#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 -2.67 3.55 0.00 -1.26 -5.08 120.51 115.05 2qrv n ALA 624 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 2qrv n ALA 624 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 3.71 -1.73 0.00 4.71 -1.26 -5.03 120.64 121.04 2qrv n GLU 625 Ca 0.00 -3.85 -0.37 0.00 -0.01 0.00 0.00 57.16 52.93 2qrv n GLU 625 Cb 0.00 -2.85 0.07 0.00 -1.01 0.00 0.00 31.44 27.65 2qrv n GLU 625 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 2qrv s LYS 626 N -0.03 2.54 0.20 3.49 1.02 -1.26 -4.96 119.74 120.73 2qrv s LYS 626 Ca 0.38 2.03 -0.30 0.00 0.02 0.00 0.00 55.97 58.11 2qrv s LYS 626 Cb 0.04 -1.85 -0.08 0.00 -0.52 0.00 0.00 37.83 35.42 2qrv s LYS 626 CO 0.02 -1.60 1.19 1.03 -0.92 0.00 0.00 175.35 175.06 2qrv s ARG 627 N -3.41 4.51 0.45 1.68 0.52 -1.26 -5.02 118.95 116.41 2qrv s ARG 627 Ca 0.82 1.88 0.06 0.00 -0.52 0.00 0.00 55.73 57.97 2qrv s ARG 627 Cb -0.37 -3.23 -0.03 0.00 0.52 0.00 0.00 34.95 31.85 2qrv s ARG 627 CO 0.40 -0.05 0.24 0.15 0.02 0.00 0.00 175.30 176.05 2qrv s LYS 628 N -0.44 2.27 0.78 3.54 3.01 -1.26 -4.19 119.74 123.45 2qrv s LYS 628 Ca 0.52 -1.88 -0.11 0.00 -1.01 0.00 0.00 55.97 53.49 2qrv s LYS 628 Cb -0.33 -2.03 0.06 0.00 -1.01 0.00 0.00 37.83 34.53 2qrv s LYS 628 CO 0.38 -0.25 1.09 -2.14 0.51 0.00 0.00 175.35 174.93 2qrv s PRO 629 N -4.01 2.22 0.12 -1.68 0.02 -1.26 -0.52 135.00 129.88 2qrv s PRO 629 Ca 0.38 1.08 -0.25 0.00 0.02 0.00 0.00 61.00 62.23 2qrv s PRO 629 Cb 0.01 -1.90 -0.07 0.00 0.02 0.00 0.00 34.50 32.57 2qrv s PRO 629 CO 0.22 -1.65 0.78 -1.50 -0.33 0.00 0.00 177.00 174.51 2qrv s ILE 630 N -2.94 4.52 -0.20 2.83 2.07 -0.04 -4.62 121.20 122.83 2qrv s ILE 630 Ca 0.61 1.68 -0.02 0.00 -1.41 0.00 0.00 60.65 61.51 2qrv s ILE 630 Cb -0.17 -4.13 -0.00 0.00 0.13 0.00 0.00 42.46 38.29 2qrv s ILE 630 CO 0.56 0.46 -0.09 -0.13 -1.91 0.00 0.00 174.94 173.82 2qrv s ARG 631 N -0.69 3.29 0.20 3.50 3.00 -1.26 -0.05 118.95 126.93 2qrv s ARG 631 Ca 0.37 -0.68 0.11 0.00 0.00 0.00 0.00 55.73 55.52 2qrv s ARG 631 Cb -0.22 -2.85 -0.04 0.00 0.00 0.00 0.00 34.95 31.84 2qrv s ARG 631 CO 0.25 -0.14 -0.17 0.08 0.00 0.00 0.00 175.30 175.32 2qrv s VAL 632 N 1.27 2.71 -0.23 3.52 1.01 0.64 -0.53 120.40 128.79 2qrv s VAL 632 Ca 0.03 -1.94 -0.01 0.00 0.00 0.00 0.00 61.98 60.06 2qrv s VAL 632 Cb -0.14 -2.34 0.07 0.00 0.00 0.00 0.00 36.38 33.97 2qrv s VAL 632 CO -0.04 -0.16 0.01 -0.22 0.00 0.00 0.00 175.10 174.69 2qrv s LEU 633 N -2.87 1.97 -0.22 3.92 2.96 0.17 -1.91 118.68 122.70 2qrv s LEU 633 Ca 0.24 -1.12 -0.07 0.00 -0.22 0.00 0.00 54.13 52.97 2qrv s LEU 633 Cb -0.08 -0.89 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 2qrv s LEU 633 CO 0.13 -0.30 0.05 -0.55 -1.32 0.00 0.00 176.35 174.36 2qrv s SER 634 N 1.62 5.16 -0.15 3.68 0.15 0.26 -1.80 113.70 122.63 2qrv s SER 634 Ca -0.01 -0.13 -0.04 0.00 0.70 0.00 0.00 55.95 56.47 2qrv s SER 634 Cb -0.18 -1.90 -0.03 0.00 -1.71 0.00 0.00 66.02 62.20 2qrv s SER 634 CO -0.10 0.05 -0.02 -0.76 1.20 0.00 0.00 173.24 173.61 2qrv s LEU 635 N 1.12 3.36 -0.86 3.45 1.43 -0.76 -0.58 118.68 125.83 2qrv s LEU 635 Ca 0.04 -0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 2qrv s LEU 635 Cb -0.14 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.28 2qrv s LEU 635 CO 0.03 0.21 0.75 0.49 0.23 0.00 0.00 176.35 178.05 2qrv n PHE 636 N 3.30 -1.78 -0.32 0.29 3.01 0.11 -3.33 117.46 118.75 2qrv n PHE 636 Ca -0.17 0.65 0.32 0.00 1.01 0.00 0.00 57.45 59.26 2qrv n PHE 636 Cb 0.53 -3.76 0.68 0.00 -0.01 0.00 0.00 39.48 36.92 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 -1.64 0.12 0.00 4.37 3.58 -1.71 -3.40 116.42 117.74 2qrv h ASP 637 Ca -0.38 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.10 2qrv h ASP 637 Cb 1.24 0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.29 2qrv h ASP 637 CO 0.36 0.02 0.00 0.61 -2.88 0.00 0.00 179.24 177.34 2qrv n GLY 638 N -1.68 3.58 2.22 -0.78 0.00 -1.26 -2.25 105.19 105.02 2qrv n GLY 638 Ca 0.25 -0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 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 3.34 -3.88 -0.61 -5.35 -1.26 -4.35 119.36 107.24 2qrv n ILE 639 Ca 0.00 -2.39 -0.26 0.00 -0.27 0.00 0.00 62.75 59.83 2qrv n ILE 639 Cb 0.00 -0.75 0.01 0.00 -1.74 0.00 0.00 39.64 37.16 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 -1.05 -1.82 -0.09 -1.28 0.00 -0.95 -4.69 120.51 110.63 2qrv n ALA 640 Ca 0.60 -0.13 -0.05 0.00 0.00 0.00 0.00 53.44 53.86 2qrv n ALA 640 Cb 1.24 -2.35 0.14 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.86 1.25 0.15 0.00 2.02 -1.92 -1.18 112.91 111.37 2qrv h THR 641 Ca -0.61 -1.13 0.01 0.00 0.77 0.00 0.00 66.41 65.45 2qrv h THR 641 Cb 1.37 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 68.76 2qrv h THR 641 CO 0.63 0.39 -0.49 1.23 0.37 0.00 0.00 175.52 177.64 2qrv h GLY 642 N 0.97 -1.06 1.00 2.16 0.00 -1.89 0.35 103.07 104.61 2qrv h GLY 642 Ca 0.12 0.59 -0.00 0.00 0.00 0.00 0.00 47.33 48.04 2qrv h GLY 642 CO 0.03 -0.28 0.38 -2.00 0.00 0.00 0.00 176.54 174.67 2qrv h LEU 643 N -0.74 0.74 -0.25 3.11 5.85 -1.92 0.10 115.31 122.20 2qrv h LEU 643 Ca 0.00 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.72 2qrv h LEU 643 Cb 0.75 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.51 2qrv h LEU 643 CO -0.26 0.58 -0.38 0.25 -0.34 0.00 0.00 178.44 178.29 2qrv h LEU 644 N 0.84 -1.22 -0.50 2.25 7.12 -0.69 0.34 115.31 123.45 2qrv h LEU 644 Ca 0.22 0.18 -0.07 0.00 0.13 0.00 0.00 57.88 58.34 2qrv h LEU 644 Cb -0.03 0.52 -0.02 0.00 -0.53 0.00 0.00 40.66 40.61 2qrv h LEU 644 CO -0.04 -0.38 0.03 0.58 -0.13 0.00 0.00 178.44 178.50 2qrv h VAL 645 N -0.38 1.26 -0.83 1.05 2.07 -0.85 -0.78 116.25 117.79 2qrv h VAL 645 Ca 0.12 -1.03 0.07 0.00 0.82 0.00 0.00 66.70 66.68 2qrv h VAL 645 Cb 0.58 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 2qrv h VAL 645 CO -0.46 0.36 0.50 -0.07 0.02 0.00 0.00 177.57 177.93 2qrv h LEU 646 N 0.73 0.76 -0.52 2.57 3.38 0.07 -0.60 115.31 121.70 2qrv h LEU 646 Ca 0.15 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.99 2qrv h LEU 646 Cb 0.48 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2qrv h LEU 646 CO 0.02 0.47 -0.43 0.11 0.09 0.00 0.00 178.44 178.70 2qrv h LYS 647 N 0.89 0.73 -0.48 1.13 1.57 -0.12 -2.69 116.57 117.59 2qrv h LYS 647 Ca 0.38 -0.39 0.10 0.00 -1.87 0.00 0.00 60.65 58.86 2qrv h LYS 647 Cb 0.24 0.02 -0.09 0.00 0.08 0.00 0.00 32.23 32.48 2qrv h LYS 647 CO -0.20 1.01 -0.08 -0.44 -0.57 0.00 0.00 179.45 179.18 2qrv h ASP 648 N 0.59 -0.36 0.29 0.86 5.19 0.36 0.14 116.42 123.49 2qrv h ASP 648 Ca 0.04 0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 2qrv h ASP 648 Cb 0.98 0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2qrv h ASP 648 CO 0.09 -0.13 0.00 0.18 -3.12 0.00 0.00 179.24 176.26 2qrv n LEU 649 N -5.31 0.00 -1.77 1.55 4.77 -0.64 -4.88 117.00 110.73 2qrv n LEU 649 Ca 0.05 0.27 -0.09 0.00 -0.03 0.00 0.00 56.01 56.20 2qrv n LEU 649 Cb 0.26 -0.27 0.03 0.00 -2.33 0.00 0.00 43.42 41.11 2qrv n LEU 649 CO 0.13 -0.12 0.10 0.61 -1.33 0.00 0.00 177.39 176.77 2qrv n GLY 650 N 0.10 0.33 3.62 -0.72 0.00 0.47 -4.95 105.19 104.04 2qrv n GLY 650 Ca 0.08 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.13 4.76 0.19 -0.61 1.01 -1.02 -1.77 121.20 120.63 2qrv s ILE 651 Ca 0.22 -0.04 -0.31 0.00 0.00 0.00 0.00 60.65 60.52 2qrv s ILE 651 Cb -0.10 -3.16 -0.09 0.00 0.01 0.00 0.00 42.46 39.12 2qrv s ILE 651 CO 0.29 0.44 1.45 -1.10 0.00 0.00 0.00 174.94 176.03 2qrv s GLN 652 N 0.52 4.28 -0.31 2.79 -0.21 -0.94 -4.58 119.66 121.20 2qrv s GLN 652 Ca 0.03 2.24 -0.04 0.00 0.02 0.00 0.00 55.36 57.61 2qrv s GLN 652 Cb -0.13 -3.16 0.04 0.00 1.00 0.00 0.00 33.01 30.76 2qrv s GLN 652 CO 0.01 -0.46 0.04 0.08 -2.12 0.00 0.00 175.29 172.84 2qrv s VAL 653 N 0.59 3.29 0.04 1.09 1.01 -1.26 -0.86 120.40 124.31 2qrv s VAL 653 Ca 0.63 -1.27 -0.25 0.00 0.00 0.00 0.00 61.98 61.10 2qrv s VAL 653 Cb -0.41 -2.87 -0.17 0.00 0.00 0.00 0.00 36.38 32.94 2qrv s VAL 653 CO 0.36 -0.12 1.52 -0.78 0.00 0.00 0.00 175.10 176.09 2qrv h ASP 654 N 8.08 -0.10 -4.13 3.32 1.82 -0.73 -3.46 116.42 121.23 2qrv h ASP 654 Ca -0.22 -0.17 -0.11 0.00 -0.39 0.00 0.00 57.03 56.14 2qrv h ASP 654 Cb 1.07 0.03 -0.23 0.00 0.68 0.00 0.00 39.33 40.88 2qrv h ASP 654 CO 0.56 0.11 -0.18 0.00 -1.61 0.00 0.00 179.24 178.12 2qrv s ARG 655 N -5.40 0.58 -0.32 0.28 1.70 -1.21 -5.02 118.95 109.56 2qrv s ARG 655 Ca -0.14 0.47 0.00 0.00 -0.47 0.00 0.00 55.73 55.59 2qrv s ARG 655 Cb 0.04 0.28 0.10 0.00 -0.57 0.00 0.00 34.95 34.79 2qrv s ARG 655 CO 0.65 -0.10 0.08 -0.47 -1.08 0.00 0.00 175.30 174.38 2qrv s TYR 656 N -0.09 2.20 -0.31 5.89 5.04 -1.26 -0.26 117.35 128.55 2qrv s TYR 656 Ca -0.03 -2.03 -0.12 0.00 -2.44 0.00 0.00 57.07 52.45 2qrv s TYR 656 Cb -0.03 -1.99 -0.03 0.00 0.35 0.00 0.00 41.96 40.25 2qrv s TYR 656 CO 0.02 -0.89 0.22 0.42 -1.34 0.00 0.00 175.55 173.97 2qrv s ILE 657 N 1.45 5.30 -0.06 3.14 1.01 -0.80 -1.36 121.20 129.86 2qrv s ILE 657 Ca 0.10 -0.02 0.03 0.00 0.00 0.00 0.00 60.65 60.76 2qrv s ILE 657 Cb -0.18 -3.62 -0.02 0.00 0.01 0.00 0.00 42.46 38.65 2qrv s ILE 657 CO -0.21 0.12 -0.16 0.00 0.00 0.00 0.00 174.94 174.69 2qrv s ALA 658 N 1.74 2.57 -0.50 9.38 0.00 -0.81 -0.58 121.76 133.57 2qrv s ALA 658 Ca 0.07 -0.98 -0.13 0.00 0.00 0.00 0.00 51.96 50.92 2qrv s ALA 658 Cb -0.17 -0.96 0.12 0.00 0.00 0.00 0.00 23.12 22.12 2qrv s ALA 658 CO 0.11 0.48 0.42 0.45 0.00 0.00 0.00 175.76 177.21 2qrv s SER 659 N -0.45 5.95 0.00 0.00 0.15 0.25 -1.08 113.70 118.52 2qrv s SER 659 Ca 0.05 -1.81 0.03 0.00 0.70 0.00 0.00 55.95 54.92 2qrv s SER 659 Cb -0.12 -2.11 -0.01 0.00 -1.71 0.00 0.00 66.02 62.07 2qrv s SER 659 CO 0.02 -0.76 -0.09 -0.70 1.20 0.00 0.00 173.24 172.90 2qrv s GLU 660 N 1.49 0.72 -0.00 5.44 -6.30 -1.20 -0.71 118.70 118.13 2qrv s GLU 660 Ca 0.04 -0.41 0.05 0.00 -2.50 0.00 0.00 54.97 52.16 2qrv s GLU 660 Cb -0.28 -0.68 -0.07 0.00 0.00 0.00 0.00 34.13 33.11 2qrv s GLU 660 CO 0.01 0.18 0.18 1.55 0.02 0.00 0.00 175.26 177.20 2qrv n VAL 661 N 2.62 0.00 -2.82 3.70 3.14 -1.26 -4.49 118.33 119.22 2qrv n VAL 661 Ca -0.15 -0.28 -0.43 0.00 -2.96 0.00 0.00 64.34 60.53 2qrv n VAL 661 Cb 0.56 0.75 -0.04 0.00 -1.06 0.00 0.00 33.84 34.06 2qrv n VAL 661 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qrv h GLU 663 N 8.73 0.50 0.34 0.00 4.39 -1.98 0.11 114.58 126.67 2qrv h GLU 663 Ca -0.24 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.42 2qrv h GLU 663 Cb 1.08 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 2qrv h GLU 663 CO 1.00 0.33 -0.16 -0.44 -1.16 0.00 0.00 179.01 178.58 2qrv h ASP 664 N 0.51 -0.38 -0.44 1.42 3.32 -2.00 0.13 116.42 118.98 2qrv h ASP 664 Ca 0.49 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.40 2qrv h ASP 664 Cb 1.07 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.70 2qrv h ASP 664 CO -0.22 -0.16 0.04 0.77 -1.72 0.00 0.00 179.24 177.95 2qrv h SER 665 N -0.59 0.73 -0.75 6.45 4.64 -1.75 -2.35 113.55 119.93 2qrv h SER 665 Ca -0.05 -0.28 0.14 0.00 -0.47 0.00 0.00 61.79 61.14 2qrv h SER 665 Cb 0.43 -0.19 -0.10 0.00 -0.31 0.00 0.00 62.40 62.23 2qrv h SER 665 CO 0.08 0.83 0.28 0.40 -0.87 0.00 0.00 176.83 177.55 2qrv h ILE 666 N 0.61 0.64 -0.27 0.95 2.04 -0.67 -0.90 117.51 119.91 2qrv h ILE 666 Ca 0.13 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2qrv h ILE 666 Cb 0.43 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 2qrv h ILE 666 CO 0.01 0.08 0.12 0.74 0.00 0.00 0.00 178.15 179.10 2qrv h THR 667 N 0.42 1.15 -0.12 -0.27 2.02 -0.66 -1.42 112.91 114.03 2qrv h THR 667 Ca 0.41 -0.45 0.04 0.00 0.77 0.00 0.00 66.41 67.19 2qrv h THR 667 Cb 0.64 0.96 -0.07 0.00 -1.74 0.00 0.00 68.15 67.94 2qrv h THR 667 CO -0.42 0.16 -0.42 0.58 0.37 0.00 0.00 175.52 175.79 2qrv h VAL 668 N 0.29 0.15 -0.32 3.16 2.07 -0.67 0.97 116.25 121.90 2qrv h VAL 668 Ca 0.09 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.66 2qrv h VAL 668 Cb 0.13 0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.00 2qrv h VAL 668 CO -0.01 0.00 0.03 1.23 0.02 0.00 0.00 177.57 178.84 2qrv h GLY 669 N -0.50 0.33 -0.01 2.17 0.00 -1.20 0.11 103.07 103.97 2qrv h GLY 669 Ca 0.07 0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.49 2qrv h GLY 669 CO -0.39 -0.05 -0.25 1.98 0.00 0.00 0.00 176.54 177.83 2qrv h MET 670 N 0.13 -0.20 -0.04 4.80 -1.53 -0.17 -1.41 114.93 116.51 2qrv h MET 670 Ca 0.15 0.01 -0.04 0.00 -3.44 0.00 0.00 59.70 56.38 2qrv h MET 670 Cb 0.19 0.05 0.00 0.00 -0.55 0.00 0.00 31.60 31.29 2qrv h MET 670 CO -0.23 -0.13 -0.14 0.28 0.14 0.00 0.00 176.91 176.82 2qrv h VAL 671 N -0.21 1.47 0.00 -5.77 2.07 -0.43 -1.71 116.25 111.67 2qrv h VAL 671 Ca 0.17 -1.59 -0.04 0.00 0.82 0.00 0.00 66.70 66.07 2qrv h VAL 671 Cb 0.48 2.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 2qrv h VAL 671 CO -0.47 0.44 -0.17 0.03 0.02 0.00 0.00 177.57 177.41 2qrv h ARG 672 N -0.40 0.00 -0.18 1.57 2.47 -0.71 -2.81 114.38 114.32 2qrv h ARG 672 Ca -0.01 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.68 2qrv h ARG 672 Cb 0.78 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.09 2qrv h ARG 672 CO 0.03 0.17 -0.04 0.72 0.56 0.00 0.00 179.97 181.41 2qrv n HIS 673 N -4.24 0.62 -4.25 3.04 8.25 -0.54 -5.00 115.22 113.10 2qrv n HIS 673 Ca -0.02 -1.07 -0.31 0.00 -0.26 0.00 0.00 57.72 56.06 2qrv n HIS 673 Cb 0.24 -0.29 -0.07 0.00 1.12 0.00 0.00 29.99 30.99 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 -0.94 -1.61 0.00 -0.41 6.02 -0.95 -2.33 117.38 117.16 2qrv n GLN 674 Ca 0.21 0.19 0.00 0.00 -0.01 0.00 0.00 57.00 57.39 2qrv n GLN 674 Cb 0.83 -4.04 0.00 0.00 1.02 0.00 0.00 30.24 28.05 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 -2.19 2.23 0.15 1.08 0.00 -0.68 -4.89 105.19 100.89 2qrv n GLY 675 Ca -0.25 -0.37 0.14 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.02 -2.40 1.61 3.00 -0.98 -4.21 118.16 115.15 2qrv n LYS 676 Ca 0.00 0.53 -0.43 0.00 -0.00 0.00 0.00 58.31 58.42 2qrv n LYS 676 Cb 0.00 -0.99 -0.02 0.00 0.00 0.00 0.00 35.03 34.02 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 -4.48 4.23 -0.59 3.15 1.01 -1.26 -4.47 121.20 118.80 2qrv s ILE 677 Ca -0.03 1.50 -0.25 0.00 0.00 0.00 0.00 60.65 61.87 2qrv s ILE 677 Cb 0.13 -3.97 0.04 0.00 0.01 0.00 0.00 42.46 38.67 2qrv s ILE 677 CO 0.32 -0.11 1.04 -0.32 0.00 0.00 0.00 174.94 175.86 2qrv s MET 678 N 3.30 3.34 -0.55 2.79 -2.45 -0.47 -4.95 119.30 120.32 2qrv s MET 678 Ca 0.56 -0.19 -0.27 0.00 -1.25 0.00 0.00 55.69 54.54 2qrv s MET 678 Cb -0.23 -4.07 0.03 0.00 1.25 0.00 0.00 34.83 31.81 2qrv s MET 678 CO 0.17 -1.63 1.10 0.71 1.05 0.00 0.00 175.02 176.42 2qrv s TYR 679 N 4.37 2.70 0.24 4.11 1.51 -1.26 -1.92 117.35 127.11 2qrv s TYR 679 Ca 0.33 0.33 -0.04 0.00 -1.01 0.00 0.00 57.07 56.69 2qrv s TYR 679 Cb -0.11 -4.35 0.05 0.00 -0.11 0.00 0.00 41.96 37.45 2qrv s TYR 679 CO 0.20 -1.45 0.33 0.28 -1.11 0.00 0.00 175.55 173.79 2qrv n VAL 680 N 6.55 0.00 0.00 0.71 0.31 -0.24 -4.98 118.33 120.68 2qrv n VAL 680 Ca 0.07 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2qrv n VAL 680 Cb 0.49 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 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 2.82 1.83 3.77 2.92 0.00 -1.26 -4.22 105.19 111.06 2qrv n GLY 681 Ca 0.04 -1.04 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.64 6.13 0.10 1.61 3.68 -1.26 -3.25 116.67 123.03 2qrv s ASP 682 Ca 0.00 3.03 -0.25 0.00 2.13 0.00 0.00 52.55 57.46 2qrv s ASP 682 Cb 0.00 -2.66 -0.09 0.00 -1.45 0.00 0.00 42.92 38.72 2qrv s ASP 682 CO 0.00 -1.02 1.42 -0.37 0.13 0.00 0.00 175.17 175.33 2qrv h VAL 683 N 2.71 0.00 0.00 1.11 -1.51 -1.93 -2.43 116.25 114.19 2qrv h VAL 683 Ca -0.51 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 64.93 2qrv h VAL 683 Cb 1.25 0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 30.40 2qrv h VAL 683 CO 0.63 0.00 0.06 -2.11 -1.23 0.00 0.00 177.57 174.92 2qrv n ARG 684 N -4.73 0.54 0.00 5.19 0.00 -1.26 -0.65 116.66 115.75 2qrv n ARG 684 Ca -0.03 -0.15 0.00 0.00 -0.00 0.00 0.00 57.85 57.66 2qrv n ARG 684 Cb 0.27 -1.46 0.00 0.00 -0.00 0.00 0.00 32.46 31.27 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 2.20 0.01 -4.75 2.89 3.41 -0.92 -5.03 113.62 111.44 2qrv n SER 685 Ca 0.07 -1.00 -0.35 0.00 -0.26 0.00 0.00 58.87 57.32 2qrv n SER 685 Cb 0.26 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.13 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 0.27 -3.33 1.01 0.18 -4.99 120.40 118.86 2qrv s VAL 686 Ca 0.00 0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.20 2qrv s VAL 686 Cb 0.00 -3.40 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 2qrv s VAL 686 CO 0.00 0.49 -0.07 0.42 0.00 0.00 0.00 175.10 175.93 2qrv s THR 687 N 0.03 1.68 0.27 3.92 -4.23 -1.26 -4.98 115.64 111.06 2qrv s THR 687 Ca 0.09 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 2qrv s THR 687 Cb -0.11 -2.39 0.25 0.00 1.34 0.00 0.00 72.50 71.59 2qrv s THR 687 CO -0.00 -0.35 1.73 -0.61 -0.54 0.00 0.00 174.62 174.86 2qrv h GLN 688 N 2.32 0.50 -0.67 3.99 5.75 -1.97 0.81 115.11 125.84 2qrv h GLN 688 Ca -0.40 -0.03 0.09 0.00 -0.15 0.00 0.00 58.65 58.16 2qrv h GLN 688 Cb 1.23 -0.11 -0.07 0.00 1.07 0.00 0.00 27.48 29.60 2qrv h GLN 688 CO 0.66 0.33 0.31 0.87 -2.65 0.00 0.00 178.83 178.35 2qrv h LYS 689 N 0.51 0.52 -0.53 1.69 1.79 -1.98 -1.67 116.57 116.89 2qrv h LYS 689 Ca 0.49 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.90 2qrv h LYS 689 Cb 0.79 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.30 2qrv h LYS 689 CO -0.43 0.34 0.22 0.45 -1.08 0.00 0.00 179.45 178.96 2qrv h HIS 690 N 0.53 0.80 0.35 -1.35 3.86 0.15 -2.08 115.15 117.41 2qrv h HIS 690 Ca 0.33 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.47 2qrv h HIS 690 Cb 0.36 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 2qrv h HIS 690 CO -0.13 0.65 -0.29 0.82 0.86 0.00 0.00 177.93 179.85 2qrv h ILE 691 N 0.72 0.00 0.00 2.45 5.03 0.03 1.18 117.51 126.92 2qrv h ILE 691 Ca 0.18 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.91 2qrv h ILE 691 Cb 0.18 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 33.97 2qrv h ILE 691 CO -0.02 0.00 -0.06 0.06 -0.68 0.00 0.00 178.15 177.45 2qrv h GLN 692 N -0.62 0.00 0.03 2.37 3.07 -1.57 -0.29 115.11 118.10 2qrv h GLN 692 Ca -0.04 0.00 -0.21 0.00 0.09 0.00 0.00 58.65 58.48 2qrv h GLN 692 Cb 0.52 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.07 2qrv h GLN 692 CO -0.00 0.06 -0.96 1.49 0.09 0.00 0.00 178.83 179.51 2qrv h GLU 693 N 0.00 0.18 -1.03 0.06 4.81 -0.81 -3.02 114.58 114.77 2qrv h GLU 693 Ca -0.00 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2qrv h GLU 693 Cb 0.33 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2qrv h GLU 693 CO 0.01 1.01 0.00 0.91 -0.73 0.00 0.00 179.01 180.21 2qrv n TRP 694 N -3.59 0.00 -0.55 0.92 8.01 0.40 -4.93 117.44 117.70 2qrv n TRP 694 Ca -0.04 -0.23 0.07 0.00 -1.31 0.00 0.00 57.50 55.99 2qrv n TRP 694 Cb 0.86 -0.16 -0.04 0.00 -2.01 0.00 0.00 31.31 29.97 2qrv n TRP 694 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2qrv n GLY 695 N 0.39 -2.90 3.78 6.99 0.00 -1.14 -4.86 105.19 107.44 2qrv n GLY 695 Ca 0.00 -1.30 -0.37 0.00 0.00 0.00 0.00 46.02 44.35 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 -3.47 4.05 -0.04 1.61 0.04 -1.26 -4.58 135.00 131.34 2qrv s PRO 696 Ca 0.00 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.67 2qrv s PRO 696 Cb 0.00 -2.53 -0.03 0.00 0.04 0.00 0.00 34.50 31.97 2qrv s PRO 696 CO 0.00 -0.26 -0.00 -0.06 0.04 0.00 0.00 177.00 176.71 2qrv s PHE 697 N -1.59 3.10 -0.17 0.56 2.99 -1.26 -4.87 117.98 116.73 2qrv s PHE 697 Ca 0.59 0.12 -0.01 0.00 0.00 0.00 0.00 56.93 57.62 2qrv s PHE 697 Cb -0.25 -1.72 -0.23 0.00 0.00 0.00 0.00 43.02 40.83 2qrv s PHE 697 CO 0.31 0.45 0.16 -0.25 -0.00 0.00 0.00 175.22 175.89 2qrv n ASP 698 N 1.73 1.90 -4.10 1.36 10.43 0.32 -4.88 116.55 123.30 2qrv n ASP 698 Ca -0.16 0.09 -0.26 0.00 2.57 0.00 0.00 54.79 57.03 2qrv n ASP 698 Cb 0.53 -0.57 -0.16 0.00 1.84 0.00 0.00 41.12 42.76 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 -6.73 1.85 -0.12 0.64 2.96 -0.91 0.07 118.68 116.44 2qrv s LEU 699 Ca -0.25 -0.35 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 2qrv s LEU 699 Cb 0.08 -0.94 0.02 0.00 0.50 0.00 0.00 46.19 45.84 2qrv s LEU 699 CO 0.72 0.12 -0.11 -0.69 -1.32 0.00 0.00 176.35 175.06 2qrv s VAL 700 N 0.23 1.27 0.14 1.68 1.01 -0.20 -0.65 120.40 123.87 2qrv s VAL 700 Ca -0.08 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.50 2qrv s VAL 700 Cb -0.13 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2qrv s VAL 700 CO 0.03 0.41 -0.11 0.27 0.00 0.00 0.00 175.10 175.70 2qrv s ILE 701 N 1.51 1.19 0.00 2.22 -4.36 -0.74 -0.15 121.20 120.86 2qrv s ILE 701 Ca 0.03 -1.94 0.00 0.00 -0.26 0.00 0.00 60.65 58.48 2qrv s ILE 701 Cb -0.13 -1.72 0.00 0.00 1.25 0.00 0.00 42.46 41.86 2qrv s ILE 701 CO -0.08 -0.65 0.00 0.61 0.24 0.00 0.00 174.94 175.06 2qrv n GLY 702 N 0.04 0.86 2.52 6.27 0.00 -0.36 -1.83 105.19 112.69 2qrv n GLY 702 Ca -0.12 -0.51 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 2qrv n GLY 702 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qrv s GLY 703 N 0.00 0.67 0.62 -0.02 0.00 -1.21 -1.52 107.32 105.85 2qrv s GLY 703 Ca 0.00 -1.75 -0.19 0.00 0.00 0.00 0.00 44.72 42.79 2qrv s GLY 703 CO 0.00 2.28 1.13 -1.14 0.00 0.00 0.00 173.10 175.37 2qrv n SER 704 N 3.82 1.46 -4.61 1.64 3.41 -1.26 -4.87 113.62 113.21 2qrv n SER 704 Ca 0.16 0.83 -0.49 0.00 -0.26 0.00 0.00 58.87 59.10 2qrv n SER 704 Cb 0.41 -1.47 -0.05 0.00 -0.26 0.00 0.00 64.21 62.84 2qrv n SER 704 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2qrv n PRO 705 N -1.36 1.42 0.09 4.33 -0.02 -1.26 -4.88 135.00 133.32 2qrv n PRO 705 Ca 0.14 0.51 -0.14 0.00 -2.02 0.00 0.00 63.50 61.99 2qrv n PRO 705 Cb 0.47 -2.13 -0.11 0.00 -0.02 0.00 0.00 33.50 31.71 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 -3.56 0.00 -0.24 0.00 3.02 -1.26 0.61 115.26 113.84 2qrv n ASN 707 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 2qrv n ASN 707 Cb 0.97 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.14 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 -0.58 0.14 0.00 6.41 9.92 -1.26 -1.93 116.55 129.24 2qrv n ASP 708 Ca 0.00 -0.60 0.00 0.00 -0.53 0.00 0.00 54.79 53.66 2qrv n ASP 708 Cb 0.00 -0.07 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 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 -0.10 0.00 -4.65 0.64 4.77 0.20 -1.22 117.00 116.65 2qrv n LEU 709 Ca 0.00 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.55 2qrv n LEU 709 Cb 0.04 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 2qrv n LEU 709 CO 0.00 0.00 1.56 -0.55 -1.33 0.00 0.00 177.39 177.07 2qrv s SER 710 N -1.90 6.35 0.55 -1.43 0.15 -0.81 -3.80 113.70 112.80 2qrv s SER 710 Ca 0.00 2.34 0.25 0.00 0.70 0.00 0.00 55.95 59.24 2qrv s SER 710 Cb 0.00 -2.53 1.47 0.00 -1.71 0.00 0.00 66.02 63.25 2qrv s SER 710 CO 0.00 -1.18 2.04 0.40 1.20 0.00 0.00 173.24 175.70 2qrv h ILE 711 N 5.90 0.66 -0.27 6.45 1.08 -1.47 -2.04 117.51 127.81 2qrv h ILE 711 Ca -0.44 0.00 -0.16 0.00 -0.39 0.00 0.00 64.86 63.87 2qrv h ILE 711 Cb 1.21 0.79 -0.00 0.00 -3.07 0.00 0.00 36.82 35.76 2qrv h ILE 711 CO 0.95 0.00 -0.45 0.58 -0.69 0.00 0.00 178.15 178.55 2qrv h VAL 712 N 0.00 1.29 -2.32 1.67 2.07 -1.90 -3.41 116.25 113.66 2qrv h VAL 712 Ca 0.16 -1.64 -0.52 0.00 0.82 0.00 0.00 66.70 65.52 2qrv h VAL 712 Cb 0.73 1.67 -0.05 0.00 -1.52 0.00 0.00 31.29 32.12 2qrv h VAL 712 CO -0.00 0.53 1.23 0.20 0.02 0.00 0.00 177.57 179.54 2qrv s ASN 713 N -6.78 5.71 0.28 0.57 0.01 -0.77 -4.87 114.94 109.10 2qrv s ASN 713 Ca -0.12 0.23 -0.01 0.00 -0.71 0.00 0.00 52.86 52.26 2qrv s ASN 713 Cb 0.09 -2.54 0.46 0.00 0.41 0.00 0.00 41.25 39.68 2qrv s ASN 713 CO 0.86 -2.05 1.89 1.55 -1.51 0.00 0.00 177.10 177.84 2qrv h PRO 714 N 12.82 1.08 0.00 -0.60 0.13 -1.83 -0.83 132.00 142.77 2qrv h PRO 714 Ca -0.27 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2qrv h PRO 714 Cb 1.12 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2qrv h PRO 714 CO 1.21 0.71 0.00 0.00 -0.23 0.00 0.00 178.00 179.69 2qrv n ALA 715 N -2.38 1.64 -1.52 -0.56 0.00 -1.26 -4.86 120.51 111.58 2qrv n ALA 715 Ca 0.15 -0.05 -0.51 0.00 0.00 0.00 0.00 53.44 53.03 2qrv n ALA 715 Cb 0.20 -1.19 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 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 -1.38 0.60 -0.75 0.00 1.85 -0.32 -4.88 116.66 111.78 2qrv n ARG 716 Ca 0.04 0.21 0.08 0.00 -1.00 0.00 0.00 57.85 57.18 2qrv n ARG 716 Cb 0.12 -1.60 0.36 0.00 -1.05 0.00 0.00 32.46 30.28 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 1.52 4.25 -1.08 2.89 5.02 -1.25 -5.02 118.16 124.48 2qrv n LYS 717 Ca 0.17 -3.05 0.15 0.00 -2.02 0.00 0.00 58.31 53.55 2qrv n LYS 717 Cb 0.20 -2.12 -0.04 0.00 -0.02 0.00 0.00 35.03 33.06 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 0.31 -1.68 0.29 0.72 0.00 -0.36 -2.87 105.19 101.60 2qrv n GLY 718 Ca 0.26 -1.12 0.17 0.00 0.00 0.00 0.00 46.02 45.32 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 0.00 0.99 5.85 -1.86 -3.21 115.31 117.08 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 0.98 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.01 2qrv h LEU 719 CO 0.01 0.05 -1.41 -1.22 -0.34 0.00 0.00 178.44 175.53 2qrv n TYR 720 N -3.44 0.47 -3.64 1.25 4.02 -1.26 -2.28 117.16 112.28 2qrv n TYR 720 Ca -0.02 0.14 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 2qrv n TYR 720 Cb 0.17 -0.69 0.00 0.00 -0.02 0.00 0.00 39.34 38.80 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 -2.40 2.41 0.00 -0.72 -0.58 -1.14 -4.52 120.64 113.69 2qrv n GLU 721 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2qrv n GLU 721 Cb 0.54 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.41 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 5.00 1.61 0.16 0.62 0.00 -1.26 -1.33 105.19 109.98 2qrv n GLY 722 Ca 0.00 -0.24 0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.90 2.61 1.35 -1.94 -3.30 112.91 110.72 2qrv h THR 723 Ca 0.00 -0.76 0.25 0.00 -0.55 0.00 0.00 66.41 65.35 2qrv h THR 723 Cb 0.00 1.69 -0.15 0.00 -1.73 0.00 0.00 68.15 67.95 2qrv h THR 723 CO 0.00 0.00 0.16 1.23 -0.25 0.00 0.00 175.52 176.66 2qrv h GLY 724 N 4.24 1.32 0.02 5.82 0.00 -1.34 0.21 103.07 113.34 2qrv h GLY 724 Ca 0.00 0.03 0.17 0.00 0.00 0.00 0.00 47.33 47.53 2qrv h GLY 724 CO 0.00 -0.43 0.35 3.21 0.00 0.00 0.00 176.54 179.67 2qrv h ARG 725 N 0.12 0.44 -1.75 4.80 3.08 -0.97 -2.49 114.38 117.61 2qrv h ARG 725 Ca 0.57 -0.03 0.51 0.00 0.07 0.00 0.00 59.98 61.10 2qrv h ARG 725 Cb 1.17 -0.10 -0.07 0.00 0.08 0.00 0.00 29.97 31.05 2qrv h ARG 725 CO -0.74 0.29 1.28 1.28 -1.07 0.00 0.00 179.97 181.01 2qrv n LEU 726 N -5.00 0.00 0.05 3.04 4.77 0.72 -0.81 117.00 119.77 2qrv n LEU 726 Ca 0.17 0.88 -0.13 0.00 -0.03 0.00 0.00 56.01 56.91 2qrv n LEU 726 Cb 0.50 -0.44 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2qrv n LEU 726 CO 0.16 -0.88 0.61 0.15 -1.33 0.00 0.00 177.39 176.09 2qrv h PHE 727 N 0.00 -1.09 -0.38 -1.77 3.57 -1.61 -1.31 116.94 114.34 2qrv h PHE 727 Ca 0.83 0.04 0.11 0.00 3.53 0.00 0.00 57.97 62.48 2qrv h PHE 727 Cb 3.38 0.48 -0.02 0.00 2.79 0.00 0.00 35.95 42.59 2qrv h PHE 727 CO 0.00 -0.47 0.36 0.74 -2.23 0.00 0.00 178.31 176.71 2qrv h PHE 728 N -0.52 0.00 -0.60 0.41 -1.00 -1.22 0.46 116.94 114.46 2qrv h PHE 728 Ca 0.06 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.85 2qrv h PHE 728 Cb 0.62 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.15 2qrv h PHE 728 CO -0.41 0.00 0.40 1.49 -1.61 0.00 0.00 178.31 178.18 2qrv h GLU 729 N 0.00 0.79 -0.10 1.51 4.57 -1.34 1.03 114.58 121.04 2qrv h GLU 729 Ca 0.18 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 2qrv h GLU 729 Cb 0.90 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.30 2qrv h GLU 729 CO -0.00 0.53 0.04 0.35 -1.18 0.00 0.00 179.01 178.74 2qrv h PHE 730 N 0.82 0.16 0.31 0.92 3.57 0.01 -1.29 116.94 121.44 2qrv h PHE 730 Ca 0.22 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2qrv h PHE 730 Cb -0.09 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 2qrv h PHE 730 CO -0.03 0.27 -0.37 -0.92 -2.23 0.00 0.00 178.31 175.03 2qrv h TYR 731 N -0.00 -1.00 -0.42 0.41 3.20 -0.20 0.20 116.97 119.16 2qrv h TYR 731 Ca 0.03 0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.00 2qrv h TYR 731 Cb 0.18 0.40 -0.09 0.00 1.54 0.00 0.00 36.73 38.75 2qrv h TYR 731 CO -0.01 -0.51 -0.32 -0.09 -1.64 0.00 0.00 178.16 175.60 2qrv h ARG 732 N -0.72 -0.22 -0.26 1.82 2.43 0.11 0.30 114.38 117.84 2qrv h ARG 732 Ca -0.02 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2qrv h ARG 732 Cb 0.67 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 2qrv h ARG 732 CO -0.10 -0.15 -0.03 -0.07 -1.51 0.00 0.00 179.97 178.12 2qrv h LEU 733 N -0.23 0.37 -0.31 3.80 3.38 -0.98 -1.44 115.31 119.91 2qrv h LEU 733 Ca 0.18 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2qrv h LEU 733 Cb 0.53 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2qrv h LEU 733 CO -0.55 0.46 0.16 0.25 0.09 0.00 0.00 178.44 178.85 2qrv h LEU 734 N 0.39 0.40 -0.97 1.67 5.85 0.13 -1.73 115.31 121.04 2qrv h LEU 734 Ca 0.08 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2qrv h LEU 734 Cb 0.30 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2qrv h LEU 734 CO 0.01 0.38 0.38 -0.74 -0.34 0.00 0.00 178.44 178.14 2qrv h HIS 735 N 0.38 1.11 0.00 1.25 2.76 -0.61 -0.36 115.15 119.67 2qrv h HIS 735 Ca 0.11 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2qrv h HIS 735 Cb 0.08 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 28.70 2qrv h HIS 735 CO -0.03 0.80 0.00 -0.25 -1.30 0.00 0.00 177.93 177.15 2qrv n ASP 736 N -4.32 0.07 -0.05 3.26 8.00 -0.58 -3.64 116.55 119.29 2qrv n ASP 736 Ca 0.08 0.52 -0.06 0.00 0.71 0.00 0.00 54.79 56.04 2qrv n ASP 736 Cb 0.13 -0.53 -0.08 0.00 -0.02 0.00 0.00 41.12 40.62 2qrv n ASP 736 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qrv n ALA 737 N -1.53 1.73 -1.77 2.24 0.00 -0.60 -4.74 120.51 115.84 2qrv n ALA 737 Ca 0.04 -0.70 -0.41 0.00 0.00 0.00 0.00 53.44 52.37 2qrv n ALA 737 Cb 0.21 0.04 -0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 -2.45 2.69 -1.68 0.00 1.85 -0.25 -4.73 116.66 112.09 2qrv n ARG 738 Ca -0.18 0.95 -0.44 0.00 -1.00 0.00 0.00 57.85 57.18 2qrv n ARG 738 Cb 0.84 -2.69 -0.02 0.00 -1.05 0.00 0.00 32.46 29.54 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 0.77 2.11 -2.21 2.89 -0.02 -1.26 -4.96 135.00 132.32 2qrv n PRO 739 Ca 0.03 0.75 -0.33 0.00 -2.02 0.00 0.00 63.50 61.92 2qrv n PRO 739 Cb 0.38 -2.39 -0.00 0.00 -0.02 0.00 0.00 33.50 31.47 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 -0.86 3.48 -0.23 -0.52 1.02 -1.26 -4.88 119.74 116.49 2qrv s LYS 740 Ca 0.64 1.26 -0.40 0.00 0.02 0.00 0.00 55.97 57.49 2qrv s LYS 740 Cb -0.61 -2.05 -0.16 0.00 -0.52 0.00 0.00 37.83 34.48 2qrv s LYS 740 CO 0.53 -0.68 1.63 -1.91 -0.92 0.00 0.00 175.35 174.00 2qrv n GLU 741 N -1.67 0.97 0.00 1.68 2.13 -1.26 -1.18 120.64 121.31 2qrv n GLU 741 Ca 0.09 0.36 0.00 0.00 0.66 0.00 0.00 57.16 58.27 2qrv n GLU 741 Cb 0.53 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 30.23 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 3.79 3.31 3.66 8.31 0.00 -1.26 -5.06 105.19 117.94 2qrv n GLY 742 Ca 0.25 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.78 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 7.05 0.00 1.61 2.15 -0.33 -4.90 116.67 122.25 2qrv s ASP 743 Ca 0.00 1.31 0.21 0.00 0.43 0.00 0.00 52.55 54.49 2qrv s ASP 743 Cb 0.00 -2.52 0.60 0.00 -0.30 0.00 0.00 42.92 40.69 2qrv s ASP 743 CO 0.00 -0.66 1.47 0.47 -0.17 0.00 0.00 175.17 176.28 2qrv n ASP 744 N 6.31 2.32 -4.53 -0.34 8.00 -1.26 -4.70 116.55 122.35 2qrv n ASP 744 Ca 0.11 -1.84 -0.47 0.00 0.71 0.00 0.00 54.79 53.30 2qrv n ASP 744 Cb 0.46 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 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 0.76 0.87 -1.77 -1.24 0.63 -1.26 -4.85 116.66 109.80 2qrv n ARG 745 Ca 0.17 0.31 -0.42 0.00 -0.92 0.00 0.00 57.85 56.99 2qrv n ARG 745 Cb 0.42 -1.62 -0.03 0.00 0.45 0.00 0.00 32.46 31.68 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 -0.97 4.14 -0.08 -0.14 0.02 -1.26 -4.91 135.00 131.79 2qrv s PRO 746 Ca 0.66 2.56 -0.03 0.00 0.02 0.00 0.00 61.00 64.21 2qrv s PRO 746 Cb -0.84 -3.11 0.05 0.00 0.02 0.00 0.00 34.50 30.62 2qrv s PRO 746 CO 0.56 -0.73 0.15 0.12 -0.33 0.00 0.00 177.00 176.77 2qrv s PHE 747 N 1.24 -0.15 0.07 6.54 5.36 -1.26 -4.79 117.98 124.98 2qrv s PHE 747 Ca 0.74 0.57 0.09 0.00 -0.96 0.00 0.00 56.93 57.37 2qrv s PHE 747 Cb -0.49 -0.29 -0.03 0.00 -0.34 0.00 0.00 43.02 41.87 2qrv s PHE 747 CO 0.32 -0.27 -0.23 -0.06 -1.46 0.00 0.00 175.22 173.52 2qrv s PHE 748 N 2.28 2.43 0.05 10.12 0.08 0.11 -4.98 117.98 128.06 2qrv s PHE 748 Ca 0.03 -0.33 -0.06 0.00 0.12 0.00 0.00 56.93 56.69 2qrv s PHE 748 Cb -0.12 -1.39 -0.01 0.00 -0.57 0.00 0.00 43.02 40.93 2qrv s PHE 748 CO -0.06 0.24 0.10 1.67 -0.10 0.00 0.00 175.22 177.07 2qrv s TRP 749 N -0.93 0.23 -0.15 0.36 1.48 -1.26 -1.04 118.94 117.63 2qrv s TRP 749 Ca 0.14 -0.59 -0.14 0.00 -1.06 0.00 0.00 56.10 54.45 2qrv s TRP 749 Cb -0.10 -0.16 0.04 0.00 -1.16 0.00 0.00 33.47 32.09 2qrv s TRP 749 CO 0.05 -0.40 0.41 -1.17 -4.06 0.00 0.00 176.95 171.78 2qrv s LEU 750 N -2.37 0.42 -0.04 -4.66 2.96 0.79 -2.52 118.68 113.26 2qrv s LEU 750 Ca -0.01 0.83 -0.01 0.00 -0.22 0.00 0.00 54.13 54.71 2qrv s LEU 750 Cb 0.01 1.41 0.03 0.00 0.50 0.00 0.00 46.19 48.14 2qrv s LEU 750 CO -0.06 -0.14 0.08 0.12 -1.32 0.00 0.00 176.35 175.02 2qrv s PHE 751 N 0.25 -0.04 0.39 5.38 5.36 -0.44 -1.22 117.98 127.65 2qrv s PHE 751 Ca -0.00 0.27 0.08 0.00 -0.96 0.00 0.00 56.93 56.32 2qrv s PHE 751 Cb -0.03 -0.20 -0.04 0.00 -0.34 0.00 0.00 43.02 42.41 2qrv s PHE 751 CO 0.00 -0.13 0.23 -2.00 -1.46 0.00 0.00 175.22 171.86 2qrv s GLU 752 N 1.20 2.38 0.00 10.12 -6.30 -0.58 -1.20 118.70 124.33 2qrv s GLU 752 Ca -0.08 -1.64 0.00 0.00 -2.50 0.00 0.00 54.97 50.75 2qrv s GLU 752 Cb -0.12 -2.18 0.00 0.00 0.00 0.00 0.00 34.13 31.83 2qrv s GLU 752 CO -0.04 -0.05 0.00 -1.71 0.02 0.00 0.00 175.26 173.48 2qrv n ASN 753 N -1.30 0.00 -4.72 -1.70 5.15 -1.04 -4.26 115.26 107.39 2qrv n ASN 753 Ca -0.00 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.55 2qrv n ASN 753 Cb 0.62 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.87 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 -0.13 1.63 -0.21 3.44 0.24 -1.26 -0.48 118.33 121.56 2qrv n VAL 754 Ca 0.00 -0.41 -0.08 0.00 -2.04 0.00 0.00 64.34 61.81 2qrv n VAL 754 Cb 0.00 -1.75 0.04 0.00 -1.47 0.00 0.00 33.84 30.66 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 2.90 1.26 -0.24 3.34 3.04 -1.87 -3.35 116.25 121.34 2qrv h VAL 755 Ca -0.47 -1.12 -0.63 0.00 -1.01 0.00 0.00 66.70 63.46 2qrv h VAL 755 Cb 1.26 0.75 -0.02 0.00 -2.01 0.00 0.00 31.29 31.27 2qrv h VAL 755 CO 0.68 0.41 2.39 0.00 -1.01 0.00 0.00 177.57 180.04 2qrv n ALA 756 N -2.48 3.91 -2.33 3.17 0.00 -1.26 -4.88 120.51 116.64 2qrv n ALA 756 Ca 0.03 -3.57 -0.17 0.00 0.00 0.00 0.00 53.44 49.73 2qrv n ALA 756 Cb 0.33 -3.57 -0.10 0.00 0.00 0.00 0.00 19.45 16.11 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 4.45 1.32 0.26 0.00 0.00 -1.26 -1.16 119.30 122.92 2qrv s MET 757 Ca 0.55 -1.66 -0.30 0.00 0.00 0.00 0.00 55.69 54.29 2qrv s MET 757 Cb 0.10 -0.69 -0.10 0.00 0.00 0.00 0.00 34.83 34.14 2qrv s MET 757 CO 0.04 -0.05 1.37 0.20 0.00 0.00 0.00 175.02 176.59 2qrv s GLY 758 N -3.30 2.53 0.36 3.16 0.00 -1.25 -4.85 107.32 103.97 2qrv s GLY 758 Ca 0.27 1.26 0.16 0.00 0.00 0.00 0.00 44.72 46.41 2qrv s GLY 758 CO 0.08 2.13 1.69 -0.39 0.00 0.00 0.00 173.10 176.61 2qrv h VAL 759 N 3.45 0.36 -0.25 1.40 -1.51 -1.98 -0.10 116.25 117.62 2qrv h VAL 759 Ca -0.46 -0.12 -0.04 0.00 -1.23 0.00 0.00 66.70 64.85 2qrv h VAL 759 Cb 1.22 -0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.34 2qrv h VAL 759 CO 0.74 0.06 0.01 0.77 -1.23 0.00 0.00 177.57 177.92 2qrv h SER 760 N 0.35 0.43 0.03 4.19 4.64 -1.99 -1.71 113.55 119.49 2qrv h SER 760 Ca 0.71 -0.30 -0.00 0.00 -0.47 0.00 0.00 61.79 61.72 2qrv h SER 760 Cb 1.69 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 2qrv h SER 760 CO -0.50 0.63 -0.01 0.44 -0.87 0.00 0.00 176.83 176.51 2qrv h ASP 761 N 0.23 -0.03 -0.58 4.97 5.19 -1.44 0.18 116.42 124.94 2qrv h ASP 761 Ca 0.07 -0.07 0.12 0.00 -0.62 0.00 0.00 57.03 56.53 2qrv h ASP 761 Cb 0.40 0.01 -0.09 0.00 0.18 0.00 0.00 39.33 39.83 2qrv h ASP 761 CO 0.01 0.05 0.04 0.11 -3.12 0.00 0.00 179.24 176.33 2qrv h LYS 762 N -0.11 0.15 0.61 3.56 1.57 -1.21 0.25 116.57 121.40 2qrv h LYS 762 Ca -0.00 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2qrv h LYS 762 Cb 0.10 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.38 2qrv h LYS 762 CO 0.01 0.10 -0.29 -0.09 -0.57 0.00 0.00 179.45 178.60 2qrv h ARG 763 N 0.16 -0.79 -0.77 3.15 2.43 -0.78 -0.89 114.38 116.88 2qrv h ARG 763 Ca 0.30 0.05 0.18 0.00 -0.81 0.00 0.00 59.98 59.70 2qrv h ARG 763 Cb 0.47 0.18 -0.13 0.00 -0.42 0.00 0.00 29.97 30.07 2qrv h ARG 763 CO -0.46 -0.53 0.03 -0.44 -1.51 0.00 0.00 179.97 177.06 2qrv h ASP 764 N -0.83 -0.32 0.01 -3.80 3.32 -0.18 0.43 116.42 115.06 2qrv h ASP 764 Ca -0.08 0.20 0.02 0.00 0.02 0.00 0.00 57.03 57.19 2qrv h ASP 764 Cb 0.63 0.34 -0.03 0.00 0.22 0.00 0.00 39.33 40.49 2qrv h ASP 764 CO 0.14 -0.18 -0.16 0.40 -1.72 0.00 0.00 179.24 177.72 2qrv h ILE 765 N 0.11 0.62 -0.70 0.35 2.04 -0.43 0.37 117.51 119.87 2qrv h ILE 765 Ca 0.43 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.40 2qrv h ILE 765 Cb 0.77 0.62 -0.08 0.00 -0.74 0.00 0.00 36.82 37.39 2qrv h ILE 765 CO -0.67 0.00 0.30 0.28 0.00 0.00 0.00 178.15 178.06 2qrv h SER 766 N -0.27 0.33 0.51 1.72 0.02 0.10 0.16 113.55 116.12 2qrv h SER 766 Ca 0.05 0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 61.01 2qrv h SER 766 Cb 0.33 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2qrv h SER 766 CO -0.14 0.17 -0.33 0.03 -1.14 0.00 0.00 176.83 175.42 2qrv h ARG 767 N 0.49 0.00 0.00 3.45 -0.00 0.75 0.43 114.38 119.49 2qrv h ARG 767 Ca 0.37 0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.85 2qrv h ARG 767 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.44 2qrv h ARG 767 CO -0.33 0.33 -0.00 0.74 0.00 0.00 0.00 179.97 180.70 2qrv h PHE 768 N 0.00 -0.00 0.00 3.04 -1.00 0.14 -3.23 116.94 115.89 2qrv h PHE 768 Ca -0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2qrv h PHE 768 Cb 0.67 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.23 2qrv h PHE 768 CO 0.00 0.96 0.00 1.28 -1.61 0.00 0.00 178.31 178.94 2qrv n LEU 769 N -4.62 0.00 -3.56 1.54 4.77 0.39 -4.91 117.00 110.61 2qrv n LEU 769 Ca -0.10 0.17 -0.22 0.00 -0.03 0.00 0.00 56.01 55.83 2qrv n LEU 769 Cb 0.46 -0.17 0.05 0.00 -2.33 0.00 0.00 43.42 41.43 2qrv n LEU 769 CO 0.33 -0.03 -0.03 -0.62 -1.33 0.00 0.00 177.39 175.72 2qrv n GLU 770 N -1.17 -3.69 -3.61 3.23 1.02 0.12 -4.98 120.64 111.57 2qrv n GLU 770 Ca 0.15 0.67 -0.00 0.00 -0.02 0.00 0.00 57.16 57.96 2qrv n GLU 770 Cb 0.16 -5.18 -0.01 0.00 -0.02 0.00 0.00 31.44 26.39 2qrv n GLU 770 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2qrv s SER 771 N -3.95 -0.07 0.05 1.62 1.04 0.29 -5.02 113.70 107.66 2qrv s SER 771 Ca 0.21 -0.08 0.03 0.00 0.48 0.00 0.00 55.95 56.59 2qrv s SER 771 Cb -0.05 0.13 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 2qrv s SER 771 CO 0.80 -0.24 -0.00 0.20 0.98 0.00 0.00 173.24 174.98 2qrv s ASN 772 N -2.70 5.03 1.07 7.02 0.01 -1.26 -4.25 114.94 119.85 2qrv s ASN 772 Ca 0.13 -0.11 -0.08 0.00 -0.71 0.00 0.00 52.86 52.09 2qrv s ASN 772 Cb 0.03 -1.24 0.11 0.00 0.41 0.00 0.00 41.25 40.57 2qrv s ASN 772 CO -0.04 0.22 0.49 -0.81 -1.51 0.00 0.00 177.10 175.45 2qrv n PRO 773 N 0.94 -1.40 -3.47 -0.60 -0.04 -1.26 -4.72 135.00 124.46 2qrv n PRO 773 Ca -0.12 -0.78 -0.24 0.00 -0.04 0.00 0.00 63.50 62.31 2qrv n PRO 773 Cb 0.52 -0.64 -0.12 0.00 -0.04 0.00 0.00 33.50 33.22 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 -1.97 -0.15 0.54 0.52 1.01 0.15 -4.83 120.40 115.66 2qrv s VAL 774 Ca 0.30 -0.90 -0.22 0.00 0.00 0.00 0.00 61.98 61.17 2qrv s VAL 774 Cb -0.02 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 2qrv s VAL 774 CO 0.22 -0.69 1.35 0.00 0.00 0.00 0.00 175.10 175.98 2qrv s MET 775 N 1.90 3.18 -0.30 2.72 0.23 -1.26 -2.52 119.30 123.25 2qrv s MET 775 Ca 0.12 2.22 -0.13 0.00 -1.03 0.00 0.00 55.69 56.86 2qrv s MET 775 Cb -0.17 -2.27 0.14 0.00 -1.53 0.00 0.00 34.83 30.99 2qrv s MET 775 CO -0.25 -1.15 0.81 -1.50 -2.03 0.00 0.00 175.02 170.90 2qrv s ILE 776 N -1.31 -0.56 -0.20 3.16 2.07 -0.87 -4.93 121.20 118.56 2qrv s ILE 776 Ca 0.71 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.88 2qrv s ILE 776 Cb -0.40 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.16 2qrv s ILE 776 CO 0.47 0.00 0.05 -0.62 -1.91 0.00 0.00 174.94 172.93 2qrv s ASP 777 N 2.36 5.33 0.00 4.50 3.68 -1.26 -2.73 116.67 128.55 2qrv s ASP 777 Ca -0.06 -0.05 0.04 0.00 2.13 0.00 0.00 52.55 54.61 2qrv s ASP 777 Cb -0.08 -1.92 0.22 0.00 -1.45 0.00 0.00 42.92 39.69 2qrv s ASP 777 CO -0.18 0.10 0.78 0.00 0.13 0.00 0.00 175.17 176.01 2qrv n ALA 778 N 4.01 1.56 -0.17 3.66 0.00 -0.88 -2.19 120.51 126.49 2qrv n ALA 778 Ca -0.16 -0.02 0.01 0.00 0.00 0.00 0.00 53.44 53.26 2qrv n ALA 778 Cb 0.52 -1.06 0.28 0.00 0.00 0.00 0.00 19.45 19.18 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 0.90 0.00 0.00 1.57 -1.67 0.59 116.57 117.96 2qrv h LYS 779 Ca 0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2qrv h LYS 779 Cb 0.01 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.12 2qrv h LYS 779 CO 0.00 0.60 0.00 0.39 -0.57 0.00 0.00 179.45 179.87 2qrv n GLU 780 N -4.43 0.15 -0.44 3.15 1.02 -0.93 -3.81 120.64 115.35 2qrv n GLU 780 Ca 0.07 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 2qrv n GLU 780 Cb 0.04 -1.77 0.00 0.00 -0.02 0.00 0.00 31.44 29.69 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 -2.05 0.00 -3.52 2.62 3.14 -0.76 -4.69 118.33 113.07 2qrv n VAL 781 Ca 0.03 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.30 2qrv n VAL 781 Cb 0.22 0.46 -0.04 0.00 -1.06 0.00 0.00 33.84 33.43 2qrv n VAL 781 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2qrv s SER 782 N -0.73 -0.42 0.00 6.55 1.04 0.13 -4.81 113.70 115.46 2qrv s SER 782 Ca 0.00 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.66 2qrv s SER 782 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2qrv s SER 782 CO 0.00 -0.56 0.62 0.00 0.98 0.00 0.00 173.24 174.28 2qrv n ALA 783 N 0.21 2.20 -2.60 5.32 0.00 -0.92 -4.35 120.51 120.38 2qrv n ALA 783 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.23 2qrv n ALA 783 Cb 0.60 -1.20 -0.08 0.00 0.00 0.00 0.00 19.45 18.77 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 0.75 0.29 -0.61 0.00 0.00 -1.26 -1.70 121.76 119.22 2qrv s ALA 784 Ca 0.00 -1.10 -0.07 0.00 0.00 0.00 0.00 51.96 50.78 2qrv s ALA 784 Cb 0.00 0.96 0.16 0.00 0.00 0.00 0.00 23.12 24.24 2qrv s ALA 784 CO 0.00 -0.64 0.47 -1.01 0.00 0.00 0.00 175.76 174.59 2qrv s HIS 785 N -4.02 3.51 -0.53 0.00 0.09 -0.69 -2.41 115.29 111.24 2qrv s HIS 785 Ca 0.22 -2.26 0.04 0.00 -0.00 0.00 0.00 55.06 53.05 2qrv s HIS 785 Cb 0.04 -3.44 0.14 0.00 -0.00 0.00 0.00 32.58 29.32 2qrv s HIS 785 CO 0.03 -0.93 0.29 1.03 -0.00 0.00 0.00 174.74 175.16 2qrv s ARG 786 N 0.50 1.87 -0.28 1.40 1.81 -1.26 -4.88 118.95 118.11 2qrv s ARG 786 Ca 0.13 -2.58 -0.22 0.00 -1.72 0.00 0.00 55.73 51.34 2qrv s ARG 786 Cb -0.20 -3.07 -0.01 0.00 -0.45 0.00 0.00 34.95 31.22 2qrv s ARG 786 CO -0.04 -1.15 0.72 0.00 -0.68 0.00 0.00 175.30 174.15 2qrv s ALA 787 N -0.30 3.57 0.06 2.13 0.00 -1.26 -2.07 121.76 123.89 2qrv s ALA 787 Ca 0.19 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.76 2qrv s ALA 787 Cb -0.22 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 2qrv s ALA 787 CO -0.03 -1.02 -0.09 1.03 0.00 0.00 0.00 175.76 175.65 2qrv s ARG 788 N 2.75 0.65 0.14 0.00 1.81 -1.11 -3.43 118.95 119.76 2qrv s ARG 788 Ca 0.30 -0.92 -0.16 0.00 -1.72 0.00 0.00 55.73 53.23 2qrv s ARG 788 Cb -0.15 -0.38 -0.07 0.00 -0.45 0.00 0.00 34.95 33.90 2qrv s ARG 788 CO 0.10 0.06 0.56 0.71 -0.68 0.00 0.00 175.30 176.06 2qrv s TYR 789 N -1.84 3.65 -0.11 -0.53 2.02 0.37 -2.05 117.35 118.85 2qrv s TYR 789 Ca -0.04 1.12 -0.01 0.00 -0.37 0.00 0.00 57.07 57.78 2qrv s TYR 789 Cb -0.07 -2.41 0.03 0.00 -0.40 0.00 0.00 41.96 39.11 2qrv s TYR 789 CO -0.00 0.46 -0.05 -0.06 -1.57 0.00 0.00 175.55 174.32 2qrv s PHE 790 N -1.40 1.29 0.04 2.71 0.40 -1.05 -2.50 117.98 117.47 2qrv s PHE 790 Ca 0.36 -0.64 0.01 0.00 -0.60 0.00 0.00 56.93 56.07 2qrv s PHE 790 Cb -0.16 -1.13 -0.04 0.00 0.51 0.00 0.00 43.02 42.20 2qrv s PHE 790 CO 0.19 -0.48 0.09 -1.58 0.70 0.00 0.00 175.22 174.14 2qrv s TRP 791 N 1.77 3.26 0.00 0.36 0.51 -0.34 0.30 118.94 124.80 2qrv s TRP 791 Ca 0.04 0.15 0.00 0.00 -2.12 0.00 0.00 56.10 54.17 2qrv s TRP 791 Cb -0.13 -1.69 0.00 0.00 -0.81 0.00 0.00 33.47 30.84 2qrv s TRP 791 CO -0.07 0.54 0.00 0.41 -0.51 0.00 0.00 176.95 177.32 2qrv n GLY 792 N 0.77 0.94 0.07 0.98 0.00 -1.26 -1.33 105.19 105.36 2qrv n GLY 792 Ca -0.10 -1.24 0.02 0.00 0.00 0.00 0.00 46.02 44.69 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 2.15 -4.78 1.61 6.94 -1.05 -5.02 115.26 115.11 2qrv n ASN 793 Ca 0.00 -2.19 -0.41 0.00 -0.02 0.00 0.00 54.58 51.96 2qrv n ASN 793 Cb 0.00 -0.09 -0.00 0.00 -2.36 0.00 0.00 39.78 37.32 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 -1.33 4.33 0.27 -4.53 1.43 -1.26 -4.86 118.68 112.73 2qrv s LEU 794 Ca 0.07 3.01 -0.30 0.00 -1.03 0.00 0.00 54.13 55.89 2qrv s LEU 794 Cb 0.06 -3.67 -0.10 0.00 0.03 0.00 0.00 46.19 42.51 2qrv s LEU 794 CO 0.02 -0.84 1.43 -2.16 0.23 0.00 0.00 176.35 175.03 2qrv s PRO 795 N -2.05 4.26 -1.17 1.29 0.04 -1.26 -3.65 135.00 132.47 2qrv s PRO 795 Ca 0.52 2.32 -0.06 0.00 0.04 0.00 0.00 61.00 63.82 2qrv s PRO 795 Cb -0.46 -3.09 0.01 0.00 0.04 0.00 0.00 34.50 31.00 2qrv s PRO 795 CO 0.62 -0.41 1.01 0.41 0.04 0.00 0.00 177.00 178.68 2qrv n GLY 796 N 1.90 -0.35 0.17 0.56 0.00 -1.26 -4.75 105.19 101.47 2qrv n GLY 796 Ca 0.06 0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.24 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 -2.23 0.00 0.02 1.61 2.86 -1.93 -3.28 114.93 111.98 2qrv h MET 797 Ca -0.51 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 56.89 2qrv h MET 797 Cb 1.32 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.95 2qrv h MET 797 CO 0.48 0.42 -1.29 -0.91 1.06 0.00 0.00 176.91 176.67 2qrv h ASN 798 N 0.00 0.06 -2.18 1.22 2.35 -1.91 -3.47 115.58 111.66 2qrv h ASN 798 Ca -0.00 -0.08 -0.63 0.00 -0.55 0.00 0.00 56.30 55.04 2qrv h ASN 798 Cb 1.09 -0.02 0.10 0.00 0.05 0.00 0.00 38.32 39.54 2qrv h ASN 798 CO 0.05 1.06 0.14 -2.11 -1.65 0.00 0.00 177.43 174.92 2qrv n ARG 799 N -3.27 1.19 -1.58 0.81 1.85 -1.24 -4.87 116.66 109.54 2qrv n ARG 799 Ca -0.07 0.42 -0.38 0.00 -1.00 0.00 0.00 57.85 56.81 2qrv n ARG 799 Cb 0.99 -1.81 0.04 0.00 -1.05 0.00 0.00 32.46 30.63 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 1.12 0.89 -1.84 2.89 -0.02 -1.26 -5.00 135.00 131.78 2qrv n PRO 800 Ca 0.12 0.34 -0.30 0.00 -2.02 0.00 0.00 63.50 61.64 2qrv n PRO 800 Cb 0.29 -2.05 0.16 0.00 -0.02 0.00 0.00 33.50 31.87 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 -1.23 2.47 -0.10 2.45 1.02 -1.26 -5.10 118.68 116.93 2qrv s LEU 801 Ca 0.72 0.49 -0.08 0.00 0.02 0.00 0.00 54.13 55.28 2qrv s LEU 801 Cb -0.44 -2.65 0.03 0.00 0.02 0.00 0.00 46.19 43.14 2qrv s LEU 801 CO 0.50 -2.58 0.25 0.00 0.02 0.00 0.00 176.35 174.54 2qrv s ALA 802 N -3.70 -0.61 0.76 4.21 0.00 -1.26 -5.12 121.76 116.04 2qrv s ALA 802 Ca 0.70 0.78 -0.11 0.00 0.00 0.00 0.00 51.96 53.32 2qrv s ALA 802 Cb -0.07 -0.46 0.05 0.00 0.00 0.00 0.00 23.12 22.63 2qrv s ALA 802 CO 0.52 -0.14 1.08 -1.54 0.00 0.00 0.00 175.76 175.69 2qrv s SER 803 N 0.40 4.82 0.21 0.00 1.04 -1.26 -4.98 113.70 113.93 2qrv s SER 803 Ca -0.02 1.45 0.09 0.00 0.48 0.00 0.00 55.95 57.96 2qrv s SER 803 Cb -0.04 -2.24 -0.05 0.00 0.10 0.00 0.00 66.02 63.79 2qrv s SER 803 CO -0.02 -1.78 -0.18 -0.89 0.98 0.00 0.00 173.24 171.35 2qrv s THR 804 N -3.10 2.01 0.50 2.02 2.01 -1.26 -4.98 115.64 112.84 2qrv s THR 804 Ca 0.60 -2.16 0.28 0.00 0.31 0.00 0.00 61.69 60.71 2qrv s THR 804 Cb -0.14 -2.06 0.46 0.00 0.01 0.00 0.00 72.50 70.77 2qrv s THR 804 CO 0.55 -0.42 1.86 0.58 -0.69 0.00 0.00 174.62 176.50 2qrv h VAL 805 N 2.75 0.56 -3.62 3.82 2.07 -2.05 -3.18 116.25 116.60 2qrv h VAL 805 Ca -0.41 -0.05 -0.68 0.00 0.82 0.00 0.00 66.70 66.39 2qrv h VAL 805 Cb 1.23 0.41 -0.37 0.00 -1.52 0.00 0.00 31.29 31.03 2qrv h VAL 805 CO 0.57 0.02 -0.65 0.54 0.02 0.00 0.00 177.57 178.07 2qrv s ASN 806 N -5.53 4.96 -0.34 0.57 4.22 -1.26 -4.98 114.94 112.58 2qrv s ASN 806 Ca -0.06 -2.04 -0.07 0.00 -2.14 0.00 0.00 52.86 48.56 2qrv s ASN 806 Cb 0.22 -1.71 0.19 0.00 1.28 0.00 0.00 41.25 41.23 2qrv s ASN 806 CO 0.78 -0.43 1.00 -1.81 -2.04 0.00 0.00 177.10 174.60 2qrv s ASP 807 N 1.30 -0.47 -0.47 3.54 -0.00 -1.20 -5.11 116.67 114.26 2qrv s ASP 807 Ca 0.08 -0.29 -0.28 0.00 -0.00 0.00 0.00 52.55 52.06 2qrv s ASP 807 Cb -0.21 0.61 -0.09 0.00 -0.00 0.00 0.00 42.92 43.23 2qrv s ASP 807 CO -0.06 -0.05 2.38 0.29 -0.00 0.00 0.00 175.17 177.73 2qrv n LYS 808 N 3.59 1.12 -0.01 8.23 4.76 -1.26 -4.76 118.16 129.83 2qrv n LYS 808 Ca 0.07 0.16 0.07 0.00 -2.87 0.00 0.00 58.31 55.73 2qrv n LYS 808 Cb 0.63 -3.02 -0.14 0.00 -1.84 0.00 0.00 35.03 30.65 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 13.47 0.14 -4.69 -0.35 4.32 -1.26 -2.17 117.00 126.46 2qrv n LEU 809 Ca 0.40 0.06 -0.37 0.00 -0.02 0.00 0.00 56.01 56.07 2qrv n LEU 809 Cb 0.42 0.09 -0.07 0.00 -1.62 0.00 0.00 43.42 42.23 2qrv n LEU 809 CO 0.73 0.08 0.05 -1.61 -1.22 0.00 0.00 177.39 175.42 2qrv s GLU 810 N -3.28 4.21 0.59 3.23 2.02 -1.26 -3.41 118.70 120.79 2qrv s GLU 810 Ca -0.07 0.16 0.29 0.00 0.02 0.00 0.00 54.97 55.37 2qrv s GLU 810 Cb 0.12 -3.49 1.61 0.00 0.10 0.00 0.00 34.13 32.47 2qrv s GLU 810 CO 0.88 0.08 2.03 1.25 0.02 0.00 0.00 175.26 179.52 2qrv h LEU 811 N 7.22 0.00 -0.82 1.80 5.85 -1.24 0.34 115.31 128.47 2qrv h LEU 811 Ca -0.38 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.25 2qrv h LEU 811 Cb 1.16 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2qrv h LEU 811 CO 0.73 0.00 -0.06 -0.61 -0.34 0.00 0.00 178.44 178.16 2qrv h GLN 812 N 0.00 0.82 0.00 1.25 5.75 -1.83 -2.48 115.11 118.63 2qrv h GLN 812 Ca 0.12 -0.26 0.00 0.00 -0.15 0.00 0.00 58.65 58.36 2qrv h GLN 812 Cb 0.70 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.17 2qrv h GLN 812 CO -0.00 0.87 0.00 0.39 -2.65 0.00 0.00 178.83 177.44 2qrv n GLU 813 N -4.18 0.57 -0.04 1.69 4.71 0.12 -2.68 120.64 120.84 2qrv n GLU 813 Ca 0.02 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.13 2qrv n GLU 813 Cb 0.34 -1.09 -0.04 0.00 -1.01 0.00 0.00 31.44 29.63 2qrv n GLU 813 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qrv n LEU 815 N -2.47 1.86 -4.93 0.00 4.77 -1.09 -4.50 117.00 110.63 2qrv n LEU 815 Ca -0.12 0.34 -0.25 0.00 -0.03 0.00 0.00 56.01 55.94 2qrv n LEU 815 Cb 0.68 -1.38 0.02 0.00 -2.33 0.00 0.00 43.42 40.42 2qrv n LEU 815 CO 0.11 -2.67 0.42 -0.70 -1.33 0.00 0.00 177.39 173.22 2qrv s GLU 816 N -4.32 3.01 0.22 3.23 2.56 -1.26 -5.00 118.70 117.14 2qrv s GLU 816 Ca 0.64 -0.21 -0.31 0.00 0.00 0.00 0.00 54.97 55.08 2qrv s GLU 816 Cb -0.22 -2.40 -0.14 0.00 2.00 0.00 0.00 34.13 33.36 2qrv s GLU 816 CO 0.61 -0.49 1.24 1.58 -0.56 0.00 0.00 175.26 177.64 2qrv n HIS 817 N -2.35 1.66 -0.64 5.30 -0.00 -1.26 -3.03 115.22 114.89 2qrv n HIS 817 Ca 0.03 0.58 0.00 0.00 -0.00 0.00 0.00 57.72 58.33 2qrv n HIS 817 Cb 0.57 -2.35 0.00 0.00 -0.00 0.00 0.00 29.99 28.22 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 1.91 0.62 3.05 1.57 0.00 -1.26 -5.07 105.19 106.01 2qrv n GLY 818 Ca 0.13 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.14 0.61 -0.05 1.61 0.52 -1.17 -4.32 118.95 115.01 2qrv s ARG 819 Ca 0.00 -0.57 0.04 0.00 -0.52 0.00 0.00 55.73 54.69 2qrv s ARG 819 Cb 0.00 -0.52 -0.02 0.00 0.52 0.00 0.00 34.95 34.93 2qrv s ARG 819 CO 0.00 0.12 -0.18 0.42 0.02 0.00 0.00 175.30 175.68 2qrv s ILE 820 N -0.81 2.69 0.08 1.52 1.09 -0.80 -4.86 121.20 120.12 2qrv s ILE 820 Ca -0.03 -0.85 -0.17 0.00 -1.10 0.00 0.00 60.65 58.50 2qrv s ILE 820 Cb -0.07 -2.03 -0.07 0.00 -1.06 0.00 0.00 42.46 39.24 2qrv s ILE 820 CO 0.00 0.58 0.54 0.00 -0.10 0.00 0.00 174.94 175.96 2qrv s ALA 821 N -0.49 3.60 -0.11 9.38 0.00 -1.26 -1.64 121.76 131.24 2qrv s ALA 821 Ca 0.06 -0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.93 2qrv s ALA 821 Cb -0.12 -2.58 -0.05 0.00 0.00 0.00 0.00 23.12 20.38 2qrv s ALA 821 CO 0.01 0.42 0.10 0.87 0.00 0.00 0.00 175.76 177.17 2qrv h LYS 822 N 4.32 0.00 -7.18 0.00 1.57 -1.93 -3.48 116.57 109.87 2qrv h LYS 822 Ca -0.50 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 57.82 2qrv h LYS 822 Cb 1.21 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.61 2qrv h LYS 822 CO 0.64 0.17 0.14 -0.06 -0.57 0.00 0.00 179.45 179.76 2qrv s PHE 823 N -1.74 1.93 -0.12 -1.35 0.08 -1.26 -5.01 117.98 110.52 2qrv s PHE 823 Ca -0.05 -0.08 0.20 0.00 0.12 0.00 0.00 56.93 57.12 2qrv s PHE 823 Cb -0.00 -3.11 -0.22 0.00 -0.57 0.00 0.00 43.02 39.12 2qrv s PHE 823 CO 0.14 -1.67 0.59 0.45 -0.10 0.00 0.00 175.22 174.63 2qrv n SER 824 N -2.88 0.34 -3.71 1.36 2.88 -1.26 -4.58 113.62 105.76 2qrv n SER 824 Ca 0.13 0.14 -0.13 0.00 -1.33 0.00 0.00 58.87 57.68 2qrv n SER 824 Cb 0.60 1.17 -0.10 0.00 -0.75 0.00 0.00 64.21 65.14 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 -3.20 0.53 0.65 -1.46 1.02 -1.26 -0.85 119.74 115.17 2qrv s LYS 825 Ca -0.06 0.70 -0.13 0.00 0.02 0.00 0.00 55.97 56.50 2qrv s LYS 825 Cb 0.11 0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 37.62 2qrv s LYS 825 CO 0.85 -0.08 1.06 0.14 -0.92 0.00 0.00 175.35 176.40 2qrv s VAL 826 N 0.48 3.95 0.00 3.17 -7.23 -0.69 -4.89 120.40 115.19 2qrv s VAL 826 Ca -0.02 0.76 0.00 0.00 -1.81 0.00 0.00 61.98 60.91 2qrv s VAL 826 Cb -0.04 -3.40 0.00 0.00 0.56 0.00 0.00 36.38 33.50 2qrv s VAL 826 CO -0.02 -0.71 0.00 -2.11 -0.31 0.00 0.00 175.10 171.95 2qrv n ARG 827 N -2.64 0.00 -0.26 4.82 0.00 -1.26 -1.71 116.66 115.61 2qrv n ARG 827 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.93 2qrv n ARG 827 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.99 2qrv n ARG 827 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2qrv n GLN 842 N -2.13 0.00 0.00 2.89 7.27 -1.26 -4.99 117.38 119.16 2qrv n GLN 842 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2qrv n GLN 842 Cb 0.00 -0.27 0.00 0.00 2.41 0.00 0.00 30.24 32.38 2qrv n GLN 842 CO 0.00 0.00 0.00 -2.39 0.07 0.00 0.00 177.06 174.74 2qrv n HIS 843 N -0.23 0.00 1.63 3.69 1.44 -1.26 -4.80 115.22 115.69 2qrv n HIS 843 Ca 0.00 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.80 2qrv n HIS 843 Cb 0.05 0.00 0.53 0.00 0.12 0.00 0.00 29.99 30.69 2qrv n HIS 843 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2qrv n PHE 844 N -0.57 0.00 0.00 -1.40 3.01 -1.26 -4.95 117.46 112.28 2qrv n PHE 844 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2qrv n PHE 844 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 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 -0.84 0.00 -3.57 -1.08 -0.02 -1.26 -3.04 135.00 125.19 2qrv n PRO 845 Ca 0.13 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.45 2qrv n PRO 845 Cb 0.06 -1.05 -0.07 0.00 -0.02 0.00 0.00 33.50 32.43 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 -0.25 0.00 0.19 -1.45 -7.23 -1.16 -3.30 120.40 107.19 2qrv s VAL 846 Ca 0.00 -0.03 0.06 0.00 -1.81 0.00 0.00 61.98 60.20 2qrv s VAL 846 Cb 0.00 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.94 2qrv s VAL 846 CO 0.00 -0.02 0.12 0.72 -0.31 0.00 0.00 175.10 175.61 2qrv s PHE 847 N -0.70 3.07 -0.16 2.82 -0.71 -0.65 -1.43 117.98 120.21 2qrv s PHE 847 Ca -0.08 -0.06 -0.08 0.00 -1.04 0.00 0.00 56.93 55.67 2qrv s PHE 847 Cb -0.02 -1.46 0.06 0.00 -1.21 0.00 0.00 43.02 40.40 2qrv s PHE 847 CO 0.07 0.52 0.38 1.41 -1.34 0.00 0.00 175.22 176.26 2qrv s MET 848 N -3.24 0.34 -0.85 1.99 0.00 0.34 -1.90 119.30 115.97 2qrv s MET 848 Ca 0.31 0.78 -0.02 0.00 0.00 0.00 0.00 55.69 56.76 2qrv s MET 848 Cb -0.09 0.01 0.02 0.00 0.00 0.00 0.00 34.83 34.76 2qrv s MET 848 CO 0.23 -0.18 0.05 0.09 0.00 0.00 0.00 175.02 175.21 2qrv n ASN 849 N 4.47 0.29 0.00 1.11 4.13 -1.26 0.21 115.26 124.20 2qrv n ASN 849 Ca -0.21 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.37 2qrv n ASN 849 Cb 0.54 -0.85 0.00 0.00 -1.54 0.00 0.00 39.78 37.93 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 -2.83 0.00 -4.36 3.52 1.02 -1.26 -5.05 120.64 111.67 2qrv n GLU 850 Ca -0.14 0.02 -0.22 0.00 -0.02 0.00 0.00 57.16 56.81 2qrv n GLU 850 Cb 0.35 -2.38 -0.13 0.00 -0.02 0.00 0.00 31.44 29.26 2qrv n GLU 850 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2qrv s LYS 851 N -0.31 1.04 -0.22 3.49 1.02 0.56 -5.12 119.74 120.20 2qrv s LYS 851 Ca 0.00 -0.92 -0.15 0.00 0.02 0.00 0.00 55.97 54.92 2qrv s LYS 851 Cb 0.00 -1.12 -0.04 0.00 -0.52 0.00 0.00 37.83 36.14 2qrv s LYS 851 CO 0.00 0.27 0.34 -2.00 -0.92 0.00 0.00 175.35 173.04 2qrv s GLU 852 N -1.43 4.13 0.16 1.68 2.12 -1.26 0.13 118.70 124.22 2qrv s GLU 852 Ca 0.03 0.08 0.01 0.00 0.36 0.00 0.00 54.97 55.45 2qrv s GLU 852 Cb -0.09 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.71 2qrv s GLU 852 CO 0.02 -0.04 0.02 0.34 -0.54 0.00 0.00 175.26 175.06 2qrv s ASP 853 N 1.11 0.92 0.58 -1.70 3.68 -0.52 -4.95 116.67 115.79 2qrv s ASP 853 Ca 0.16 -1.19 -0.07 0.00 2.13 0.00 0.00 52.55 53.58 2qrv s ASP 853 Cb -0.15 0.18 -0.01 0.00 -1.45 0.00 0.00 42.92 41.50 2qrv s ASP 853 CO 0.07 -0.63 0.91 -0.63 0.13 0.00 0.00 175.17 175.03 2qrv s ILE 854 N -3.79 4.01 0.27 4.11 1.01 -1.17 -3.00 121.20 122.64 2qrv s ILE 854 Ca 0.24 0.18 -0.30 0.00 0.00 0.00 0.00 60.65 60.78 2qrv s ILE 854 Cb 0.07 -3.58 -0.10 0.00 0.01 0.00 0.00 42.46 38.85 2qrv s ILE 854 CO 0.03 -0.63 1.41 -0.76 0.00 0.00 0.00 174.94 174.99 2qrv s LEU 855 N -5.00 4.39 0.68 2.97 1.43 -1.24 -4.84 118.68 117.07 2qrv s LEU 855 Ca 0.53 2.67 -0.11 0.00 -1.03 0.00 0.00 54.13 56.19 2qrv s LEU 855 Cb -0.11 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.48 2qrv s LEU 855 CO 0.47 -0.67 1.06 0.26 0.23 0.00 0.00 176.35 177.70 2qrv s TRP 856 N -0.24 3.36 0.12 0.29 0.51 -1.26 -4.90 118.94 116.82 2qrv s TRP 856 Ca 0.57 1.23 -0.12 0.00 -2.12 0.00 0.00 56.10 55.67 2qrv s TRP 856 Cb -0.41 -2.89 -0.09 0.00 -0.81 0.00 0.00 33.47 29.26 2qrv s TRP 856 CO 0.45 -1.05 1.39 0.00 -0.51 0.00 0.00 176.95 177.24 2qrv h THR 858 N 0.66 0.51 -0.82 0.00 1.35 -1.98 0.47 112.91 113.10 2qrv h THR 858 Ca 0.00 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 65.95 2qrv h THR 858 Cb 1.19 0.51 -0.07 0.00 -1.73 0.00 0.00 68.15 68.06 2qrv h THR 858 CO 0.13 0.00 0.48 -0.33 -0.25 0.00 0.00 175.52 175.54 2qrv h GLU 859 N -0.19 0.79 -0.15 4.72 5.08 -1.74 0.19 114.58 123.29 2qrv h GLU 859 Ca 0.13 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 2qrv h GLU 859 Cb 0.38 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2qrv h GLU 859 CO -0.32 0.53 -0.26 1.98 -1.00 0.00 0.00 179.01 179.93 2qrv h MET 860 N 0.82 0.27 -0.03 2.33 4.05 0.31 0.48 114.93 123.16 2qrv h MET 860 Ca 0.38 -0.09 -0.00 0.00 -0.28 0.00 0.00 59.70 59.71 2qrv h MET 860 Cb 0.31 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.09 2qrv h MET 860 CO -0.23 0.52 0.01 0.93 0.23 0.00 0.00 176.91 178.37 2qrv h GLU 861 N 0.24 0.04 0.00 0.39 5.08 0.16 -1.23 114.58 119.27 2qrv h GLU 861 Ca 0.04 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2qrv h GLU 861 Cb 0.60 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2qrv h GLU 861 CO 0.04 0.22 -0.00 0.00 -1.00 0.00 0.00 179.01 178.27 2qrv h ARG 862 N -0.14 0.00 0.00 2.33 3.08 0.37 -0.69 114.38 119.33 2qrv h ARG 862 Ca 0.01 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.95 2qrv h ARG 862 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2qrv h ARG 862 CO -0.00 0.00 -0.65 0.28 -1.07 0.00 0.00 179.97 178.53 2qrv h VAL 863 N 0.00 0.80 0.00 2.04 2.07 0.11 -3.27 116.25 118.00 2qrv h VAL 863 Ca -0.00 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.35 2qrv h VAL 863 Cb 0.02 2.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 2qrv h VAL 863 CO 0.00 0.45 -0.97 0.49 0.02 0.00 0.00 177.57 177.57 2qrv n PHE 864 N -3.17 0.02 -1.17 1.57 3.01 -0.57 -4.28 117.46 112.87 2qrv n PHE 864 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 2qrv n PHE 864 Cb 0.75 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 40.12 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 1.48 0.53 3.68 1.37 0.00 -0.40 -0.78 105.19 111.06 2qrv n GLY 865 Ca 0.04 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.18 2.80 0.87 1.61 0.08 -0.43 -4.36 117.98 116.37 2qrv s PHE 866 Ca 0.00 -0.18 -0.10 0.00 0.12 0.00 0.00 56.93 56.77 2qrv s PHE 866 Cb 0.00 -1.28 0.12 0.00 -0.57 0.00 0.00 43.02 41.29 2qrv s PHE 866 CO 0.00 0.57 1.14 -2.14 -0.10 0.00 0.00 175.22 174.69 2qrv s PRO 867 N -3.47 1.38 0.35 0.24 0.02 -1.26 -4.24 135.00 128.03 2qrv s PRO 867 Ca 0.30 1.47 -0.26 0.00 0.02 0.00 0.00 61.00 62.53 2qrv s PRO 867 Cb -0.08 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.58 2qrv s PRO 867 CO 0.20 -2.35 1.07 0.08 -0.33 0.00 0.00 177.00 175.68 2qrv s VAL 868 N -2.67 3.59 -1.27 3.83 1.01 -1.26 -2.66 120.40 120.97 2qrv s VAL 868 Ca 0.66 1.38 0.00 0.00 0.00 0.00 0.00 61.98 64.02 2qrv s VAL 868 Cb -0.22 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.37 2qrv s VAL 868 CO 0.57 0.16 0.00 1.41 0.00 0.00 0.00 175.10 177.24 2qrv n HIS 869 N 0.45 0.00 0.06 5.22 8.25 -1.26 -4.88 115.22 123.06 2qrv n HIS 869 Ca 0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2qrv n HIS 869 Cb 0.47 -2.30 0.26 0.00 1.12 0.00 0.00 29.99 29.54 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 0.41 -0.59 4.41 3.20 -1.87 -2.76 116.97 119.76 2qrv h TYR 870 Ca -0.25 -0.08 -0.20 0.00 3.14 0.00 0.00 58.73 61.35 2qrv h TYR 870 Cb 0.86 -0.10 -0.12 0.00 1.54 0.00 0.00 36.73 38.91 2qrv h TYR 870 CO 0.38 0.59 0.19 0.25 -1.64 0.00 0.00 178.16 177.93 2qrv n THR 871 N -4.14 2.76 -2.49 1.81 -2.24 -1.26 -4.75 114.28 103.97 2qrv n THR 871 Ca -0.01 -1.95 -0.43 0.00 -2.27 0.00 0.00 64.05 59.40 2qrv n THR 871 Cb 0.38 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 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 -0.53 5.25 -4.18 3.42 4.64 -1.04 -4.92 116.55 119.19 2qrv n ASP 872 Ca 0.38 -3.13 -0.11 0.00 -1.38 0.00 0.00 54.79 50.55 2qrv n ASP 872 Cb 1.25 -1.47 -0.10 0.00 -1.04 0.00 0.00 41.12 39.77 2qrv n ASP 872 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 2qrv s VAL 873 N 0.18 0.72 0.00 5.18 -7.23 -1.26 -5.10 120.40 112.88 2qrv s VAL 873 Ca 0.39 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 2qrv s VAL 873 Cb 0.07 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 35.30 2qrv s VAL 873 CO 0.01 -0.85 0.00 -1.54 -0.31 0.00 0.00 175.10 172.42 2qrv n SER 874 N -0.06 -4.22 -1.16 4.85 3.41 -1.26 -4.28 113.62 110.90 2qrv n SER 874 Ca -0.12 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.49 2qrv n SER 874 Cb 0.61 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.69 2qrv n SER 874 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2qrv n ASN 875 N -2.32 2.22 -4.63 4.04 3.02 -1.26 -5.07 115.26 111.27 2qrv n ASN 875 Ca 0.00 -3.45 -0.30 0.00 -0.03 0.00 0.00 54.58 50.80 2qrv n ASN 875 Cb 0.00 -0.45 0.18 0.00 -0.61 0.00 0.00 39.78 38.90 2qrv n ASN 875 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qrv s MET 876 N -2.80 0.52 0.72 3.52 0.23 -1.26 -4.99 119.30 115.24 2qrv s MET 876 Ca 0.39 1.15 -0.11 0.00 -1.03 0.00 0.00 55.69 56.09 2qrv s MET 876 Cb 0.38 -1.70 0.03 0.00 -1.53 0.00 0.00 34.83 32.01 2qrv s MET 876 CO -0.06 -2.84 1.09 -1.54 -2.03 0.00 0.00 175.02 169.64 2qrv s SER 877 N -2.83 5.26 0.21 -1.18 1.04 -1.26 -4.84 113.70 110.10 2qrv s SER 877 Ca 0.66 1.01 -0.10 0.00 0.48 0.00 0.00 55.95 58.00 2qrv s SER 877 Cb -0.22 -1.76 0.17 0.00 0.10 0.00 0.00 66.02 64.31 2qrv s SER 877 CO 0.60 -1.44 1.87 -0.09 0.98 0.00 0.00 173.24 175.16 2qrv h ARG 878 N -0.69 0.95 -0.93 4.02 2.43 -1.98 0.88 114.38 119.06 2qrv h ARG 878 Ca -0.45 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.65 2qrv h ARG 878 Cb 1.27 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 2qrv h ARG 878 CO 0.64 0.63 0.54 -0.07 -1.51 0.00 0.00 179.97 180.20 2qrv h LEU 879 N 0.98 1.13 0.00 3.80 3.38 -1.99 0.79 115.31 123.40 2qrv h LEU 879 Ca 0.28 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2qrv h LEU 879 Cb -0.07 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.39 2qrv h LEU 879 CO -0.08 0.88 0.00 0.00 0.09 0.00 0.00 178.44 179.34 2qrv n ALA 880 N -2.40 -0.38 -0.23 1.53 0.00 -0.56 -1.77 120.51 116.69 2qrv n ALA 880 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.49 2qrv n ALA 880 Cb 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.48 2qrv n ALA 880 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qrv n ARG 881 N -1.91 -0.23 -0.16 0.00 5.12 0.20 0.12 116.66 119.79 2qrv n ARG 881 Ca 0.00 0.86 -0.09 0.00 -1.93 0.00 0.00 57.85 56.69 2qrv n ARG 881 Cb 0.00 -1.26 -0.03 0.00 -1.16 0.00 0.00 32.46 30.00 2qrv n ARG 881 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 2qrv h GLN 882 N 0.00 -0.26 -1.02 5.56 4.15 -0.80 0.50 115.11 123.25 2qrv h GLN 882 Ca 0.11 0.02 0.25 0.00 0.77 0.00 0.00 58.65 59.80 2qrv h GLN 882 Cb 0.25 0.06 -0.09 0.00 0.21 0.00 0.00 27.48 27.91 2qrv h GLN 882 CO -0.54 -0.17 0.66 -0.09 -1.93 0.00 0.00 178.83 176.76 2qrv h ARG 883 N -0.27 0.37 0.00 1.69 2.43 0.17 1.87 114.38 120.64 2qrv h ARG 883 Ca 0.16 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2qrv h ARG 883 Cb 0.57 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2qrv h ARG 883 CO -0.62 0.25 0.00 1.28 -1.51 0.00 0.00 179.97 179.36 2qrv n LEU 884 N -4.58 0.00 -0.29 3.80 4.32 0.17 -2.62 117.00 117.81 2qrv n LEU 884 Ca 0.24 0.05 0.28 0.00 -0.02 0.00 0.00 56.01 56.57 2qrv n LEU 884 Cb 0.85 0.00 0.51 0.00 -1.62 0.00 0.00 43.42 43.16 2qrv n LEU 884 CO 0.27 0.00 0.92 0.18 -1.22 0.00 0.00 177.39 177.55 2qrv n LEU 885 N -0.05 0.28 -0.22 2.23 4.77 -0.92 -0.68 117.00 122.40 2qrv n LEU 885 Ca 0.00 1.38 -0.02 0.00 -0.03 0.00 0.00 56.01 57.34 2qrv n LEU 885 Cb 0.00 -0.67 0.04 0.00 -2.33 0.00 0.00 43.42 40.46 2qrv n LEU 885 CO 0.00 -1.54 0.68 1.23 -1.33 0.00 0.00 177.39 176.43 2qrv h GLY 886 N 0.00 0.20 -2.94 -0.72 0.00 0.30 -2.48 103.07 97.43 2qrv h GLY 886 Ca 0.73 0.33 -0.28 0.00 0.00 0.00 0.00 47.33 48.11 2qrv h GLY 886 CO -0.62 -0.24 0.23 -0.96 0.00 0.00 0.00 176.54 174.96 2qrv n ARG 887 N -5.45 2.46 -1.07 4.80 1.85 0.14 -5.01 116.66 114.38 2qrv n ARG 887 Ca 0.07 -3.08 -0.05 0.00 -1.00 0.00 0.00 57.85 53.79 2qrv n ARG 887 Cb 0.36 -2.02 0.03 0.00 -1.05 0.00 0.00 32.46 29.78 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 -0.88 0.31 -4.83 2.89 3.41 -0.94 -5.07 113.62 108.51 2qrv n SER 888 Ca 0.42 -1.26 -0.37 0.00 -0.26 0.00 0.00 58.87 57.40 2qrv n SER 888 Cb 1.30 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 65.04 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 -0.49 3.62 -0.39 7.33 0.51 -1.26 -5.03 118.94 123.23 2qrv s TRP 889 Ca 0.15 0.71 -0.28 0.00 -2.12 0.00 0.00 56.10 54.56 2qrv s TRP 889 Cb -0.01 -2.16 -0.01 0.00 -0.81 0.00 0.00 33.47 30.48 2qrv s TRP 889 CO 0.10 0.59 1.74 0.45 -0.51 0.00 0.00 176.95 179.32 2qrv s SER 890 N -0.71 5.87 0.30 2.95 0.15 -1.26 -4.87 113.70 116.14 2qrv s SER 890 Ca 0.18 1.07 0.04 0.00 0.70 0.00 0.00 55.95 57.95 2qrv s SER 890 Cb -0.14 -2.53 0.80 0.00 -1.71 0.00 0.00 66.02 62.44 2qrv s SER 890 CO 0.07 -1.76 1.62 0.58 1.20 0.00 0.00 173.24 174.95 2qrv h VAL 891 N 6.76 0.20 -0.52 4.45 2.07 -1.16 0.15 116.25 128.20 2qrv h VAL 891 Ca -0.31 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.21 2qrv h VAL 891 Cb 1.16 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2qrv h VAL 891 CO 1.07 0.02 0.35 -0.65 0.02 0.00 0.00 177.57 178.38 2qrv h PRO 892 N 0.13 0.50 0.06 1.57 0.11 -1.83 0.27 132.00 132.81 2qrv h PRO 892 Ca 0.60 -0.03 -0.25 0.00 0.11 0.00 0.00 66.00 66.43 2qrv h PRO 892 Cb 1.28 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 2qrv h PRO 892 CO -0.74 0.33 -1.18 0.28 -0.21 0.00 0.00 178.00 176.48 2qrv h VAL 893 N 0.51 1.54 0.00 3.15 2.07 -1.07 -1.38 116.25 121.07 2qrv h VAL 893 Ca 0.22 -3.19 -0.16 0.00 0.82 0.00 0.00 66.70 64.39 2qrv h VAL 893 Cb 0.23 2.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.84 2qrv h VAL 893 CO -0.06 0.91 -0.75 0.40 0.02 0.00 0.00 177.57 178.09 2qrv h ILE 894 N 0.03 1.30 0.18 4.57 1.08 -0.80 0.46 117.51 124.34 2qrv h ILE 894 Ca -0.09 -2.80 -0.01 0.00 -0.39 0.00 0.00 64.86 61.57 2qrv h ILE 894 Cb 1.88 2.61 0.00 0.00 -3.07 0.00 0.00 36.82 38.25 2qrv h ILE 894 CO 0.16 0.73 -0.09 -0.09 -0.69 0.00 0.00 178.15 178.17 2qrv h ARG 895 N 0.00 -0.24 -0.30 2.37 2.43 -0.48 0.53 114.38 118.69 2qrv h ARG 895 Ca -0.01 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.25 2qrv h ARG 895 Cb 1.55 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 31.08 2qrv h ARG 895 CO 0.10 0.04 -0.26 1.25 -1.51 0.00 0.00 179.97 179.60 2qrv h HIS 896 N -0.51 -0.68 0.33 2.20 2.76 -1.14 0.60 115.15 118.71 2qrv h HIS 896 Ca -0.03 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2qrv h HIS 896 Cb 0.39 0.35 -0.00 0.00 1.55 0.00 0.00 27.41 29.69 2qrv h HIS 896 CO 0.01 -0.33 -0.20 -0.07 -1.30 0.00 0.00 177.93 176.04 2qrv h LEU 897 N -0.23 -0.51 -0.83 0.26 3.38 0.12 -3.23 115.31 114.27 2qrv h LEU 897 Ca 0.15 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 2qrv h LEU 897 Cb 0.48 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2qrv h LEU 897 CO -0.44 -0.33 -0.26 -0.26 0.09 0.00 0.00 178.44 177.25 2qrv h PHE 898 N -0.51 0.65 -0.18 1.13 0.05 0.37 -3.37 116.94 115.09 2qrv h PHE 898 Ca -0.03 -0.15 0.02 0.00 3.82 0.00 0.00 57.97 61.63 2qrv h PHE 898 Cb 0.42 -0.16 -0.02 0.00 2.00 0.00 0.00 35.95 38.20 2qrv h PHE 898 CO -0.09 0.78 -0.10 0.00 -0.18 0.00 0.00 178.31 178.72 2qrv n ALA 899 N -2.49 -0.11 0.43 2.45 0.00 0.21 0.78 120.51 121.79 2qrv n ALA 899 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2qrv n ALA 899 Cb 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 -4.22 0.40 -0.02 0.00 -0.04 -1.26 -2.28 135.00 127.58 2qrv n PRO 900 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.37 2qrv n PRO 900 Cb 0.05 -1.18 -0.14 0.00 -0.04 0.00 0.00 33.50 32.19 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 0.55 0.05 -1.76 1.53 3.38 0.06 -3.36 115.31 115.75 2qrv h LEU 901 Ca 0.00 -0.10 0.48 0.00 0.09 0.00 0.00 57.88 58.35 2qrv h LEU 901 Cb 0.18 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.82 2qrv h LEU 901 CO 0.00 1.09 1.11 0.11 0.09 0.00 0.00 178.44 180.84 2qrv h LYS 902 N 0.01 0.03 -0.00 1.13 1.57 -1.64 1.19 116.57 118.86 2qrv h LYS 902 Ca -0.29 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2qrv h LYS 902 Cb 2.01 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.31 2qrv h LYS 902 CO 0.08 0.02 -0.08 0.39 -0.57 0.00 0.00 179.45 179.29 2qrv n GLU 903 N -4.28 0.40 -0.06 3.15 -0.58 -1.26 -3.97 120.64 114.04 2qrv n GLU 903 Ca 0.39 -0.08 0.03 0.00 -0.42 0.00 0.00 57.16 57.07 2qrv n GLU 903 Cb 1.67 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 31.10 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 -1.22 0.16 -3.86 -0.32 4.02 0.41 -5.04 117.16 111.31 2qrv n TYR 904 Ca 0.12 -0.36 -0.09 0.00 -0.01 0.00 0.00 57.90 57.56 2qrv n TYR 904 Cb 0.28 -0.03 -0.07 0.00 -0.02 0.00 0.00 39.34 39.50 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 -0.85 0.14 0.75 -0.72 0.40 -1.20 -4.74 117.98 111.76 2qrv s PHE 905 Ca 0.10 -0.54 -0.16 0.00 -0.60 0.00 0.00 56.93 55.73 2qrv s PHE 905 Cb 0.06 -0.06 -0.04 0.00 0.51 0.00 0.00 43.02 43.48 2qrv s PHE 905 CO 0.07 -0.52 0.43 0.00 0.70 0.00 0.00 175.22 175.90 2qrv n ALA 906 N 0.06 -1.86 -2.59 5.36 0.00 0.32 -4.87 120.51 116.93 2qrv n ALA 906 Ca -0.16 -0.29 -0.22 0.00 0.00 0.00 0.00 53.44 52.78 2qrv n ALA 906 Cb 0.62 -1.80 -0.14 0.00 0.00 0.00 0.00 19.45 18.13 2qrv n ALA 906 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50