#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o9k h THR 645 N 0.00 0.76 -0.89 2.46 2.02 -2.04 -1.83 112.91 113.39 1o9k h THR 645 Ca 0.00 -0.22 0.01 0.00 0.77 0.00 0.00 66.41 66.97 1o9k h THR 645 Cb 0.00 0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 66.45 1o9k h THR 645 CO 0.00 0.11 0.58 0.77 0.37 0.00 0.00 175.52 177.35 1o9k h SER 646 N 0.63 1.03 -0.16 4.18 4.64 -2.05 0.27 113.55 122.09 1o9k h SER 646 Ca 0.43 -0.04 -0.17 0.00 -0.47 0.00 0.00 61.79 61.54 1o9k h SER 646 Cb 0.57 -0.26 0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1o9k h SER 646 CO -0.34 0.76 -0.58 0.25 -0.87 0.00 0.00 176.83 176.05 1o9k h LEU 647 N 1.21 0.78 -0.68 5.97 5.85 -1.84 -1.89 115.31 124.71 1o9k h LEU 647 Ca 0.32 -0.61 -0.13 0.00 0.84 0.00 0.00 57.88 58.31 1o9k h LEU 647 Cb -0.12 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.67 1o9k h LEU 647 CO -0.07 1.26 -0.60 0.77 -0.34 0.00 0.00 178.44 179.46 1o9k h SER 648 N 0.35 0.00 -0.15 1.25 4.64 -1.16 -0.99 113.55 117.49 1o9k h SER 648 Ca -0.03 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.14 1o9k h SER 648 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1o9k h SER 648 CO 0.12 0.60 -0.46 0.25 -0.87 0.00 0.00 176.83 176.46 1o9k h LEU 649 N 0.00 0.77 0.67 5.97 7.12 -0.44 -1.41 115.31 127.99 1o9k h LEU 649 Ca -0.01 -0.38 -0.03 0.00 0.13 0.00 0.00 57.88 57.59 1o9k h LEU 649 Cb 1.14 -0.22 0.01 0.00 -0.53 0.00 0.00 40.66 41.06 1o9k h LEU 649 CO 0.08 1.12 -0.32 0.15 -0.13 0.00 0.00 178.44 179.33 1o9k h PHE 650 N 0.57 -0.83 -0.69 1.25 3.57 -1.13 -2.69 116.94 116.98 1o9k h PHE 650 Ca 0.03 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.58 1o9k h PHE 650 Cb 1.02 0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.99 1o9k h PHE 650 CO 0.05 -0.49 0.46 1.88 -2.23 0.00 0.00 178.31 177.98 1o9k h TYR 651 N -1.14 0.69 -0.67 0.41 0.05 -1.21 0.44 116.97 115.55 1o9k h TYR 651 Ca -0.09 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.63 1o9k h TYR 651 Cb 0.72 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.21 1o9k h TYR 651 CO 0.00 0.36 0.11 -0.22 -1.05 0.00 0.00 178.16 177.36 1o9k h LYS 652 N 0.68 1.10 -0.26 4.88 3.64 -1.24 -0.90 116.57 124.47 1o9k h LYS 652 Ca 0.30 -0.29 -0.18 0.00 -1.27 0.00 0.00 60.65 59.21 1o9k h LYS 652 Cb 0.31 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1o9k h LYS 652 CO -0.10 1.01 -0.54 0.87 -2.27 0.00 0.00 179.45 178.42 1o9k h LYS 653 N 1.02 0.79 -0.79 1.90 1.57 -0.96 -2.72 116.57 117.38 1o9k h LYS 653 Ca 0.20 -0.50 -0.01 0.00 -1.87 0.00 0.00 60.65 58.48 1o9k h LYS 653 Cb 0.44 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 1o9k h LYS 653 CO 0.01 1.12 0.46 0.28 -0.57 0.00 0.00 179.45 180.76 1o9k h VAL 654 N 0.61 1.22 -0.45 0.50 2.07 -0.73 -1.88 116.25 117.59 1o9k h VAL 654 Ca 0.01 -0.52 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 1o9k h VAL 654 Cb 1.13 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1o9k h VAL 654 CO 0.12 0.24 0.10 1.88 0.02 0.00 0.00 177.57 179.93 1o9k h TYR 655 N 1.09 0.77 -0.55 1.57 0.05 -1.09 -0.27 116.97 118.53 1o9k h TYR 655 Ca 0.28 -0.09 -0.08 0.00 0.05 0.00 0.00 58.73 58.88 1o9k h TYR 655 Cb -0.02 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.48 1o9k h TYR 655 CO 0.01 0.71 0.01 -0.09 -1.05 0.00 0.00 178.16 177.75 1o9k h ARG 656 N 0.60 0.93 -0.40 4.88 2.43 -1.25 -0.21 114.38 121.38 1o9k h ARG 656 Ca 0.14 -0.27 -0.15 0.00 -0.81 0.00 0.00 59.98 58.90 1o9k h ARG 656 Cb 0.33 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1o9k h ARG 656 CO 0.00 0.92 -0.33 1.25 -1.51 0.00 0.00 179.97 180.30 1o9k h LEU 657 N 0.86 0.95 -0.03 3.80 6.46 -1.18 -2.66 115.31 123.50 1o9k h LEU 657 Ca 0.16 -0.41 -0.01 0.00 -0.12 0.00 0.00 57.88 57.50 1o9k h LEU 657 Cb 0.49 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.16 1o9k h LEU 657 CO 0.02 1.19 -0.03 0.00 -0.62 0.00 0.00 178.44 179.00 1o9k h ALA 658 N 0.87 0.05 -0.02 1.25 0.00 -0.94 -3.16 119.26 117.30 1o9k h ALA 658 Ca 0.08 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.76 1o9k h ALA 658 Cb 0.90 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1o9k h ALA 658 CO 0.08 -0.18 -0.19 -0.92 0.00 0.00 0.00 179.25 178.04 1o9k h TYR 659 N -0.37 -0.50 -0.71 0.00 3.20 -1.07 -1.96 116.97 115.56 1o9k h TYR 659 Ca 0.01 0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.99 1o9k h TYR 659 Cb 0.52 0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.96 1o9k h TYR 659 CO 0.09 -0.27 0.47 -0.07 -1.64 0.00 0.00 178.16 176.74 1o9k h LEU 660 N -0.30 0.52 -0.44 2.82 3.38 -1.58 0.62 115.31 120.34 1o9k h LEU 660 Ca 0.06 0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 1o9k h LEU 660 Cb 0.38 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1o9k h LEU 660 CO -0.19 0.31 -0.69 0.03 0.09 0.00 0.00 178.44 177.99 1o9k h ARG 661 N 0.57 0.43 -0.15 1.13 3.08 -1.45 -2.83 114.38 115.17 1o9k h ARG 661 Ca 0.33 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1o9k h ARG 661 Cb 0.51 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 1o9k h ARG 661 CO -0.11 0.96 0.03 1.25 -1.07 0.00 0.00 179.97 181.03 1o9k h LEU 662 N 0.31 0.24 -0.37 3.04 6.46 -0.28 -2.48 115.31 122.23 1o9k h LEU 662 Ca -0.02 -0.24 0.05 0.00 -0.12 0.00 0.00 57.88 57.55 1o9k h LEU 662 Cb 1.25 -0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 41.07 1o9k h LEU 662 CO 0.12 0.42 0.08 -1.13 -0.62 0.00 0.00 178.44 177.30 1o9k h ASN 663 N 0.05 0.02 -0.27 1.25 -0.00 -0.97 0.24 115.58 115.89 1o9k h ASN 663 Ca 0.05 0.06 0.02 0.00 -0.00 0.00 0.00 56.30 56.43 1o9k h ASN 663 Cb 0.28 0.08 -0.02 0.00 -0.00 0.00 0.00 38.32 38.65 1o9k h ASN 663 CO 0.00 0.05 0.13 0.74 -0.00 0.00 0.00 177.43 178.35 1o9k h THR 664 N 0.20 0.98 0.00 -3.57 2.02 -1.41 0.35 112.91 111.49 1o9k h THR 664 Ca 0.17 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 67.20 1o9k h THR 664 Cb 0.20 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 1o9k h THR 664 CO -0.23 0.05 -0.28 -0.07 0.37 0.00 0.00 175.52 175.37 1o9k h LEU 665 N 0.27 0.00 0.09 2.58 3.38 -0.96 -3.08 115.31 117.59 1o9k h LEU 665 Ca 0.11 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.82 1o9k h LEU 665 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1o9k h LEU 665 CO -0.09 0.28 -1.24 0.00 0.09 0.00 0.00 178.44 177.48 1o9k n GLU 667 N -3.46 1.41 0.00 0.00 1.02 0.12 -1.96 120.64 117.77 1o9k n GLU 667 Ca -0.08 -0.42 0.00 0.00 -0.02 0.00 0.00 57.16 56.65 1o9k n GLU 667 Cb 1.01 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.97 1o9k n GLU 667 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1o9k n ARG 668 N 0.15 0.00 -0.00 3.49 0.63 -1.22 -4.86 116.66 114.85 1o9k n ARG 668 Ca 0.05 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 57.02 1o9k n ARG 668 Cb 0.47 -0.41 -0.05 0.00 0.45 0.00 0.00 32.46 32.92 1o9k n ARG 668 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1o9k n LEU 669 N -0.63 0.19 -1.09 6.15 4.32 -0.78 -4.72 117.00 120.45 1o9k n LEU 669 Ca 0.00 -0.28 0.05 0.00 -0.02 0.00 0.00 56.01 55.76 1o9k n LEU 669 Cb 0.00 0.00 0.08 0.00 -1.62 0.00 0.00 43.42 41.88 1o9k n LEU 669 CO 0.00 0.05 0.19 0.18 -1.22 0.00 0.00 177.39 176.59 1o9k n LEU 670 N -1.44 1.53 0.20 2.23 4.77 -0.83 -4.84 117.00 118.63 1o9k n LEU 670 Ca 0.00 -2.59 0.16 0.00 -0.03 0.00 0.00 56.01 53.55 1o9k n LEU 670 Cb 0.15 -0.19 0.63 0.00 -2.33 0.00 0.00 43.42 41.69 1o9k n LEU 670 CO 0.16 0.78 1.14 0.28 -1.33 0.00 0.00 177.39 178.42 1o9k h SER 671 N 0.89 0.00 -0.56 -1.43 0.02 -1.84 0.17 113.55 110.80 1o9k h SER 671 Ca -0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1o9k h SER 671 Cb 1.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.08 1o9k h SER 671 CO 0.06 0.00 0.00 -0.62 -1.14 0.00 0.00 176.83 175.13 1o9k n GLU 672 N -3.11 2.69 -3.11 3.45 1.02 -1.26 -4.53 120.64 115.80 1o9k n GLU 672 Ca 0.04 -2.40 -0.17 0.00 -0.02 0.00 0.00 57.16 54.60 1o9k n GLU 672 Cb 0.67 -1.46 -0.02 0.00 -0.02 0.00 0.00 31.44 30.60 1o9k n GLU 672 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1o9k n HIS 673 N 1.27 0.50 0.09 -0.32 8.25 0.59 -4.98 115.22 120.63 1o9k n HIS 673 Ca 0.20 -3.70 0.20 0.00 -0.26 0.00 0.00 57.72 54.16 1o9k n HIS 673 Cb 0.55 -0.42 0.68 0.00 1.12 0.00 0.00 29.99 31.92 1o9k n HIS 673 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1o9k h PRO 674 N 3.00 0.00 0.00 -0.41 0.11 -1.80 -0.71 132.00 132.19 1o9k h PRO 674 Ca 0.08 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.10 1o9k h PRO 674 Cb 0.97 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1o9k h PRO 674 CO 0.52 0.00 -0.43 1.05 -0.21 0.00 0.00 178.00 178.93 1o9k h GLU 675 N 0.00 0.00 0.59 1.05 9.09 -1.93 -3.34 114.58 120.03 1o9k h GLU 675 Ca 0.20 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.59 1o9k h GLU 675 Cb 1.36 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.45 1o9k h GLU 675 CO -0.00 0.43 -0.44 -0.07 0.05 0.00 0.00 179.01 178.98 1o9k h LEU 676 N 0.00 -1.15 -0.63 3.06 3.38 -1.50 -3.27 115.31 115.19 1o9k h LEU 676 Ca -0.00 0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.16 1o9k h LEU 676 Cb 0.89 0.36 -0.11 0.00 0.09 0.00 0.00 40.66 41.89 1o9k h LEU 676 CO 0.06 -0.63 -0.19 1.21 0.09 0.00 0.00 178.44 178.97 1o9k n GLU 677 N -5.15 -0.09 0.20 1.13 2.13 -1.25 0.16 120.64 117.77 1o9k n GLU 677 Ca -0.12 0.97 0.07 0.00 0.66 0.00 0.00 57.16 58.74 1o9k n GLU 677 Cb 0.43 -1.45 0.38 0.00 0.27 0.00 0.00 31.44 31.07 1o9k n GLU 677 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1o9k h HIS 678 N 0.00 0.00 0.24 4.31 2.76 -1.81 -0.29 115.15 120.35 1o9k h HIS 678 Ca 0.27 0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 58.12 1o9k h HIS 678 Cb 0.43 0.00 0.04 0.00 1.55 0.00 0.00 27.41 29.42 1o9k h HIS 678 CO -0.51 0.34 -1.40 0.82 -1.30 0.00 0.00 177.93 175.88 1o9k h ILE 679 N 0.00 1.30 -0.26 6.26 2.04 0.15 -2.90 117.51 124.10 1o9k h ILE 679 Ca -0.00 -2.67 0.02 0.00 1.00 0.00 0.00 64.86 63.20 1o9k h ILE 679 Cb 0.82 3.06 -0.02 0.00 -0.74 0.00 0.00 36.82 39.94 1o9k h ILE 679 CO 0.04 0.80 0.13 0.40 0.00 0.00 0.00 178.15 179.52 1o9k h ILE 680 N 0.07 1.00 -0.31 -0.67 2.04 -0.60 -1.74 117.51 117.30 1o9k h ILE 680 Ca -0.25 -0.10 0.09 0.00 1.00 0.00 0.00 64.86 65.61 1o9k h ILE 680 Cb 2.09 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.85 1o9k h ILE 680 CO 0.26 0.05 0.29 -0.25 0.00 0.00 0.00 178.15 178.50 1o9k h TRP 681 N 0.28 0.00 -0.01 1.37 2.91 -1.08 0.93 115.95 120.35 1o9k h TRP 681 Ca 0.11 0.00 -0.24 0.00 1.13 0.00 0.00 58.89 59.89 1o9k h TRP 681 Cb 0.03 0.00 0.01 0.00 -0.51 0.00 0.00 29.16 28.69 1o9k h TRP 681 CO -0.09 0.00 -0.96 1.15 -1.03 0.00 0.00 178.44 177.50 1o9k h THR 682 N 0.00 1.36 -0.05 2.65 2.02 -1.10 -1.34 112.91 116.45 1o9k h THR 682 Ca 0.15 -2.36 -0.07 0.00 0.77 0.00 0.00 66.41 64.90 1o9k h THR 682 Cb 0.73 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 1o9k h THR 682 CO -0.00 0.71 -0.24 0.25 0.37 0.00 0.00 175.52 176.61 1o9k h LEU 683 N 0.29 0.29 -0.43 2.58 6.46 -0.97 -1.59 115.31 121.95 1o9k h LEU 683 Ca -0.09 -0.66 0.07 0.00 -0.12 0.00 0.00 57.88 57.07 1o9k h LEU 683 Cb 1.60 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 41.39 1o9k h LEU 683 CO 0.18 0.91 0.09 0.15 -0.62 0.00 0.00 178.44 179.15 1o9k h PHE 684 N -0.30 0.15 -0.16 1.25 3.57 -0.91 0.16 116.94 120.70 1o9k h PHE 684 Ca -0.02 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1o9k h PHE 684 Cb 0.90 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.64 1o9k h PHE 684 CO 0.14 0.02 -0.04 0.37 -2.23 0.00 0.00 178.31 176.57 1o9k h GLN 685 N 0.23 0.31 -0.92 1.11 -0.00 -1.32 -2.17 115.11 112.34 1o9k h GLN 685 Ca 0.21 -0.12 0.01 0.00 -0.00 0.00 0.00 58.65 58.75 1o9k h GLN 685 Cb 0.25 -0.02 -0.05 0.00 0.00 0.00 0.00 27.48 27.67 1o9k h GLN 685 CO -0.27 0.58 0.61 1.25 0.00 0.00 0.00 178.83 181.01 1o9k h HIS 686 N 0.01 1.16 0.81 3.99 2.76 -0.83 -1.23 115.15 121.82 1o9k h HIS 686 Ca 0.04 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.20 1o9k h HIS 686 Cb 0.47 -0.39 0.01 0.00 1.55 0.00 0.00 27.41 29.04 1o9k h HIS 686 CO 0.05 0.73 -0.39 1.15 -1.30 0.00 0.00 177.93 178.17 1o9k h THR 687 N 1.25 0.20 -0.52 6.26 2.02 -0.59 0.27 112.91 121.80 1o9k h THR 687 Ca 0.34 -0.01 0.14 0.00 0.77 0.00 0.00 66.41 67.65 1o9k h THR 687 Cb -0.14 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.44 1o9k h THR 687 CO -0.07 0.00 0.37 -0.07 0.37 0.00 0.00 175.52 176.12 1o9k h LEU 688 N -1.10 0.06 0.12 2.58 3.38 -1.10 1.01 115.31 120.26 1o9k h LEU 688 Ca -0.11 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.50 1o9k h LEU 688 Cb 0.84 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1o9k h LEU 688 CO 0.18 0.03 -1.94 -0.61 0.09 0.00 0.00 178.44 176.20 1o9k h GLN 689 N 0.06 0.26 0.00 1.13 4.15 -0.98 -3.38 115.11 116.35 1o9k h GLN 689 Ca 0.25 -0.44 0.00 0.00 0.77 0.00 0.00 58.65 59.23 1o9k h GLN 689 Cb 0.91 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.76 1o9k h GLN 689 CO -0.02 1.21 -0.78 0.09 -1.93 0.00 0.00 178.83 177.41 1o9k n ASN 690 N -3.55 1.17 -2.42 -0.69 3.02 0.93 -4.64 115.26 109.08 1o9k n ASN 690 Ca -0.32 -0.50 -0.20 0.00 -0.03 0.00 0.00 54.58 53.53 1o9k n ASN 690 Cb 1.03 1.14 0.02 0.00 -0.61 0.00 0.00 39.78 41.36 1o9k n ASN 690 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1o9k n GLU 691 N -1.43 2.93 0.31 3.52 -0.58 0.35 -4.88 120.64 120.86 1o9k n GLU 691 Ca 0.01 -4.10 0.19 0.00 -0.42 0.00 0.00 57.16 52.84 1o9k n GLU 691 Cb 0.19 -2.03 0.99 0.00 -0.57 0.00 0.00 31.44 30.02 1o9k n GLU 691 CO 0.00 0.00 0.00 0.10 -0.48 0.00 0.00 177.13 176.75 1o9k h TYR 692 N 2.54 0.00 0.00 -0.32 -0.00 -1.70 -1.60 116.97 115.89 1o9k h TYR 692 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.93 1o9k h TYR 692 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.90 1o9k h TYR 692 CO 0.74 0.02 -0.03 0.93 -0.00 0.00 0.00 178.16 179.82 1o9k h GLU 693 N 0.00 0.00 0.00 0.10 4.39 -1.89 0.10 114.58 117.28 1o9k h GLU 693 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1o9k h GLU 693 Cb 0.18 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1o9k h GLU 693 CO 0.00 0.03 -0.05 -0.07 -1.16 0.00 0.00 179.01 177.76 1o9k h LEU 694 N 0.00 0.00 0.00 1.33 -0.00 -1.65 -2.37 115.31 112.62 1o9k h LEU 694 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1o9k h LEU 694 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.96 1o9k h LEU 694 CO 0.00 0.05 -0.19 0.24 -0.00 0.00 0.00 178.44 178.55 1o9k h MET 695 N 0.00 0.00 -6.03 1.13 2.86 -0.97 -3.43 114.93 108.48 1o9k h MET 695 Ca -0.00 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 57.00 1o9k h MET 695 Cb 0.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1o9k h MET 695 CO 0.01 0.00 1.39 -2.13 1.06 0.00 0.00 176.91 177.24 1o9k n ARG 696 N -2.72 1.50 -1.63 1.72 0.63 -0.89 -1.07 116.66 114.20 1o9k n ARG 696 Ca 0.04 0.44 -0.13 0.00 -0.92 0.00 0.00 57.85 57.28 1o9k n ARG 696 Cb 0.50 -2.72 -0.04 0.00 0.45 0.00 0.00 32.46 30.65 1o9k n ARG 696 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1o9k n ASP 697 N 9.90 -4.41 -3.60 6.15 8.00 -1.26 -4.99 116.55 126.35 1o9k n ASP 697 Ca 0.35 0.22 -0.22 0.00 0.71 0.00 0.00 54.79 55.85 1o9k n ASP 697 Cb 0.30 -3.21 -0.06 0.00 -0.02 0.00 0.00 41.12 38.14 1o9k n ASP 697 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1o9k n ARG 698 N -2.51 0.68 -4.99 -1.24 1.74 -0.23 -4.70 116.66 105.40 1o9k n ARG 698 Ca -0.14 -2.96 -0.32 0.00 -0.77 0.00 0.00 57.85 53.66 1o9k n ARG 698 Cb 0.48 1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 33.28 1o9k n ARG 698 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1o9k s HIS 699 N -2.81 2.63 0.26 -1.55 5.65 -1.26 -4.97 115.29 113.24 1o9k s HIS 699 Ca 0.15 -0.36 -0.04 0.00 0.25 0.00 0.00 55.06 55.06 1o9k s HIS 699 Cb 0.01 -1.64 0.53 0.00 -1.18 0.00 0.00 32.58 30.30 1o9k s HIS 699 CO 0.11 0.03 1.64 1.25 -0.65 0.00 0.00 174.74 177.12 1o9k h LEU 700 N 5.70 -0.20 -2.26 8.88 6.46 -1.99 0.24 115.31 132.14 1o9k h LEU 700 Ca -0.40 0.19 -0.01 0.00 -0.12 0.00 0.00 57.88 57.54 1o9k h LEU 700 Cb 1.16 0.30 -0.00 0.00 -0.73 0.00 0.00 40.66 41.39 1o9k h LEU 700 CO 0.50 -0.16 -0.03 0.44 -0.62 0.00 0.00 178.44 178.58 1o9k h ASP 701 N 0.16 0.00 -0.16 1.25 3.32 -1.98 -0.98 116.42 118.02 1o9k h ASP 701 Ca 0.46 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.45 1o9k h ASP 701 Cb 0.85 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 1o9k h ASP 701 CO -0.65 0.03 -0.13 1.56 -1.72 0.00 0.00 179.24 178.33 1o9k h GLN 702 N 0.00 0.38 -0.62 3.56 4.20 -0.84 -1.74 115.11 120.05 1o9k h GLN 702 Ca -0.00 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.50 1o9k h GLN 702 Cb 0.23 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1o9k h GLN 702 CO 0.00 0.73 0.30 0.82 -0.67 0.00 0.00 178.83 180.01 1o9k h ILE 703 N 0.03 1.21 0.37 2.54 5.03 -1.33 -1.67 117.51 123.68 1o9k h ILE 703 Ca 0.03 -0.60 -0.00 0.00 -0.12 0.00 0.00 64.86 64.16 1o9k h ILE 703 Cb 0.65 0.47 -0.03 0.00 -3.03 0.00 0.00 36.82 34.88 1o9k h ILE 703 CO 0.03 0.25 -0.49 -0.03 -0.68 0.00 0.00 178.15 177.23 1o9k h MET 704 N 0.85 -0.86 -0.95 2.37 1.85 -1.11 0.29 114.93 117.36 1o9k h MET 704 Ca 0.21 0.06 0.07 0.00 -0.61 0.00 0.00 59.70 59.44 1o9k h MET 704 Cb 0.11 0.20 -0.07 0.00 0.43 0.00 0.00 31.60 32.28 1o9k h MET 704 CO -0.03 -0.58 0.62 0.52 -0.40 0.00 0.00 176.91 177.04 1o9k h MET 705 N -0.90 1.03 0.00 0.39 2.86 -1.24 -1.15 114.93 115.93 1o9k h MET 705 Ca -0.04 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.44 1o9k h MET 705 Cb 0.81 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1o9k h MET 705 CO -0.13 0.68 -0.50 0.00 1.06 0.00 0.00 176.91 178.02 1o9k h SER 707 N 0.00 0.18 -0.13 0.00 0.02 0.24 -0.80 113.55 113.06 1o9k h SER 707 Ca -0.00 -0.08 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 1o9k h SER 707 Cb 1.00 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.49 1o9k h SER 707 CO 0.06 0.65 -0.27 0.24 -1.14 0.00 0.00 176.83 176.37 1o9k h MET 708 N 0.13 0.41 -0.45 3.45 2.86 -0.81 -2.93 114.93 117.59 1o9k h MET 708 Ca 0.00 -0.27 -0.09 0.00 -2.06 0.00 0.00 59.70 57.28 1o9k h MET 708 Cb 0.93 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.61 1o9k h MET 708 CO 0.07 0.87 -0.08 -0.92 1.06 0.00 0.00 176.91 177.92 1o9k h TYR 709 N -0.00 0.94 -0.42 -0.22 3.20 -1.24 -2.24 116.97 116.99 1o9k h TYR 709 Ca 0.00 -0.19 -0.00 0.00 3.14 0.00 0.00 58.73 61.68 1o9k h TYR 709 Cb 0.87 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1o9k h TYR 709 CO 0.10 0.93 0.25 0.78 -1.64 0.00 0.00 178.16 178.58 1o9k h GLY 710 N 0.68 0.60 2.00 1.82 0.00 -1.22 -1.73 103.07 105.22 1o9k h GLY 710 Ca 0.12 -0.25 -0.13 0.00 0.00 0.00 0.00 47.33 47.07 1o9k h GLY 710 CO 0.04 0.24 -0.60 -2.22 0.00 0.00 0.00 176.54 174.01 1o9k h ILE 711 N 0.55 1.29 0.00 2.60 2.04 -1.48 -2.72 117.51 119.78 1o9k h ILE 711 Ca 0.15 -2.14 -0.08 0.00 1.00 0.00 0.00 64.86 63.79 1o9k h ILE 711 Cb 0.00 2.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 1o9k h ILE 711 CO -0.03 0.58 -0.38 0.00 0.00 0.00 0.00 178.15 178.33 1o9k h LYS 713 N 0.00 0.68 -0.15 0.00 1.79 -1.13 0.20 116.57 117.96 1o9k h LYS 713 Ca -0.00 -0.66 -0.17 0.00 -2.18 0.00 0.00 60.65 57.64 1o9k h LYS 713 Cb 1.16 0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.97 1o9k h LYS 713 CO 0.05 1.26 -0.61 -0.39 -1.08 0.00 0.00 179.45 178.68 1o9k h VAL 714 N 0.35 1.34 -0.28 0.50 -1.51 -1.49 -2.76 116.25 112.40 1o9k h VAL 714 Ca -0.09 -1.90 -0.12 0.00 -1.23 0.00 0.00 66.70 63.36 1o9k h VAL 714 Cb 1.51 1.88 -0.07 0.00 -2.13 0.00 0.00 31.29 32.48 1o9k h VAL 714 CO 0.17 0.58 0.15 0.29 -1.23 0.00 0.00 177.57 177.54 1o9k n LYS 715 N -3.92 1.60 -3.44 5.19 4.76 -0.84 -4.87 118.16 116.63 1o9k n LYS 715 Ca -0.04 -0.95 -0.23 0.00 -2.87 0.00 0.00 58.31 54.23 1o9k n LYS 715 Cb 0.64 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 32.32 1o9k n LYS 715 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1o9k n ASN 716 N 0.04 -1.33 -4.95 4.39 4.13 -1.04 -4.93 115.26 111.56 1o9k n ASN 716 Ca 0.16 -0.50 -0.23 0.00 1.68 0.00 0.00 54.58 55.70 1o9k n ASN 716 Cb 0.79 -1.21 0.03 0.00 -1.54 0.00 0.00 39.78 37.84 1o9k n ASN 716 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1o9k s ILE 717 N -2.51 3.30 -0.59 2.41 -1.09 0.69 -5.03 121.20 118.38 1o9k s ILE 717 Ca 0.45 -0.48 0.03 0.00 -2.23 0.00 0.00 60.65 58.42 1o9k s ILE 717 Cb -0.26 -3.25 0.15 0.00 -1.58 0.00 0.00 42.46 37.51 1o9k s ILE 717 CO 0.55 -0.19 0.36 -0.62 -1.23 0.00 0.00 174.94 173.81 1o9k s ASP 718 N -4.33 4.65 -0.51 3.58 2.15 -1.26 -4.54 116.67 116.40 1o9k s ASP 718 Ca 0.53 -3.17 0.03 0.00 0.43 0.00 0.00 52.55 50.38 1o9k s ASP 718 Cb -0.10 -1.69 0.15 0.00 -0.30 0.00 0.00 42.92 40.97 1o9k s ASP 718 CO 0.39 -0.23 0.31 -0.22 -0.17 0.00 0.00 175.17 175.26 1o9k s LEU 719 N -0.51 3.19 0.59 -1.34 2.96 -1.26 -5.11 118.68 117.20 1o9k s LEU 719 Ca 0.19 -3.02 -0.19 0.00 -0.22 0.00 0.00 54.13 50.89 1o9k s LEU 719 Cb -0.20 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.29 1o9k s LEU 719 CO -0.04 -0.21 1.14 0.29 -1.32 0.00 0.00 176.35 176.21 1o9k n LYS 720 N 3.03 1.15 -0.20 1.98 5.02 -1.26 -4.85 118.16 123.02 1o9k n LYS 720 Ca 0.14 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.87 1o9k n LYS 720 Cb 0.36 -2.35 0.24 0.00 -0.02 0.00 0.00 35.03 33.27 1o9k n LYS 720 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1o9k h PHE 721 N 0.76 0.93 -0.95 2.13 3.04 -1.99 0.41 116.94 121.26 1o9k h PHE 721 Ca -0.49 0.01 0.23 0.00 3.98 0.00 0.00 57.97 61.69 1o9k h PHE 721 Cb 1.34 -0.31 -0.07 0.00 2.56 0.00 0.00 35.95 39.47 1o9k h PHE 721 CO 0.40 0.60 0.63 -0.22 -2.02 0.00 0.00 178.31 177.70 1o9k h LYS 722 N 0.99 0.37 0.11 1.11 3.64 -2.00 -0.10 116.57 120.69 1o9k h LYS 722 Ca 0.26 -0.02 -0.29 0.00 -1.27 0.00 0.00 60.65 59.33 1o9k h LYS 722 Cb -0.08 -0.08 0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1o9k h LYS 722 CO -0.05 0.25 -1.22 0.82 -2.27 0.00 0.00 179.45 176.97 1o9k h ILE 723 N 0.38 1.32 0.16 2.00 1.08 -1.27 -3.07 117.51 118.12 1o9k h ILE 723 Ca 0.51 -2.54 -0.01 0.00 -0.39 0.00 0.00 64.86 62.43 1o9k h ILE 723 Cb 1.31 2.70 0.00 0.00 -3.07 0.00 0.00 36.82 37.76 1o9k h ILE 723 CO -0.20 0.77 -0.08 0.40 -0.69 0.00 0.00 178.15 178.35 1o9k h ILE 724 N 0.24 0.84 -0.79 -0.67 2.04 -0.72 -2.80 117.51 115.65 1o9k h ILE 724 Ca -0.17 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 65.74 1o9k h ILE 724 Cb 1.90 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 38.77 1o9k h ILE 724 CO 0.23 0.00 0.47 0.58 0.00 0.00 0.00 178.15 179.43 1o9k h VAL 725 N -0.22 1.02 -0.49 1.67 2.07 -1.20 0.40 116.25 119.50 1o9k h VAL 725 Ca -0.02 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.24 1o9k h VAL 725 Cb 0.17 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 1o9k h VAL 725 CO 0.04 0.16 0.33 0.74 0.02 0.00 0.00 177.57 178.85 1o9k h THR 726 N 0.87 1.02 0.23 2.57 2.02 -1.44 0.69 112.91 118.85 1o9k h THR 726 Ca 0.35 -0.17 -0.30 0.00 0.77 0.00 0.00 66.41 67.06 1o9k h THR 726 Cb 0.18 0.47 0.03 0.00 -1.74 0.00 0.00 68.15 67.09 1o9k h THR 726 CO -0.18 0.09 -1.31 0.00 0.37 0.00 0.00 175.52 174.50 1o9k h ALA 727 N 1.72 -0.15 -0.43 6.16 0.00 -0.78 -3.28 119.26 122.50 1o9k h ALA 727 Ca 0.21 -0.82 0.06 0.00 0.00 0.00 0.00 54.91 54.35 1o9k h ALA 727 Cb 0.19 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1o9k h ALA 727 CO -0.05 0.61 0.14 -0.92 0.00 0.00 0.00 179.25 179.03 1o9k h TYR 728 N 0.01 0.25 0.00 0.00 3.20 0.14 -0.38 116.97 120.18 1o9k h TYR 728 Ca -0.23 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.66 1o9k h TYR 728 Cb 2.03 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 40.25 1o9k h TYR 728 CO 0.15 0.08 0.02 1.63 -1.64 0.00 0.00 178.16 178.40 1o9k n LYS 729 N -5.02 0.00 0.00 1.82 5.02 0.22 -1.30 118.16 118.90 1o9k n LYS 729 Ca 0.03 0.06 0.09 0.00 -2.02 0.00 0.00 58.31 56.47 1o9k n LYS 729 Cb 0.17 -1.52 -0.04 0.00 -0.02 0.00 0.00 35.03 33.62 1o9k n LYS 729 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1o9k n ASP 730 N -0.96 1.39 -4.77 4.39 8.00 -0.15 -4.91 116.55 119.53 1o9k n ASP 730 Ca 0.00 -1.19 -0.38 0.00 0.71 0.00 0.00 54.79 53.93 1o9k n ASP 730 Cb 0.02 0.68 -0.03 0.00 -0.02 0.00 0.00 41.12 41.77 1o9k n ASP 730 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1o9k s LEU 731 N -2.42 4.26 0.57 0.64 1.43 -0.42 -4.92 118.68 117.81 1o9k s LEU 731 Ca 0.12 2.23 0.27 0.00 -1.03 0.00 0.00 54.13 55.71 1o9k s LEU 731 Cb 0.14 -3.98 1.58 0.00 0.03 0.00 0.00 46.19 43.96 1o9k s LEU 731 CO 0.55 -0.50 2.10 1.55 0.23 0.00 0.00 176.35 180.29 1o9k h PRO 732 N 2.86 0.00 -0.01 1.29 0.13 -1.92 -2.15 132.00 132.19 1o9k h PRO 732 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1o9k h PRO 732 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1o9k h PRO 732 CO 0.63 0.00 -0.57 -2.39 -0.23 0.00 0.00 178.00 175.44 1o9k n HIS 733 N -3.98 0.00 -1.72 1.56 1.44 -1.26 -5.01 115.22 106.25 1o9k n HIS 733 Ca 0.02 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.30 1o9k n HIS 733 Cb 0.32 -0.01 -0.02 0.00 0.12 0.00 0.00 29.99 30.40 1o9k n HIS 733 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1o9k n ALA 734 N -0.34 2.31 -2.82 1.59 0.00 -0.81 -5.02 120.51 115.43 1o9k n ALA 734 Ca 0.08 0.39 -0.30 0.00 0.00 0.00 0.00 53.44 53.61 1o9k n ALA 734 Cb 0.44 -2.44 -0.16 0.00 0.00 0.00 0.00 19.45 17.28 1o9k n ALA 734 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1o9k s VAL 735 N 0.31 1.89 0.48 0.00 1.01 -1.26 -5.00 120.40 117.83 1o9k s VAL 735 Ca 0.68 -0.97 0.15 0.00 0.00 0.00 0.00 61.98 61.84 1o9k s VAL 735 Cb -0.53 -1.61 0.22 0.00 0.00 0.00 0.00 36.38 34.46 1o9k s VAL 735 CO 0.44 0.53 2.06 1.56 0.00 0.00 0.00 175.10 179.69 1o9k h GLN 736 N 6.16 0.00 -0.85 2.72 4.20 -1.99 -1.41 115.11 123.95 1o9k h GLN 736 Ca -0.31 0.00 0.19 0.00 0.06 0.00 0.00 58.65 58.59 1o9k h GLN 736 Cb 1.18 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.90 1o9k h GLN 736 CO 0.47 0.10 0.57 1.49 -0.67 0.00 0.00 178.83 180.79 1o9k h GLU 737 N 0.00 0.35 -0.38 1.46 4.81 -1.97 -1.28 114.58 117.57 1o9k h GLU 737 Ca -0.00 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.28 1o9k h GLU 737 Cb 0.18 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1o9k h GLU 737 CO 0.01 0.23 0.26 1.15 -0.73 0.00 0.00 179.01 179.93 1o9k h THR 738 N 0.36 0.92 -0.00 0.32 2.02 -1.57 -0.71 112.91 114.25 1o9k h THR 738 Ca 0.43 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.54 1o9k h THR 738 Cb 1.13 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1o9k h THR 738 CO -0.14 0.04 -0.59 2.22 0.37 0.00 0.00 175.52 177.42 1o9k n PHE 739 N -4.47 0.00 0.24 3.16 1.16 -0.52 -4.53 117.46 112.50 1o9k n PHE 739 Ca 0.05 0.00 0.10 0.00 -1.87 0.00 0.00 57.45 55.73 1o9k n PHE 739 Cb 0.29 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.02 1o9k n PHE 739 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 1o9k n LYS 740 N -0.92 0.57 -3.63 3.97 5.02 -0.90 -1.46 118.16 120.80 1o9k n LYS 740 Ca 0.04 -0.14 -0.28 0.00 -2.02 0.00 0.00 58.31 55.92 1o9k n LYS 740 Cb 0.28 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 33.70 1o9k n LYS 740 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1o9k s ARG 741 N -3.28 1.56 -0.12 1.97 3.52 -0.32 -3.67 118.95 118.61 1o9k s ARG 741 Ca -0.04 -2.59 -0.01 0.00 -0.13 0.00 0.00 55.73 52.97 1o9k s ARG 741 Cb 0.14 -2.31 -0.02 0.00 -1.56 0.00 0.00 34.95 31.19 1o9k s ARG 741 CO 0.85 -1.32 -0.09 0.08 -0.81 0.00 0.00 175.30 174.01 1o9k s VAL 742 N -0.51 3.48 0.17 7.11 1.01 0.11 -4.83 120.40 126.95 1o9k s VAL 742 Ca 0.28 -0.52 -0.32 0.00 0.00 0.00 0.00 61.98 61.42 1o9k s VAL 742 Cb -0.03 -2.48 -0.11 0.00 0.00 0.00 0.00 36.38 33.77 1o9k s VAL 742 CO -0.16 0.53 1.72 -0.22 0.00 0.00 0.00 175.10 176.96 1o9k s LEU 743 N 0.08 4.38 0.00 3.92 0.20 -1.26 -1.63 118.68 124.37 1o9k s LEU 743 Ca -0.03 2.77 0.00 0.00 0.69 0.00 0.00 54.13 57.56 1o9k s LEU 743 Cb -0.14 -3.59 0.00 0.00 -0.43 0.00 0.00 46.19 42.03 1o9k s LEU 743 CO 0.04 -0.95 0.00 -0.38 -0.29 0.00 0.00 176.35 174.77 1o9k n ILE 744 N 4.20 0.00 -3.81 6.68 2.08 -0.36 -4.93 119.36 123.21 1o9k n ILE 744 Ca 0.16 0.00 -0.26 0.00 0.56 0.00 0.00 62.75 63.21 1o9k n ILE 744 Cb 0.37 -0.67 -0.00 0.00 -0.75 0.00 0.00 39.64 38.58 1o9k n ILE 744 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1o9k s LYS 745 N 0.00 2.26 0.00 0.38 1.02 -1.23 -4.99 119.74 117.18 1o9k s LYS 745 Ca 0.00 -1.98 0.00 0.00 0.02 0.00 0.00 55.97 54.01 1o9k s LYS 745 Cb 0.00 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1o9k s LYS 745 CO 0.00 -0.63 0.00 -0.85 -0.92 0.00 0.00 175.35 172.95 1o9k n GLU 746 N -1.80 0.00 -0.13 1.68 0.00 -1.26 -1.89 120.64 117.24 1o9k n GLU 746 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.18 1o9k n GLU 746 Cb 0.64 0.00 0.04 0.00 0.00 0.00 0.00 31.44 32.12 1o9k n GLU 746 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1o9k n GLU 747 N -0.58 1.13 -3.70 3.44 1.02 -1.26 -5.06 120.64 115.64 1o9k n GLU 747 Ca 0.00 -1.42 -0.37 0.00 -0.02 0.00 0.00 57.16 55.35 1o9k n GLU 747 Cb 0.00 -0.89 -0.06 0.00 -0.02 0.00 0.00 31.44 30.47 1o9k n GLU 747 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1o9k s GLU 748 N -1.01 3.67 0.28 3.49 2.56 -0.79 -5.02 118.70 121.89 1o9k s GLU 748 Ca 0.08 0.12 0.11 0.00 0.00 0.00 0.00 54.97 55.27 1o9k s GLU 748 Cb 0.07 -3.19 -0.05 0.00 2.00 0.00 0.00 34.13 32.97 1o9k s GLU 748 CO 0.01 0.72 -0.11 0.71 -0.56 0.00 0.00 175.26 176.03 1o9k s TYR 749 N -1.09 2.45 0.03 5.30 1.51 -1.26 -1.23 117.35 123.06 1o9k s TYR 749 Ca 0.20 -0.32 -0.29 0.00 -1.01 0.00 0.00 57.07 55.66 1o9k s TYR 749 Cb -0.14 -1.13 0.10 0.00 -0.11 0.00 0.00 41.96 40.69 1o9k s TYR 749 CO 0.10 0.66 1.17 0.34 -1.11 0.00 0.00 175.55 176.70 1o9k s ASP 750 N -3.59 -0.11 1.19 2.29 -1.08 -0.65 -4.89 116.67 109.83 1o9k s ASP 750 Ca 0.31 -0.21 -0.17 0.00 -0.52 0.00 0.00 52.55 51.97 1o9k s ASP 750 Cb -0.05 0.27 0.22 0.00 -1.46 0.00 0.00 42.92 41.91 1o9k s ASP 750 CO 0.17 -0.49 0.52 -1.54 0.52 0.00 0.00 175.17 174.35 1o9k n SER 751 N -0.45 -2.38 0.15 -0.34 3.41 -1.24 0.08 113.62 112.85 1o9k n SER 751 Ca -0.07 -0.25 0.02 0.00 -0.26 0.00 0.00 58.87 58.31 1o9k n SER 751 Cb 0.62 -1.07 0.17 0.00 -0.26 0.00 0.00 64.21 63.67 1o9k n SER 751 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1o9k h ILE 752 N -2.56 1.03 -0.35 -1.33 2.10 -1.57 -2.63 117.51 112.20 1o9k h ILE 752 Ca -0.55 -2.02 -0.17 0.00 1.08 0.00 0.00 64.86 63.19 1o9k h ILE 752 Cb 1.32 2.21 -0.00 0.00 -1.09 0.00 0.00 36.82 39.25 1o9k h ILE 752 CO 0.41 0.50 -0.45 0.40 -1.08 0.00 0.00 178.15 177.93 1o9k h ILE 753 N 0.00 1.27 -0.16 2.19 2.04 -1.92 -0.45 117.51 120.49 1o9k h ILE 753 Ca -0.01 -1.62 -0.10 0.00 1.00 0.00 0.00 64.86 64.13 1o9k h ILE 753 Cb 1.17 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 1o9k h ILE 753 CO 0.07 0.54 -0.34 0.58 0.00 0.00 0.00 178.15 178.99 1o9k h VAL 754 N 0.72 1.28 -0.26 1.67 2.07 -1.91 -1.37 116.25 118.47 1o9k h VAL 754 Ca 0.04 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.18 1o9k h VAL 754 Cb 1.05 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 1o9k h VAL 754 CO 0.11 0.42 0.15 0.15 0.02 0.00 0.00 177.57 178.42 1o9k h PHE 755 N 0.28 0.34 0.31 1.57 3.57 -1.11 -1.60 116.94 120.30 1o9k h PHE 755 Ca 0.03 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1o9k h PHE 755 Cb 0.74 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 1o9k h PHE 755 CO 0.02 0.28 -0.22 -0.92 -2.23 0.00 0.00 178.31 175.23 1o9k h TYR 756 N 0.31 -0.58 0.00 0.41 3.20 -0.49 0.30 116.97 120.13 1o9k h TYR 756 Ca 0.09 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1o9k h TYR 756 Cb 0.04 0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.52 1o9k h TYR 756 CO -0.04 -0.34 0.00 -0.91 -1.64 0.00 0.00 178.16 175.23 1o9k h ASN 757 N -0.53 0.00 0.00 -2.11 2.35 -1.26 0.20 115.58 114.24 1o9k h ASN 757 Ca -0.02 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.62 1o9k h ASN 757 Cb 0.45 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 1o9k h ASN 757 CO 0.00 0.00 -1.81 -1.20 -1.65 0.00 0.00 177.43 172.78 1o9k n SER 758 N -3.01 1.52 0.05 5.81 7.64 -0.61 -4.71 113.62 120.31 1o9k n SER 758 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1o9k n SER 758 Cb 0.33 1.35 0.00 0.00 -1.01 0.00 0.00 64.21 64.88 1o9k n SER 758 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1o9k n VAL 759 N -2.23 0.39 0.01 0.44 0.31 0.05 -4.73 118.33 112.57 1o9k n VAL 759 Ca -0.11 0.13 -0.10 0.00 -0.01 0.00 0.00 64.34 64.25 1o9k n VAL 759 Cb 0.62 -0.88 -0.04 0.00 -0.91 0.00 0.00 33.84 32.64 1o9k n VAL 759 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1o9k h PHE 760 N 0.00 -0.75 -0.06 3.52 3.57 -1.45 -1.38 116.94 120.40 1o9k h PHE 760 Ca 0.00 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 1o9k h PHE 760 Cb 0.00 0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1o9k h PHE 760 CO 0.00 -0.36 -0.28 1.98 -2.23 0.00 0.00 178.31 177.42 1o9k h MET 761 N -0.35 0.10 -0.09 1.11 4.05 -0.84 -2.59 114.93 116.31 1o9k h MET 761 Ca 0.10 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.45 1o9k h MET 761 Cb 0.50 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.29 1o9k h MET 761 CO -0.32 0.38 -0.07 1.96 0.23 0.00 0.00 176.91 179.09 1o9k h GLN 762 N 0.09 0.22 0.00 0.39 1.08 -1.62 0.18 115.11 115.45 1o9k h GLN 762 Ca 0.01 -0.10 -0.05 0.00 -1.45 0.00 0.00 58.65 57.05 1o9k h GLN 762 Cb 0.55 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 1o9k h GLN 762 CO 0.04 0.61 -0.26 -0.09 -0.95 0.00 0.00 178.83 178.18 1o9k h ARG 763 N -0.18 0.00 -0.09 1.46 9.65 -1.25 -3.28 114.38 120.70 1o9k h ARG 763 Ca 0.02 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 1o9k h ARG 763 Cb 0.56 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 1o9k h ARG 763 CO 0.02 0.26 0.00 1.28 2.80 0.00 0.00 179.97 184.32 1o9k n LEU 764 N -3.33 1.98 -0.02 3.80 4.77 -0.98 -4.84 117.00 118.37 1o9k n LEU 764 Ca 0.01 -1.56 -0.01 0.00 -0.03 0.00 0.00 56.01 54.42 1o9k n LEU 764 Cb 0.49 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 1o9k n LEU 764 CO 0.35 0.47 0.50 0.50 -1.33 0.00 0.00 177.39 177.88 1o9k h LYS 765 N 0.96 -0.03 -0.87 3.23 3.64 -0.69 0.74 116.57 123.54 1o9k h LYS 765 Ca 0.00 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.55 1o9k h LYS 765 Cb 0.43 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.19 1o9k h LYS 765 CO 0.00 -0.02 0.57 1.79 -2.27 0.00 0.00 179.45 179.52 1o9k h THR 766 N -0.03 0.78 -0.02 1.00 1.35 -1.87 0.24 112.91 114.36 1o9k h THR 766 Ca 0.01 -0.19 -0.09 0.00 -0.55 0.00 0.00 66.41 65.58 1o9k h THR 766 Cb 0.05 0.16 -0.01 0.00 -1.73 0.00 0.00 68.15 66.62 1o9k h THR 766 CO -0.07 0.10 -0.42 -1.13 -0.25 0.00 0.00 175.52 173.75 1o9k h ASN 767 N 0.57 0.05 0.93 5.36 -0.73 -1.65 -3.08 115.58 117.03 1o9k h ASN 767 Ca 0.45 -0.02 -0.18 0.00 1.87 0.00 0.00 56.30 58.42 1o9k h ASN 767 Cb 0.88 -0.01 -0.03 0.00 0.27 0.00 0.00 38.32 39.43 1o9k h ASN 767 CO -0.19 0.47 -0.86 0.40 -0.37 0.00 0.00 177.43 176.87 1o9k h ILE 768 N 0.04 1.58 0.00 2.57 2.04 0.12 -3.25 117.51 120.62 1o9k h ILE 768 Ca 0.00 -3.00 -0.03 0.00 1.00 0.00 0.00 64.86 62.83 1o9k h ILE 768 Cb 0.77 2.63 -0.00 0.00 -0.74 0.00 0.00 36.82 39.48 1o9k h ILE 768 CO 0.06 0.85 -0.14 -0.07 0.00 0.00 0.00 178.15 178.85 1o9k h LEU 769 N 0.00 0.00 -0.52 1.44 -0.00 -1.31 -3.08 115.31 111.84 1o9k h LEU 769 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1o9k h LEU 769 Cb 1.56 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.22 1o9k h LEU 769 CO 0.11 0.14 0.00 0.00 -0.00 0.00 0.00 178.44 178.69 1o9k n GLN 770 N -3.41 0.05 -0.10 1.13 6.02 -1.23 -0.62 117.38 119.23 1o9k n GLN 770 Ca -0.01 0.53 0.10 0.00 -0.01 0.00 0.00 57.00 57.62 1o9k n GLN 770 Cb 0.32 -1.67 0.34 0.00 1.02 0.00 0.00 30.24 30.24 1o9k n GLN 770 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1o9k n TYR 771 N -1.79 0.27 -0.01 1.08 4.01 -1.16 -3.84 117.16 115.71 1o9k n TYR 771 Ca -0.00 -0.13 -0.01 0.00 -0.16 0.00 0.00 57.90 57.59 1o9k n TYR 771 Cb 0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.05 1o9k n TYR 771 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1o9k h ALA 772 N 4.10 -0.09 -2.62 -0.72 0.00 -1.10 -3.47 119.26 115.36 1o9k h ALA 772 Ca 0.00 -0.02 -0.53 0.00 0.00 0.00 0.00 54.91 54.36 1o9k h ALA 772 Cb 0.56 0.03 0.15 0.00 0.00 0.00 0.00 17.79 18.53 1o9k h ALA 772 CO 0.00 -0.09 0.38 0.45 0.00 0.00 0.00 179.25 180.00 1o9k s SER 773 N -5.16 4.32 0.00 0.00 0.15 -1.26 -4.84 113.70 106.91 1o9k s SER 773 Ca -0.01 2.28 0.09 0.00 0.70 0.00 0.00 55.95 59.01 1o9k s SER 773 Cb 0.00 -2.58 0.56 0.00 -1.71 0.00 0.00 66.02 62.29 1o9k s SER 773 CO 0.04 -2.17 0.98 0.35 1.20 0.00 0.00 173.24 173.63 1o9k n THR 774 N -2.73 0.00 -3.04 6.45 -2.24 -1.26 -3.18 114.28 108.28 1o9k n THR 774 Ca 0.13 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.61 1o9k n THR 774 Cb 0.51 -0.70 -0.04 0.00 -2.10 0.00 0.00 70.33 68.00 1o9k n THR 774 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1o9k n ARG 775 N -0.89 3.37 -2.04 -0.78 0.63 -1.26 -5.09 116.66 110.61 1o9k n ARG 775 Ca 0.07 -4.78 -0.28 0.00 -0.92 0.00 0.00 57.85 51.94 1o9k n ARG 775 Cb 0.03 -2.29 0.14 0.00 0.45 0.00 0.00 32.46 30.79 1o9k n ARG 775 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 1o9k s PRO 776 N -3.26 1.31 1.10 -0.14 0.04 -1.19 -4.97 135.00 127.89 1o9k s PRO 776 Ca 0.44 -0.34 -0.13 0.00 0.04 0.00 0.00 61.00 61.02 1o9k s PRO 776 Cb 0.22 -1.97 0.25 0.00 0.04 0.00 0.00 34.50 33.03 1o9k s PRO 776 CO -0.09 -1.94 1.06 -1.25 0.04 0.00 0.00 177.00 174.82 1o9k s PRO 777 N -5.64 -0.39 -0.17 0.56 0.04 -1.26 -4.97 135.00 123.18 1o9k s PRO 777 Ca 0.68 0.62 -0.29 0.00 0.04 0.00 0.00 61.00 62.05 1o9k s PRO 777 Cb -0.07 -1.63 -0.01 0.00 0.04 0.00 0.00 34.50 32.83 1o9k s PRO 777 CO 0.50 -3.31 1.13 0.99 0.04 0.00 0.00 177.00 176.34 1o9k s THR 778 N -2.72 4.51 0.37 1.26 2.01 -1.26 -4.99 115.64 114.82 1o9k s THR 778 Ca 0.67 1.82 -0.26 0.00 0.31 0.00 0.00 61.69 64.23 1o9k s THR 778 Cb -0.22 -4.17 -0.12 0.00 0.01 0.00 0.00 72.50 68.00 1o9k s THR 778 CO 0.61 -0.11 1.03 0.18 -0.69 0.00 0.00 174.62 175.64 1o9k n LEU 779 N 6.05 2.39 -4.79 4.42 4.77 -1.26 -4.96 117.00 123.61 1o9k n LEU 779 Ca 0.12 1.10 -0.39 0.00 -0.03 0.00 0.00 56.01 56.81 1o9k n LEU 779 Cb 0.46 -1.34 -0.06 0.00 -2.33 0.00 0.00 43.42 40.15 1o9k n LEU 779 CO 0.54 -1.36 0.38 -0.44 -1.33 0.00 0.00 177.39 175.17 1o9k s SER 780 N -0.63 7.23 0.35 -1.43 0.01 -1.26 -5.03 113.70 112.93 1o9k s SER 780 Ca 0.61 1.46 -0.28 0.00 1.31 0.00 0.00 55.95 59.04 1o9k s SER 780 Cb -0.61 -2.43 -0.12 0.00 0.21 0.00 0.00 66.02 63.07 1o9k s SER 780 CO 0.59 0.24 1.32 -0.81 0.41 0.00 0.00 173.24 174.99 1o9k n PRO 781 N 1.62 2.21 -2.63 12.44 -0.04 -1.26 -4.83 135.00 142.52 1o9k n PRO 781 Ca -0.08 0.78 -0.43 0.00 -0.04 0.00 0.00 63.50 63.73 1o9k n PRO 781 Cb 0.50 -2.39 -0.02 0.00 -0.04 0.00 0.00 33.50 31.55 1o9k n PRO 781 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1o9k s ILE 782 N -1.10 4.65 -0.32 0.52 -1.09 -1.26 -4.93 121.20 117.67 1o9k s ILE 782 Ca 0.55 1.94 -0.39 0.00 -2.23 0.00 0.00 60.65 60.52 1o9k s ILE 782 Cb -0.55 -4.25 -0.14 0.00 -1.58 0.00 0.00 42.46 35.94 1o9k s ILE 782 CO 0.62 -0.02 1.95 -2.65 -1.23 0.00 0.00 174.94 173.61 1o9k n PRO 783 N 5.22 1.07 -1.55 2.79 -0.02 -1.26 -4.70 135.00 136.55 1o9k n PRO 783 Ca 0.10 0.36 -0.13 0.00 -2.02 0.00 0.00 63.50 61.80 1o9k n PRO 783 Cb 0.48 -2.20 -0.09 0.00 -0.02 0.00 0.00 33.50 31.67 1o9k n PRO 783 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1o9k n HIS 784 N 7.22 1.01 -3.49 6.00 -0.00 -1.26 -4.84 115.22 119.86 1o9k n HIS 784 Ca 0.34 -0.06 -0.42 0.00 0.46 0.00 0.00 57.72 58.04 1o9k n HIS 784 Cb 0.16 -2.48 -0.05 0.00 -0.12 0.00 0.00 29.99 27.50 1o9k n HIS 784 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1o9k s ILE 785 N 14.71 4.92 0.48 3.57 1.01 -1.26 -5.07 121.20 139.56 1o9k s ILE 785 Ca 0.89 -2.88 -0.22 0.00 0.00 0.00 0.00 60.65 58.45 1o9k s ILE 785 Cb -0.14 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 1o9k s ILE 785 CO 0.13 -1.00 1.15 -2.84 0.00 0.00 0.00 174.94 172.38 1o9k s PRO 786 N -0.22 3.67 0.00 2.79 0.02 -1.26 -5.23 135.00 134.77 1o9k s PRO 786 Ca 0.20 1.72 0.00 0.00 0.02 0.00 0.00 61.00 62.94 1o9k s PRO 786 Cb -0.13 -2.30 0.00 0.00 0.02 0.00 0.00 34.50 32.09 1o9k s PRO 786 CO -0.07 -0.61 0.00 0.54 -0.33 0.00 0.00 177.00 176.52