#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o77 s TYR 641 N -0.31 0.95 0.07 0.00 1.51 0.15 -4.99 117.35 114.72 1o77 s TYR 641 Ca 0.00 -0.27 -0.20 0.00 -1.01 0.00 0.00 57.07 55.59 1o77 s TYR 641 Cb 0.00 -0.58 -0.11 0.00 -0.11 0.00 0.00 41.96 41.16 1o77 s TYR 641 CO 0.00 -0.01 1.48 -0.44 -1.11 0.00 0.00 175.55 175.47 1o77 h ASP 642 N 5.39 0.35 -4.94 2.29 3.45 -0.39 -0.61 116.42 121.96 1o77 h ASP 642 Ca -0.34 -0.34 -0.10 0.00 0.43 0.00 0.00 57.03 56.68 1o77 h ASP 642 Cb 1.18 -0.10 -0.20 0.00 -0.56 0.00 0.00 39.33 39.66 1o77 h ASP 642 CO 0.46 0.60 -0.14 0.00 -1.57 0.00 0.00 179.24 178.60 1o77 s ALA 643 N -4.88 -1.08 -0.34 3.45 0.00 -0.90 -2.55 121.76 115.47 1o77 s ALA 643 Ca -0.14 0.65 -0.05 0.00 0.00 0.00 0.00 51.96 52.43 1o77 s ALA 643 Cb 0.06 0.01 0.06 0.00 0.00 0.00 0.00 23.12 23.25 1o77 s ALA 643 CO 0.73 -0.29 0.09 0.12 0.00 0.00 0.00 175.76 176.42 1o77 s PHE 644 N -1.21 3.31 -0.25 0.00 5.36 -0.37 -1.04 117.98 123.77 1o77 s PHE 644 Ca -0.12 -1.72 -0.25 0.00 -0.96 0.00 0.00 56.93 53.88 1o77 s PHE 644 Cb -0.04 -2.39 -0.00 0.00 -0.34 0.00 0.00 43.02 40.25 1o77 s PHE 644 CO 0.06 -0.80 0.86 0.08 -1.46 0.00 0.00 175.22 173.96 1o77 s VAL 645 N 1.32 4.80 -0.26 3.12 1.01 -0.59 -1.16 120.40 128.64 1o77 s VAL 645 Ca -0.01 1.59 -0.08 0.00 0.00 0.00 0.00 61.98 63.48 1o77 s VAL 645 Cb -0.20 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1o77 s VAL 645 CO 0.01 -0.11 0.09 -0.55 0.00 0.00 0.00 175.10 174.53 1o77 s SER 646 N 1.36 5.24 0.23 3.32 0.15 0.61 -1.30 113.70 123.32 1o77 s SER 646 Ca 0.36 -0.27 -0.13 0.00 0.70 0.00 0.00 55.95 56.61 1o77 s SER 646 Cb -0.15 -1.94 -0.00 0.00 -1.71 0.00 0.00 66.02 62.22 1o77 s SER 646 CO 0.08 -0.07 0.46 -0.72 1.20 0.00 0.00 173.24 174.19 1o77 s TYR 647 N 1.62 0.31 1.03 3.44 -0.85 -1.26 -2.33 117.35 119.31 1o77 s TYR 647 Ca 0.06 -0.67 -0.16 0.00 -0.52 0.00 0.00 57.07 55.78 1o77 s TYR 647 Cb -0.16 0.19 0.21 0.00 0.38 0.00 0.00 41.96 42.58 1o77 s TYR 647 CO 0.04 -0.96 1.19 0.45 -1.52 0.00 0.00 175.55 174.76 1o77 s SER 648 N -3.00 2.47 0.03 -0.18 0.15 -1.26 -4.65 113.70 107.26 1o77 s SER 648 Ca 0.20 0.62 0.22 0.00 0.70 0.00 0.00 55.95 57.69 1o77 s SER 648 Cb -0.00 -0.90 -0.12 0.00 -1.71 0.00 0.00 66.02 63.29 1o77 s SER 648 CO 0.07 -3.17 0.85 -0.62 1.20 0.00 0.00 173.24 171.57 1o77 n GLU 649 N -4.12 0.35 0.16 5.44 -0.58 -1.26 -3.90 120.64 116.74 1o77 n GLU 649 Ca 0.12 -0.05 0.05 0.00 -0.42 0.00 0.00 57.16 56.85 1o77 n GLU 649 Cb 0.59 -1.57 0.10 0.00 -0.57 0.00 0.00 31.44 29.99 1o77 n GLU 649 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1o77 h ARG 650 N 0.00 0.00 -2.66 3.49 3.08 -2.02 -3.32 114.38 112.96 1o77 h ARG 650 Ca 0.00 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 59.32 1o77 h ARG 650 Cb 0.77 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.49 1o77 h ARG 650 CO 0.00 0.41 0.25 -0.25 -1.07 0.00 0.00 179.97 179.30 1o77 n ASP 651 N -3.24 5.38 -0.05 7.04 8.00 -1.25 -4.76 116.55 127.66 1o77 n ASP 651 Ca 0.02 -3.42 -0.07 0.00 0.71 0.00 0.00 54.79 52.03 1o77 n ASP 651 Cb 0.67 -1.04 -0.02 0.00 -0.02 0.00 0.00 41.12 40.71 1o77 n ASP 651 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o77 n ALA 652 N 1.17 1.43 -0.31 2.24 0.00 -1.25 -4.19 120.51 119.60 1o77 n ALA 652 Ca 0.27 -0.61 0.12 0.00 0.00 0.00 0.00 53.44 53.22 1o77 n ALA 652 Cb 0.36 0.09 0.24 0.00 0.00 0.00 0.00 19.45 20.14 1o77 n ALA 652 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1o77 n TYR 653 N -4.21 0.53 0.00 0.00 9.36 -1.26 0.18 117.16 121.77 1o77 n TYR 653 Ca -0.11 1.08 0.00 0.00 3.32 0.00 0.00 57.90 62.19 1o77 n TYR 653 Cb 0.39 -1.15 0.00 0.00 -0.63 0.00 0.00 39.34 37.95 1o77 n TYR 653 CO 0.00 0.00 0.00 1.87 0.22 0.00 0.00 176.86 178.95 1o77 n TRP 654 N -5.33 0.00 -0.01 2.98 -0.00 -1.26 -0.74 117.44 113.08 1o77 n TRP 654 Ca 0.20 0.00 -0.09 0.00 -0.00 0.00 0.00 57.50 57.61 1o77 n TRP 654 Cb 0.65 -0.46 -0.03 0.00 -0.00 0.00 0.00 31.31 31.47 1o77 n TRP 654 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1o77 h VAL 655 N 0.00 0.61 0.00 5.87 2.07 -0.70 -0.65 116.25 123.44 1o77 h VAL 655 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1o77 h VAL 655 Cb 0.00 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1o77 h VAL 655 CO 0.00 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.97 1o77 n GLU 656 N -5.29 0.12 -0.02 1.57 1.02 0.48 -2.62 120.64 115.89 1o77 n GLU 656 Ca -0.03 0.14 -0.04 0.00 -0.02 0.00 0.00 57.16 57.22 1o77 n GLU 656 Cb 0.21 -1.65 -0.02 0.00 -0.02 0.00 0.00 31.44 29.96 1o77 n GLU 656 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1o77 n ASN 657 N -1.85 2.27 0.00 1.62 3.02 0.08 -4.59 115.26 115.80 1o77 n ASN 657 Ca 0.06 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 1o77 n ASN 657 Cb 0.35 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.42 1o77 n ASN 657 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1o77 n LEU 658 N -2.87 0.71 -0.38 3.41 4.77 -0.29 -2.50 117.00 119.85 1o77 n LEU 658 Ca -0.08 0.31 0.30 0.00 -0.03 0.00 0.00 56.01 56.50 1o77 n LEU 658 Cb 0.57 -0.36 0.57 0.00 -2.33 0.00 0.00 43.42 41.87 1o77 n LEU 658 CO 0.03 -0.36 1.17 -0.03 -1.33 0.00 0.00 177.39 176.87 1o77 h MET 659 N 0.00 0.19 0.29 3.23 4.05 -1.52 0.56 114.93 121.72 1o77 h MET 659 Ca 0.00 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 1o77 h MET 659 Cb 0.00 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.76 1o77 h MET 659 CO 0.00 0.13 -0.14 0.28 0.23 0.00 0.00 176.91 177.41 1o77 h VAL 660 N 0.19 0.71 -0.00 -5.77 2.07 -1.67 0.17 116.25 111.96 1o77 h VAL 660 Ca 0.77 -0.66 0.03 0.00 0.82 0.00 0.00 66.70 67.66 1o77 h VAL 660 Cb 2.10 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 32.86 1o77 h VAL 660 CO -0.51 0.13 -0.34 -0.61 0.02 0.00 0.00 177.57 176.26 1o77 h GLN 661 N -0.76 -0.47 0.00 1.57 5.75 -0.06 3.15 115.11 124.28 1o77 h GLN 661 Ca -0.04 0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1o77 h GLN 661 Cb 0.50 0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.16 1o77 h GLN 661 CO 0.06 -0.31 -0.05 0.93 -2.65 0.00 0.00 178.83 176.81 1o77 h GLU 662 N -0.49 0.00 0.00 1.69 4.39 -0.12 -2.67 114.58 117.38 1o77 h GLU 662 Ca 0.06 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.58 1o77 h GLU 662 Cb 0.58 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.20 1o77 h GLU 662 CO -0.28 0.05 -1.68 1.28 -1.16 0.00 0.00 179.01 177.22 1o77 n LEU 663 N -4.08 2.15 -1.60 1.33 4.77 0.61 -4.20 117.00 115.97 1o77 n LEU 663 Ca -0.03 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1o77 n LEU 663 Cb 0.13 -0.24 0.26 0.00 -2.33 0.00 0.00 43.42 41.25 1o77 n LEU 663 CO 0.31 0.57 0.78 -0.62 -1.33 0.00 0.00 177.39 177.11 1o77 n GLU 664 N -2.71 3.47 0.00 3.23 1.02 1.04 -1.16 120.64 125.53 1o77 n GLU 664 Ca -0.20 -2.29 0.00 0.00 -0.02 0.00 0.00 57.16 54.65 1o77 n GLU 664 Cb 0.75 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1o77 n GLU 664 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1o77 n ASN 665 N 0.22 0.00 0.00 1.62 4.13 -1.01 -4.79 115.26 115.44 1o77 n ASN 665 Ca 0.25 -1.00 0.00 0.00 1.68 0.00 0.00 54.58 55.51 1o77 n ASN 665 Cb 1.03 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.27 1o77 n ASN 665 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1o77 n PHE 666 N 0.00 0.00 0.00 3.10 7.35 -1.25 -4.90 117.46 121.76 1o77 n PHE 666 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1o77 n PHE 666 Cb 0.45 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.28 1o77 n PHE 666 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1o77 n ASN 667 N 0.00 0.00 -4.77 -2.13 5.15 -1.26 -4.34 115.26 107.91 1o77 n ASN 667 Ca 0.00 0.00 -0.38 0.00 -0.60 0.00 0.00 54.58 53.60 1o77 n ASN 667 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 1o77 n ASN 667 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1o77 s PRO 668 N 0.00 4.04 0.94 1.20 0.04 -1.26 -5.14 135.00 134.81 1o77 s PRO 668 Ca 0.00 1.74 -0.11 0.00 0.04 0.00 0.00 61.00 62.67 1o77 s PRO 668 Cb 0.00 -2.60 0.14 0.00 0.04 0.00 0.00 34.50 32.08 1o77 s PRO 668 CO 0.00 -0.31 1.02 -0.35 0.04 0.00 0.00 177.00 177.40 1o77 n PRO 669 N -0.05 -0.54 -3.45 0.56 -0.04 -1.26 -5.01 135.00 125.21 1o77 n PRO 669 Ca 0.05 -0.10 -0.20 0.00 -0.04 0.00 0.00 63.50 63.21 1o77 n PRO 669 Cb 0.48 -2.28 -0.00 0.00 -0.04 0.00 0.00 33.50 31.65 1o77 n PRO 669 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1o77 s PHE 670 N -2.59 3.22 -0.30 0.54 0.40 -0.31 -4.98 117.98 113.96 1o77 s PHE 670 Ca 0.65 -0.05 -0.04 0.00 -0.60 0.00 0.00 56.93 56.89 1o77 s PHE 670 Cb -0.23 -1.98 0.03 0.00 0.51 0.00 0.00 43.02 41.36 1o77 s PHE 670 CO 0.60 0.00 0.04 0.15 0.70 0.00 0.00 175.22 176.71 1o77 s LYS 671 N -4.23 2.70 0.09 0.44 1.02 -1.26 -4.67 119.74 113.83 1o77 s LYS 671 Ca 0.43 -1.10 0.10 0.00 0.02 0.00 0.00 55.97 55.42 1o77 s LYS 671 Cb -0.10 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.90 1o77 s LYS 671 CO 0.32 -0.56 -0.25 -0.51 -0.92 0.00 0.00 175.35 173.44 1o77 s LEU 672 N 1.37 2.34 -0.36 3.17 1.43 -1.26 0.38 118.68 125.75 1o77 s LEU 672 Ca -0.02 -0.64 0.03 0.00 -1.03 0.00 0.00 54.13 52.48 1o77 s LEU 672 Cb -0.19 -1.31 0.10 0.00 0.03 0.00 0.00 46.19 44.82 1o77 s LEU 672 CO 0.00 0.22 0.09 0.00 0.23 0.00 0.00 176.35 176.89 1o77 s LEU 674 N 0.90 4.04 0.00 0.00 1.02 -1.26 -1.54 118.68 121.84 1o77 s LEU 674 Ca 0.11 0.77 0.00 0.00 0.02 0.00 0.00 54.13 55.03 1o77 s LEU 674 Cb -0.20 -3.24 0.00 0.00 0.02 0.00 0.00 46.19 42.78 1o77 s LEU 674 CO -0.07 -0.72 0.07 1.57 0.02 0.00 0.00 176.35 177.22 1o77 n HIS 675 N 6.46 0.00 -0.40 0.29 -0.00 -0.42 -0.49 115.22 120.66 1o77 n HIS 675 Ca 0.07 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.75 1o77 n HIS 675 Cb 0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.42 1o77 n HIS 675 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 1o77 n LYS 676 N -0.16 0.80 0.00 1.57 4.76 -1.26 -3.42 118.16 120.45 1o77 n LYS 676 Ca 0.00 -0.26 0.00 0.00 -2.87 0.00 0.00 58.31 55.18 1o77 n LYS 676 Cb 0.00 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 1o77 n LYS 676 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1o77 n ARG 677 N 2.20 0.00 -0.24 1.97 0.63 -0.59 -4.97 116.66 115.66 1o77 n ARG 677 Ca 0.11 0.00 0.07 0.00 -0.92 0.00 0.00 57.85 57.11 1o77 n ARG 677 Cb 0.38 -0.07 0.18 0.00 0.45 0.00 0.00 32.46 33.40 1o77 n ARG 677 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1o77 n ASP 678 N -2.20 3.08 -4.69 6.15 10.43 0.36 -4.99 116.55 124.69 1o77 n ASP 678 Ca 0.00 -2.72 -0.42 0.00 2.57 0.00 0.00 54.79 54.22 1o77 n ASP 678 Cb 0.00 -0.39 -0.03 0.00 1.84 0.00 0.00 41.12 42.54 1o77 n ASP 678 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1o77 s PHE 679 N -2.28 3.52 0.59 1.24 2.99 -1.22 -4.96 117.98 117.86 1o77 s PHE 679 Ca 0.31 1.52 -0.17 0.00 0.00 0.00 0.00 56.93 58.59 1o77 s PHE 679 Cb 0.24 -3.12 -0.03 0.00 0.00 0.00 0.00 43.02 40.11 1o77 s PHE 679 CO 0.08 -0.18 1.09 0.96 -0.00 0.00 0.00 175.22 177.16 1o77 s ILE 680 N 1.85 3.45 0.00 0.64 -0.00 -1.26 -5.04 121.20 120.83 1o77 s ILE 680 Ca 0.46 0.75 0.00 0.00 -0.00 0.00 0.00 60.65 61.86 1o77 s ILE 680 Cb -0.18 -3.26 0.00 0.00 -0.00 0.00 0.00 42.46 39.01 1o77 s ILE 680 CO 0.18 -0.34 0.44 -0.81 -0.00 0.00 0.00 174.94 174.41 1o77 n PRO 681 N -1.88 0.00 0.17 0.37 -0.04 -1.26 -3.92 135.00 128.44 1o77 n PRO 681 Ca 0.10 0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1o77 n PRO 681 Cb 0.52 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 1o77 n PRO 681 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o77 n GLY 682 N 0.60 -0.25 3.72 0.55 0.00 -1.26 -4.31 105.19 104.23 1o77 n GLY 682 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1o77 n GLY 682 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1o77 s LYS 683 N -2.65 2.65 0.25 1.61 2.20 -1.25 -5.10 119.74 117.45 1o77 s LYS 683 Ca 0.00 -0.81 -0.30 0.00 -0.36 0.00 0.00 55.97 54.50 1o77 s LYS 683 Cb 0.00 -2.59 -0.09 0.00 -1.51 0.00 0.00 37.83 33.64 1o77 s LYS 683 CO 0.00 0.54 0.95 -1.58 -0.36 0.00 0.00 175.35 174.90 1o77 s TRP 684 N -1.37 3.95 0.00 4.03 0.23 -1.26 -4.84 118.94 119.68 1o77 s TRP 684 Ca 0.27 1.90 0.00 0.00 -2.03 0.00 0.00 56.10 56.24 1o77 s TRP 684 Cb -0.12 -2.99 0.00 0.00 0.03 0.00 0.00 33.47 30.40 1o77 s TRP 684 CO 0.20 0.39 0.85 -0.89 0.96 0.00 0.00 176.95 178.46 1o77 n ILE 685 N 1.39 0.00 -0.19 2.03 2.08 -1.26 -0.56 119.36 122.86 1o77 n ILE 685 Ca -0.02 1.33 -0.05 0.00 0.56 0.00 0.00 62.75 64.57 1o77 n ILE 685 Cb 0.47 -1.80 -0.05 0.00 -0.75 0.00 0.00 39.64 37.52 1o77 n ILE 685 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1o77 n ILE 686 N -2.56 -0.31 0.05 1.39 3.06 -1.26 0.14 119.36 119.87 1o77 n ILE 686 Ca 0.00 1.16 -0.12 0.00 -2.50 0.00 0.00 62.75 61.29 1o77 n ILE 686 Cb 0.00 -1.44 -0.07 0.00 0.54 0.00 0.00 39.64 38.67 1o77 n ILE 686 CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 1o77 h ASP 687 N 0.00 -0.02 -0.98 9.51 3.32 -1.80 -0.72 116.42 125.73 1o77 h ASP 687 Ca 0.07 -0.00 0.35 0.00 0.02 0.00 0.00 57.03 57.47 1o77 h ASP 687 Cb 0.19 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.57 1o77 h ASP 687 CO -0.43 -0.01 0.41 -1.13 -1.72 0.00 0.00 179.24 176.36 1o77 h ASN 688 N -0.03 0.17 0.68 6.45 -0.73 0.38 0.81 115.58 123.31 1o77 h ASN 688 Ca -0.00 0.24 -0.03 0.00 1.87 0.00 0.00 56.30 58.38 1o77 h ASN 688 Cb 0.02 0.28 0.01 0.00 0.27 0.00 0.00 38.32 38.90 1o77 h ASN 688 CO 0.00 -0.32 -0.33 0.40 -0.37 0.00 0.00 177.43 176.82 1o77 h ILE 689 N 0.10 0.00 -0.15 2.57 2.04 0.52 -3.03 117.51 119.57 1o77 h ILE 689 Ca 0.74 -0.27 0.04 0.00 1.00 0.00 0.00 64.86 66.37 1o77 h ILE 689 Cb 1.78 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1o77 h ILE 689 CO -0.75 0.00 0.31 0.40 0.00 0.00 0.00 178.15 178.11 1o77 h ILE 690 N -1.19 0.19 -0.00 -0.67 2.04 0.90 0.94 117.51 119.73 1o77 h ILE 690 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1o77 h ILE 690 Cb 0.70 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1o77 h ILE 690 CO 0.15 0.00 -0.06 0.47 0.00 0.00 0.00 178.15 178.71 1o77 n ASP 691 N -3.31 0.54 -0.05 1.72 8.00 0.25 -3.05 116.55 120.65 1o77 n ASP 691 Ca 0.01 -0.85 -0.09 0.00 0.71 0.00 0.00 54.79 54.57 1o77 n ASP 691 Cb 0.40 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.42 1o77 n ASP 691 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1o77 n SER 692 N -0.76 1.13 -0.15 -2.24 7.64 0.29 -3.73 113.62 115.81 1o77 n SER 692 Ca 0.18 0.08 -0.06 0.00 1.01 0.00 0.00 58.87 60.08 1o77 n SER 692 Cb 0.25 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1o77 n SER 692 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1o77 h ILE 693 N -0.27 0.25 0.00 0.44 2.04 -0.67 0.27 117.51 119.57 1o77 h ILE 693 Ca -0.22 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1o77 h ILE 693 Cb 1.22 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1o77 h ILE 693 CO -0.12 0.00 -0.09 -0.33 0.00 0.00 0.00 178.15 177.61 1o77 h GLU 694 N -0.19 0.00 -0.65 2.37 5.08 -1.78 -3.16 114.58 116.25 1o77 h GLU 694 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1o77 h GLU 694 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1o77 h GLU 694 CO -0.58 0.09 0.00 1.63 -1.00 0.00 0.00 179.01 179.15 1o77 n LYS 695 N -3.15 2.69 -3.89 2.33 5.02 0.01 -4.61 118.16 116.56 1o77 n LYS 695 Ca 0.02 -1.58 -0.11 0.00 -2.02 0.00 0.00 58.31 54.62 1o77 n LYS 695 Cb 0.48 -1.71 -0.11 0.00 -0.02 0.00 0.00 35.03 33.67 1o77 n LYS 695 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1o77 s SER 696 N -0.60 0.04 0.12 4.39 0.01 -0.73 -0.68 113.70 116.25 1o77 s SER 696 Ca 0.28 -0.15 -0.24 0.00 1.31 0.00 0.00 55.95 57.15 1o77 s SER 696 Cb 0.19 0.18 -0.06 0.00 0.21 0.00 0.00 66.02 66.54 1o77 s SER 696 CO 0.11 -0.25 1.67 -0.74 0.41 0.00 0.00 173.24 174.45 1o77 h HIS 697 N 4.91 -0.39 -3.68 2.43 2.76 -1.09 -3.45 115.15 116.63 1o77 h HIS 697 Ca -0.29 0.01 -0.34 0.00 -2.20 0.00 0.00 60.37 57.55 1o77 h HIS 697 Cb 1.20 0.18 -0.14 0.00 1.55 0.00 0.00 27.41 30.19 1o77 h HIS 697 CO 0.55 -0.22 -0.63 0.15 -1.30 0.00 0.00 177.93 176.47 1o77 s LYS 698 N -6.13 1.32 -0.14 5.26 1.02 -1.06 -5.01 119.74 115.00 1o77 s LYS 698 Ca -0.15 -1.69 0.01 0.00 0.02 0.00 0.00 55.97 54.17 1o77 s LYS 698 Cb 0.09 -0.33 0.02 0.00 -0.52 0.00 0.00 37.83 37.09 1o77 s LYS 698 CO 0.67 -0.22 -0.18 0.99 -0.92 0.00 0.00 175.35 175.69 1o77 s THR 699 N -3.67 1.78 -0.34 2.17 2.01 -1.26 -1.24 115.64 115.08 1o77 s THR 699 Ca 0.33 -0.79 -0.12 0.00 0.31 0.00 0.00 61.69 61.42 1o77 s THR 699 Cb 0.07 -1.61 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 1o77 s THR 699 CO 0.10 0.49 0.22 -0.69 -0.69 0.00 0.00 174.62 174.06 1o77 s VAL 700 N 1.13 5.01 -1.15 3.82 1.01 -0.31 -0.20 120.40 129.71 1o77 s VAL 700 Ca -0.01 -0.38 -0.09 0.00 0.00 0.00 0.00 61.98 61.49 1o77 s VAL 700 Cb -0.14 -3.61 0.25 0.00 0.00 0.00 0.00 36.38 32.87 1o77 s VAL 700 CO -0.06 -0.04 1.33 0.49 0.00 0.00 0.00 175.10 176.82 1o77 n PHE 701 N 5.07 4.48 -1.12 5.22 0.99 -0.27 -0.28 117.46 131.55 1o77 n PHE 701 Ca -0.13 -3.45 -0.21 0.00 -0.00 0.00 0.00 57.45 53.67 1o77 n PHE 701 Cb 0.49 -1.77 -0.09 0.00 -1.00 0.00 0.00 39.48 37.10 1o77 n PHE 701 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1o77 n VAL 702 N 2.98 0.00 -1.93 -4.37 0.31 -0.98 -2.85 118.33 111.48 1o77 n VAL 702 Ca 0.29 -0.11 -0.41 0.00 -0.01 0.00 0.00 64.34 64.10 1o77 n VAL 702 Cb 0.39 -1.57 -0.01 0.00 -0.91 0.00 0.00 33.84 31.74 1o77 n VAL 702 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1o77 s LEU 703 N 8.31 4.36 0.37 7.52 1.43 -0.91 -4.66 118.68 135.10 1o77 s LEU 703 Ca 0.60 2.90 -0.11 0.00 -1.03 0.00 0.00 54.13 56.49 1o77 s LEU 703 Cb 0.02 -3.67 0.04 0.00 0.03 0.00 0.00 46.19 42.61 1o77 s LEU 703 CO 0.20 -0.74 0.68 -0.55 0.23 0.00 0.00 176.35 176.17 1o77 s SER 704 N -0.30 0.32 -0.05 2.29 0.15 -1.26 -1.16 113.70 113.70 1o77 s SER 704 Ca 0.51 -1.26 -0.22 0.00 0.70 0.00 0.00 55.95 55.69 1o77 s SER 704 Cb -0.44 0.79 -0.17 0.00 -1.71 0.00 0.00 66.02 64.49 1o77 s SER 704 CO 0.59 -1.55 0.92 -0.08 1.20 0.00 0.00 173.24 174.32 1o77 h GLU 705 N 2.04 -0.18 -0.24 5.44 4.81 -1.87 -3.15 114.58 121.43 1o77 h GLU 705 Ca -0.31 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.97 1o77 h GLU 705 Cb 1.25 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.61 1o77 h GLU 705 CO 0.40 0.28 -0.38 -0.91 -0.73 0.00 0.00 179.01 177.67 1o77 h ASN 706 N -0.82 -1.25 0.00 1.04 2.35 -1.98 -2.65 115.58 112.27 1o77 h ASN 706 Ca -0.02 0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1o77 h ASN 706 Cb 0.54 0.51 0.00 0.00 0.05 0.00 0.00 38.32 39.42 1o77 h ASN 706 CO 0.03 -0.28 0.00 0.33 -1.65 0.00 0.00 177.43 175.86 1o77 n PHE 707 N -4.51 0.00 -0.29 1.19 7.35 -1.24 0.97 117.46 120.93 1o77 n PHE 707 Ca -0.03 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 56.84 1o77 n PHE 707 Cb 0.24 -0.10 0.33 0.00 0.35 0.00 0.00 39.48 40.30 1o77 n PHE 707 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1o77 n VAL 708 N -1.45 -0.37 0.43 -2.13 0.31 -1.09 0.45 118.33 114.48 1o77 n VAL 708 Ca 0.00 1.87 -0.19 0.00 -0.01 0.00 0.00 64.34 66.01 1o77 n VAL 708 Cb 0.00 -2.82 -0.09 0.00 -0.91 0.00 0.00 33.84 30.02 1o77 n VAL 708 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1o77 h LYS 709 N 0.00 -1.06 -0.02 5.55 3.64 0.96 -3.24 116.57 122.40 1o77 h LYS 709 Ca 0.59 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 60.04 1o77 h LYS 709 Cb 1.35 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.41 1o77 h LYS 709 CO -0.77 -0.70 -0.02 -1.13 -2.27 0.00 0.00 179.45 174.56 1o77 n SER 710 N -5.54 2.21 -0.07 4.20 3.41 0.68 -4.70 113.62 113.82 1o77 n SER 710 Ca -0.15 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 1o77 n SER 710 Cb 0.44 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1o77 n SER 710 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1o77 n GLU 711 N 0.70 0.00 0.11 4.33 1.02 0.17 -4.97 120.64 122.00 1o77 n GLU 711 Ca 0.16 -0.11 -0.24 0.00 -0.02 0.00 0.00 57.16 56.96 1o77 n GLU 711 Cb 0.47 -0.09 -0.15 0.00 -0.02 0.00 0.00 31.44 31.65 1o77 n GLU 711 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 1o77 h TRP 712 N 0.00 0.83 -0.98 -0.32 2.91 -1.59 -3.37 115.95 113.43 1o77 h TRP 712 Ca 0.00 -0.61 0.21 0.00 1.13 0.00 0.00 58.89 59.62 1o77 h TRP 712 Cb 1.01 -0.03 -0.19 0.00 -0.51 0.00 0.00 29.16 29.44 1o77 h TRP 712 CO -0.03 1.60 -0.20 1.03 -1.03 0.00 0.00 178.44 179.81 1o77 h SER 713 N 0.08 -0.84 -0.98 2.65 0.87 -1.91 -0.41 113.55 113.00 1o77 h SER 713 Ca -0.29 0.29 0.26 0.00 -1.23 0.00 0.00 61.79 60.82 1o77 h SER 713 Cb 2.10 0.59 -0.18 0.00 -0.44 0.00 0.00 62.40 64.46 1o77 h SER 713 CO 0.22 -0.33 -0.01 0.11 -0.53 0.00 0.00 176.83 176.29 1o77 h LYS 714 N 0.00 0.01 0.00 2.24 1.57 -1.98 0.42 116.57 118.84 1o77 h LYS 714 Ca 0.49 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1o77 h LYS 714 Cb 0.81 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1o77 h LYS 714 CO -1.00 0.01 -0.42 0.66 -0.57 0.00 0.00 179.45 178.13 1o77 n TYR 715 N -5.50 0.35 0.11 -1.35 4.02 -0.18 -1.19 117.16 113.42 1o77 n TYR 715 Ca 0.22 0.10 -0.02 0.00 -0.01 0.00 0.00 57.90 58.19 1o77 n TYR 715 Cb 0.72 -0.55 0.02 0.00 -0.02 0.00 0.00 39.34 39.51 1o77 n TYR 715 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1o77 h GLU 716 N 0.00 0.00 0.00 -0.72 4.39 0.01 -3.37 114.58 114.89 1o77 h GLU 716 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1o77 h GLU 716 Cb 0.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 1o77 h GLU 716 CO 0.00 0.75 0.00 1.28 -1.16 0.00 0.00 179.01 179.88 1o77 n LEU 717 N -3.43 0.00 0.19 1.33 4.32 -1.05 -4.65 117.00 113.71 1o77 n LEU 717 Ca 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 56.01 55.85 1o77 n LEU 717 Cb 0.79 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.51 1o77 n LEU 717 CO 0.44 -0.04 0.71 0.44 -1.22 0.00 0.00 177.39 177.71 1o77 h ASP 718 N 0.00 -0.38 -0.82 -1.43 5.19 -1.66 -2.62 116.42 114.70 1o77 h ASP 718 Ca 0.00 -0.05 -0.48 0.00 -0.62 0.00 0.00 57.03 55.88 1o77 h ASP 718 Cb 0.00 0.10 -0.25 0.00 0.18 0.00 0.00 39.33 39.36 1o77 h ASP 718 CO 0.00 -0.19 0.62 0.49 -3.12 0.00 0.00 179.24 177.04 1o77 n PHE 719 N -5.24 2.58 1.51 4.55 0.99 -0.33 -4.40 117.46 117.12 1o77 n PHE 719 Ca -0.10 -2.07 0.14 0.00 -0.00 0.00 0.00 57.45 55.42 1o77 n PHE 719 Cb 0.22 -1.02 0.62 0.00 -1.00 0.00 0.00 39.48 38.29 1o77 n PHE 719 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1o77 n SER 720 N -0.69 0.73 0.09 4.37 2.88 -0.99 -3.36 113.62 116.65 1o77 n SER 720 Ca 0.50 -0.93 0.09 0.00 -1.33 0.00 0.00 58.87 57.20 1o77 n SER 720 Cb 1.11 -0.01 -0.02 0.00 -0.75 0.00 0.00 64.21 64.53 1o77 n SER 720 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o77 n HIS 721 N -0.62 0.96 1.39 0.66 1.44 -1.26 -3.68 115.22 114.11 1o77 n HIS 721 Ca 0.17 0.29 0.14 0.00 -2.01 0.00 0.00 57.72 56.31 1o77 n HIS 721 Cb 0.28 -0.98 0.74 0.00 0.12 0.00 0.00 29.99 30.14 1o77 n HIS 721 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1o77 n PHE 722 N -2.72 0.00 -4.13 -1.40 0.99 -1.21 -4.93 117.46 104.06 1o77 n PHE 722 Ca -0.02 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.10 1o77 n PHE 722 Cb 0.62 -0.28 -0.06 0.00 -1.00 0.00 0.00 39.48 38.76 1o77 n PHE 722 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1o77 n ARG 723 N -1.28 -0.72 0.00 -1.08 1.74 -1.24 -4.77 116.66 109.31 1o77 n ARG 723 Ca 0.14 0.05 0.01 0.00 -0.77 0.00 0.00 57.85 57.28 1o77 n ARG 723 Cb 0.23 -2.89 0.05 0.00 -1.02 0.00 0.00 32.46 28.83 1o77 n ARG 723 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1o77 n LEU 724 N -4.42 0.00 -3.25 0.55 4.77 -1.26 -4.83 117.00 108.56 1o77 n LEU 724 Ca -0.23 0.37 -0.25 0.00 -0.03 0.00 0.00 56.01 55.87 1o77 n LEU 724 Cb 0.60 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 1o77 n LEU 724 CO 0.74 -0.34 -0.25 0.49 -1.33 0.00 0.00 177.39 176.70 1o77 n PHE 725 N -1.37 0.17 -2.84 -1.77 3.01 -1.26 -4.13 117.46 109.27 1o77 n PHE 725 Ca 0.01 -3.63 -0.43 0.00 1.01 0.00 0.00 57.45 54.41 1o77 n PHE 725 Cb 0.02 -0.32 -0.04 0.00 -0.01 0.00 0.00 39.48 39.13 1o77 n PHE 725 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1o77 s ALA 731 N -1.24 3.10 -0.14 4.37 0.00 -1.26 -5.23 121.76 121.36 1o77 s ALA 731 Ca 0.35 -1.80 0.01 0.00 0.00 0.00 0.00 51.96 50.52 1o77 s ALA 731 Cb 0.15 -3.87 0.02 0.00 0.00 0.00 0.00 23.12 19.42 1o77 s ALA 731 CO -0.11 -2.79 -0.14 0.00 0.00 0.00 0.00 175.76 172.72 1o77 s ALA 732 N 4.15 1.82 0.27 0.00 0.00 -1.26 -4.22 121.76 122.51 1o77 s ALA 732 Ca 0.23 -0.86 -0.29 0.00 0.00 0.00 0.00 51.96 51.03 1o77 s ALA 732 Cb -0.16 -1.01 -0.09 0.00 0.00 0.00 0.00 23.12 21.85 1o77 s ALA 732 CO 0.11 -0.32 1.21 0.42 0.00 0.00 0.00 175.76 177.17 1o77 s ILE 733 N 1.39 3.23 -0.28 0.00 1.01 0.71 -4.96 121.20 122.30 1o77 s ILE 733 Ca 0.03 1.16 0.02 0.00 0.00 0.00 0.00 60.65 61.86 1o77 s ILE 733 Cb -0.13 -3.74 0.08 0.00 0.01 0.00 0.00 42.46 38.67 1o77 s ILE 733 CO -0.09 0.25 -0.01 -0.76 0.00 0.00 0.00 174.94 174.33 1o77 s LEU 734 N -1.18 3.43 0.46 2.97 1.43 -1.26 -1.11 118.68 123.41 1o77 s LEU 734 Ca 0.49 -1.60 -0.05 0.00 -1.03 0.00 0.00 54.13 51.94 1o77 s LEU 734 Cb -0.35 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 1o77 s LEU 734 CO 0.44 -0.29 0.75 -0.63 0.23 0.00 0.00 176.35 176.84 1o77 s ILE 735 N 1.20 4.93 -0.38 -0.59 1.01 -1.13 -1.64 121.20 124.59 1o77 s ILE 735 Ca 0.01 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.82 1o77 s ILE 735 Cb -0.19 -3.85 0.14 0.00 0.01 0.00 0.00 42.46 38.56 1o77 s ILE 735 CO -0.09 -0.78 0.21 -0.22 0.00 0.00 0.00 174.94 174.07 1o77 s LEU 736 N -4.59 1.56 0.49 2.97 2.96 -0.30 -2.13 118.68 119.64 1o77 s LEU 736 Ca 0.47 -2.29 0.28 0.00 -0.22 0.00 0.00 54.13 52.37 1o77 s LEU 736 Cb -0.10 -0.62 1.19 0.00 0.50 0.00 0.00 46.19 47.16 1o77 s LEU 736 CO 0.42 -0.30 1.93 0.25 -1.32 0.00 0.00 176.35 177.33 1o77 h LEU 737 N 6.99 0.00 -7.41 -0.68 5.85 -1.41 0.32 115.31 118.97 1o77 h LEU 737 Ca 0.02 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1o77 h LEU 737 Cb 0.96 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.88 1o77 h LEU 737 CO 0.35 0.14 0.10 -1.83 -0.34 0.00 0.00 178.44 176.86 1o77 s GLU 738 N -3.77 1.33 0.63 1.25 -1.05 -1.26 -4.70 118.70 111.14 1o77 s GLU 738 Ca -0.00 -0.70 -0.17 0.00 -0.15 0.00 0.00 54.97 53.95 1o77 s GLU 738 Cb 0.10 0.55 -0.01 0.00 -0.44 0.00 0.00 34.13 34.33 1o77 s GLU 738 CO 0.59 -0.57 1.15 -1.25 0.95 0.00 0.00 175.26 176.13 1o77 s PRO 739 N -3.82 2.86 -0.15 -4.83 0.04 -1.26 -4.80 135.00 123.03 1o77 s PRO 739 Ca 0.05 1.58 -0.11 0.00 0.04 0.00 0.00 61.00 62.57 1o77 s PRO 739 Cb -0.01 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 32.64 1o77 s PRO 739 CO -0.07 -1.24 0.39 0.42 0.04 0.00 0.00 177.00 176.54 1o77 s ILE 740 N -2.01 -0.02 -0.36 0.56 1.01 -1.26 -4.71 121.20 114.41 1o77 s ILE 740 Ca 0.71 0.06 -0.29 0.00 0.00 0.00 0.00 60.65 61.13 1o77 s ILE 740 Cb -0.24 -0.56 0.02 0.00 0.01 0.00 0.00 42.46 41.68 1o77 s ILE 740 CO 0.37 0.02 1.07 -1.61 0.00 0.00 0.00 174.94 174.80 1o77 s GLU 741 N 0.86 3.97 0.00 2.79 0.41 -1.26 -4.89 118.70 120.59 1o77 s GLU 741 Ca -0.05 0.91 0.00 0.00 -0.41 0.00 0.00 54.97 55.42 1o77 s GLU 741 Cb -0.06 -3.78 0.00 0.00 -1.78 0.00 0.00 34.13 28.51 1o77 s GLU 741 CO -0.07 -1.01 0.40 0.36 -0.49 0.00 0.00 175.26 174.46 1o77 n LYS 742 N 7.07 0.00 0.00 1.61 2.85 -1.26 0.46 118.16 128.89 1o77 n LYS 742 Ca 0.11 0.03 0.10 0.00 -1.05 0.00 0.00 58.31 57.51 1o77 n LYS 742 Cb 0.48 -1.51 -0.08 0.00 -0.65 0.00 0.00 35.03 33.26 1o77 n LYS 742 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1o77 n LYS 743 N -0.90 0.10 -0.27 -1.58 5.02 -1.26 -4.12 118.16 115.15 1o77 n LYS 743 Ca 0.00 -0.08 0.12 0.00 -2.02 0.00 0.00 58.31 56.33 1o77 n LYS 743 Cb 0.01 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 33.79 1o77 n LYS 743 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1o77 n ALA 744 N -1.38 2.41 -2.63 7.82 0.00 0.17 -4.89 120.51 122.00 1o77 n ALA 744 Ca 0.05 -1.10 -0.40 0.00 0.00 0.00 0.00 53.44 51.99 1o77 n ALA 744 Cb 0.34 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 1o77 n ALA 744 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1o77 s ILE 745 N -1.30 5.08 0.15 0.00 1.01 -1.25 -5.03 121.20 119.87 1o77 s ILE 745 Ca 0.43 0.90 -0.33 0.00 0.00 0.00 0.00 60.65 61.64 1o77 s ILE 745 Cb 0.24 -3.83 -0.16 0.00 0.01 0.00 0.00 42.46 38.71 1o77 s ILE 745 CO 0.32 0.11 1.11 -2.65 0.00 0.00 0.00 174.94 173.83 1o77 n PRO 746 N 5.31 0.93 0.02 2.79 -0.02 -1.26 -4.83 135.00 137.94 1o77 n PRO 746 Ca -0.04 0.33 0.06 0.00 -2.02 0.00 0.00 63.50 61.83 1o77 n PRO 746 Cb 0.50 -1.79 0.28 0.00 -0.02 0.00 0.00 33.50 32.47 1o77 n PRO 746 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1o77 n GLN 747 N 1.69 0.03 0.21 -0.52 -0.06 -1.26 -1.40 117.38 116.07 1o77 n GLN 747 Ca 0.16 0.34 0.12 0.00 -2.00 0.00 0.00 57.00 55.62 1o77 n GLN 747 Cb 0.22 -1.57 0.20 0.00 -4.06 0.00 0.00 30.24 25.04 1o77 n GLN 747 CO 0.00 0.00 0.00 0.07 -0.20 0.00 0.00 177.06 176.93 1o77 h ARG 748 N 0.00 0.00 -2.07 3.69 0.11 -2.05 -3.34 114.38 110.72 1o77 h ARG 748 Ca 0.00 0.00 -0.39 0.00 0.10 0.00 0.00 59.98 59.69 1o77 h ARG 748 Cb 0.21 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 31.16 1o77 h ARG 748 CO 0.00 0.00 0.30 1.19 0.10 0.00 0.00 179.97 181.56 1o77 n PHE 749 N -2.99 1.01 -0.16 4.08 0.99 -0.49 -4.78 117.46 115.11 1o77 n PHE 749 Ca 0.04 -1.84 -0.04 0.00 -0.00 0.00 0.00 57.45 55.61 1o77 n PHE 749 Cb 0.52 -1.54 -0.04 0.00 -1.00 0.00 0.00 39.48 37.42 1o77 n PHE 749 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1o77 h LYS 751 N 0.00 0.02 -0.02 0.00 1.79 -1.95 0.76 116.57 117.18 1o77 h LYS 751 Ca 0.06 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1o77 h LYS 751 Cb 0.16 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1o77 h LYS 751 CO -0.36 0.01 0.03 1.25 -1.08 0.00 0.00 179.45 179.31 1o77 h LEU 752 N 0.02 0.00 0.36 2.94 5.85 -1.52 -1.40 115.31 121.57 1o77 h LEU 752 Ca 0.33 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.03 1o77 h LEU 752 Cb 0.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1o77 h LEU 752 CO -0.66 0.00 -0.17 0.03 -0.34 0.00 0.00 178.44 177.29 1o77 h ARG 753 N 0.00 -0.47 -1.33 1.25 3.08 0.12 -2.29 114.38 114.75 1o77 h ARG 753 Ca 0.01 0.03 0.47 0.00 0.07 0.00 0.00 59.98 60.56 1o77 h ARG 753 Cb 0.07 0.11 -0.14 0.00 0.08 0.00 0.00 29.97 30.09 1o77 h ARG 753 CO -0.00 -0.31 0.84 -0.22 -1.07 0.00 0.00 179.97 179.21 1o77 h LYS 754 N -0.57 0.01 -0.51 0.04 3.64 -0.97 0.92 116.57 119.15 1o77 h LYS 754 Ca -0.05 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1o77 h LYS 754 Cb 0.37 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1o77 h LYS 754 CO 0.08 0.01 0.27 0.82 -2.27 0.00 0.00 179.45 178.36 1o77 h ILE 755 N 0.01 1.18 -0.01 2.00 1.08 -0.97 -1.60 117.51 119.19 1o77 h ILE 755 Ca 0.87 -0.47 0.00 0.00 -0.39 0.00 0.00 64.86 64.87 1o77 h ILE 755 Cb 2.74 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 37.05 1o77 h ILE 755 CO -0.50 0.19 0.00 0.23 -0.69 0.00 0.00 178.15 177.38 1o77 n MET 756 N -4.64 1.09 -0.05 2.37 2.81 0.32 -2.83 117.12 116.20 1o77 n MET 756 Ca 0.02 -0.14 -0.06 0.00 -1.81 0.00 0.00 57.70 55.72 1o77 n MET 756 Cb 0.09 -1.39 -0.02 0.00 -0.71 0.00 0.00 33.22 31.19 1o77 n MET 756 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1o77 n ASN 757 N -0.74 1.44 0.00 7.83 4.13 -0.91 -4.37 115.26 122.64 1o77 n ASN 757 Ca 0.18 0.23 0.03 0.00 1.68 0.00 0.00 54.58 56.71 1o77 n ASN 757 Cb 0.12 -0.60 0.19 0.00 -1.54 0.00 0.00 39.78 37.94 1o77 n ASN 757 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1o77 n THR 758 N -3.93 0.53 -3.03 3.41 -2.24 -0.65 -4.78 114.28 103.59 1o77 n THR 758 Ca -0.09 0.13 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 1o77 n THR 758 Cb 0.33 -1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 67.51 1o77 n THR 758 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1o77 n LYS 759 N -1.17 -2.32 -2.51 -0.78 5.02 -1.13 -4.83 118.16 110.44 1o77 n LYS 759 Ca 0.04 0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 55.97 1o77 n LYS 759 Cb 0.04 -4.46 -0.03 0.00 -0.02 0.00 0.00 35.03 30.56 1o77 n LYS 759 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1o77 s THR 760 N -2.31 3.81 -0.10 -0.18 -4.23 -1.25 -4.90 115.64 106.49 1o77 s THR 760 Ca 0.23 -0.34 -0.33 0.00 -1.18 0.00 0.00 61.69 60.08 1o77 s THR 760 Cb -0.14 -4.93 0.14 0.00 1.34 0.00 0.00 72.50 68.92 1o77 s THR 760 CO 0.29 -1.83 1.35 -0.72 -0.54 0.00 0.00 174.62 173.16 1o77 s TYR 761 N 5.62 -0.03 -0.51 3.99 -0.85 -1.26 -4.72 117.35 119.58 1o77 s TYR 761 Ca 0.44 -0.01 -0.17 0.00 -0.52 0.00 0.00 57.07 56.81 1o77 s TYR 761 Cb -0.03 0.52 0.08 0.00 0.38 0.00 0.00 41.96 42.91 1o77 s TYR 761 CO -0.01 -0.14 0.54 -0.51 -1.52 0.00 0.00 175.55 173.91 1o77 s LEU 762 N -2.75 5.48 -0.10 -3.49 1.43 -0.65 -4.94 118.68 113.66 1o77 s LEU 762 Ca 0.13 -1.30 -0.30 0.00 -1.03 0.00 0.00 54.13 51.64 1o77 s LEU 762 Cb 0.04 -2.29 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 1o77 s LEU 762 CO -0.05 -0.84 1.10 -0.70 0.23 0.00 0.00 176.35 176.09 1o77 s GLU 763 N 2.12 4.37 -0.55 1.70 2.12 -1.26 -1.15 118.70 126.05 1o77 s GLU 763 Ca 0.08 1.51 -0.28 0.00 0.36 0.00 0.00 54.97 56.64 1o77 s GLU 763 Cb -0.24 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.61 1o77 s GLU 763 CO 0.08 -0.41 1.32 -0.46 -0.54 0.00 0.00 175.26 175.24 1o77 s TRP 764 N 2.25 2.44 0.52 5.30 -0.11 0.10 -4.93 118.94 124.51 1o77 s TRP 764 Ca 0.51 0.48 -0.23 0.00 1.22 0.00 0.00 56.10 58.09 1o77 s TRP 764 Cb -0.21 -4.44 -0.06 0.00 -1.50 0.00 0.00 33.47 27.27 1o77 s TRP 764 CO 0.18 -1.80 1.37 -0.35 -4.62 0.00 0.00 176.95 171.74 1o77 n PRO 765 N 8.48 1.83 0.17 5.86 -0.04 -1.26 -4.79 135.00 145.25 1o77 n PRO 765 Ca 0.11 0.67 0.07 0.00 -0.04 0.00 0.00 63.50 64.31 1o77 n PRO 765 Cb 0.49 -2.59 0.08 0.00 -0.04 0.00 0.00 33.50 31.45 1o77 n PRO 765 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1o77 h MET 766 N 1.65 0.00 -6.04 0.54 2.86 -1.98 -3.44 114.93 108.52 1o77 h MET 766 Ca -0.51 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 56.56 1o77 h MET 766 Cb 1.30 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 1o77 h MET 766 CO 0.58 0.27 1.44 -0.51 1.06 0.00 0.00 176.91 179.75 1o77 s ASP 767 N -6.30 5.47 0.00 1.22 1.01 -1.26 -4.79 116.67 112.02 1o77 s ASP 767 Ca 0.05 1.57 0.02 0.00 0.71 0.00 0.00 52.55 54.90 1o77 s ASP 767 Cb 0.07 -2.51 0.10 0.00 1.01 0.00 0.00 42.92 41.58 1o77 s ASP 767 CO 0.72 -2.00 0.37 1.21 0.21 0.00 0.00 175.17 175.68 1o77 n GLU 768 N 8.70 0.15 -0.03 8.23 2.13 -1.26 -2.25 120.64 136.31 1o77 n GLU 768 Ca 0.28 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 58.05 1o77 n GLU 768 Cb 0.47 -1.18 -0.02 0.00 0.27 0.00 0.00 31.44 30.97 1o77 n GLU 768 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1o77 n ALA 769 N -0.68 2.36 0.89 4.31 0.00 -1.26 -4.67 120.51 121.46 1o77 n ALA 769 Ca 0.01 -0.23 0.07 0.00 0.00 0.00 0.00 53.44 53.29 1o77 n ALA 769 Cb 0.01 0.41 0.42 0.00 0.00 0.00 0.00 19.45 20.29 1o77 n ALA 769 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1o77 n GLN 770 N -3.05 0.44 0.13 0.00 6.02 -0.95 -2.76 117.38 117.21 1o77 n GLN 770 Ca -0.11 0.01 -0.23 0.00 -0.01 0.00 0.00 57.00 56.66 1o77 n GLN 770 Cb 0.59 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 30.19 1o77 n GLN 770 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1o77 h ARG 771 N 0.00 0.48 -0.55 -1.09 3.08 -1.81 -3.19 114.38 111.30 1o77 h ARG 771 Ca 0.00 -0.81 0.16 0.00 0.07 0.00 0.00 59.98 59.40 1o77 h ARG 771 Cb 0.01 0.30 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1o77 h ARG 771 CO 0.00 1.39 0.63 1.49 -1.07 0.00 0.00 179.97 182.40 1o77 h GLU 772 N 0.13 0.00 0.00 0.04 4.81 -1.83 0.49 114.58 118.23 1o77 h GLU 772 Ca -0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1o77 h GLU 772 Cb 2.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.51 1o77 h GLU 772 CO 0.25 0.00 -0.96 0.41 -0.73 0.00 0.00 179.01 177.99 1o77 n GLY 773 N -1.53 -1.09 0.25 1.92 0.00 -1.21 -4.04 105.19 99.49 1o77 n GLY 773 Ca 0.11 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 1o77 n GLY 773 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1o77 h PHE 774 N 0.00 -0.52 -0.14 1.61 3.57 -0.02 -2.16 116.94 119.28 1o77 h PHE 774 Ca 0.00 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.53 1o77 h PHE 774 Cb 0.57 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1o77 h PHE 774 CO 0.00 -0.20 0.20 -1.49 -2.23 0.00 0.00 178.31 174.58 1o77 h TRP 775 N -1.00 0.00 0.04 0.41 4.06 -1.72 0.56 115.95 118.30 1o77 h TRP 775 Ca -0.06 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 60.66 1o77 h TRP 775 Cb 0.55 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.69 1o77 h TRP 775 CO 0.02 0.00 -1.11 0.28 -3.56 0.00 0.00 178.44 174.07 1o77 h VAL 776 N 0.00 1.61 0.00 1.49 2.07 -1.68 -1.81 116.25 117.93 1o77 h VAL 776 Ca 0.06 -3.28 -0.11 0.00 0.82 0.00 0.00 66.70 64.19 1o77 h VAL 776 Cb 0.46 2.86 -0.02 0.00 -1.52 0.00 0.00 31.29 33.07 1o77 h VAL 776 CO -0.00 0.93 -0.53 0.78 0.02 0.00 0.00 177.57 178.77 1o77 h ASN 777 N 0.02 0.00 0.00 0.57 2.35 0.10 -2.87 115.58 115.75 1o77 h ASN 777 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1o77 h ASN 777 Cb 1.84 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.21 1o77 h ASN 777 CO 0.15 0.53 0.00 -0.11 -1.65 0.00 0.00 177.43 176.35 1o77 n LEU 778 N -3.36 0.00 -0.30 1.61 7.94 0.16 -2.22 117.00 120.83 1o77 n LEU 778 Ca 0.01 0.82 -0.03 0.00 -1.11 0.00 0.00 56.01 55.70 1o77 n LEU 778 Cb 0.68 -0.50 0.03 0.00 0.53 0.00 0.00 43.42 44.16 1o77 n LEU 778 CO 0.40 -0.50 0.61 0.03 -1.11 0.00 0.00 177.39 176.82 1o77 h ARG 779 N 0.00 -0.07 -0.30 1.96 3.08 -1.44 0.92 114.38 118.53 1o77 h ARG 779 Ca 0.00 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.14 1o77 h ARG 779 Cb 0.00 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1o77 h ARG 779 CO 0.00 -0.05 0.32 0.00 -1.07 0.00 0.00 179.97 179.17 1o77 h ALA 780 N 1.23 1.98 0.13 0.04 0.00 -1.59 0.58 119.26 121.63 1o77 h ALA 780 Ca 0.30 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.97 1o77 h ALA 780 Cb 0.58 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.42 1o77 h ALA 780 CO -0.85 -0.47 -0.99 0.00 0.00 0.00 0.00 179.25 176.94 1o77 h ALA 781 N 1.65 -0.05 0.30 0.00 0.00 0.13 -2.31 119.26 118.97 1o77 h ALA 781 Ca 0.14 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 1o77 h ALA 781 Cb 0.78 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1o77 h ALA 781 CO -0.00 0.50 -0.14 0.82 0.00 0.00 0.00 179.25 180.42 1o77 h ILE 782 N -0.07 0.00 0.00 0.00 2.04 0.45 -2.84 117.51 117.09 1o77 h ILE 782 Ca -0.16 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1o77 h ILE 782 Cb 1.73 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1o77 h ILE 782 CO 0.19 0.00 0.03 0.29 0.00 0.00 0.00 178.15 178.66 1o77 n LYS 783 N -3.24 0.00 0.00 2.37 4.76 0.18 -4.86 118.16 117.37 1o77 n LYS 783 Ca -0.05 0.31 0.03 0.00 -2.87 0.00 0.00 58.31 55.73 1o77 n LYS 783 Cb 0.16 -1.53 0.17 0.00 -1.84 0.00 0.00 35.03 31.99 1o77 n LYS 783 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48