qrv h ASP 654 N 7.95 0.20 -4.29 3.32 1.82 -0.92 -3.46 116.42 121.04 2qrv h ASP 654 Ca -0.22 -0.28 -0.09 0.00 -0.39 0.00 0.00 57.03 56.04 2qrv h ASP 654 Cb 1.06 -0.05 -0.22 0.00 0.68 0.00 0.00 39.33 40.80 2qrv h ASP 654 CO 0.52 0.43 -0.10 0.00 -1.61 0.00 0.00 179.24 178.48 2qrv s ARG 655 N -5.09 0.68 -0.35 0.28 1.70 -1.20 -5.02 118.95 109.93 2qrv s ARG 655 Ca -0.14 0.47 0.01 0.00 -0.47 0.00 0.00 55.73 55.60 2qrv s ARG 655 Cb 0.05 0.32 0.11 0.00 -0.57 0.00 0.00 34.95 34.86 2qrv s ARG 655 CO 0.70 -0.13 0.12 -0.47 -1.08 0.00 0.00 175.30 174.44 2qrv s TYR 656 N -0.26 2.37 -0.26 5.89 5.04 -1.26 -0.63 117.35 128.24 2qrv s TYR 656 Ca -0.04 -2.26 -0.13 0.00 -2.44 0.00 0.00 57.07 52.20 2qrv s TYR 656 Cb -0.03 -2.12 -0.04 0.00 0.35 0.00 0.00 41.96 40.11 2qrv s TYR 656 CO 0.03 -0.88 0.27 0.42 -1.34 0.00 0.00 175.55 174.06 2qrv s ILE 657 N 1.13 5.26 -0.07 3.14 1.01 -0.73 -1.58 121.20 129.34 2qrv s ILE 657 Ca 0.12 0.37 -0.02 0.00 0.00 0.00 0.00 60.65 61.12 2qrv s ILE 657 Cb -0.19 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 2qrv s ILE 657 CO -0.15 0.23 0.02 0.00 0.00 0.00 0.00 174.94 175.04 2qrv s ALA 658 N 1.74 3.37 -0.38 9.38 0.00 -0.69 0.13 121.76 135.30 2qrv s ALA 658 Ca 0.11 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.26 2qrv s ALA 658 Cb -0.15 -1.52 0.11 0.00 0.00 0.00 0.00 23.12 21.56 2qrv s ALA 658 CO 0.09 0.61 0.14 0.45 0.00 0.00 0.00 175.76 177.05 2qrv s SER 659 N -1.05 5.01 0.02 0.00 0.15 0.24 -1.05 113.70 117.02 2qrv s SER 659 Ca 0.15 -2.13 0.03 0.00 0.70 0.00 0.00 55.95 54.70 2qrv s SER 659 Cb -0.11 -1.73 -0.02 0.00 -1.71 0.00 0.00 66.02 62.45 2qrv s SER 659 CO 0.04 -0.46 -0.10 -1.61 1.20 0.00 0.00 173.24 172.32 2qrv s GLU 660 N 0.97 0.70 -0.10 5.44 0.41 -1.14 -0.54 118.70 124.45 2qrv s GLU 660 Ca 0.10 -0.56 0.09 0.00 -0.41 0.00 0.00 54.97 54.19 2qrv s GLU 660 Cb -0.21 -0.64 -0.13 0.00 -1.78 0.00 0.00 34.13 31.37 2qrv s GLU 660 CO -0.06 0.16 0.04 0.28 -0.49 0.00 0.00 175.26 175.20 2qrv n VAL 661 N 2.19 0.66 -2.50 2.63 0.31 -1.26 -4.41 118.33 115.95 2qrv n VAL 661 Ca -0.17 -0.42 -0.43 0.00 -0.01 0.00 0.00 64.34 63.31 2qrv n VAL 661 Cb 0.56 -0.69 -0.02 0.00 -0.91 0.00 0.00 33.84 32.78 2qrv n VAL 661 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qrv h GLU 663 N 9.01 0.71 0.11 0.00 4.39 -1.98 -0.34 114.58 126.48 2qrv h GLU 663 Ca -0.24 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.42 2qrv h GLU 663 Cb 1.08 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 2qrv h GLU 663 CO 1.05 0.47 -0.13 -0.44 -1.16 0.00 0.00 179.01 178.79 2qrv h ASP 664 N 0.73 -0.35 0.27 1.42 3.32 -2.00 0.95 116.42 120.77 2qrv h ASP 664 Ca 0.40 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.47 2qrv h ASP 664 Cb 0.42 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2qrv h ASP 664 CO -0.27 -0.20 -0.13 0.28 -1.72 0.00 0.00 179.24 177.20 2qrv h SER 665 N -0.28 -0.31 -0.98 6.45 0.02 -1.79 -2.22 113.55 114.44 2qrv h SER 665 Ca 0.01 -0.00 0.20 0.00 -0.84 0.00 0.00 61.79 61.16 2qrv h SER 665 Cb 0.28 0.08 -0.11 0.00 0.14 0.00 0.00 62.40 62.78 2qrv h SER 665 CO -0.05 -0.20 0.58 0.40 -1.14 0.00 0.00 176.83 176.42 2qrv h ILE 666 N -0.39 0.65 -0.35 3.27 2.04 -0.83 0.31 117.51 122.22 2qrv h ILE 666 Ca -0.04 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 2qrv h ILE 666 Cb 0.30 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 2qrv h ILE 666 CO 0.06 0.13 0.06 0.74 0.00 0.00 0.00 178.15 179.14 2qrv h THR 667 N 0.69 1.24 -0.34 -0.27 2.02 -0.44 -1.82 112.91 113.99 2qrv h THR 667 Ca 0.58 -0.82 0.06 0.00 0.77 0.00 0.00 66.41 67.01 2qrv h THR 667 Cb 0.96 1.11 -0.06 0.00 -1.74 0.00 0.00 68.15 68.42 2qrv h THR 667 CO -0.41 0.28 -0.05 0.58 0.37 0.00 0.00 175.52 176.29 2qrv h VAL 668 N 0.41 0.70 0.20 3.16 2.07 0.14 0.11 116.25 123.05 2qrv h VAL 668 Ca 0.11 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.61 2qrv h VAL 668 Cb 0.35 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2qrv h VAL 668 CO 0.01 0.01 -0.18 1.23 0.02 0.00 0.00 177.57 178.65 2qrv h GLY 669 N 0.04 -0.40 -0.43 2.17 0.00 -1.10 0.21 103.07 103.56 2qrv h GLY 669 Ca 0.16 0.20 0.05 0.00 0.00 0.00 0.00 47.33 47.75 2qrv h GLY 669 CO -0.32 -0.18 -0.55 1.98 0.00 0.00 0.00 176.54 177.48 2qrv h MET 670 N -0.40 -0.36 0.13 4.80 -1.53 -0.48 0.56 114.93 117.65 2qrv h MET 670 Ca -0.00 0.02 -0.01 0.00 -3.44 0.00 0.00 59.70 56.27 2qrv h MET 670 Cb 0.37 0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.50 2qrv h MET 670 CO -0.03 -0.24 -0.06 0.28 0.14 0.00 0.00 176.91 177.00 2qrv h VAL 671 N -0.37 0.98 -0.23 -5.77 2.07 -0.70 -0.90 116.25 111.32 2qrv h VAL 671 Ca 0.08 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 2qrv h VAL 671 Cb 0.59 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2qrv h VAL 671 CO -0.62 0.12 0.10 0.03 0.02 0.00 0.00 177.57 177.22 2qrv h ARG 672 N -0.42 0.32 -0.40 1.57 2.47 -0.76 -2.63 114.38 114.54 2qrv h ARG 672 Ca -0.02 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2qrv h ARG 672 Cb 0.33 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.59 2qrv h ARG 672 CO 0.03 0.27 0.00 0.72 0.56 0.00 0.00 179.97 181.55 2qrv n HIS 673 N -4.44 0.71 -4.01 3.04 8.25 0.17 -5.00 115.22 113.94 2qrv n HIS 673 Ca 0.00 -0.58 -0.28 0.00 -0.26 0.00 0.00 57.72 56.60 2qrv n HIS 673 Cb 0.12 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.11 2qrv n HIS 673 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2qrv n GLN 674 N 0.49 -3.37 0.00 -0.41 6.02 -0.41 -2.54 117.38 117.15 2qrv n GLN 674 Ca 0.16 0.41 0.00 0.00 -0.01 0.00 0.00 57.00 57.56 2qrv n GLN 674 Cb 0.58 -4.69 0.00 0.00 1.02 0.00 0.00 30.24 27.15 2qrv n GLN 674 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qrv n GLY 675 N -1.85 2.60 0.17 1.08 0.00 -0.78 -4.92 105.19 101.49 2qrv n GLY 675 Ca -0.21 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.31 2qrv n GLY 675 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qrv n LYS 676 N 0.00 -0.04 -2.25 1.61 3.00 -1.05 -4.28 118.16 115.15 2qrv n LYS 676 Ca 0.00 0.74 -0.42 0.00 -0.00 0.00 0.00 58.31 58.63 2qrv n LYS 676 Cb 0.00 -1.25 -0.03 0.00 0.00 0.00 0.00 35.03 33.76 2qrv n LYS 676 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 2qrv s ILE 677 N -5.09 3.93 -0.59 3.15 1.01 -1.26 -4.51 121.20 117.84 2qrv s ILE 677 Ca -0.06 1.19 -0.24 0.00 0.00 0.00 0.00 60.65 61.54 2qrv s ILE 677 Cb 0.16 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.91 2qrv s ILE 677 CO 0.40 -0.07 0.98 -0.32 0.00 0.00 0.00 174.94 175.93 2qrv s MET 678 N 3.31 3.28 -0.66 2.79 -2.45 -0.62 -4.93 119.30 120.03 2qrv s MET 678 Ca 0.63 -0.37 -0.25 0.00 -1.25 0.00 0.00 55.69 54.44 2qrv s MET 678 Cb -0.28 -4.10 0.04 0.00 1.25 0.00 0.00 34.83 31.75 2qrv s MET 678 CO 0.22 -1.61 1.11 0.71 1.05 0.00 0.00 175.02 176.51 2qrv s TYR 679 N 4.13 2.54 0.00 4.11 1.51 -1.26 -1.70 117.35 126.68 2qrv s TYR 679 Ca 0.29 -0.10 0.00 0.00 -1.01 0.00 0.00 57.07 56.25 2qrv s TYR 679 Cb -0.13 -4.41 0.00 0.00 -0.11 0.00 0.00 41.96 37.31 2qrv s TYR 679 CO 0.17 -1.74 0.00 0.28 -1.11 0.00 0.00 175.55 173.15 2qrv n VAL 680 N 6.27 0.00 0.00 0.71 0.31 -0.21 -4.98 118.33 120.43 2qrv n VAL 680 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2qrv n VAL 680 Cb 0.48 -1.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 2qrv n VAL 680 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qrv n GLY 681 N 3.61 1.35 3.73 2.92 0.00 -1.26 -4.27 105.19 111.26 2qrv n GLY 681 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 2qrv n GLY 681 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qrv s ASP 682 N -0.01 6.82 0.17 1.61 2.15 -1.26 -2.87 116.67 123.28 2qrv s ASP 682 Ca 0.00 2.44 -0.28 0.00 0.43 0.00 0.00 52.55 55.14 2qrv s ASP 682 Cb 0.00 -2.61 -0.01 0.00 -0.30 0.00 0.00 42.92 40.00 2qrv s ASP 682 CO 0.00 -0.60 1.55 -0.37 -0.17 0.00 0.00 175.17 175.58 2qrv h VAL 683 N 3.83 0.01 0.00 1.11 -1.51 -1.92 -1.94 116.25 115.84 2qrv h VAL 683 Ca -0.44 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 64.99 2qrv h VAL 683 Cb 1.21 0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.37 2qrv h VAL 683 CO 0.80 0.00 0.01 -2.11 -1.23 0.00 0.00 177.57 175.04 2qrv n ARG 684 N -5.33 0.71 0.00 5.19 0.00 -1.26 -0.42 116.66 115.56 2qrv n ARG 684 Ca 0.03 -0.19 0.00 0.00 -0.00 0.00 0.00 57.85 57.68 2qrv n ARG 684 Cb 0.31 -1.43 0.00 0.00 -0.00 0.00 0.00 32.46 31.34 2qrv n ARG 684 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2qrv n SER 685 N 2.11 0.00 -4.77 2.89 3.41 -0.73 -5.03 113.62 111.50 2qrv n SER 685 Ca 0.08 -1.00 -0.36 0.00 -0.26 0.00 0.00 58.87 57.33 2qrv n SER 685 Cb 0.34 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.22 2qrv n SER 685 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2qrv s VAL 686 N 0.00 5.32 0.21 -3.33 1.01 0.44 -4.99 120.40 119.06 2qrv s VAL 686 Ca 0.00 0.47 0.08 0.00 0.00 0.00 0.00 61.98 62.53 2qrv s VAL 686 Cb 0.00 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 2qrv s VAL 686 CO 0.00 0.47 -0.14 0.42 0.00 0.00 0.00 175.10 175.84 2qrv s THR 687 N -0.04 1.77 0.26 3.92 -4.23 -1.26 -4.98 115.64 111.07 2qrv s THR 687 Ca 0.16 -2.22 -0.03 0.00 -1.18 0.00 0.00 61.69 58.42 2qrv s THR 687 Cb -0.13 -2.07 0.28 0.00 1.34 0.00 0.00 72.50 71.92 2qrv s THR 687 CO 0.04 -0.58 1.65 -0.61 -0.54 0.00 0.00 174.62 174.59 2qrv h GLN 688 N 2.54 0.18 -0.90 3.99 5.75 -1.97 1.28 115.11 125.98 2qrv h GLN 688 Ca -0.38 -0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.21 2qrv h GLN 688 Cb 1.22 -0.04 -0.08 0.00 1.07 0.00 0.00 27.48 29.66 2qrv h GLN 688 CO 0.62 0.12 0.54 0.87 -2.65 0.00 0.00 178.83 178.33 2qrv h LYS 689 N 0.19 0.87 -0.29 1.69 1.79 -1.99 -1.66 116.57 117.17 2qrv h LYS 689 Ca 0.46 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.87 2qrv h LYS 689 Cb 0.86 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.30 2qrv h LYS 689 CO -0.62 0.58 0.15 0.45 -1.08 0.00 0.00 179.45 178.92 2qrv h HIS 690 N 0.90 0.41 0.22 -1.35 3.86 0.12 -2.57 115.15 116.73 2qrv h HIS 690 Ca 0.43 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.62 2qrv h HIS 690 Cb 0.38 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.70 2qrv h HIS 690 CO -0.04 0.37 -0.33 0.82 0.86 0.00 0.00 177.93 179.61 2qrv h ILE 691 N 0.34 0.00 0.00 2.45 5.03 -0.08 1.55 117.51 126.81 2qrv h ILE 691 Ca 0.10 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.84 2qrv h ILE 691 Cb 0.10 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.89 2qrv h ILE 691 CO -0.01 0.00 0.00 0.06 -0.68 0.00 0.00 178.15 177.52 2qrv h GLN 692 N -0.58 0.00 0.03 2.37 -0.00 -1.64 -1.70 115.11 113.60 2qrv h GLN 692 Ca -0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 58.65 58.35 2qrv h GLN 692 Cb 0.53 0.00 0.02 0.00 -0.00 0.00 0.00 27.48 28.03 2qrv h GLN 692 CO -0.10 0.00 -1.09 1.49 -0.00 0.00 0.00 178.83 179.13 2qrv h GLU 693 N 0.00 0.63 -0.75 0.06 4.81 -1.00 -3.00 114.58 115.33 2qrv h GLU 693 Ca 0.00 -0.72 0.00 0.00 -0.13 0.00 0.00 59.36 58.51 2qrv h GLU 693 Cb 0.47 0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.07 2qrv h GLU 693 CO 0.00 1.31 0.00 0.91 -0.73 0.00 0.00 179.01 180.50 2qrv n TRP 694 N -3.81 0.00 -0.78 0.92 5.03 0.53 -4.92 117.44 114.41 2qrv n TRP 694 Ca -0.11 -0.06 0.09 0.00 3.03 0.00 0.00 57.50 60.44 2qrv n TRP 694 Cb 0.91 -0.08 -0.05 0.00 -1.03 0.00 0.00 31.31 31.06 2qrv n TRP 694 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2qrv n GLY 695 N 0.36 -3.08 3.77 6.99 0.00 -1.13 -4.85 105.19 107.25 2qrv n GLY 695 Ca 0.00 -1.22 -0.36 0.00 0.00 0.00 0.00 46.02 44.44 2qrv n GLY 695 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qrv s PRO 696 N -3.80 3.62 -0.05 1.61 0.04 -1.26 -4.57 135.00 130.59 2qrv s PRO 696 Ca 0.00 1.71 0.01 0.00 0.04 0.00 0.00 61.00 62.76 2qrv s PRO 696 Cb 0.00 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 2qrv s PRO 696 CO 0.00 -0.66 -0.04 -0.06 0.04 0.00 0.00 177.00 176.28 2qrv s PHE 697 N -1.63 3.00 -0.18 0.56 0.40 -1.26 -4.88 117.98 113.99 2qrv s PHE 697 Ca 0.67 0.06 -0.00 0.00 -0.60 0.00 0.00 56.93 57.06 2qrv s PHE 697 Cb -0.27 -1.71 -0.22 0.00 0.51 0.00 0.00 43.02 41.34 2qrv s PHE 697 CO 0.32 0.39 0.10 -0.25 0.70 0.00 0.00 175.22 176.48 2qrv n ASP 698 N 1.96 1.85 -4.15 1.36 10.43 0.12 -4.88 116.55 123.24 2qrv n ASP 698 Ca -0.17 0.06 -0.27 0.00 2.57 0.00 0.00 54.79 56.97 2qrv n ASP 698 Cb 0.53 -0.50 -0.16 0.00 1.84 0.00 0.00 41.12 42.83 2qrv n ASP 698 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2qrv s LEU 699 N -6.66 1.92 -0.15 0.64 2.96 -0.93 -0.06 118.68 116.40 2qrv s LEU 699 Ca -0.26 -0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.25 2qrv s LEU 699 Cb 0.08 -1.07 0.04 0.00 0.50 0.00 0.00 46.19 45.74 2qrv s LEU 699 CO 0.70 0.15 -0.06 -0.69 -1.32 0.00 0.00 176.35 175.13 2qrv s VAL 700 N 0.14 1.12 0.23 1.68 1.01 -0.03 -0.68 120.40 123.88 2qrv s VAL 700 Ca -0.07 -0.56 0.10 0.00 0.00 0.00 0.00 61.98 61.44 2qrv s VAL 700 Cb -0.13 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2qrv s VAL 700 CO 0.04 0.20 -0.18 0.27 0.00 0.00 0.00 175.10 175.43 2qrv s ILE 701 N 1.64 2.07 -0.29 2.22 -4.36 -0.02 -0.46 121.20 122.01 2qrv s ILE 701 Ca 0.02 -2.25 -0.31 0.00 -0.26 0.00 0.00 60.65 57.85 2qrv s ILE 701 Cb -0.15 -2.12 0.19 0.00 1.25 0.00 0.00 42.46 41.63 2qrv s ILE 701 CO -0.08 -0.46 1.37 -0.83 0.24 0.00 0.00 174.94 175.18 2qrv s GLY 702 N -3.28 0.04 -0.38 6.27 0.00 -0.38 -1.75 107.32 107.84 2qrv s GLY 702 Ca 0.25 2.67 0.02 0.00 0.00 0.00 0.00 44.72 47.66 2qrv s GLY 702 CO 0.10 1.01 0.30 -0.32 0.00 0.00 0.00 173.10 174.20 2qrv s GLY 703 N -1.22 0.68 0.64 0.20 0.00 -1.20 -0.93 107.32 105.49 2qrv s GLY 703 Ca 0.10 -1.79 -0.18 0.00 0.00 0.00 0.00 44.72 42.85 2qrv s GLY 703 CO -0.07 2.30 1.25 -1.35 0.00 0.00 0.00 173.10 175.24 2qrv s SER 704 N 0.84 4.74 -0.02 1.64 1.04 -1.26 -4.85 113.70 115.82 2qrv s SER 704 Ca 0.23 2.50 -0.40 0.00 0.48 0.00 0.00 55.95 58.76 2qrv s SER 704 Cb -0.13 -2.61 -0.19 0.00 0.10 0.00 0.00 66.02 63.19 2qrv s SER 704 CO -0.06 -1.91 1.17 -2.65 0.98 0.00 0.00 173.24 170.78 2qrv n PRO 705 N -1.92 0.25 0.03 4.02 -0.02 -1.26 -4.87 135.00 131.23 2qrv n PRO 705 Ca 0.15 0.09 -0.01 0.00 -2.02 0.00 0.00 63.50 61.70 2qrv n PRO 705 Cb 0.49 -1.62 -0.09 0.00 -0.02 0.00 0.00 33.50 32.26 2qrv n PRO 705 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qrv n ASN 707 N -2.93 -0.64 -0.42 0.00 3.02 -1.26 0.07 115.26 113.10 2qrv n ASN 707 Ca -0.10 1.39 0.00 0.00 -0.03 0.00 0.00 54.58 55.84 2qrv n ASN 707 Cb 0.87 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.77 2qrv n ASN 707 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2qrv n ASP 708 N -5.10 0.72 0.00 6.41 9.92 -1.26 -2.71 116.55 124.54 2qrv n ASP 708 Ca 0.06 -1.74 0.00 0.00 -0.53 0.00 0.00 54.79 52.58 2qrv n ASP 708 Cb 0.27 -0.36 0.00 0.00 -0.64 0.00 0.00 41.12 40.39 2qrv n ASP 708 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2qrv n LEU 709 N -0.03 0.00 -4.66 0.64 4.77 0.11 -1.34 117.00 116.50 2qrv n LEU 709 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 2qrv n LEU 709 Cb 0.18 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2qrv n LEU 709 CO 0.00 0.00 1.34 -0.55 -1.33 0.00 0.00 177.39 176.85 2qrv s SER 710 N -2.03 6.67 0.59 -1.43 0.15 -0.89 -3.83 113.70 112.93 2qrv s SER 710 Ca 0.00 2.14 0.29 0.00 0.70 0.00 0.00 55.95 59.08 2qrv s SER 710 Cb 0.00 -2.53 1.58 0.00 -1.71 0.00 0.00 66.02 63.35 2qrv s SER 710 CO 0.00 -0.94 2.00 0.40 1.20 0.00 0.00 173.24 175.90 2qrv h ILE 711 N 5.61 0.40 -0.23 6.45 1.08 -1.60 -1.38 117.51 127.85 2qrv h ILE 711 Ca -0.38 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.05 2qrv h ILE 711 Cb 1.17 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 35.64 2qrv h ILE 711 CO 0.96 0.00 -0.03 0.58 -0.69 0.00 0.00 178.15 178.97 2qrv h VAL 712 N 0.00 1.27 -2.12 1.67 2.07 -1.89 -3.40 116.25 113.85 2qrv h VAL 712 Ca 0.14 -0.98 -0.51 0.00 0.82 0.00 0.00 66.70 66.17 2qrv h VAL 712 Cb 0.81 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.99 2qrv h VAL 712 CO -0.00 0.30 1.25 0.20 0.02 0.00 0.00 177.57 179.34 2qrv s ASN 713 N -5.97 5.59 0.52 0.57 0.01 -0.52 -4.85 114.94 110.28 2qrv s ASN 713 Ca -0.14 0.07 0.18 0.00 -0.71 0.00 0.00 52.86 52.27 2qrv s ASN 713 Cb 0.07 -2.54 1.31 0.00 0.41 0.00 0.00 41.25 40.50 2qrv s ASN 713 CO 0.75 -2.18 2.14 1.55 -1.51 0.00 0.00 177.10 177.84 2qrv h PRO 714 N 13.23 0.00 0.00 -0.60 0.13 -1.83 -0.81 132.00 142.12 2qrv h PRO 714 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2qrv h PRO 714 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2qrv h PRO 714 CO 1.24 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 179.04 2qrv n ALA 715 N -2.50 1.68 -1.49 -0.56 0.00 -1.26 -4.87 120.51 111.51 2qrv n ALA 715 Ca -0.03 -0.00 -0.52 0.00 0.00 0.00 0.00 53.44 52.89 2qrv n ALA 715 Cb 0.11 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 2qrv n ALA 715 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qrv n ARG 716 N -1.78 0.32 -0.72 0.00 1.85 -0.31 -4.88 116.66 111.14 2qrv n ARG 716 Ca 0.03 0.11 0.08 0.00 -1.00 0.00 0.00 57.85 57.07 2qrv n ARG 716 Cb 0.20 -1.44 0.36 0.00 -1.05 0.00 0.00 32.46 30.52 2qrv n ARG 716 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2qrv n LYS 717 N 1.39 4.17 -0.79 2.89 5.02 -1.26 -5.02 118.16 124.57 2qrv n LYS 717 Ca 0.18 -3.00 0.11 0.00 -2.02 0.00 0.00 58.31 53.57 2qrv n LYS 717 Cb 0.18 -2.06 -0.03 0.00 -0.02 0.00 0.00 35.03 33.11 2qrv n LYS 717 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qrv n GLY 718 N 0.57 -1.78 0.29 0.72 0.00 -0.45 -3.22 105.19 101.32 2qrv n GLY 718 Ca 0.26 -1.21 0.17 0.00 0.00 0.00 0.00 46.02 45.24 2qrv n GLY 718 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2qrv h LEU 719 N 0.00 0.00 -0.04 0.99 5.85 -1.88 -3.24 115.31 116.99 2qrv h LEU 719 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2qrv h LEU 719 Cb 0.72 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.75 2qrv h LEU 719 CO 0.01 0.04 -0.93 -1.22 -0.34 0.00 0.00 178.44 176.00 2qrv n TYR 720 N -3.22 0.00 -3.70 1.25 4.02 -1.26 -2.19 117.16 112.07 2qrv n TYR 720 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 2qrv n TYR 720 Cb 0.23 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.53 2qrv n TYR 720 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2qrv n GLU 721 N -1.44 1.96 0.00 -0.72 -0.58 -1.20 -4.56 120.64 114.10 2qrv n GLU 721 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2qrv n GLU 721 Cb 0.34 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.21 2qrv n GLU 721 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qrv n GLY 722 N 3.76 1.49 0.16 0.62 0.00 -1.26 -1.16 105.19 108.79 2qrv n GLY 722 Ca 0.00 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.87 2qrv n GLY 722 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2qrv h THR 723 N 0.00 0.00 -0.89 2.61 1.35 -1.94 -3.31 112.91 110.73 2qrv h THR 723 Ca 0.00 -0.76 0.16 0.00 -0.55 0.00 0.00 66.41 65.27 2qrv h THR 723 Cb 0.00 1.70 -0.16 0.00 -1.73 0.00 0.00 68.15 67.96 2qrv h THR 723 CO 0.00 0.00 -0.30 1.23 -0.25 0.00 0.00 175.52 176.20 2qrv h GLY 724 N 4.24 0.34 -0.72 5.82 0.00 -1.26 0.37 103.07 111.86 2qrv h GLY 724 Ca 0.00 0.39 0.36 0.00 0.00 0.00 0.00 47.33 48.09 2qrv h GLY 724 CO 0.00 -0.28 0.56 3.21 0.00 0.00 0.00 176.54 180.03 2qrv h ARG 725 N -0.03 0.18 -1.63 4.80 3.08 -0.90 -1.61 114.38 118.28 2qrv h ARG 725 Ca 0.38 -0.01 0.52 0.00 0.07 0.00 0.00 59.98 60.93 2qrv h ARG 725 Cb 0.62 -0.04 -0.12 0.00 0.08 0.00 0.00 29.97 30.52 2qrv h ARG 725 CO -0.91 0.12 1.11 1.28 -1.07 0.00 0.00 179.97 180.49 2qrv n LEU 726 N -5.14 0.13 0.05 3.04 4.77 0.13 -0.87 117.00 119.11 2qrv n LEU 726 Ca 0.34 1.24 -0.15 0.00 -0.03 0.00 0.00 56.01 57.42 2qrv n LEU 726 Cb 1.11 -0.61 -0.09 0.00 -2.33 0.00 0.00 43.42 41.50 2qrv n LEU 726 CO 0.06 -1.32 0.54 0.15 -1.33 0.00 0.00 177.39 175.49 2qrv h PHE 727 N 0.00 -1.44 -0.90 -1.77 3.57 -1.46 -0.86 116.94 114.09 2qrv h PHE 727 Ca 0.91 0.05 0.26 0.00 3.53 0.00 0.00 57.97 62.72 2qrv h PHE 727 Cb 3.24 0.63 -0.04 0.00 2.79 0.00 0.00 35.95 42.57 2qrv h PHE 727 CO -0.00 -0.55 0.78 0.74 -2.23 0.00 0.00 178.31 177.05 2qrv h PHE 728 N -0.63 0.00 -0.37 0.41 -1.00 -1.25 0.91 116.94 115.02 2qrv h PHE 728 Ca 0.03 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.80 2qrv h PHE 728 Cb 0.70 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.24 2qrv h PHE 728 CO -0.49 0.00 0.21 0.93 -1.61 0.00 0.00 178.31 177.35 2qrv h GLU 729 N 0.00 0.51 -0.78 1.51 3.07 -1.24 0.76 114.58 118.42 2qrv h GLU 729 Ca 0.43 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 59.18 2qrv h GLU 729 Cb 1.98 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 29.76 2qrv h GLU 729 CO -0.00 0.41 0.29 0.35 -1.40 0.00 0.00 179.01 178.65 2qrv h PHE 730 N 0.47 1.21 0.88 4.33 3.57 0.86 -0.39 116.94 127.88 2qrv h PHE 730 Ca 0.13 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 2qrv h PHE 730 Cb 0.04 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.43 2qrv h PHE 730 CO -0.03 0.93 -0.49 -0.92 -2.23 0.00 0.00 178.31 175.57 2qrv h TYR 731 N 1.14 -1.29 -0.55 0.41 3.20 -0.62 0.26 116.97 119.52 2qrv h TYR 731 Ca 0.26 -0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.22 2qrv h TYR 731 Cb 0.25 0.45 -0.10 0.00 1.54 0.00 0.00 36.73 38.87 2qrv h TYR 731 CO 0.02 -0.75 -0.15 -0.09 -1.64 0.00 0.00 178.16 175.55 2qrv h ARG 732 N -1.27 -0.01 -0.19 1.82 2.43 0.87 -0.87 114.38 117.17 2qrv h ARG 732 Ca -0.12 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.95 2qrv h ARG 732 Cb 1.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 2qrv h ARG 732 CO 0.15 -0.01 -0.33 -0.07 -1.51 0.00 0.00 179.97 178.21 2qrv h LEU 733 N -0.01 0.39 -0.04 3.80 -0.00 -1.03 -1.42 115.31 116.99 2qrv h LEU 733 Ca 0.26 -0.14 -0.00 0.00 -0.00 0.00 0.00 57.88 58.00 2qrv h LEU 733 Cb 0.41 -0.11 -0.00 0.00 -0.00 0.00 0.00 40.66 40.96 2qrv h LEU 733 CO -0.57 0.70 0.02 0.25 -0.00 0.00 0.00 178.44 178.84 2qrv h LEU 734 N 0.33 0.04 -0.78 1.67 6.46 0.06 -1.53 115.31 121.56 2qrv h LEU 734 Ca 0.04 -0.03 0.06 0.00 -0.12 0.00 0.00 57.88 57.82 2qrv h LEU 734 Cb 0.74 -0.01 -0.06 0.00 -0.73 0.00 0.00 40.66 40.60 2qrv h LEU 734 CO 0.06 0.06 0.47 -0.74 -0.62 0.00 0.00 178.44 177.67 2qrv h HIS 735 N 0.02 0.87 0.00 1.25 2.76 -1.02 0.01 115.15 119.03 2qrv h HIS 735 Ca 0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2qrv h HIS 735 Cb 0.03 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.71 2qrv h HIS 735 CO -0.07 0.44 0.00 -0.44 -1.30 0.00 0.00 177.93 176.56 2qrv h ASP 736 N 0.87 0.00 0.00 3.26 3.32 -0.75 -3.30 116.42 119.82 2qrv h ASP 736 Ca 0.34 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.14 2qrv h ASP 736 Cb 0.16 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.66 2qrv h ASP 736 CO -0.17 0.00 -1.94 0.00 -1.72 0.00 0.00 179.24 175.41 2qrv n ALA 737 N -1.89 1.66 -1.75 3.45 0.00 -0.58 -4.77 120.51 116.63 2qrv n ALA 737 Ca 0.01 -0.83 -0.42 0.00 0.00 0.00 0.00 53.44 52.20 2qrv n ALA 737 Cb 0.22 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.68 2qrv n ALA 737 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qrv n ARG 738 N -2.67 2.52 -1.63 0.00 1.85 -0.12 -4.75 116.66 111.86 2qrv n ARG 738 Ca -0.25 0.88 -0.45 0.00 -1.00 0.00 0.00 57.85 57.03 2qrv n ARG 738 Cb 0.90 -2.58 -0.02 0.00 -1.05 0.00 0.00 32.46 29.71 2qrv n ARG 738 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2qrv n PRO 739 N 0.60 1.67 -2.42 2.89 -0.02 -1.26 -4.95 135.00 131.50 2qrv n PRO 739 Ca 0.03 0.59 -0.34 0.00 -2.02 0.00 0.00 63.50 61.76 2qrv n PRO 739 Cb 0.38 -2.12 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 2qrv n PRO 739 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2qrv s LYS 740 N -0.92 3.65 -0.27 -0.52 1.02 -1.26 -4.88 119.74 116.56 2qrv s LYS 740 Ca 0.65 1.39 -0.41 0.00 0.02 0.00 0.00 55.97 57.62 2qrv s LYS 740 Cb -0.70 -2.07 -0.17 0.00 -0.52 0.00 0.00 37.83 34.38 2qrv s LYS 740 CO 0.55 -0.56 1.65 -1.91 -0.92 0.00 0.00 175.35 174.16 2qrv n GLU 741 N -1.18 0.92 0.00 1.68 2.13 -1.26 -1.04 120.64 121.89 2qrv n GLU 741 Ca 0.10 0.33 0.00 0.00 0.66 0.00 0.00 57.16 58.25 2qrv n GLU 741 Cb 0.52 -1.98 0.00 0.00 0.27 0.00 0.00 31.44 30.26 2qrv n GLU 741 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qrv n GLY 742 N 3.88 3.44 3.65 8.31 0.00 -1.26 -5.06 105.19 118.15 2qrv n GLY 742 Ca 0.26 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 2qrv n GLY 742 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qrv s ASP 743 N 0.00 6.94 -0.03 1.61 2.15 -0.21 -4.90 116.67 122.23 2qrv s ASP 743 Ca 0.00 1.38 0.17 0.00 0.43 0.00 0.00 52.55 54.54 2qrv s ASP 743 Cb 0.00 -2.54 0.55 0.00 -0.30 0.00 0.00 42.92 40.63 2qrv s ASP 743 CO 0.00 -0.82 1.45 0.47 -0.17 0.00 0.00 175.17 176.10 2qrv n ASP 744 N 6.77 3.46 -4.59 -0.34 8.00 -1.26 -4.69 116.55 123.90 2qrv n ASP 744 Ca 0.13 -2.12 -0.43 0.00 0.71 0.00 0.00 54.79 53.08 2qrv n ASP 744 Cb 0.46 -0.44 -0.00 0.00 -0.02 0.00 0.00 41.12 41.12 2qrv n ASP 744 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2qrv n ARG 745 N 1.13 1.31 -2.02 -1.24 0.63 -1.26 -4.89 116.66 110.32 2qrv n ARG 745 Ca 0.20 0.46 -0.42 0.00 -0.92 0.00 0.00 57.85 57.18 2qrv n ARG 745 Cb 0.59 -1.90 -0.03 0.00 0.45 0.00 0.00 32.46 31.57 2qrv n ARG 745 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2qrv s PRO 746 N -1.74 4.27 -0.15 -0.14 0.02 -1.26 -4.92 135.00 131.08 2qrv s PRO 746 Ca 0.61 2.29 -0.06 0.00 0.02 0.00 0.00 61.00 63.86 2qrv s PRO 746 Cb -0.63 -3.13 0.07 0.00 0.02 0.00 0.00 34.50 30.83 2qrv s PRO 746 CO 0.59 -0.45 0.32 0.12 -0.33 0.00 0.00 177.00 177.24 2qrv s PHE 747 N 0.30 -0.54 0.02 6.54 5.36 -1.26 -4.78 117.98 123.62 2qrv s PHE 747 Ca 0.62 1.15 0.08 0.00 -0.96 0.00 0.00 56.93 57.81 2qrv s PHE 747 Cb -0.42 0.09 -0.03 0.00 -0.34 0.00 0.00 43.02 42.32 2qrv s PHE 747 CO 0.40 -0.39 -0.22 -0.06 -1.46 0.00 0.00 175.22 173.49 2qrv s PHE 748 N 2.35 2.44 0.01 10.12 0.08 0.92 -5.00 117.98 128.89 2qrv s PHE 748 Ca -0.01 -0.34 -0.08 0.00 0.12 0.00 0.00 56.93 56.61 2qrv s PHE 748 Cb -0.12 -1.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.88 2qrv s PHE 748 CO -0.10 0.14 0.16 1.67 -0.10 0.00 0.00 175.22 177.00 2qrv s TRP 749 N -0.80 0.02 -0.03 0.36 1.48 -1.26 -0.85 118.94 117.86 2qrv s TRP 749 Ca 0.12 -0.12 -0.07 0.00 -1.06 0.00 0.00 56.10 54.97 2qrv s TRP 749 Cb -0.10 -0.03 0.01 0.00 -1.16 0.00 0.00 33.47 32.19 2qrv s TRP 749 CO 0.02 -0.32 0.17 -1.17 -4.06 0.00 0.00 176.95 171.59 2qrv s LEU 750 N -1.50 1.39 -0.09 -4.66 2.96 0.39 -2.44 118.68 114.73 2qrv s LEU 750 Ca -0.13 0.09 -0.05 0.00 -0.22 0.00 0.00 54.13 53.82 2qrv s LEU 750 Cb -0.06 0.69 0.04 0.00 0.50 0.00 0.00 46.19 47.36 2qrv s LEU 750 CO 0.01 -0.23 0.22 0.12 -1.32 0.00 0.00 176.35 175.15 2qrv s PHE 751 N -0.67 -0.28 0.44 5.38 5.36 -0.45 -1.25 117.98 126.51 2qrv s PHE 751 Ca -0.08 0.69 0.06 0.00 -0.96 0.00 0.00 56.93 56.64 2qrv s PHE 751 Cb -0.04 0.02 -0.05 0.00 -0.34 0.00 0.00 43.02 42.61 2qrv s PHE 751 CO 0.01 -0.20 0.12 -2.00 -1.46 0.00 0.00 175.22 171.69 2qrv s GLU 752 N 1.12 2.15 0.00 10.12 -6.30 -0.10 -1.14 118.70 124.54 2qrv s GLU 752 Ca -0.08 -2.02 0.00 0.00 -2.50 0.00 0.00 54.97 50.36 2qrv s GLU 752 Cb -0.10 -1.82 0.00 0.00 0.00 0.00 0.00 34.13 32.21 2qrv s GLU 752 CO -0.07 -0.18 0.00 -1.71 0.02 0.00 0.00 175.26 173.32 2qrv n ASN 753 N -1.21 0.00 -4.69 -1.70 5.15 -1.12 -4.25 115.26 107.44 2qrv n ASN 753 Ca -0.05 0.00 -0.44 0.00 -0.60 0.00 0.00 54.58 53.49 2qrv n ASN 753 Cb 0.66 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.89 2qrv n ASN 753 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2qrv n VAL 754 N -0.49 1.14 -0.19 3.44 0.24 -1.26 -0.85 118.33 120.37 2qrv n VAL 754 Ca 0.00 -0.28 -0.10 0.00 -2.04 0.00 0.00 64.34 61.92 2qrv n VAL 754 Cb 0.00 -1.60 0.01 0.00 -1.47 0.00 0.00 33.84 30.78 2qrv n VAL 754 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 2qrv h VAL 755 N 3.03 1.27 -0.31 3.34 3.04 -1.88 -3.35 116.25 121.38 2qrv h VAL 755 Ca -0.46 -1.15 -0.62 0.00 -1.01 0.00 0.00 66.70 63.47 2qrv h VAL 755 Cb 1.27 0.94 -0.03 0.00 -2.01 0.00 0.00 31.29 31.45 2qrv h VAL 755 CO 0.74 0.41 2.31 0.00 -1.01 0.00 0.00 177.57 180.02 2qrv n ALA 756 N -2.47 3.80 -2.28 3.17 0.00 -1.26 -4.88 120.51 116.59 2qrv n ALA 756 Ca 0.01 -3.58 -0.15 0.00 0.00 0.00 0.00 53.44 49.73 2qrv n ALA 756 Cb 0.35 -3.57 -0.10 0.00 0.00 0.00 0.00 19.45 16.12 2qrv n ALA 756 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qrv s MET 757 N 4.50 1.25 0.16 0.00 0.00 -1.26 -1.47 119.30 122.48 2qrv s MET 757 Ca 0.55 -1.64 -0.31 0.00 0.00 0.00 0.00 55.69 54.29 2qrv s MET 757 Cb 0.09 -0.27 -0.09 0.00 0.00 0.00 0.00 34.83 34.55 2qrv s MET 757 CO 0.05 -0.20 1.51 0.20 0.00 0.00 0.00 175.02 176.57 2qrv s GLY 758 N -3.24 1.73 0.60 3.16 0.00 -1.25 -4.85 107.32 103.48 2qrv s GLY 758 Ca 0.30 1.30 0.28 0.00 0.00 0.00 0.00 44.72 46.60 2qrv s GLY 758 CO 0.08 2.53 1.78 -0.39 0.00 0.00 0.00 173.10 177.10 2qrv h VAL 759 N 4.05 0.25 0.03 1.40 -1.51 -1.98 0.31 116.25 118.80 2qrv h VAL 759 Ca -0.43 0.00 -0.25 0.00 -1.23 0.00 0.00 66.70 64.80 2qrv h VAL 759 Cb 1.21 0.51 0.01 0.00 -2.13 0.00 0.00 31.29 30.88 2qrv h VAL 759 CO 0.89 0.00 -1.04 0.77 -1.23 0.00 0.00 177.57 176.96 2qrv h SER 760 N 0.00 0.61 -0.13 4.19 4.64 -1.99 -2.43 113.55 118.45 2qrv h SER 760 Ca 0.23 -0.52 -0.04 0.00 -0.47 0.00 0.00 61.79 60.99 2qrv h SER 760 Cb 1.43 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2qrv h SER 760 CO -0.00 1.33 -0.09 0.44 -0.87 0.00 0.00 176.83 177.64 2qrv h ASP 761 N 0.23 0.30 -0.63 4.97 5.19 -0.81 0.14 116.42 125.81 2qrv h ASP 761 Ca -0.11 -0.45 0.13 0.00 -0.62 0.00 0.00 57.03 55.98 2qrv h ASP 761 Cb 1.69 -0.08 -0.10 0.00 0.18 0.00 0.00 39.33 41.02 2qrv h ASP 761 CO 0.18 0.68 0.09 0.11 -3.12 0.00 0.00 179.24 177.19 2qrv h LYS 762 N -0.09 0.20 0.23 3.56 1.57 -1.29 0.21 116.57 120.97 2qrv h LYS 762 Ca 0.02 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2qrv h LYS 762 Cb 0.59 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2qrv h LYS 762 CO 0.02 0.13 -0.14 -0.09 -0.57 0.00 0.00 179.45 178.80 2qrv h ARG 763 N 0.21 -0.34 -0.89 3.15 2.43 -1.19 -0.61 114.38 117.15 2qrv h ARG 763 Ca 0.34 0.02 0.23 0.00 -0.81 0.00 0.00 59.98 59.76 2qrv h ARG 763 Cb 0.54 0.08 -0.13 0.00 -0.42 0.00 0.00 29.97 30.03 2qrv h ARG 763 CO -0.47 -0.22 0.33 -0.44 -1.51 0.00 0.00 179.97 177.65 2qrv h ASP 764 N -0.35 0.19 0.04 -3.80 3.32 -0.19 0.73 116.42 116.35 2qrv h ASP 764 Ca -0.03 0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 2qrv h ASP 764 Cb 0.28 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.03 2qrv h ASP 764 CO 0.03 -0.08 -0.02 0.40 -1.72 0.00 0.00 179.24 177.85 2qrv h ILE 765 N 0.30 1.10 -0.99 0.35 2.04 -0.54 0.30 117.51 120.08 2qrv h ILE 765 Ca 0.56 -0.45 0.12 0.00 1.00 0.00 0.00 64.86 66.09 2qrv h ILE 765 Cb 1.11 1.39 -0.08 0.00 -0.74 0.00 0.00 36.82 38.50 2qrv h ILE 765 CO -0.59 0.11 0.63 0.28 0.00 0.00 0.00 178.15 178.59 2qrv h SER 766 N -0.25 0.91 -0.08 1.72 0.02 0.94 0.10 113.55 116.91 2qrv h SER 766 Ca -0.01 0.05 -0.10 0.00 -0.84 0.00 0.00 61.79 60.89 2qrv h SER 766 Cb 0.23 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2qrv h SER 766 CO 0.01 0.48 -0.25 0.03 -1.14 0.00 0.00 176.83 175.96 2qrv h ARG 767 N 0.98 0.52 0.05 3.45 -0.00 0.94 0.67 114.38 120.99 2qrv h ARG 767 Ca 0.49 -0.20 -0.00 0.00 -0.50 0.00 0.00 59.98 59.77 2qrv h ARG 767 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 30.44 2qrv h ARG 767 CO -0.26 0.73 -0.03 0.74 0.00 0.00 0.00 179.97 181.16 2qrv h PHE 768 N 0.46 -0.07 0.00 3.04 -1.00 0.14 -3.14 116.94 116.38 2qrv h PHE 768 Ca 0.07 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.84 2qrv h PHE 768 Cb 0.68 0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.26 2qrv h PHE 768 CO 0.02 0.53 0.00 1.28 -1.61 0.00 0.00 178.31 178.54 2qrv n LEU 769 N -4.81 0.00 -3.57 1.54 4.77 0.17 -4.90 117.00 110.21 2qrv n LEU 769 Ca -0.08 0.19 -0.23 0.00 -0.03 0.00 0.00 56.01 55.85 2qrv n LEU 769 Cb 0.31 -0.19 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 2qrv n LEU 769 CO 0.30 -0.05 -0.04 -0.62 -1.33 0.00 0.00 177.39 175.65 2qrv n GLU 770 N -1.19 -2.90 -3.61 3.23 1.02 0.04 -4.97 120.64 112.26 2qrv n GLU 770 Ca 0.13 0.63 -0.01 0.00 -0.02 0.00 0.00 57.16 57.89 2qrv n GLU 770 Cb 0.14 -4.99 -0.01 0.00 -0.02 0.00 0.00 31.44 26.56 2qrv n GLU 770 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2qrv s SER 771 N -3.78 -0.07 0.09 1.62 0.15 -0.12 -5.03 113.70 106.57 2qrv s SER 771 Ca 0.30 -0.04 0.06 0.00 0.70 0.00 0.00 55.95 56.97 2qrv s SER 771 Cb -0.08 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.29 2qrv s SER 771 CO 0.81 -0.17 -0.07 0.20 1.20 0.00 0.00 173.24 175.20 2qrv s ASN 772 N -2.46 4.56 1.36 5.45 0.01 -1.26 -4.26 114.94 118.34 2qrv s ASN 772 Ca 0.12 -0.32 -0.22 0.00 -0.71 0.00 0.00 52.86 51.73 2qrv s ASN 772 Cb 0.02 -0.94 0.33 0.00 0.41 0.00 0.00 41.25 41.07 2qrv s ASN 772 CO -0.04 0.18 0.94 -0.81 -1.51 0.00 0.00 177.10 175.86 2qrv n PRO 773 N 0.73 -3.95 -3.36 -0.60 -0.04 -1.26 -4.70 135.00 121.82 2qrv n PRO 773 Ca -0.13 -1.54 -0.21 0.00 -0.04 0.00 0.00 63.50 61.59 2qrv n PRO 773 Cb 0.52 -1.70 -0.09 0.00 -0.04 0.00 0.00 33.50 32.20 2qrv n PRO 773 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2qrv s VAL 774 N -2.48 -0.17 0.38 0.52 1.01 -0.30 -4.84 120.40 114.53 2qrv s VAL 774 Ca 0.66 -1.37 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 2qrv s VAL 774 Cb -0.09 -0.81 -0.10 0.00 0.00 0.00 0.00 36.38 35.38 2qrv s VAL 774 CO 0.53 -0.74 1.39 0.00 0.00 0.00 0.00 175.10 176.28 2qrv s MET 775 N 1.15 4.08 -0.24 2.72 0.23 -1.26 -2.88 119.30 123.09 2qrv s MET 775 Ca 0.20 2.37 -0.13 0.00 -1.03 0.00 0.00 55.69 57.09 2qrv s MET 775 Cb -0.15 -2.90 0.07 0.00 -1.53 0.00 0.00 34.83 30.32 2qrv s MET 775 CO -0.03 -0.48 0.58 -1.50 -2.03 0.00 0.00 175.02 171.55 2qrv s ILE 776 N -1.17 -0.03 -0.22 3.16 2.07 -0.57 -4.96 121.20 119.48 2qrv s ILE 776 Ca 0.54 0.04 -0.06 0.00 -1.41 0.00 0.00 60.65 59.75 2qrv s ILE 776 Cb -0.43 -0.85 -0.03 0.00 0.13 0.00 0.00 42.46 41.29 2qrv s ILE 776 CO 0.57 0.02 0.04 -0.62 -1.91 0.00 0.00 174.94 173.03 2qrv s ASP 777 N 1.58 5.09 0.02 4.50 3.68 -1.26 -2.45 116.67 127.83 2qrv s ASP 777 Ca -0.10 -0.16 0.01 0.00 2.13 0.00 0.00 52.55 54.43 2qrv s ASP 777 Cb -0.07 -1.89 0.06 0.00 -1.45 0.00 0.00 42.92 39.57 2qrv s ASP 777 CO -0.17 0.03 0.92 0.00 0.13 0.00 0.00 175.17 176.08 2qrv n ALA 778 N 4.47 0.76 -0.25 3.66 0.00 -0.94 -1.89 120.51 126.31 2qrv n ALA 778 Ca -0.17 0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.35 2qrv n ALA 778 Cb 0.52 -0.77 0.31 0.00 0.00 0.00 0.00 19.45 19.50 2qrv n ALA 778 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qrv h LYS 779 N 0.00 0.84 0.00 0.00 1.57 -1.61 0.27 116.57 117.64 2qrv h LYS 779 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2qrv h LYS 779 Cb 0.25 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2qrv h LYS 779 CO 0.00 0.56 0.00 0.39 -0.57 0.00 0.00 179.45 179.83 2qrv n GLU 780 N -4.50 0.41 -0.04 3.15 1.02 -0.79 -3.80 120.64 116.09 2qrv n GLU 780 Ca 0.13 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 2qrv n GLU 780 Cb 0.26 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 2qrv n GLU 780 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2qrv n VAL 781 N -1.25 0.00 -3.49 2.62 3.14 -0.41 -4.67 118.33 114.27 2qrv n VAL 781 Ca 0.13 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.36 2qrv n VAL 781 Cb 0.18 0.74 -0.04 0.00 -1.06 0.00 0.00 33.84 33.66 2qrv n VAL 781 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2qrv s SER 782 N -0.05 -0.57 0.00 6.55 0.15 0.82 -4.77 113.70 115.83 2qrv s SER 782 Ca 0.00 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.02 2qrv s SER 782 Cb 0.00 0.52 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 2qrv s SER 782 CO 0.00 -0.70 0.77 0.00 1.20 0.00 0.00 173.24 174.50 2qrv n ALA 783 N 0.33 2.41 -2.65 5.45 0.00 -0.83 -4.27 120.51 120.95 2qrv n ALA 783 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.19 2qrv n ALA 783 Cb 0.60 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.67 2qrv n ALA 783 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qrv s ALA 784 N 0.83 -0.29 -0.75 0.00 0.00 -1.26 -1.58 121.76 118.71 2qrv s ALA 784 Ca 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 51.96 51.31 2qrv s ALA 784 Cb 0.00 0.58 0.19 0.00 0.00 0.00 0.00 23.12 23.89 2qrv s ALA 784 CO 0.00 -0.55 0.63 -1.01 0.00 0.00 0.00 175.76 174.82 2qrv s HIS 785 N -3.87 3.62 -0.46 0.00 0.09 -0.54 -2.14 115.29 111.98 2qrv s HIS 785 Ca 0.07 -2.48 0.04 0.00 -0.00 0.00 0.00 55.06 52.69 2qrv s HIS 785 Cb 0.04 -3.46 0.12 0.00 -0.00 0.00 0.00 32.58 29.28 2qrv s HIS 785 CO -0.09 -0.89 0.19 1.03 -0.00 0.00 0.00 174.74 174.98 2qrv s ARG 786 N -0.17 1.80 -0.36 1.40 1.81 -1.26 -4.89 118.95 117.29 2qrv s ARG 786 Ca 0.19 -2.37 -0.23 0.00 -1.72 0.00 0.00 55.73 51.60 2qrv s ARG 786 Cb -0.15 -3.25 0.01 0.00 -0.45 0.00 0.00 34.95 31.10 2qrv s ARG 786 CO -0.06 -1.06 0.75 0.00 -0.68 0.00 0.00 175.30 174.25 2qrv s ALA 787 N 0.10 3.45 0.09 2.13 0.00 -1.26 -2.20 121.76 124.06 2qrv s ALA 787 Ca 0.15 -0.68 0.07 0.00 0.00 0.00 0.00 51.96 51.50 2qrv s ALA 787 Cb -0.24 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2qrv s ALA 787 CO -0.03 -1.42 -0.18 1.03 0.00 0.00 0.00 175.76 175.16 2qrv s ARG 788 N 2.99 1.00 0.17 0.00 1.81 -1.03 -3.44 118.95 120.45 2qrv s ARG 788 Ca 0.30 -1.09 -0.18 0.00 -1.72 0.00 0.00 55.73 53.03 2qrv s ARG 788 Cb -0.14 -1.13 -0.08 0.00 -0.45 0.00 0.00 34.95 33.16 2qrv s ARG 788 CO 0.16 0.26 0.65 0.71 -0.68 0.00 0.00 175.30 176.40 2qrv s TYR 789 N -1.28 3.68 -0.12 -0.53 2.02 -0.02 -1.51 117.35 119.59 2qrv s TYR 789 Ca 0.03 1.30 -0.03 0.00 -0.37 0.00 0.00 57.07 58.00 2qrv s TYR 789 Cb -0.10 -2.54 0.04 0.00 -0.40 0.00 0.00 41.96 38.97 2qrv s TYR 789 CO 0.03 0.42 0.04 -0.06 -1.57 0.00 0.00 175.55 174.41 2qrv s PHE 790 N -1.41 0.58 0.06 2.71 0.40 -1.14 -2.79 117.98 116.38 2qrv s PHE 790 Ca 0.39 -0.33 -0.10 0.00 -0.60 0.00 0.00 56.93 56.29 2qrv s PHE 790 Cb -0.17 -0.79 -0.06 0.00 0.51 0.00 0.00 43.02 42.51 2qrv s PHE 790 CO 0.21 -0.42 0.38 -1.58 0.70 0.00 0.00 175.22 174.50 2qrv s TRP 791 N 2.00 3.60 0.00 0.36 0.51 -0.29 -1.15 118.94 123.97 2qrv s TRP 791 Ca 0.03 0.77 0.00 0.00 -2.12 0.00 0.00 56.10 54.78 2qrv s TRP 791 Cb -0.14 -2.14 0.00 0.00 -0.81 0.00 0.00 33.47 30.37 2qrv s TRP 791 CO -0.06 0.55 0.00 0.41 -0.51 0.00 0.00 176.95 177.34 2qrv n GLY 792 N 1.05 1.02 0.22 0.98 0.00 -1.26 -1.34 105.19 105.86 2qrv n GLY 792 Ca -0.09 -1.09 0.03 0.00 0.00 0.00 0.00 46.02 44.87 2qrv n GLY 792 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qrv n ASN 793 N 0.00 2.35 -4.73 1.61 6.94 -1.02 -5.03 115.26 115.38 2qrv n ASN 793 Ca 0.00 -2.10 -0.42 0.00 -0.02 0.00 0.00 54.58 52.05 2qrv n ASN 793 Cb 0.00 -0.11 -0.03 0.00 -2.36 0.00 0.00 39.78 37.28 2qrv n ASN 793 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2qrv s LEU 794 N -1.17 4.37 0.30 -4.53 1.43 -1.26 -4.87 118.68 112.95 2qrv s LEU 794 Ca 0.10 2.73 -0.29 0.00 -1.03 0.00 0.00 54.13 55.63 2qrv s LEU 794 Cb 0.06 -3.61 -0.13 0.00 0.03 0.00 0.00 46.19 42.55 2qrv s LEU 794 CO 0.05 -0.85 1.37 -0.81 0.23 0.00 0.00 176.35 176.34 2qrv n PRO 795 N 3.44 2.15 -3.56 1.29 -0.04 -1.26 -3.27 135.00 133.74 2qrv n PRO 795 Ca 0.12 0.76 -0.22 0.00 -0.04 0.00 0.00 63.50 64.12 2qrv n PRO 795 Cb 0.38 -2.39 0.08 0.00 -0.04 0.00 0.00 33.50 31.53 2qrv n PRO 795 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qrv n GLY 796 N 1.46 -0.50 0.24 0.55 0.00 -1.26 -4.82 105.19 100.86 2qrv n GLY 796 Ca 0.08 0.22 0.15 0.00 0.00 0.00 0.00 46.02 46.47 2qrv n GLY 796 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2qrv h MET 797 N -2.49 0.00 0.10 1.61 2.86 -1.94 -3.24 114.93 111.83 2qrv h MET 797 Ca -0.58 0.00 -0.32 0.00 -2.06 0.00 0.00 59.70 56.74 2qrv h MET 797 Cb 1.36 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.01 2qrv h MET 797 CO 0.55 0.00 -1.71 -0.91 1.06 0.00 0.00 176.91 175.89 2qrv h ASN 798 N 0.00 0.34 -2.40 1.22 2.35 -1.90 -3.48 115.58 111.71 2qrv h ASN 798 Ca 0.00 -0.59 -0.61 0.00 -0.55 0.00 0.00 56.30 54.55 2qrv h ASN 798 Cb 0.66 -0.11 0.10 0.00 0.05 0.00 0.00 38.32 39.02 2qrv h ASN 798 CO 0.00 1.51 0.22 -2.11 -1.65 0.00 0.00 177.43 175.40 2qrv n ARG 799 N -3.40 1.40 -1.43 0.81 1.85 -1.23 -4.88 116.66 109.80 2qrv n ARG 799 Ca -0.22 0.49 -0.45 0.00 -1.00 0.00 0.00 57.85 56.68 2qrv n ARG 799 Cb 1.05 -1.93 -0.02 0.00 -1.05 0.00 0.00 32.46 30.51 2qrv n ARG 799 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2qrv n PRO 800 N 1.07 0.36 -1.90 2.89 -0.02 -1.26 -5.00 135.00 131.14 2qrv n PRO 800 Ca 0.11 0.13 -0.29 0.00 -2.02 0.00 0.00 63.50 61.42 2qrv n PRO 800 Cb 0.30 -1.25 0.11 0.00 -0.02 0.00 0.00 33.50 32.65 2qrv n PRO 800 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2qrv s LEU 801 N 2.51 2.54 -0.09 2.45 1.02 -1.26 -5.09 118.68 120.76 2qrv s LEU 801 Ca 0.62 0.67 -0.10 0.00 0.02 0.00 0.00 54.13 55.34 2qrv s LEU 801 Cb -0.78 -3.06 0.02 0.00 0.02 0.00 0.00 46.19 42.40 2qrv s LEU 801 CO 0.58 -2.10 0.27 0.00 0.02 0.00 0.00 176.35 175.12 2qrv s ALA 802 N -3.65 -0.67 0.60 4.21 0.00 -1.26 -5.11 121.76 115.88 2qrv s ALA 802 Ca 0.65 0.68 -0.14 0.00 0.00 0.00 0.00 51.96 53.15 2qrv s ALA 802 Cb -0.09 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 2qrv s ALA 802 CO 0.50 -0.15 1.03 -1.54 0.00 0.00 0.00 175.76 175.60 2qrv s SER 803 N -0.09 6.09 0.19 0.00 1.04 -1.26 -4.97 113.70 114.70 2qrv s SER 803 Ca -0.02 1.58 0.09 0.00 0.48 0.00 0.00 55.95 58.08 2qrv s SER 803 Cb -0.03 -2.50 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 2qrv s SER 803 CO 0.01 -0.96 -0.10 -0.89 0.98 0.00 0.00 173.24 172.28 2qrv s THR 804 N -2.84 3.13 0.41 2.02 2.01 -1.26 -4.99 115.64 114.11 2qrv s THR 804 Ca 0.58 -1.74 0.19 0.00 0.31 0.00 0.00 61.69 61.04 2qrv s THR 804 Cb -0.12 -2.56 0.40 0.00 0.01 0.00 0.00 72.50 70.22 2qrv s THR 804 CO 0.44 -0.15 1.78 0.58 -0.69 0.00 0.00 174.62 176.58 2qrv h VAL 805 N 2.68 0.52 -3.63 3.82 2.07 -2.05 -3.15 116.25 116.51 2qrv h VAL 805 Ca -0.46 -0.13 -0.68 0.00 0.82 0.00 0.00 66.70 66.25 2qrv h VAL 805 Cb 1.21 0.12 -0.35 0.00 -1.52 0.00 0.00 31.29 30.75 2qrv h VAL 805 CO 0.55 0.07 -0.64 0.54 0.02 0.00 0.00 177.57 178.11 2qrv s ASN 806 N -5.27 5.04 -0.36 0.57 4.22 -1.26 -4.98 114.94 112.89 2qrv s ASN 806 Ca -0.08 -1.75 -0.04 0.00 -2.14 0.00 0.00 52.86 48.85 2qrv s ASN 806 Cb 0.25 -1.75 0.19 0.00 1.28 0.00 0.00 41.25 41.22 2qrv s ASN 806 CO 0.80 -0.41 0.94 -0.62 -2.04 0.00 0.00 177.10 175.77 2qrv s ASP 807 N 1.46 -0.68 -0.68 3.54 3.68 -1.19 -5.10 116.67 117.69 2qrv s ASP 807 Ca 0.03 -0.46 -0.28 0.00 2.13 0.00 0.00 52.55 53.98 2qrv s ASP 807 Cb -0.21 0.88 -0.13 0.00 -1.45 0.00 0.00 42.92 42.01 2qrv s ASP 807 CO -0.04 -0.06 2.52 0.29 0.13 0.00 0.00 175.17 178.01 2qrv n LYS 808 N 3.61 0.65 -0.04 4.34 4.76 -1.26 -4.73 118.16 125.50 2qrv n LYS 808 Ca 0.09 -0.03 -0.04 0.00 -2.87 0.00 0.00 58.31 55.46 2qrv n LYS 808 Cb 0.62 -2.75 -0.14 0.00 -1.84 0.00 0.00 35.03 30.92 2qrv n LYS 808 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2qrv n LEU 809 N 14.00 0.37 -4.64 -0.35 4.32 -1.26 -1.97 117.00 127.46 2qrv n LEU 809 Ca 0.48 0.17 -0.39 0.00 -0.02 0.00 0.00 56.01 56.25 2qrv n LEU 809 Cb 0.36 0.27 -0.08 0.00 -1.62 0.00 0.00 43.42 42.35 2qrv n LEU 809 CO 0.79 0.32 0.09 -1.83 -1.22 0.00 0.00 177.39 175.55 2qrv s GLU 810 N -2.76 4.11 0.42 3.23 1.03 -1.26 -3.12 118.70 120.35 2qrv s GLU 810 Ca -0.07 0.15 0.22 0.00 0.03 0.00 0.00 54.97 55.30 2qrv s GLU 810 Cb 0.08 -3.58 1.21 0.00 -0.80 0.00 0.00 34.13 31.04 2qrv s GLU 810 CO 0.84 -0.14 1.76 1.25 -1.33 0.00 0.00 175.26 177.63 2qrv h LEU 811 N 8.04 0.36 -0.75 1.83 7.12 -1.09 0.43 115.31 131.25 2qrv h LEU 811 Ca -0.34 0.08 -0.03 0.00 0.13 0.00 0.00 57.88 57.72 2qrv h LEU 811 Cb 1.16 0.03 -0.03 0.00 -0.53 0.00 0.00 40.66 41.28 2qrv h LEU 811 CO 0.69 0.04 0.34 -0.61 -0.13 0.00 0.00 178.44 178.77 2qrv h GLN 812 N 0.30 1.09 0.00 1.25 5.75 -1.83 -2.45 115.11 119.22 2qrv h GLN 812 Ca 0.62 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.95 2qrv h GLN 812 Cb 1.75 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 30.11 2qrv h GLN 812 CO -0.27 0.86 0.00 0.39 -2.65 0.00 0.00 178.83 177.16 2qrv n GLU 813 N -4.37 0.61 -0.05 1.69 -0.58 0.15 -2.29 120.64 115.80 2qrv n GLU 813 Ca 0.06 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.76 2qrv n GLU 813 Cb 0.15 -1.03 -0.08 0.00 -0.57 0.00 0.00 31.44 29.91 2qrv n GLU 813 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qrv s LEU 815 N -4.73 2.99 0.31 0.00 1.43 -0.97 -4.61 118.68 113.11 2qrv s LEU 815 Ca -0.05 2.12 -0.03 0.00 -1.03 0.00 0.00 54.13 55.14 2qrv s LEU 815 Cb 0.03 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.65 2qrv s LEU 815 CO 0.41 -2.64 0.55 -0.70 0.23 0.00 0.00 176.35 174.20 2qrv s GLU 816 N -4.57 3.57 0.01 1.70 2.56 -1.26 -5.00 118.70 115.72 2qrv s GLU 816 Ca 0.67 -0.12 -0.34 0.00 0.00 0.00 0.00 54.97 55.17 2qrv s GLU 816 Cb -0.22 -2.65 -0.17 0.00 2.00 0.00 0.00 34.13 33.08 2qrv s GLU 816 CO 0.55 0.19 0.91 1.58 -0.56 0.00 0.00 175.26 177.92 2qrv n HIS 817 N -1.25 0.49 -0.67 5.30 -0.00 -1.26 -2.88 115.22 114.95 2qrv n HIS 817 Ca -0.03 0.93 0.00 0.00 -0.00 0.00 0.00 57.72 58.62 2qrv n HIS 817 Cb 0.55 -1.83 0.00 0.00 -0.00 0.00 0.00 29.99 28.70 2qrv n HIS 817 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2qrv n GLY 818 N 1.36 0.63 3.16 1.57 0.00 -1.26 -5.07 105.19 105.57 2qrv n GLY 818 Ca 0.18 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.63 2qrv n GLY 818 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qrv s ARG 819 N -0.82 0.94 -0.06 1.61 0.52 -1.14 -4.20 118.95 115.79 2qrv s ARG 819 Ca 0.00 -0.81 0.04 0.00 -0.52 0.00 0.00 55.73 54.44 2qrv s ARG 819 Cb 0.00 -0.96 -0.02 0.00 0.52 0.00 0.00 34.95 34.49 2qrv s ARG 819 CO 0.00 0.23 -0.17 0.42 0.02 0.00 0.00 175.30 175.80 2qrv s ILE 820 N -0.93 2.78 0.07 1.52 1.09 0.82 -4.87 121.20 121.67 2qrv s ILE 820 Ca 0.01 -0.81 -0.22 0.00 -1.10 0.00 0.00 60.65 58.53 2qrv s ILE 820 Cb -0.08 -2.08 -0.06 0.00 -1.06 0.00 0.00 42.46 39.17 2qrv s ILE 820 CO 0.02 0.57 0.67 0.00 -0.10 0.00 0.00 174.94 176.10 2qrv s ALA 821 N -0.42 3.48 -0.20 9.38 0.00 -1.26 -0.65 121.76 132.10 2qrv s ALA 821 Ca 0.04 0.16 -0.21 0.00 0.00 0.00 0.00 51.96 51.95 2qrv s ALA 821 Cb -0.12 -2.82 -0.20 0.00 0.00 0.00 0.00 23.12 19.98 2qrv s ALA 821 CO 0.02 0.24 0.27 0.87 0.00 0.00 0.00 175.76 177.16 2qrv h LYS 822 N 5.02 0.02 -6.61 0.00 1.57 -1.70 -3.48 116.57 111.39 2qrv h LYS 822 Ca -0.47 -0.03 -0.46 0.00 -1.87 0.00 0.00 60.65 57.83 2qrv h LYS 822 Cb 1.21 0.01 0.03 0.00 0.08 0.00 0.00 32.23 33.56 2qrv h LYS 822 CO 0.67 1.01 -0.14 -0.06 -0.57 0.00 0.00 179.45 180.36 2qrv s PHE 823 N -2.36 2.05 -0.24 -1.35 0.08 -1.26 -5.02 117.98 109.87 2qrv s PHE 823 Ca -0.28 -0.53 0.22 0.00 0.12 0.00 0.00 56.93 56.47 2qrv s PHE 823 Cb 0.05 -2.36 -0.23 0.00 -0.57 0.00 0.00 43.02 39.90 2qrv s PHE 823 CO 0.61 -0.89 0.67 0.45 -0.10 0.00 0.00 175.22 175.96 2qrv n SER 824 N -2.14 0.31 -3.71 1.36 2.88 -1.26 -4.56 113.62 106.50 2qrv n SER 824 Ca 0.12 -0.10 -0.12 0.00 -1.33 0.00 0.00 58.87 57.45 2qrv n SER 824 Cb 0.60 1.53 -0.10 0.00 -0.75 0.00 0.00 64.21 65.49 2qrv n SER 824 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2qrv s LYS 825 N -3.40 0.43 0.51 -1.46 1.02 -1.26 -0.59 119.74 115.00 2qrv s LYS 825 Ca -0.04 0.71 -0.17 0.00 0.02 0.00 0.00 55.97 56.48 2qrv s LYS 825 Cb 0.14 0.08 -0.08 0.00 -0.52 0.00 0.00 37.83 37.45 2qrv s LYS 825 CO 0.88 -0.12 1.00 0.14 -0.92 0.00 0.00 175.35 176.32 2qrv s VAL 826 N 0.91 4.33 -0.00 3.17 -7.23 -0.62 -4.90 120.40 116.07 2qrv s VAL 826 Ca -0.06 1.20 -0.00 0.00 -1.81 0.00 0.00 61.98 61.31 2qrv s VAL 826 Cb -0.06 -3.62 -0.00 0.00 0.56 0.00 0.00 36.38 33.26 2qrv s VAL 826 CO -0.07 -0.56 -0.00 0.54 -0.31 0.00 0.00 175.10 174.70 2qrv n ARG 827 N -1.44 0.00 -0.07 4.82 5.12 -1.26 -1.47 116.66 122.36 2qrv n ARG 827 Ca 0.07 0.00 -0.02 0.00 -1.93 0.00 0.00 57.85 55.97 2qrv n ARG 827 Cb 0.54 -0.77 -0.00 0.00 -1.16 0.00 0.00 32.46 31.06 2qrv n ARG 827 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 2qrv n PHE 844 N -2.74 0.12 0.00 -1.55 3.01 -1.26 -5.00 117.46 110.04 2qrv n PHE 844 Ca -0.00 -0.61 0.00 0.00 1.01 0.00 0.00 57.45 57.85 2qrv n PHE 844 Cb 0.50 -0.69 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 2qrv n PHE 844 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 2qrv n PRO 845 N 4.83 0.00 -4.34 -1.08 -0.02 -1.26 -4.63 135.00 128.50 2qrv n PRO 845 Ca 0.04 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.32 2qrv n PRO 845 Cb 0.01 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.41 2qrv n PRO 845 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2qrv s VAL 846 N -2.54 0.26 -0.04 -1.45 -7.23 -1.20 -1.74 120.40 106.46 2qrv s VAL 846 Ca 0.00 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.20 2qrv s VAL 846 Cb 0.00 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.46 2qrv s VAL 846 CO 0.00 0.00 -0.12 0.72 -0.31 0.00 0.00 175.10 175.39 2qrv s PHE 847 N -3.53 1.29 -0.14 2.82 -0.71 0.17 -2.84 117.98 115.05 2qrv s PHE 847 Ca 0.35 -0.37 -0.03 0.00 -1.04 0.00 0.00 56.93 55.84 2qrv s PHE 847 Cb 0.04 -0.90 0.05 0.00 -1.21 0.00 0.00 43.02 40.99 2qrv s PHE 847 CO 0.19 -0.15 0.05 1.41 -1.34 0.00 0.00 175.22 175.39 2qrv s MET 848 N 0.23 0.30 -0.82 1.99 1.75 0.10 -0.13 119.30 122.72 2qrv s MET 848 Ca -0.05 -0.07 -0.01 0.00 -1.25 0.00 0.00 55.69 54.30 2qrv s MET 848 Cb -0.11 -1.54 0.00 0.00 2.84 0.00 0.00 34.83 36.02 2qrv s MET 848 CO 0.02 -0.54 0.64 0.09 -0.65 0.00 0.00 175.02 174.57 2qrv n ASN 849 N 5.20 -5.68 -3.92 1.11 4.13 -1.26 -2.41 115.26 112.43 2qrv n ASN 849 Ca -0.07 -0.73 -0.27 0.00 1.68 0.00 0.00 54.58 55.19 2qrv n ASN 849 Cb 0.49 -2.75 0.00 0.00 -1.54 0.00 0.00 39.78 35.98 2qrv n ASN 849 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2qrv n GLU 850 N -2.50 -4.29 -3.71 3.52 1.02 -1.26 -4.98 120.64 108.45 2qrv n GLU 850 Ca -0.22 0.51 -0.13 0.00 -0.02 0.00 0.00 57.16 57.29 2qrv n GLU 850 Cb 0.63 -5.05 -0.09 0.00 -0.02 0.00 0.00 31.44 26.92 2qrv n GLU 850 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2qrv s LYS 851 N -6.48 0.58 -0.46 3.49 2.47 -1.01 -5.13 119.74 113.19 2qrv s LYS 851 Ca 0.30 0.60 -0.14 0.00 -1.56 0.00 0.00 55.97 55.17 2qrv s LYS 851 Cb -0.15 0.28 0.08 0.00 -1.46 0.00 0.00 37.83 36.58 2qrv s LYS 851 CO 0.86 -0.08 0.36 -2.00 0.16 0.00 0.00 175.35 174.65 2qrv s GLU 852 N 0.11 2.86 0.45 4.03 2.12 -1.26 0.03 118.70 127.03 2qrv s GLU 852 Ca -0.01 -1.41 0.03 0.00 0.36 0.00 0.00 54.97 53.93 2qrv s GLU 852 Cb -0.03 -4.03 -0.02 0.00 0.26 0.00 0.00 34.13 30.30 2qrv s GLU 852 CO 0.01 -1.03 0.06 0.16 -0.54 0.00 0.00 175.26 173.92 2qrv s ASP 853 N 2.52 3.47 0.65 -1.70 -4.77 -1.13 -5.03 116.67 110.68 2qrv s ASP 853 Ca 0.04 -1.63 0.00 0.00 -3.30 0.00 0.00 52.55 47.65 2qrv s ASP 853 Cb -0.24 0.43 0.00 0.00 -1.09 0.00 0.00 42.92 42.02 2qrv s ASP 853 CO 0.05 -0.85 0.00 -0.38 0.70 0.00 0.00 175.17 174.69 2qrv n ILE 854 N -1.07 0.00 -3.14 2.11 5.41 -1.26 -3.25 119.36 118.15 2qrv n ILE 854 Ca -0.12 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.24 2qrv n ILE 854 Cb 0.66 -1.71 -0.06 0.00 -0.71 0.00 0.00 39.64 37.82 2qrv n ILE 854 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2qrv s LEU 855 N 0.00 4.49 0.30 1.39 1.43 -1.26 -4.73 118.68 120.30 2qrv s LEU 855 Ca 0.00 1.34 -0.28 0.00 -1.03 0.00 0.00 54.13 54.17 2qrv s LEU 855 Cb 0.00 -3.04 -0.09 0.00 0.03 0.00 0.00 46.19 43.08 2qrv s LEU 855 CO 0.00 0.16 0.98 0.26 0.23 0.00 0.00 176.35 177.99 2qrv s TRP 856 N -0.66 3.72 0.03 0.29 0.51 -1.26 -4.90 118.94 116.67 2qrv s TRP 856 Ca 0.33 1.80 0.32 0.00 -2.12 0.00 0.00 56.10 56.42 2qrv s TRP 856 Cb -0.20 -3.03 1.47 0.00 -0.81 0.00 0.00 33.47 30.90 2qrv s TRP 856 CO 0.21 0.05 1.95 0.00 -0.51 0.00 0.00 176.95 178.65 2qrv h THR 858 N 0.00 1.28 -0.04 0.00 2.02 -1.99 -0.79 112.91 113.39 2qrv h THR 858 Ca 0.00 -1.08 -0.15 0.00 0.77 0.00 0.00 66.41 65.95 2qrv h THR 858 Cb 0.29 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2qrv h THR 858 CO 0.00 0.34 -0.66 -0.33 0.37 0.00 0.00 175.52 175.24 2qrv h GLU 859 N 0.26 0.19 -0.28 6.66 5.08 -1.39 -2.96 114.58 122.14 2qrv h GLU 859 Ca 0.07 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.17 2qrv h GLU 859 Cb 0.53 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2qrv h GLU 859 CO 0.03 0.78 -0.30 1.98 -1.00 0.00 0.00 179.01 180.50 2qrv h MET 860 N 0.13 0.57 -0.44 2.33 4.05 -0.69 -0.99 114.93 119.89 2qrv h MET 860 Ca -0.01 -0.24 0.08 0.00 -0.28 0.00 0.00 59.70 59.24 2qrv h MET 860 Cb 1.19 -0.02 -0.07 0.00 -0.80 0.00 0.00 31.60 31.90 2qrv h MET 860 CO 0.10 0.81 0.04 0.93 0.23 0.00 0.00 176.91 179.02 2qrv h GLU 861 N 0.49 0.15 -0.58 0.39 5.08 -0.98 -1.96 114.58 117.17 2qrv h GLU 861 Ca 0.06 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2qrv h GLU 861 Cb 0.77 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 2qrv h GLU 861 CO 0.06 0.10 0.26 0.00 -1.00 0.00 0.00 179.01 178.43 2qrv h ARG 862 N 0.16 0.85 -0.20 2.33 3.08 -1.39 -2.01 114.38 117.20 2qrv h ARG 862 Ca 0.22 -0.14 0.06 0.00 0.07 0.00 0.00 59.98 60.18 2qrv h ARG 862 Cb 0.30 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 2qrv h ARG 862 CO -0.33 0.71 -0.24 0.28 -1.07 0.00 0.00 179.97 179.32 2qrv h VAL 863 N 0.79 0.40 0.00 2.04 2.07 -0.58 -0.99 116.25 119.98 2qrv h VAL 863 Ca 0.20 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.72 2qrv h VAL 863 Cb 0.16 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2qrv h VAL 863 CO -0.02 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.06 2qrv n PHE 864 N -5.37 0.00 -0.71 1.57 3.01 -0.80 -4.16 117.46 111.00 2qrv n PHE 864 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 2qrv n PHE 864 Cb 0.29 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.75 2qrv n PHE 864 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qrv n GLY 865 N 0.20 0.79 3.89 1.37 0.00 -0.38 -1.97 105.19 109.09 2qrv n GLY 865 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 2qrv n GLY 865 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qrv s PHE 866 N -3.00 3.49 0.79 1.61 0.08 -0.82 -4.72 117.98 115.41 2qrv s PHE 866 Ca 0.00 1.01 -0.11 0.00 0.12 0.00 0.00 56.93 57.95 2qrv s PHE 866 Cb 0.00 -2.69 0.07 0.00 -0.57 0.00 0.00 43.02 39.82 2qrv s PHE 866 CO 0.00 -0.71 1.09 -2.14 -0.10 0.00 0.00 175.22 173.36 2qrv s PRO 867 N -5.08 2.14 0.14 0.24 0.02 -1.26 -4.21 135.00 126.99 2qrv s PRO 867 Ca 0.54 0.78 -0.31 0.00 0.02 0.00 0.00 61.00 62.03 2qrv s PRO 867 Cb -0.11 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 32.42 2qrv s PRO 867 CO 0.50 -1.62 1.37 0.08 -0.33 0.00 0.00 177.00 176.99 2qrv s VAL 868 N -3.07 3.26 0.00 3.83 1.01 -1.26 -2.29 120.40 121.88 2qrv s VAL 868 Ca 0.61 0.95 0.00 0.00 0.00 0.00 0.00 61.98 63.53 2qrv s VAL 868 Cb -0.15 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2qrv s VAL 868 CO 0.55 0.10 0.00 1.41 0.00 0.00 0.00 175.10 177.16 2qrv n HIS 869 N 3.50 0.00 -0.35 5.22 8.25 -1.26 -4.92 115.22 125.67 2qrv n HIS 869 Ca 0.10 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.66 2qrv n HIS 869 Cb 0.42 -0.01 0.28 0.00 1.12 0.00 0.00 29.99 31.80 2qrv n HIS 869 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2qrv h TYR 870 N 0.00 1.05 -0.59 4.41 3.20 -1.82 -2.04 116.97 121.18 2qrv h TYR 870 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2qrv h TYR 870 Cb 0.00 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 37.95 2qrv h TYR 870 CO 0.00 0.30 0.00 0.25 -1.64 0.00 0.00 178.16 177.07 2qrv n THR 871 N -4.74 2.55 -3.20 1.81 -2.24 -1.26 -4.69 114.28 102.50 2qrv n THR 871 Ca 0.21 -1.34 -0.44 0.00 -2.27 0.00 0.00 64.05 60.20 2qrv n THR 871 Cb 0.48 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2qrv n THR 871 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2qrv n ASP 872 N 0.73 5.66 0.00 3.42 4.64 -0.77 -4.81 116.55 125.42 2qrv n ASP 872 Ca 0.27 -3.11 0.00 0.00 -1.38 0.00 0.00 54.79 50.58 2qrv n ASP 872 Cb 1.13 -1.38 0.00 0.00 -1.04 0.00 0.00 41.12 39.83 2qrv n ASP 872 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 2qrv n VAL 873 N 2.64 0.00 -1.24 5.18 0.24 -1.26 -5.06 118.33 118.83 2qrv n VAL 873 Ca 0.26 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.27 2qrv n VAL 873 Cb 0.38 -0.00 0.14 0.00 -1.47 0.00 0.00 33.84 32.89 2qrv n VAL 873 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2qrv s SER 874 N 0.98 3.41 0.00 -1.34 1.04 -1.26 -4.81 113.70 111.72 2qrv s SER 874 Ca 0.00 1.41 -0.02 0.00 0.48 0.00 0.00 55.95 57.81 2qrv s SER 874 Cb 0.00 -2.09 -0.11 0.00 0.10 0.00 0.00 66.02 63.92 2qrv s SER 874 CO 0.00 -2.67 2.08 0.59 0.98 0.00 0.00 173.24 174.23 2qrv n ASN 875 N -3.89 3.43 -4.74 7.02 3.02 -1.26 -4.82 115.26 114.02 2qrv n ASN 875 Ca 0.07 -2.06 -0.41 0.00 -0.03 0.00 0.00 54.58 52.15 2qrv n ASN 875 Cb 0.56 -0.85 -0.04 0.00 -0.61 0.00 0.00 39.78 38.83 2qrv n ASN 875 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2qrv s MET 876 N 1.34 4.62 0.86 3.52 -2.45 -1.26 -5.04 119.30 120.89 2qrv s MET 876 Ca 0.28 1.66 -0.10 0.00 -1.25 0.00 0.00 55.69 56.28 2qrv s MET 876 Cb 0.13 -3.30 0.11 0.00 1.25 0.00 0.00 34.83 33.03 2qrv s MET 876 CO 0.00 0.11 1.11 -1.54 1.05 0.00 0.00 175.02 175.75 2qrv s SER 877 N -0.10 3.56 0.18 1.11 1.04 -1.26 -4.69 113.70 113.54 2qrv s SER 877 Ca 0.49 1.95 -0.13 0.00 0.48 0.00 0.00 55.95 58.73 2qrv s SER 877 Cb -0.28 -2.50 0.12 0.00 0.10 0.00 0.00 66.02 63.45 2qrv s SER 877 CO 0.34 -2.66 1.80 -0.09 0.98 0.00 0.00 173.24 173.62 2qrv h ARG 878 N -1.56 0.56 -0.56 4.02 2.43 -1.98 0.25 114.38 117.54 2qrv h ARG 878 Ca -0.45 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 58.79 2qrv h ARG 878 Cb 1.26 -0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 30.60 2qrv h ARG 878 CO 0.47 0.37 0.12 1.25 -1.51 0.00 0.00 179.97 180.67 2qrv h LEU 879 N 0.57 0.01 0.23 3.80 5.85 -1.98 0.38 115.31 124.17 2qrv h LEU 879 Ca 0.22 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 2qrv h LEU 879 Cb 0.07 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.24 2qrv h LEU 879 CO -0.12 0.03 -0.11 0.00 -0.34 0.00 0.00 178.44 177.90 2qrv h ALA 880 N 1.44 -0.30 -0.88 1.25 0.00 -1.53 0.49 119.26 119.73 2qrv h ALA 880 Ca 0.29 -0.13 0.17 0.00 0.00 0.00 0.00 54.91 55.23 2qrv h ALA 880 Cb 0.40 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 2qrv h ALA 880 CO -0.36 -0.58 0.57 -0.09 0.00 0.00 0.00 179.25 178.78 2qrv h ARG 881 N -0.48 0.53 -0.11 0.00 2.43 0.06 0.90 114.38 117.71 2qrv h ARG 881 Ca -0.03 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 2qrv h ARG 881 Cb 0.36 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2qrv h ARG 881 CO 0.05 0.35 -0.07 0.37 -1.51 0.00 0.00 179.97 179.17 2qrv h GLN 882 N 0.55 0.24 -0.28 0.20 4.15 0.27 -2.69 115.11 117.56 2qrv h GLN 882 Ca 0.45 -0.11 0.05 0.00 0.77 0.00 0.00 58.65 59.81 2qrv h GLN 882 Cb 0.91 -0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.55 2qrv h GLN 882 CO -0.19 0.60 -0.04 -0.09 -1.93 0.00 0.00 178.83 177.19 2qrv h ARG 883 N -0.13 0.04 -0.02 1.69 2.43 0.21 1.23 114.38 119.84 2qrv h ARG 883 Ca 0.02 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2qrv h ARG 883 Cb 0.54 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.03 2qrv h ARG 883 CO 0.02 0.03 -0.43 -0.07 -1.51 0.00 0.00 179.97 178.00 2qrv h LEU 884 N 0.04 -1.34 -0.65 3.80 4.07 -0.92 -1.50 115.31 118.82 2qrv h LEU 884 Ca 0.13 0.15 0.03 0.00 0.08 0.00 0.00 57.88 58.28 2qrv h LEU 884 Cb 0.19 0.51 -0.04 0.00 1.08 0.00 0.00 40.66 42.40 2qrv h LEU 884 CO -0.26 -0.41 0.40 -0.07 -1.08 0.00 0.00 178.44 177.02 2qrv h LEU 885 N -0.53 0.64 -0.12 1.67 3.38 -1.26 -2.89 115.31 116.20 2qrv h LEU 885 Ca 0.01 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2qrv h LEU 885 Cb 0.57 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2qrv h LEU 885 CO -0.30 0.44 -0.07 0.61 0.09 0.00 0.00 178.44 179.21 2qrv n GLY 886 N -1.28 -2.24 0.00 0.83 0.00 0.42 -1.38 105.19 101.55 2qrv n GLY 886 Ca 0.07 0.51 0.16 0.00 0.00 0.00 0.00 46.02 46.75 2qrv n GLY 886 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qrv n ARG 887 N -3.10 0.99 -0.31 1.61 1.85 -0.79 -4.94 116.66 111.97 2qrv n ARG 887 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.73 2qrv n ARG 887 Cb 0.03 -1.50 0.11 0.00 -1.05 0.00 0.00 32.46 30.05 2qrv n ARG 887 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2qrv n SER 888 N -1.00 -1.95 -4.71 2.89 3.41 -0.48 -5.03 113.62 106.75 2qrv n SER 888 Ca 0.24 -0.62 -0.35 0.00 -0.26 0.00 0.00 58.87 57.87 2qrv n SER 888 Cb 0.11 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.57 2qrv n SER 888 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2qrv s TRP 889 N -1.68 3.28 0.05 7.33 0.51 -1.26 -5.04 118.94 122.13 2qrv s TRP 889 Ca 0.28 0.23 -0.30 0.00 -2.12 0.00 0.00 56.10 54.19 2qrv s TRP 889 Cb -0.03 -1.88 -0.09 0.00 -0.81 0.00 0.00 33.47 30.65 2qrv s TRP 889 CO 0.22 0.46 1.93 0.45 -0.51 0.00 0.00 176.95 179.49 2qrv s SER 890 N -0.64 6.45 0.17 2.95 0.15 -1.26 -4.86 113.70 116.65 2qrv s SER 890 Ca 0.11 2.68 -0.22 0.00 0.70 0.00 0.00 55.95 59.22 2qrv s SER 890 Cb -0.12 -2.54 0.07 0.00 -1.71 0.00 0.00 66.02 61.72 2qrv s SER 890 CO 0.02 -1.04 1.61 0.58 1.20 0.00 0.00 173.24 175.61 2qrv h VAL 891 N 5.43 0.27 -0.67 4.45 2.07 -1.68 -1.59 116.25 124.53 2qrv h VAL 891 Ca -0.48 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.16 2qrv h VAL 891 Cb 1.23 0.27 -0.09 0.00 -1.52 0.00 0.00 31.29 31.18 2qrv h VAL 891 CO 0.94 0.00 0.20 -0.65 0.02 0.00 0.00 177.57 178.09 2qrv h PRO 892 N -0.23 0.33 -0.47 1.57 0.11 -1.87 0.31 132.00 131.76 2qrv h PRO 892 Ca 0.18 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.31 2qrv h PRO 892 Cb 0.52 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.51 2qrv h PRO 892 CO -0.52 0.22 0.22 0.28 -0.21 0.00 0.00 178.00 177.99 2qrv h VAL 893 N 0.34 0.94 -0.31 3.15 2.07 -1.68 -1.80 116.25 118.96 2qrv h VAL 893 Ca 0.36 -0.15 -0.11 0.00 0.82 0.00 0.00 66.70 67.62 2qrv h VAL 893 Cb 0.54 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2qrv h VAL 893 CO -0.40 0.08 -0.24 0.40 0.02 0.00 0.00 177.57 177.42 2qrv h ILE 894 N 0.44 1.30 -0.09 4.57 1.08 -0.46 -2.68 117.51 121.66 2qrv h ILE 894 Ca 0.21 -1.39 0.03 0.00 -0.39 0.00 0.00 64.86 63.31 2qrv h ILE 894 Cb 0.14 1.50 -0.00 0.00 -3.07 0.00 0.00 36.82 35.38 2qrv h ILE 894 CO -0.16 0.45 0.23 -0.09 -0.69 0.00 0.00 178.15 177.89 2qrv h ARG 895 N 0.48 0.00 0.02 2.37 2.43 -0.02 -1.15 114.38 118.50 2qrv h ARG 895 Ca 0.06 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2qrv h ARG 895 Cb 0.80 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 2qrv h ARG 895 CO 0.06 0.00 -0.01 1.25 -1.51 0.00 0.00 179.97 179.77 2qrv h HIS 896 N 0.00 -0.02 0.00 2.20 2.76 -1.05 -2.66 115.15 116.38 2qrv h HIS 896 Ca 0.04 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2qrv h HIS 896 Cb 0.50 0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.47 2qrv h HIS 896 CO 0.00 -0.01 0.13 1.28 -1.30 0.00 0.00 177.93 178.02 2qrv n LEU 897 N -2.19 0.00 -0.00 0.26 4.77 -0.54 -2.89 117.00 116.41 2qrv n LEU 897 Ca -0.00 0.10 -0.04 0.00 -0.03 0.00 0.00 56.01 56.04 2qrv n LEU 897 Cb 0.01 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 40.99 2qrv n LEU 897 CO 0.01 -0.10 -0.39 0.49 -1.33 0.00 0.00 177.39 176.07 2qrv n PHE 898 N -0.94 0.00 -0.01 -1.77 0.99 -0.57 -4.84 117.46 110.33 2qrv n PHE 898 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.45 57.46 2qrv n PHE 898 Cb 0.13 -0.14 0.01 0.00 -1.00 0.00 0.00 39.48 38.48 2qrv n PHE 898 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2qrv n ALA 899 N -3.48 0.02 0.43 4.37 0.00 -1.00 0.21 120.51 121.07 2qrv n ALA 899 Ca -0.06 0.03 0.06 0.00 0.00 0.00 0.00 53.44 53.47 2qrv n ALA 899 Cb 0.32 -0.03 0.27 0.00 0.00 0.00 0.00 19.45 20.02 2qrv n ALA 899 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qrv n PRO 900 N -3.26 0.00 0.17 0.00 -0.04 -1.26 -1.51 135.00 129.11 2qrv n PRO 900 Ca 0.01 0.29 0.13 0.00 -0.04 0.00 0.00 63.50 63.89 2qrv n PRO 900 Cb 0.03 -1.51 0.44 0.00 -0.04 0.00 0.00 33.50 32.42 2qrv n PRO 900 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2qrv h LEU 901 N 0.00 0.00 -0.40 1.53 3.38 0.22 -3.20 115.31 116.84 2qrv h LEU 901 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2qrv h LEU 901 Cb 0.22 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 2qrv h LEU 901 CO 0.00 0.00 -0.03 0.11 0.09 0.00 0.00 178.44 178.61 2qrv h LYS 902 N 0.00 0.07 0.00 1.13 1.57 -1.43 -1.98 116.57 115.93 2qrv h LYS 902 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qrv h LYS 902 Cb 0.65 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2qrv h LYS 902 CO 0.00 0.04 0.00 0.39 -0.57 0.00 0.00 179.45 179.31 2qrv n GLU 903 N -5.24 0.30 -0.00 3.15 -0.58 -1.21 -2.89 120.64 114.17 2qrv n GLU 903 Ca 0.03 0.03 0.04 0.00 -0.42 0.00 0.00 57.16 56.83 2qrv n GLU 903 Cb 0.22 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.53 2qrv n GLU 903 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2qrv n TYR 904 N -1.05 0.00 -4.36 -0.32 4.02 -0.75 -5.07 117.16 109.63 2qrv n TYR 904 Ca 0.07 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.78 2qrv n TYR 904 Cb 0.04 -0.12 -0.10 0.00 -0.02 0.00 0.00 39.34 39.14 2qrv n TYR 904 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2qrv s PHE 905 N -2.29 1.68 0.18 -0.72 0.40 -1.14 -4.67 117.98 111.42 2qrv s PHE 905 Ca -0.01 -1.12 -0.29 0.00 -0.60 0.00 0.00 56.93 54.91 2qrv s PHE 905 Cb 0.05 -1.03 -0.17 0.00 0.51 0.00 0.00 43.02 42.38 2qrv s PHE 905 CO 0.31 -0.23 0.56 0.00 0.70 0.00 0.00 175.22 176.56 2qrv n ALA 906 N -0.55 -2.93 -3.78 5.36 0.00 0.37 -4.86 120.51 114.12 2qrv n ALA 906 Ca -0.01 0.45 -0.34 0.00 0.00 0.00 0.00 53.44 53.55 2qrv n ALA 906 Cb 0.66 -1.61 -0.10 0.00 0.00 0.00 0.00 19.45 18.40 2qrv n ALA 906 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50