#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zla s HIS 639 N 0.00 3.36 -0.30 6.00 2.46 -1.26 -5.08 115.29 120.48 1zla s HIS 639 Ca 0.00 1.40 -0.17 0.00 0.47 0.00 0.00 55.06 56.76 1zla s HIS 639 Cb 0.00 -2.82 0.18 0.00 -0.13 0.00 0.00 32.58 29.81 1zla s HIS 639 CO 0.00 -0.83 1.14 0.50 -2.47 0.00 0.00 174.74 173.08 1zla s ARG 640 N -4.74 0.15 0.28 2.88 3.52 -1.26 -5.16 118.95 114.63 1zla s ARG 640 Ca 0.58 0.37 -0.29 0.00 -0.13 0.00 0.00 55.73 56.26 1zla s ARG 640 Cb -0.12 0.22 -0.10 0.00 -1.56 0.00 0.00 34.95 33.39 1zla s ARG 640 CO 0.47 -0.07 1.11 0.71 -0.81 0.00 0.00 175.30 176.71 1zla s TYR 641 N 2.35 3.55 0.61 5.12 1.51 -1.26 -5.01 117.35 124.22 1zla s TYR 641 Ca -0.01 1.69 -0.19 0.00 -1.01 0.00 0.00 57.07 57.54 1zla s TYR 641 Cb -0.04 -3.30 -0.02 0.00 -0.11 0.00 0.00 41.96 38.48 1zla s TYR 641 CO -0.16 -0.62 1.29 1.03 -1.11 0.00 0.00 175.55 175.99 1zla s ARG 642 N -1.48 2.78 0.11 -0.62 0.52 -1.26 -4.86 118.95 114.14 1zla s ARG 642 Ca 0.45 2.06 -0.31 0.00 -0.52 0.00 0.00 55.73 57.40 1zla s ARG 642 Cb -0.32 -1.96 -0.10 0.00 0.52 0.00 0.00 34.95 33.08 1zla s ARG 642 CO 0.42 -1.42 1.87 -0.35 0.02 0.00 0.00 175.30 175.84 1zla n PRO 643 N -1.63 2.83 0.00 3.54 -0.04 -1.26 -2.14 135.00 136.29 1zla n PRO 643 Ca 0.14 1.03 0.00 0.00 -0.04 0.00 0.00 63.50 64.63 1zla n PRO 643 Cb 0.48 -2.94 0.00 0.00 -0.04 0.00 0.00 33.50 31.00 1zla n PRO 643 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zla n GLY 644 N 4.31 1.89 0.07 0.55 0.00 -1.26 -4.97 105.19 105.78 1zla n GLY 644 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1zla n GLY 644 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1zla h THR 645 N 0.00 1.25 -0.68 2.61 2.02 -1.78 -1.19 112.91 115.13 1zla h THR 645 Ca 0.00 -0.89 -0.07 0.00 0.77 0.00 0.00 66.41 66.21 1zla h THR 645 Cb 0.00 1.84 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 1zla h THR 645 CO 0.00 0.23 0.13 0.58 0.37 0.00 0.00 175.52 176.83 1zla h VAL 646 N -0.43 1.26 -0.66 3.16 2.07 -1.93 -0.87 116.25 118.85 1zla h VAL 646 Ca -0.00 -1.01 0.06 0.00 0.82 0.00 0.00 66.70 66.57 1zla h VAL 646 Cb 0.40 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1zla h VAL 646 CO 0.01 0.38 0.36 0.00 0.02 0.00 0.00 177.57 178.34 1zla h ALA 647 N 1.06 0.88 -0.22 1.67 0.00 -1.92 0.39 119.26 121.12 1zla h ALA 647 Ca 0.21 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1zla h ALA 647 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1zla h ALA 647 CO 0.01 0.03 -0.31 -0.07 0.00 0.00 0.00 179.25 178.90 1zla h LEU 648 N 0.66 0.46 -0.67 0.00 3.38 -0.86 -1.38 115.31 116.91 1zla h LEU 648 Ca 0.30 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1zla h LEU 648 Cb 0.20 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1zla h LEU 648 CO -0.19 0.76 0.31 0.03 0.09 0.00 0.00 178.44 179.43 1zla h ARG 649 N 0.39 0.97 -0.36 1.13 3.08 0.50 -2.40 114.38 117.70 1zla h ARG 649 Ca 0.05 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1zla h ARG 649 Cb 0.74 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1zla h ARG 649 CO 0.06 0.79 0.12 0.93 -1.07 0.00 0.00 179.97 180.80 1zla h GLU 650 N 0.93 0.56 -0.35 0.04 5.08 0.23 -0.87 114.58 120.20 1zla h GLU 650 Ca 0.23 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1zla h GLU 650 Cb 0.15 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1zla h GLU 650 CO -0.03 0.57 0.11 0.82 -1.00 0.00 0.00 179.01 179.49 1zla h ILE 651 N 0.44 0.89 -0.89 3.13 1.08 -1.11 0.20 117.51 121.25 1zla h ILE 651 Ca 0.12 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.50 1zla h ILE 651 Cb 0.24 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 34.55 1zla h ILE 651 CO -0.01 0.05 0.56 0.03 -0.69 0.00 0.00 178.15 178.10 1zla h ARG 652 N 0.26 1.19 0.47 2.37 3.08 -1.23 -0.73 114.38 119.78 1zla h ARG 652 Ca 0.16 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1zla h ARG 652 Cb 0.14 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1zla h ARG 652 CO -0.17 0.81 -0.23 -0.09 -1.07 0.00 0.00 179.97 179.22 1zla h ARG 653 N 1.22 -0.61 0.00 0.04 2.43 -0.05 -3.01 114.38 114.40 1zla h ARG 653 Ca 0.32 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.52 1zla h ARG 653 Cb -0.10 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1zla h ARG 653 CO -0.07 -0.31 -0.08 1.88 -1.51 0.00 0.00 179.97 179.88 1zla h TYR 654 N -1.03 0.00 0.00 2.20 -1.99 -0.62 0.11 116.97 115.65 1zla h TYR 654 Ca -0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.67 1zla h TYR 654 Cb 0.58 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.31 1zla h TYR 654 CO 0.01 0.08 0.00 1.04 -0.00 0.00 0.00 178.16 179.30 1zla n GLN 655 N -3.54 0.30 -0.07 4.88 6.02 -0.29 -3.07 117.38 121.62 1zla n GLN 655 Ca -0.02 0.02 -0.08 0.00 -0.01 0.00 0.00 57.00 56.92 1zla n GLN 655 Cb 0.21 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.82 1zla n GLN 655 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1zla n LYS 656 N -1.34 0.67 -2.91 -1.09 4.81 0.01 -4.98 118.16 113.32 1zla n LYS 656 Ca 0.12 0.08 -0.18 0.00 -0.87 0.00 0.00 58.31 57.46 1zla n LYS 656 Cb 0.24 -1.61 0.02 0.00 0.02 0.00 0.00 35.03 33.70 1zla n LYS 656 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1zla s SER 657 N -5.63 5.49 -0.05 3.14 1.04 -1.08 -5.04 113.70 111.57 1zla s SER 657 Ca -0.08 -0.36 0.07 0.00 0.48 0.00 0.00 55.95 56.06 1zla s SER 657 Cb 0.07 -0.61 0.10 0.00 0.10 0.00 0.00 66.02 65.68 1zla s SER 657 CO 0.83 -0.93 1.02 0.35 0.98 0.00 0.00 173.24 175.49 1zla n THR 658 N -2.03 0.69 -2.38 2.02 -2.24 -1.26 -4.96 114.28 104.12 1zla n THR 658 Ca 0.09 -0.82 -0.31 0.00 -2.27 0.00 0.00 64.05 60.74 1zla n THR 658 Cb 0.59 0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 69.08 1zla n THR 658 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1zla s GLU 659 N -1.03 3.77 0.37 -0.78 1.03 -1.26 -5.02 118.70 115.78 1zla s GLU 659 Ca 0.11 0.70 -0.26 0.00 0.03 0.00 0.00 54.97 55.55 1zla s GLU 659 Cb 0.10 -2.21 -0.09 0.00 -0.80 0.00 0.00 34.13 31.13 1zla s GLU 659 CO 0.01 -0.29 1.15 -0.51 -1.33 0.00 0.00 175.26 174.28 1zla s LEU 660 N -4.41 4.26 0.00 1.83 1.43 -1.26 -4.96 118.68 115.57 1zla s LEU 660 Ca 0.55 2.31 0.24 0.00 -1.03 0.00 0.00 54.13 56.19 1zla s LEU 660 Cb -0.10 -3.96 0.19 0.00 0.03 0.00 0.00 46.19 42.35 1zla s LEU 660 CO 0.39 -0.55 1.23 0.18 0.23 0.00 0.00 176.35 177.84 1zla n LEU 661 N 0.29 2.42 -4.71 1.79 4.77 -1.26 -4.90 117.00 115.40 1zla n LEU 661 Ca 0.03 -0.84 -0.35 0.00 -0.03 0.00 0.00 56.01 54.82 1zla n LEU 661 Cb 0.46 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.46 1zla n LEU 661 CO 0.51 0.42 -0.28 -0.63 -1.33 0.00 0.00 177.39 176.08 1zla s ILE 662 N -2.22 4.53 0.20 -0.08 1.01 -1.26 -5.05 121.20 118.32 1zla s ILE 662 Ca 0.24 -0.16 -0.33 0.00 0.00 0.00 0.00 60.65 60.41 1zla s ILE 662 Cb 0.19 -2.93 -0.14 0.00 0.01 0.00 0.00 42.46 39.59 1zla s ILE 662 CO 0.42 0.60 1.41 0.54 0.00 0.00 0.00 174.94 177.91 1zla n ARG 663 N 2.24 1.87 0.33 2.79 5.12 -1.26 -4.91 116.66 122.84 1zla n ARG 663 Ca -0.19 0.67 -0.13 0.00 -1.93 0.00 0.00 57.85 56.27 1zla n ARG 663 Cb 0.54 -2.33 -0.06 0.00 -1.16 0.00 0.00 32.46 29.44 1zla n ARG 663 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1zla h LYS 664 N 4.59 -0.82 -0.62 5.56 1.57 -1.96 -2.37 116.57 122.52 1zla h LYS 664 Ca -0.45 0.06 0.13 0.00 -1.87 0.00 0.00 60.65 58.52 1zla h LYS 664 Cb 1.28 0.19 -0.10 0.00 0.08 0.00 0.00 32.23 33.68 1zla h LYS 664 CO 0.79 -0.55 0.01 1.25 -0.57 0.00 0.00 179.45 180.38 1zla h LEU 665 N -1.00 -0.25 -0.23 2.94 5.85 -2.00 -1.43 115.31 119.19 1zla h LEU 665 Ca -0.09 0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.83 1zla h LEU 665 Cb 0.65 0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 1zla h LEU 665 CO 0.14 -0.11 -0.07 -0.65 -0.34 0.00 0.00 178.44 177.42 1zla h PRO 666 N 0.13 -0.02 -0.86 5.25 0.11 -1.96 -2.24 132.00 132.42 1zla h PRO 666 Ca 0.33 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.50 1zla h PRO 666 Cb 0.53 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.58 1zla h PRO 666 CO -0.52 -0.01 0.53 0.35 -0.21 0.00 0.00 178.00 178.14 1zla h PHE 667 N -0.02 0.98 -0.70 0.65 3.57 -0.76 -2.36 116.94 118.30 1zla h PHE 667 Ca 0.11 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.73 1zla h PHE 667 Cb 0.19 -0.31 -0.07 0.00 2.79 0.00 0.00 35.95 38.54 1zla h PHE 667 CO -0.25 0.49 0.35 0.37 -2.23 0.00 0.00 178.31 177.05 1zla h GLN 668 N 0.96 0.58 -0.01 1.11 4.15 -0.70 -1.79 115.11 119.41 1zla h GLN 668 Ca 0.37 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.76 1zla h GLN 668 Cb 0.18 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.74 1zla h GLN 668 CO -0.18 0.38 0.00 0.00 -1.93 0.00 0.00 178.83 177.11 1zla h ARG 669 N 0.60 0.01 -0.87 1.69 3.08 -1.12 0.13 114.38 117.90 1zla h ARG 669 Ca 0.34 -0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.60 1zla h ARG 669 Cb 0.35 -0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.28 1zla h ARG 669 CO -0.26 0.18 0.35 1.25 -1.07 0.00 0.00 179.97 180.42 1zla h LEU 670 N -0.17 0.27 -0.17 3.04 5.85 -1.13 1.00 115.31 124.01 1zla h LEU 670 Ca 0.00 0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1zla h LEU 670 Cb 0.18 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 1zla h LEU 670 CO -0.00 -0.00 -0.06 0.58 -0.34 0.00 0.00 178.44 178.61 1zla h VAL 671 N 0.38 1.30 -0.02 1.05 2.07 -0.84 -0.24 116.25 119.95 1zla h VAL 671 Ca 0.53 -1.08 -0.05 0.00 0.82 0.00 0.00 66.70 66.92 1zla h VAL 671 Cb 0.98 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 1zla h VAL 671 CO -0.52 0.32 -0.25 0.03 0.02 0.00 0.00 177.57 177.17 1zla h ARG 672 N 0.03 0.04 0.19 1.57 3.08 0.10 0.75 114.38 120.14 1zla h ARG 672 Ca 0.04 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1zla h ARG 672 Cb 0.52 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1zla h ARG 672 CO 0.02 0.28 -0.09 1.49 -1.07 0.00 0.00 179.97 180.60 1zla h GLU 673 N 0.03 -0.25 -0.76 0.04 4.81 0.12 -0.19 114.58 118.39 1zla h GLU 673 Ca 0.00 0.02 0.15 0.00 -0.13 0.00 0.00 59.36 59.40 1zla h GLU 673 Cb 0.46 0.06 -0.14 0.00 0.63 0.00 0.00 28.75 29.75 1zla h GLU 673 CO 0.03 -0.16 -0.19 0.82 -0.73 0.00 0.00 179.01 178.78 1zla h ILE 674 N -0.46 0.24 -0.62 2.32 1.08 -1.03 0.18 117.51 119.22 1zla h ILE 674 Ca -0.03 -0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.45 1zla h ILE 674 Cb 0.20 0.24 -0.03 0.00 -3.07 0.00 0.00 36.82 34.16 1zla h ILE 674 CO 0.04 0.00 0.41 0.00 -0.69 0.00 0.00 178.15 177.91 1zla h ALA 675 N 1.76 0.79 -0.49 1.87 0.00 -0.91 -2.68 119.26 119.60 1zla h ALA 675 Ca 0.37 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1zla h ALA 675 Cb 0.56 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1zla h ALA 675 CO -0.78 0.21 0.22 0.37 0.00 0.00 0.00 179.25 179.26 1zla h GLN 676 N 0.83 0.70 0.00 0.00 4.15 0.12 -0.70 115.11 120.21 1zla h GLN 676 Ca 0.23 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.56 1zla h GLN 676 Cb -0.08 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.48 1zla h GLN 676 CO -0.06 0.56 0.00 -0.25 -1.93 0.00 0.00 178.83 177.15 1zla n ASP 677 N -4.37 0.26 -0.01 -0.69 8.00 -0.42 -2.78 116.55 116.54 1zla n ASP 677 Ca 0.04 0.55 -0.03 0.00 0.71 0.00 0.00 54.79 56.06 1zla n ASP 677 Cb 0.14 -0.61 -0.12 0.00 -0.02 0.00 0.00 41.12 40.52 1zla n ASP 677 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1zla n PHE 678 N -1.77 0.74 -3.64 1.24 3.01 -0.35 -4.95 117.46 111.74 1zla n PHE 678 Ca 0.05 0.25 -0.05 0.00 1.01 0.00 0.00 57.45 58.71 1zla n PHE 678 Cb 0.27 -1.05 -0.07 0.00 -0.01 0.00 0.00 39.48 38.62 1zla n PHE 678 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1zla s LYS 679 N -2.82 0.33 0.58 -1.08 2.36 -0.74 -5.13 119.74 113.25 1zla s LYS 679 Ca -0.05 0.44 -0.06 0.00 -2.55 0.00 0.00 55.97 53.75 1zla s LYS 679 Cb 0.08 0.13 0.01 0.00 -1.05 0.00 0.00 37.83 37.00 1zla s LYS 679 CO 0.82 -0.05 0.89 0.95 1.55 0.00 0.00 175.35 179.52 1zla s THR 680 N 0.49 3.71 -1.41 3.43 -4.23 -1.25 -4.03 115.64 112.35 1zla s THR 680 Ca 0.01 0.01 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 1zla s THR 680 Cb -0.04 -3.47 0.01 0.00 1.34 0.00 0.00 72.50 70.34 1zla s THR 680 CO -0.11 -0.48 0.54 0.47 -0.54 0.00 0.00 174.62 174.50 1zla n ASP 681 N -2.57 -0.92 -4.93 3.99 9.92 -1.26 -4.98 116.55 115.81 1zla n ASP 681 Ca 0.04 -0.95 -0.27 0.00 -0.53 0.00 0.00 54.79 53.08 1zla n ASP 681 Cb 0.57 -3.33 -0.03 0.00 -0.64 0.00 0.00 41.12 37.69 1zla n ASP 681 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1zla s LEU 682 N -6.93 4.26 0.15 0.64 1.43 -1.26 -5.12 118.68 111.86 1zla s LEU 682 Ca 0.08 0.34 0.09 0.00 -1.03 0.00 0.00 54.13 53.61 1zla s LEU 682 Cb -0.04 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.04 1zla s LEU 682 CO 0.87 -0.01 -0.20 -0.13 0.23 0.00 0.00 176.35 177.11 1zla s ARG 683 N -3.24 1.28 -0.02 1.70 0.52 -1.26 -5.09 118.95 112.84 1zla s ARG 683 Ca 0.37 -1.36 0.04 0.00 -0.52 0.00 0.00 55.73 54.26 1zla s ARG 683 Cb -0.11 -1.45 -0.01 0.00 0.52 0.00 0.00 34.95 33.90 1zla s ARG 683 CO 0.29 0.31 -0.14 -0.06 0.02 0.00 0.00 175.30 175.72 1zla s PHE 684 N -1.73 1.36 0.22 -0.53 0.40 -1.26 -5.11 117.98 111.32 1zla s PHE 684 Ca 0.14 -0.32 -0.30 0.00 -0.60 0.00 0.00 56.93 55.85 1zla s PHE 684 Cb -0.07 -0.90 -0.08 0.00 0.51 0.00 0.00 43.02 42.47 1zla s PHE 684 CO 0.06 -0.08 0.99 -0.65 0.70 0.00 0.00 175.22 176.24 1zla s GLN 685 N -0.10 4.77 0.22 0.44 -0.21 -1.26 -4.92 119.66 118.59 1zla s GLN 685 Ca 0.01 1.56 -0.13 0.00 0.02 0.00 0.00 55.36 56.81 1zla s GLN 685 Cb -0.08 -3.28 0.25 0.00 1.00 0.00 0.00 33.01 30.90 1zla s GLN 685 CO 0.00 0.37 1.62 0.66 -2.12 0.00 0.00 175.29 175.83 1zla h SER 686 N 4.45 -0.61 -0.23 5.90 4.64 -2.01 0.23 113.55 125.91 1zla h SER 686 Ca -0.45 0.20 0.07 0.00 -0.47 0.00 0.00 61.79 61.14 1zla h SER 686 Cb 1.20 0.41 -0.01 0.00 -0.31 0.00 0.00 62.40 63.70 1zla h SER 686 CO 0.69 -0.22 0.27 0.77 -0.87 0.00 0.00 176.83 177.47 1zla h SER 687 N 0.00 0.00 0.41 4.97 4.64 -1.99 -0.49 113.55 121.09 1zla h SER 687 Ca 0.32 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.44 1zla h SER 687 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1zla h SER 687 CO -0.68 0.00 -0.83 0.00 -0.87 0.00 0.00 176.83 174.45 1zla h ALA 688 N 1.67 0.54 -0.35 5.18 0.00 -0.92 -0.79 119.26 124.59 1zla h ALA 688 Ca 0.11 -0.67 -0.16 0.00 0.00 0.00 0.00 54.91 54.19 1zla h ALA 688 Cb 0.65 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1zla h ALA 688 CO -0.00 0.83 -0.41 0.28 0.00 0.00 0.00 179.25 179.94 1zla h VAL 689 N 0.19 1.28 -0.73 0.00 2.07 -0.97 -1.85 116.25 116.24 1zla h VAL 689 Ca -0.05 -1.59 0.01 0.00 0.82 0.00 0.00 66.70 65.90 1zla h VAL 689 Cb 1.43 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 32.63 1zla h VAL 689 CO 0.13 0.53 0.48 0.24 0.02 0.00 0.00 177.57 178.97 1zla h MET 690 N 0.70 0.93 -0.45 1.57 2.86 -1.29 0.11 114.93 119.35 1zla h MET 690 Ca 0.05 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1zla h MET 690 Cb 1.01 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 1zla h MET 690 CO 0.10 0.62 0.21 0.00 1.06 0.00 0.00 176.91 178.90 1zla h ALA 691 N 1.28 0.58 -0.74 6.32 0.00 -0.97 0.21 119.26 125.95 1zla h ALA 691 Ca 0.27 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1zla h ALA 691 Cb -0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1zla h ALA 691 CO -0.07 0.15 0.29 -0.07 0.00 0.00 0.00 179.25 179.54 1zla h LEU 692 N 0.59 1.01 -0.05 0.00 3.38 -0.79 0.91 115.31 120.36 1zla h LEU 692 Ca 0.15 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1zla h LEU 692 Cb 0.13 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1zla h LEU 692 CO -0.02 0.90 -0.00 -0.61 0.09 0.00 0.00 178.44 178.80 1zla h GLN 693 N 1.07 0.09 -0.41 1.13 4.15 -0.49 0.29 115.11 120.94 1zla h GLN 693 Ca 0.25 -0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.72 1zla h GLN 693 Cb 0.21 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.82 1zla h GLN 693 CO -0.02 0.39 -0.06 0.93 -1.93 0.00 0.00 178.83 178.15 1zla h GLU 694 N -0.22 0.04 -0.03 1.69 4.39 -0.29 -0.13 114.58 120.03 1zla h GLU 694 Ca 0.01 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.71 1zla h GLU 694 Cb 0.35 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1zla h GLU 694 CO 0.00 0.03 0.02 0.00 -1.16 0.00 0.00 179.01 177.90 1zla h ALA 695 N 1.39 0.04 -0.39 3.43 0.00 -0.68 -2.13 119.26 120.92 1zla h ALA 695 Ca 0.20 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1zla h ALA 695 Cb 0.30 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1zla h ALA 695 CO -0.39 -0.44 0.14 0.77 0.00 0.00 0.00 179.25 179.33 1zla h SER 696 N -0.01 0.14 -0.30 0.00 0.02 -0.40 -0.40 113.55 112.59 1zla h SER 696 Ca 0.01 0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.88 1zla h SER 696 Cb 0.05 0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 1zla h SER 696 CO -0.00 0.12 -0.31 -0.33 -1.14 0.00 0.00 176.83 175.17 1zla h GLU 697 N 0.29 0.74 0.00 3.45 5.08 -1.00 0.23 114.58 123.37 1zla h GLU 697 Ca 0.18 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1zla h GLU 697 Cb 0.16 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1zla h GLU 697 CO -0.19 1.01 -0.06 0.00 -1.00 0.00 0.00 179.01 178.78 1zla h ALA 698 N 0.71 1.73 0.14 3.43 0.00 -1.20 0.12 119.26 124.19 1zla h ALA 698 Ca 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1zla h ALA 698 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1zla h ALA 698 CO 0.08 0.07 -0.07 -0.92 0.00 0.00 0.00 179.25 178.41 1zla h TYR 699 N 0.00 -0.17 -0.98 0.00 3.20 -0.52 -2.63 116.97 115.86 1zla h TYR 699 Ca -0.00 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.91 1zla h TYR 699 Cb 0.11 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.38 1zla h TYR 699 CO 0.00 0.27 0.64 -0.07 -1.64 0.00 0.00 178.16 177.36 1zla h LEU 700 N -0.90 1.05 0.13 2.82 3.38 -0.07 -1.18 115.31 120.54 1zla h LEU 700 Ca -0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1zla h LEU 700 Cb 0.52 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1zla h LEU 700 CO 0.03 0.70 -0.06 0.58 0.09 0.00 0.00 178.44 179.77 1zla h VAL 701 N 1.20 0.98 -0.19 1.22 2.07 -0.87 -0.93 116.25 119.72 1zla h VAL 701 Ca 0.40 -0.46 0.06 0.00 0.82 0.00 0.00 66.70 67.52 1zla h VAL 701 Cb 0.08 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1zla h VAL 701 CO -0.14 0.11 0.15 0.00 0.02 0.00 0.00 177.57 177.71 1zla h ALA 702 N 0.44 2.10 -0.07 1.67 0.00 -1.23 -0.74 119.26 121.43 1zla h ALA 702 Ca -0.02 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 1zla h ALA 702 Cb 0.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1zla h ALA 702 CO 0.03 -0.24 -0.82 1.25 0.00 0.00 0.00 179.25 179.46 1zla h LEU 703 N 0.00 0.62 -0.88 0.00 5.85 -0.75 -3.15 115.31 117.00 1zla h LEU 703 Ca 0.09 -0.44 -0.09 0.00 0.84 0.00 0.00 57.88 58.29 1zla h LEU 703 Cb 0.38 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1zla h LEU 703 CO -0.00 1.21 -0.11 -0.26 -0.34 0.00 0.00 178.44 178.93 1zla h PHE 704 N 0.32 0.77 0.01 1.25 0.05 0.24 -1.35 116.94 118.22 1zla h PHE 704 Ca -0.06 -0.13 -0.00 0.00 3.82 0.00 0.00 57.97 61.60 1zla h PHE 704 Cb 1.43 -0.20 0.00 0.00 2.00 0.00 0.00 35.95 39.18 1zla h PHE 704 CO 0.06 0.78 -0.00 0.93 -0.18 0.00 0.00 178.31 179.90 1zla h GLU 705 N 0.64 -0.01 -0.80 1.51 5.08 -1.45 0.51 114.58 120.05 1zla h GLU 705 Ca 0.11 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 1zla h GLU 705 Cb 0.56 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 1zla h GLU 705 CO 0.04 0.03 0.49 -0.44 -1.00 0.00 0.00 179.01 178.12 1zla h ASP 706 N -0.04 0.76 0.30 1.42 3.32 -1.46 0.02 116.42 120.73 1zla h ASP 706 Ca -0.00 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1zla h ASP 706 Cb 0.04 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1zla h ASP 706 CO 0.00 0.49 -0.16 0.74 -1.72 0.00 0.00 179.24 178.59 1zla h THR 707 N 0.89 0.67 -1.00 0.35 2.02 -0.67 -0.57 112.91 114.60 1zla h THR 707 Ca 0.35 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.71 1zla h THR 707 Cb 0.17 0.67 -0.10 0.00 -1.74 0.00 0.00 68.15 67.14 1zla h THR 707 CO -0.17 0.00 0.62 -1.13 0.37 0.00 0.00 175.52 175.20 1zla h ASN 708 N -0.43 0.78 -0.43 4.18 -1.24 0.85 0.17 115.58 119.47 1zla h ASN 708 Ca -0.04 0.09 -0.11 0.00 0.71 0.00 0.00 56.30 56.95 1zla h ASN 708 Cb 0.34 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.33 1zla h ASN 708 CO 0.05 0.29 -0.16 -0.07 -1.29 0.00 0.00 177.43 176.25 1zla h LEU 709 N 0.77 0.88 -1.09 0.34 3.38 -0.55 -2.13 115.31 116.92 1zla h LEU 709 Ca 0.57 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1zla h LEU 709 Cb 0.87 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 1zla h LEU 709 CO -0.36 1.07 0.58 0.00 0.09 0.00 0.00 178.44 179.82 1zla h ALA 711 N 1.42 -0.20 -0.96 0.00 0.00 -0.96 -2.59 119.26 115.96 1zla h ALA 711 Ca 0.33 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 55.22 1zla h ALA 711 Cb -0.12 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.67 1zla h ALA 711 CO -0.07 -0.43 0.60 0.82 0.00 0.00 0.00 179.25 180.18 1zla h ILE 712 N -0.58 0.77 -0.77 0.00 5.03 -1.12 0.32 117.51 121.17 1zla h ILE 712 Ca -0.02 -0.24 0.07 0.00 -0.12 0.00 0.00 64.86 64.55 1zla h ILE 712 Cb 0.44 -0.00 -0.05 0.00 -3.03 0.00 0.00 36.82 34.18 1zla h ILE 712 CO 0.03 0.13 0.50 -0.74 -0.68 0.00 0.00 178.15 177.40 1zla h HIS 713 N 0.71 0.80 -0.21 1.37 2.76 -0.44 0.35 115.15 120.50 1zla h HIS 713 Ca 0.51 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.70 1zla h HIS 713 Cb 0.84 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 29.54 1zla h HIS 713 CO -0.00 0.41 0.00 0.00 -1.30 0.00 0.00 177.93 177.04 1zla n ALA 714 N -2.44 2.47 -3.33 5.26 0.00 0.11 -4.89 120.51 117.68 1zla n ALA 714 Ca 0.12 -0.37 -0.18 0.00 0.00 0.00 0.00 53.44 53.00 1zla n ALA 714 Cb 0.25 -0.99 0.07 0.00 0.00 0.00 0.00 19.45 18.78 1zla n ALA 714 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1zla n LYS 715 N 0.11 -6.23 -4.47 0.00 5.02 0.12 -5.03 118.16 107.69 1zla n LYS 715 Ca 0.08 0.68 -0.22 0.00 -2.02 0.00 0.00 58.31 56.83 1zla n LYS 715 Cb 0.18 -5.27 -0.10 0.00 -0.02 0.00 0.00 35.03 29.82 1zla n LYS 715 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1zla s ARG 716 N -5.80 1.70 0.00 1.97 0.52 -0.83 -4.99 118.95 111.52 1zla s ARG 716 Ca 0.34 -1.96 0.00 0.00 -0.52 0.00 0.00 55.73 53.59 1zla s ARG 716 Cb -0.15 -0.86 0.00 0.00 0.52 0.00 0.00 34.95 34.46 1zla s ARG 716 CO 0.60 -0.23 0.64 1.33 0.02 0.00 0.00 175.30 177.66 1zla n VAL 717 N -0.73 0.38 -3.56 3.52 0.24 -1.26 -3.00 118.33 113.92 1zla n VAL 717 Ca -0.03 -0.43 -0.41 0.00 -2.04 0.00 0.00 64.34 61.43 1zla n VAL 717 Cb 0.66 0.91 -0.09 0.00 -1.47 0.00 0.00 33.84 33.86 1zla n VAL 717 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1zla s HIS 718 N -0.38 3.40 0.29 6.34 4.02 -1.26 -5.01 115.29 122.69 1zla s HIS 718 Ca 0.00 -1.78 -0.29 0.00 1.02 0.00 0.00 55.06 54.00 1zla s HIS 718 Cb 0.00 -3.37 -0.10 0.00 -1.02 0.00 0.00 32.58 28.09 1zla s HIS 718 CO 0.00 -0.96 1.33 0.96 1.02 0.00 0.00 174.74 177.09 1zla s ILE 719 N 1.38 2.81 0.35 0.60 -4.36 -1.26 -4.91 121.20 115.81 1zla s ILE 719 Ca 0.05 0.76 0.04 0.00 -0.26 0.00 0.00 60.65 61.24 1zla s ILE 719 Cb -0.25 -3.48 -0.06 0.00 1.25 0.00 0.00 42.46 39.91 1zla s ILE 719 CO -0.00 0.16 0.06 -0.04 0.24 0.00 0.00 174.94 175.35 1zla s MET 720 N -1.18 1.72 0.19 0.37 -1.94 -1.26 -5.03 119.30 112.18 1zla s MET 720 Ca 0.52 -1.97 -0.12 0.00 -1.71 0.00 0.00 55.69 52.41 1zla s MET 720 Cb -0.39 -0.96 0.13 0.00 2.01 0.00 0.00 34.83 35.61 1zla s MET 720 CO 0.48 -0.19 1.86 -1.35 -0.01 0.00 0.00 175.02 175.80 1zla h PRO 721 N 2.03 0.83 -0.83 2.03 0.11 -2.00 -0.59 132.00 133.59 1zla h PRO 721 Ca -0.41 -0.05 0.22 0.00 0.11 0.00 0.00 66.00 65.87 1zla h PRO 721 Cb 1.25 -0.19 -0.05 0.00 0.11 0.00 0.00 31.00 32.12 1zla h PRO 721 CO 0.70 0.55 0.58 1.57 -0.21 0.00 0.00 178.00 181.19 1zla h LYS 722 N 0.86 0.16 -0.03 1.05 2.10 -1.98 0.30 116.57 119.03 1zla h LYS 722 Ca 0.25 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.88 1zla h LYS 722 Cb -0.07 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.22 1zla h LYS 722 CO -0.07 0.11 -0.01 -0.44 -2.00 0.00 0.00 179.45 177.04 1zla h ASP 723 N 0.17 0.06 -0.55 7.07 3.32 -1.48 0.06 116.42 125.07 1zla h ASP 723 Ca 0.41 -0.40 0.02 0.00 0.02 0.00 0.00 57.03 57.08 1zla h ASP 723 Cb 1.36 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.86 1zla h ASP 723 CO -0.08 0.45 0.37 0.40 -1.72 0.00 0.00 179.24 178.66 1zla h ILE 724 N -0.33 1.09 -0.07 0.35 2.04 -0.58 -1.55 117.51 118.46 1zla h ILE 724 Ca 0.01 -0.23 -0.18 0.00 1.00 0.00 0.00 64.86 65.46 1zla h ILE 724 Cb 0.43 0.36 0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1zla h ILE 724 CO 0.00 0.12 -0.64 1.56 0.00 0.00 0.00 178.15 179.20 1zla h GLN 725 N 0.67 0.56 -0.80 2.37 4.20 -0.31 -1.91 115.11 119.89 1zla h GLN 725 Ca 0.21 -0.51 -0.01 0.00 0.06 0.00 0.00 58.65 58.41 1zla h GLN 725 Cb 0.03 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 1zla h GLN 725 CO -0.05 1.13 0.48 1.25 -0.67 0.00 0.00 178.83 180.97 1zla h LEU 726 N 0.17 0.97 0.04 1.46 5.85 -0.67 -0.46 115.31 122.67 1zla h LEU 726 Ca -0.06 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1zla h LEU 726 Cb 1.30 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.08 1zla h LEU 726 CO 0.13 0.75 -0.02 0.00 -0.34 0.00 0.00 178.44 178.96 1zla h ALA 727 N 1.26 -0.05 -0.30 1.25 0.00 -1.24 -1.20 119.26 118.97 1zla h ALA 727 Ca 0.29 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 1zla h ALA 727 Cb -0.03 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1zla h ALA 727 CO -0.05 -0.52 0.04 0.00 0.00 0.00 0.00 179.25 178.71 1zla h ARG 728 N -0.06 0.45 0.12 0.00 3.08 -1.04 0.12 114.38 117.05 1zla h ARG 728 Ca -0.01 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1zla h ARG 728 Cb 0.05 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1zla h ARG 728 CO 0.01 0.44 -0.06 -0.09 -1.07 0.00 0.00 179.97 179.21 1zla h ARG 729 N 0.44 -0.16 -0.49 0.04 2.43 -0.68 -0.29 114.38 115.67 1zla h ARG 729 Ca 0.10 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1zla h ARG 729 Cb 0.23 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1zla h ARG 729 CO 0.00 0.10 0.32 0.82 -1.51 0.00 0.00 179.97 179.70 1zla h ILE 730 N -0.40 1.13 -0.73 1.20 2.04 -0.83 -1.84 117.51 118.09 1zla h ILE 730 Ca -0.02 -0.23 0.14 0.00 1.00 0.00 0.00 64.86 65.76 1zla h ILE 730 Cb 0.32 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 1zla h ILE 730 CO 0.03 0.12 0.49 0.03 0.00 0.00 0.00 178.15 178.82 1zla h ARG 731 N 0.66 0.38 0.00 2.37 3.08 -0.68 -3.46 114.38 116.74 1zla h ARG 731 Ca 0.18 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1zla h ARG 731 Cb -0.07 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.89 1zla h ARG 731 CO -0.04 0.25 0.00 0.41 -1.07 0.00 0.00 179.97 179.52 1zla n GLY 732 N -1.53 1.26 0.01 0.04 0.00 -0.59 -4.97 105.19 99.41 1zla n GLY 732 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.27 1zla n GLY 732 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1zla n GLU 733 N -1.48 0.08 0.00 1.61 1.02 -0.22 -4.86 120.64 116.79 1zla n GLU 733 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1zla n GLU 733 Cb 0.00 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 1zla n GLU 733 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1zla n ARG 734 N -1.64 0.02 -0.23 3.49 0.63 -1.10 -4.94 116.66 112.88 1zla n ARG 734 Ca 0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 1zla n ARG 734 Cb 0.36 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.27 1zla n ARG 734 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12