#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p3i s GLY 633 N 0.00 0.44 0.00 3.41 0.00 -1.26 -4.59 107.32 105.32 1p3i s GLY 633 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.88 1p3i s GLY 633 CO 0.00 3.54 0.14 -1.84 0.00 0.00 0.00 173.10 174.95 1p3i n GLU 634 N 8.73 0.00 0.13 2.90 0.28 -1.26 -4.89 120.64 126.53 1p3i n GLU 634 Ca 0.26 -0.14 0.07 0.00 -0.16 0.00 0.00 57.16 57.19 1p3i n GLU 634 Cb 0.49 -0.26 0.39 0.00 1.43 0.00 0.00 31.44 33.48 1p3i n GLU 634 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1p3i n SER 635 N 0.00 0.37 -4.14 -1.84 7.64 -1.26 -4.12 113.62 110.27 1p3i n SER 635 Ca 0.00 0.63 -0.35 0.00 1.01 0.00 0.00 58.87 60.16 1p3i n SER 635 Cb 0.39 -0.65 -0.13 0.00 -1.01 0.00 0.00 64.21 62.81 1p3i n SER 635 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1p3i s LYS 636 N -3.32 2.23 0.81 1.43 -2.85 -1.26 -5.10 119.74 111.67 1p3i s LYS 636 Ca -0.02 -1.45 -0.13 0.00 -1.00 0.00 0.00 55.97 53.37 1p3i s LYS 636 Cb 0.04 -3.25 0.08 0.00 -2.06 0.00 0.00 37.83 32.64 1p3i s LYS 636 CO 0.13 -0.75 1.18 0.36 0.10 0.00 0.00 175.35 176.37 1p3i n LYS 637 N 4.57 0.20 -1.83 1.78 2.85 -1.26 -4.95 118.16 119.52 1p3i n LYS 637 Ca -0.09 0.14 -0.40 0.00 -1.05 0.00 0.00 58.31 56.92 1p3i n LYS 637 Cb 0.43 -2.42 0.02 0.00 -0.65 0.00 0.00 35.03 32.41 1p3i n LYS 637 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 1p3i s PRO 638 N -4.05 3.66 0.30 -1.58 0.02 -1.26 -4.89 135.00 127.19 1p3i s PRO 638 Ca 0.73 2.36 -0.30 0.00 0.02 0.00 0.00 61.00 63.81 1p3i s PRO 638 Cb -0.29 -2.62 -0.12 0.00 0.02 0.00 0.00 34.50 31.49 1p3i s PRO 638 CO 0.51 -0.82 1.46 1.58 -0.33 0.00 0.00 177.00 179.40 1p3i n HIS 639 N -0.26 2.55 -3.53 6.54 -0.00 -1.26 -5.00 115.22 114.26 1p3i n HIS 639 Ca 0.06 0.40 -0.19 0.00 0.46 0.00 0.00 57.72 58.45 1p3i n HIS 639 Cb 0.42 -2.51 -0.14 0.00 -0.12 0.00 0.00 29.99 27.65 1p3i n HIS 639 CO 0.00 0.00 0.00 0.50 0.46 0.00 0.00 176.34 177.30 1p3i s ARG 640 N -0.99 0.16 0.64 1.57 3.52 -1.26 -5.14 118.95 117.44 1p3i s ARG 640 Ca 0.62 0.24 -0.18 0.00 -0.13 0.00 0.00 55.73 56.28 1p3i s ARG 640 Cb -0.55 -1.11 -0.01 0.00 -1.56 0.00 0.00 34.95 31.71 1p3i s ARG 640 CO 0.54 -0.60 1.24 0.71 -0.81 0.00 0.00 175.30 176.37 1p3i s TYR 641 N 2.31 2.22 0.49 5.12 1.51 -1.26 -4.99 117.35 122.74 1p3i s TYR 641 Ca 0.06 1.52 -0.17 0.00 -1.01 0.00 0.00 57.07 57.47 1p3i s TYR 641 Cb -0.15 -3.56 -0.08 0.00 -0.11 0.00 0.00 41.96 38.06 1p3i s TYR 641 CO -0.11 -2.54 0.96 1.03 -1.11 0.00 0.00 175.55 173.78 1p3i s ARG 642 N -3.46 3.98 0.20 -0.62 0.52 -1.26 -4.98 118.95 113.32 1p3i s ARG 642 Ca 0.79 0.93 -0.32 0.00 -0.52 0.00 0.00 55.73 56.61 1p3i s ARG 642 Cb -0.33 -2.17 -0.12 0.00 0.52 0.00 0.00 34.95 32.85 1p3i s ARG 642 CO 0.38 -0.21 1.70 -0.35 0.02 0.00 0.00 175.30 176.84 1p3i n PRO 643 N -1.39 2.67 0.00 3.54 -0.04 -1.26 -1.85 135.00 136.67 1p3i n PRO 643 Ca 0.06 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.48 1p3i n PRO 643 Cb 0.54 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1p3i n PRO 643 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p3i n GLY 644 N 3.88 2.03 0.24 0.55 0.00 -1.26 -4.93 105.19 105.70 1p3i n GLY 644 Ca 0.16 -0.25 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 1p3i n GLY 644 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1p3i h THR 645 N 0.00 1.21 0.00 2.61 2.02 -1.75 -0.63 112.91 116.38 1p3i h THR 645 Ca 0.00 -0.66 -0.20 0.00 0.77 0.00 0.00 66.41 66.33 1p3i h THR 645 Cb 0.00 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 1p3i h THR 645 CO 0.00 0.25 -0.93 0.58 0.37 0.00 0.00 175.52 175.79 1p3i h VAL 646 N 0.71 1.65 -0.62 3.16 2.07 -1.92 -1.95 116.25 119.36 1p3i h VAL 646 Ca 0.18 -3.21 -0.09 0.00 0.82 0.00 0.00 66.70 64.40 1p3i h VAL 646 Cb 0.18 2.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 1p3i h VAL 646 CO -0.02 0.91 0.05 0.00 0.02 0.00 0.00 177.57 178.53 1p3i h ALA 647 N 1.07 0.92 -0.34 1.67 0.00 -1.87 -0.11 119.26 120.59 1p3i h ALA 647 Ca -0.01 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 1p3i h ALA 647 Cb 1.67 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1p3i h ALA 647 CO 0.12 0.66 -0.39 -0.07 0.00 0.00 0.00 179.25 179.57 1p3i h LEU 648 N 0.97 0.86 -1.35 0.00 3.38 -1.05 -1.28 115.31 116.83 1p3i h LEU 648 Ca 0.18 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 57.80 1p3i h LEU 648 Cb 0.49 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1p3i h LEU 648 CO 0.02 1.15 0.46 -0.09 0.09 0.00 0.00 178.44 180.07 1p3i h ARG 649 N 0.67 0.82 -0.08 1.13 2.43 -0.85 -1.77 114.38 116.72 1p3i h ARG 649 Ca 0.06 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1p3i h ARG 649 Cb 0.95 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1p3i h ARG 649 CO 0.09 0.54 -0.10 0.93 -1.51 0.00 0.00 179.97 179.92 1p3i h GLU 650 N 0.84 0.21 -0.61 0.20 5.08 -0.55 -1.75 114.58 118.00 1p3i h GLU 650 Ca 0.28 -0.12 0.07 0.00 -1.00 0.00 0.00 59.36 58.59 1p3i h GLU 650 Cb 0.07 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 1p3i h GLU 650 CO -0.08 0.66 0.29 0.82 -1.00 0.00 0.00 179.01 179.70 1p3i h ILE 651 N -0.22 0.89 -0.75 3.13 2.04 -1.00 0.49 117.51 122.08 1p3i h ILE 651 Ca 0.01 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 1p3i h ILE 651 Cb 0.62 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1p3i h ILE 651 CO 0.02 0.10 0.30 0.03 0.00 0.00 0.00 178.15 178.60 1p3i h ARG 652 N 0.54 1.12 0.12 2.37 3.08 -1.24 -0.94 114.38 119.44 1p3i h ARG 652 Ca 0.29 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 1p3i h ARG 652 Cb 0.25 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1p3i h ARG 652 CO -0.22 0.91 -0.06 -0.09 -1.07 0.00 0.00 179.97 179.44 1p3i h ARG 653 N 1.10 -0.16 0.00 0.04 2.43 -0.63 -2.89 114.38 114.26 1p3i h ARG 653 Ca 0.25 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.38 1p3i h ARG 653 Cb 0.21 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1p3i h ARG 653 CO -0.02 0.24 -0.26 1.88 -1.51 0.00 0.00 179.97 180.30 1p3i h TYR 654 N -0.61 0.00 0.00 2.20 0.99 -0.84 -1.21 116.97 117.50 1p3i h TYR 654 Ca -0.02 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1p3i h TYR 654 Cb 0.47 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.20 1p3i h TYR 654 CO 0.06 0.26 0.00 1.04 -0.00 0.00 0.00 178.16 179.52 1p3i n GLN 655 N -4.17 0.09 -0.01 4.88 6.02 -0.37 -3.02 117.38 120.81 1p3i n GLN 655 Ca -0.02 0.17 -0.02 0.00 -0.01 0.00 0.00 57.00 57.12 1p3i n GLN 655 Cb 0.32 -1.63 -0.12 0.00 1.02 0.00 0.00 30.24 29.83 1p3i n GLN 655 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1p3i n LYS 656 N -1.79 0.64 -3.27 -1.09 4.81 -0.51 -4.95 118.16 112.00 1p3i n LYS 656 Ca 0.05 0.12 -0.20 0.00 -0.87 0.00 0.00 58.31 57.42 1p3i n LYS 656 Cb 0.31 -1.71 0.00 0.00 0.02 0.00 0.00 35.03 33.66 1p3i n LYS 656 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1p3i s SER 657 N -5.58 5.26 0.00 3.14 1.04 -0.91 -5.06 113.70 111.59 1p3i s SER 657 Ca -0.05 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.70 1p3i s SER 657 Cb 0.09 -0.35 0.00 0.00 0.10 0.00 0.00 66.02 65.85 1p3i s SER 657 CO 0.83 -0.87 0.30 1.07 0.98 0.00 0.00 173.24 175.55 1p3i n THR 658 N -1.82 0.00 -1.44 2.02 5.66 -1.26 -4.94 114.28 112.51 1p3i n THR 658 Ca 0.07 -0.34 -0.33 0.00 -3.05 0.00 0.00 64.05 60.40 1p3i n THR 658 Cb 0.61 1.28 0.09 0.00 -1.55 0.00 0.00 70.33 70.75 1p3i n THR 658 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1p3i s GLU 659 N -0.08 2.25 0.39 1.09 4.04 -1.26 -4.96 118.70 120.17 1p3i s GLU 659 Ca 0.00 1.54 -0.26 0.00 0.04 0.00 0.00 54.97 56.28 1p3i s GLU 659 Cb 0.00 -1.87 -0.09 0.00 0.02 0.00 0.00 34.13 32.19 1p3i s GLU 659 CO 0.00 -1.70 1.30 -0.51 -1.84 0.00 0.00 175.26 172.51 1p3i s LEU 660 N -5.31 4.25 0.01 1.83 1.43 -1.26 -4.96 118.68 114.67 1p3i s LEU 660 Ca 0.69 2.65 0.22 0.00 -1.03 0.00 0.00 54.13 56.66 1p3i s LEU 660 Cb -0.24 -3.86 -0.18 0.00 0.03 0.00 0.00 46.19 41.94 1p3i s LEU 660 CO 0.47 -0.78 0.80 0.18 0.23 0.00 0.00 176.35 177.25 1p3i n LEU 661 N 0.26 0.56 -4.85 1.79 4.77 -1.26 -4.91 117.00 113.36 1p3i n LEU 661 Ca 0.03 -0.19 -0.38 0.00 -0.03 0.00 0.00 56.01 55.45 1p3i n LEU 661 Cb 0.43 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.43 1p3i n LEU 661 CO 0.56 0.10 0.02 -0.63 -1.33 0.00 0.00 177.39 176.12 1p3i s ILE 662 N -3.23 5.18 0.28 -0.08 1.01 -1.26 -5.04 121.20 118.06 1p3i s ILE 662 Ca 0.01 0.65 -0.30 0.00 0.00 0.00 0.00 60.65 61.01 1p3i s ILE 662 Cb 0.15 -3.62 -0.13 0.00 0.01 0.00 0.00 42.46 38.87 1p3i s ILE 662 CO 0.86 0.59 1.28 0.54 0.00 0.00 0.00 174.94 178.21 1p3i n ARG 663 N 1.91 1.90 0.26 2.79 5.12 -1.26 -4.92 116.66 122.46 1p3i n ARG 663 Ca -0.16 0.67 -0.15 0.00 -1.93 0.00 0.00 57.85 56.28 1p3i n ARG 663 Cb 0.53 -2.24 -0.08 0.00 -1.16 0.00 0.00 32.46 29.51 1p3i n ARG 663 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1p3i h LYS 664 N 3.17 -0.63 -0.26 5.56 1.57 -1.97 -2.56 116.57 121.44 1p3i h LYS 664 Ca -0.44 0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 1p3i h LYS 664 Cb 1.29 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.74 1p3i h LYS 664 CO 0.68 -0.34 0.12 1.25 -0.57 0.00 0.00 179.45 180.59 1p3i h LEU 665 N -0.85 0.35 -1.09 2.94 5.85 -1.99 -1.27 115.31 119.25 1p3i h LEU 665 Ca -0.07 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1p3i h LEU 665 Cb 0.58 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 1p3i h LEU 665 CO 0.11 0.39 0.62 -0.65 -0.34 0.00 0.00 178.44 178.57 1p3i h PRO 666 N 0.29 1.15 -0.43 5.25 0.11 -1.97 -1.38 132.00 135.03 1p3i h PRO 666 Ca 0.09 -0.07 -0.10 0.00 0.11 0.00 0.00 66.00 66.03 1p3i h PRO 666 Cb 0.14 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 30.97 1p3i h PRO 666 CO -0.01 0.76 -0.14 0.35 -0.21 0.00 0.00 178.00 178.76 1p3i h PHE 667 N 1.19 0.87 -0.74 0.65 3.57 -1.13 -2.50 116.94 118.84 1p3i h PHE 667 Ca 0.37 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1p3i h PHE 667 Cb -0.00 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.48 1p3i h PHE 667 CO -0.00 0.87 0.38 0.37 -2.23 0.00 0.00 178.31 177.70 1p3i h GLN 668 N 0.70 1.04 -0.35 1.11 4.15 -0.37 -1.76 115.11 119.65 1p3i h GLN 668 Ca 0.11 -0.13 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 1p3i h GLN 668 Cb 0.62 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1p3i h GLN 668 CO 0.04 0.79 -0.25 0.00 -1.93 0.00 0.00 178.83 177.48 1p3i h ARG 669 N 1.05 0.70 -0.28 1.69 3.08 -0.99 -0.06 114.38 119.58 1p3i h ARG 669 Ca 0.26 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1p3i h ARG 669 Cb 0.07 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1p3i h ARG 669 CO -0.04 0.89 0.08 1.25 -1.07 0.00 0.00 179.97 181.08 1p3i h LEU 670 N 0.61 0.41 -0.60 3.04 5.85 -0.97 0.96 115.31 124.61 1p3i h LEU 670 Ca 0.08 -0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1p3i h LEU 670 Cb 0.75 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1p3i h LEU 670 CO 0.06 0.51 0.39 0.58 -0.34 0.00 0.00 178.44 179.64 1p3i h VAL 671 N 0.29 1.13 -0.77 1.05 2.07 -1.11 -0.38 116.25 118.53 1p3i h VAL 671 Ca 0.09 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 1p3i h VAL 671 Cb 0.25 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1p3i h VAL 671 CO -0.00 0.14 0.29 0.03 0.02 0.00 0.00 177.57 178.05 1p3i h ARG 672 N 0.78 1.16 0.19 1.57 3.08 -0.70 0.42 114.38 120.88 1p3i h ARG 672 Ca 0.23 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1p3i h ARG 672 Cb -0.05 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.81 1p3i h ARG 672 CO -0.07 0.95 -0.09 1.49 -1.07 0.00 0.00 179.97 181.19 1p3i h GLU 673 N 1.13 -0.24 -0.27 0.04 4.81 -0.24 -0.87 114.58 118.93 1p3i h GLU 673 Ca 0.25 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1p3i h GLU 673 Cb 0.24 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1p3i h GLU 673 CO -0.02 0.05 0.17 0.82 -0.73 0.00 0.00 179.01 179.30 1p3i h ILE 674 N -0.54 1.08 -0.75 2.32 2.04 -1.03 -2.09 117.51 118.56 1p3i h ILE 674 Ca -0.03 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.70 1p3i h ILE 674 Cb 0.40 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 1p3i h ILE 674 CO 0.04 0.08 0.46 0.00 0.00 0.00 0.00 178.15 178.73 1p3i h ALA 675 N 1.08 1.00 -0.83 1.87 0.00 -0.84 -2.57 119.26 118.97 1p3i h ALA 675 Ca 0.10 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1p3i h ALA 675 Cb -0.02 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1p3i h ALA 675 CO -0.02 0.22 0.53 0.37 0.00 0.00 0.00 179.25 180.35 1p3i h GLN 676 N 0.87 1.00 0.00 0.00 4.15 -0.72 0.21 115.11 120.62 1p3i h GLN 676 Ca 0.31 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.67 1p3i h GLN 676 Cb 0.09 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 27.55 1p3i h GLN 676 CO -0.14 0.66 0.00 -0.25 -1.93 0.00 0.00 178.83 177.17 1p3i n ASP 677 N -4.57 0.61 -0.09 -0.69 8.00 -0.82 -2.79 116.55 116.19 1p3i n ASP 677 Ca 0.10 0.70 -0.23 0.00 0.71 0.00 0.00 54.79 56.08 1p3i n ASP 677 Cb 0.09 -0.81 -0.12 0.00 -0.02 0.00 0.00 41.12 40.26 1p3i n ASP 677 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1p3i n PHE 678 N -2.23 0.95 -3.71 1.24 0.99 0.60 -4.97 117.46 110.32 1p3i n PHE 678 Ca 0.01 0.35 -0.12 0.00 -0.00 0.00 0.00 57.45 57.69 1p3i n PHE 678 Cb 0.15 -1.10 -0.10 0.00 -1.00 0.00 0.00 39.48 37.42 1p3i n PHE 678 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 1p3i s LYS 679 N -2.42 0.43 0.72 -1.08 2.36 -0.40 -5.14 119.74 114.21 1p3i s LYS 679 Ca -0.29 0.68 -0.12 0.00 -2.55 0.00 0.00 55.97 53.70 1p3i s LYS 679 Cb 0.07 0.10 0.02 0.00 -1.05 0.00 0.00 37.83 36.97 1p3i s LYS 679 CO 0.62 -0.11 1.11 0.95 1.55 0.00 0.00 175.35 179.47 1p3i s THR 680 N 0.84 3.25 -1.48 3.43 -4.23 -1.25 -4.04 115.64 112.16 1p3i s THR 680 Ca -0.05 0.41 -0.08 0.00 -1.18 0.00 0.00 61.69 60.79 1p3i s THR 680 Cb -0.06 -3.40 0.06 0.00 1.34 0.00 0.00 72.50 70.44 1p3i s THR 680 CO -0.06 -0.53 0.70 0.47 -0.54 0.00 0.00 174.62 174.66 1p3i n ASP 681 N -3.06 -2.30 -4.89 3.99 9.92 -1.26 -4.97 116.55 113.98 1p3i n ASP 681 Ca 0.07 -0.91 -0.34 0.00 -0.53 0.00 0.00 54.79 53.09 1p3i n ASP 681 Cb 0.58 -3.42 -0.05 0.00 -0.64 0.00 0.00 41.12 37.59 1p3i n ASP 681 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1p3i s LEU 682 N -7.05 4.36 0.28 0.64 1.43 -1.26 -5.10 118.68 111.97 1p3i s LEU 682 Ca 0.33 0.51 0.09 0.00 -1.03 0.00 0.00 54.13 54.03 1p3i s LEU 682 Cb -0.17 -2.78 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 1p3i s LEU 682 CO 0.87 0.22 0.04 -0.13 0.23 0.00 0.00 176.35 177.57 1p3i s ARG 683 N -1.97 2.37 -0.05 1.70 0.52 -1.26 -5.07 118.95 115.19 1p3i s ARG 683 Ca 0.30 -1.40 0.02 0.00 -0.52 0.00 0.00 55.73 54.12 1p3i s ARG 683 Cb -0.13 -2.20 0.02 0.00 0.52 0.00 0.00 34.95 33.15 1p3i s ARG 683 CO 0.19 0.33 -0.08 -0.06 0.02 0.00 0.00 175.30 175.70 1p3i s PHE 684 N -2.32 0.97 0.54 -0.53 0.40 -1.26 -5.12 117.98 110.65 1p3i s PHE 684 Ca 0.33 -0.30 -0.21 0.00 -0.60 0.00 0.00 56.93 56.15 1p3i s PHE 684 Cb -0.06 -0.77 -0.05 0.00 0.51 0.00 0.00 43.02 42.65 1p3i s PHE 684 CO 0.21 -0.19 1.19 -0.65 0.70 0.00 0.00 175.22 176.48 1p3i s GLN 685 N 0.68 3.32 0.40 0.44 -0.21 -1.26 -4.89 119.66 118.14 1p3i s GLN 685 Ca -0.11 1.80 0.19 0.00 0.02 0.00 0.00 55.36 57.26 1p3i s GLN 685 Cb -0.14 -2.13 0.82 0.00 1.00 0.00 0.00 33.01 32.57 1p3i s GLN 685 CO 0.01 -0.92 1.81 0.66 -2.12 0.00 0.00 175.29 174.74 1p3i h SER 686 N 1.38 0.00 0.81 5.90 4.64 -2.00 -2.01 113.55 122.26 1p3i h SER 686 Ca -0.50 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.80 1p3i h SER 686 Cb 1.27 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1p3i h SER 686 CO 0.57 0.33 -0.07 0.77 -0.87 0.00 0.00 176.83 177.56 1p3i h SER 687 N 0.00 0.00 0.06 4.97 4.64 -1.99 -1.85 113.55 119.38 1p3i h SER 687 Ca -0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 1p3i h SER 687 Cb 0.75 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.84 1p3i h SER 687 CO 0.04 0.07 -0.82 0.00 -0.87 0.00 0.00 176.83 175.26 1p3i h ALA 688 N 1.93 0.38 -0.39 5.18 0.00 -1.73 -0.88 119.26 123.75 1p3i h ALA 688 Ca -0.00 -0.63 -0.13 0.00 0.00 0.00 0.00 54.91 54.15 1p3i h ALA 688 Cb 0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1p3i h ALA 688 CO 0.01 0.73 -0.27 0.28 0.00 0.00 0.00 179.25 180.00 1p3i h VAL 689 N 0.40 1.27 -0.46 0.00 2.07 -1.30 -2.42 116.25 115.82 1p3i h VAL 689 Ca -0.06 -1.41 -0.09 0.00 0.82 0.00 0.00 66.70 65.96 1p3i h VAL 689 Cb 1.43 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1p3i h VAL 689 CO 0.16 0.47 -0.09 0.24 0.02 0.00 0.00 177.57 178.36 1p3i h MET 690 N 0.70 0.83 -0.69 1.57 2.86 -1.26 -1.61 114.93 117.33 1p3i h MET 690 Ca 0.09 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.42 1p3i h MET 690 Cb 0.80 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 1p3i h MET 690 CO 0.07 0.89 0.32 0.00 1.06 0.00 0.00 176.91 179.24 1p3i h ALA 691 N 1.14 0.89 -0.57 6.32 0.00 -0.91 -0.25 119.26 125.89 1p3i h ALA 691 Ca 0.13 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1p3i h ALA 691 Cb 0.59 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1p3i h ALA 691 CO 0.04 0.47 0.14 -0.07 0.00 0.00 0.00 179.25 179.83 1p3i h LEU 692 N 0.97 0.81 -0.36 0.00 3.38 -1.18 -1.19 115.31 117.74 1p3i h LEU 692 Ca 0.24 -0.15 -0.19 0.00 0.09 0.00 0.00 57.88 57.87 1p3i h LEU 692 Cb 0.14 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1p3i h LEU 692 CO -0.03 0.79 -0.67 -0.61 0.09 0.00 0.00 178.44 178.01 1p3i h GLN 693 N 0.84 0.60 -0.36 1.13 4.15 -0.52 0.42 115.11 121.36 1p3i h GLN 693 Ca 0.18 -0.44 -0.07 0.00 0.77 0.00 0.00 58.65 59.09 1p3i h GLN 693 Cb 0.29 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 1p3i h GLN 693 CO -0.00 1.06 -0.06 0.93 -1.93 0.00 0.00 178.83 178.83 1p3i h GLU 694 N 0.43 0.68 -0.44 1.69 4.39 -0.86 -1.47 114.58 119.00 1p3i h GLU 694 Ca -0.02 -0.25 -0.04 0.00 0.34 0.00 0.00 59.36 59.39 1p3i h GLU 694 Cb 1.25 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 1p3i h GLU 694 CO 0.13 0.83 0.12 0.00 -1.16 0.00 0.00 179.01 178.92 1p3i h ALA 695 N 0.83 0.57 -0.48 3.43 0.00 -1.18 -1.98 119.26 120.46 1p3i h ALA 695 Ca 0.09 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1p3i h ALA 695 Cb 0.56 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1p3i h ALA 695 CO 0.03 0.25 0.13 0.77 0.00 0.00 0.00 179.25 180.43 1p3i h SER 696 N 0.57 0.72 0.10 0.00 0.02 -0.84 -1.34 113.55 112.78 1p3i h SER 696 Ca 0.14 -0.22 -0.15 0.00 -0.84 0.00 0.00 61.79 60.72 1p3i h SER 696 Cb 0.30 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1p3i h SER 696 CO -0.00 0.75 -0.52 -0.33 -1.14 0.00 0.00 176.83 175.59 1p3i h GLU 697 N 0.65 0.46 -0.23 3.45 5.08 -1.26 -1.53 114.58 121.20 1p3i h GLU 697 Ca 0.15 -0.28 -0.16 0.00 -1.00 0.00 0.00 59.36 58.07 1p3i h GLU 697 Cb 0.30 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1p3i h GLU 697 CO -0.00 0.87 -0.51 0.00 -1.00 0.00 0.00 179.01 178.37 1p3i h ALA 698 N 1.07 0.67 -0.29 3.43 0.00 -1.24 0.05 119.26 122.95 1p3i h ALA 698 Ca 0.01 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1p3i h ALA 698 Cb 1.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1p3i h ALA 698 CO 0.09 0.68 0.17 -0.92 0.00 0.00 0.00 179.25 179.27 1p3i h TYR 699 N 0.51 0.39 -0.42 0.00 3.20 -1.15 -1.70 116.97 117.80 1p3i h TYR 699 Ca 0.02 -0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.74 1p3i h TYR 699 Cb 1.07 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 1p3i h TYR 699 CO 0.05 0.31 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.49 1p3i h LEU 700 N 0.36 0.99 -0.01 2.82 3.38 -1.11 -0.67 115.31 121.08 1p3i h LEU 700 Ca 0.10 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1p3i h LEU 700 Cb 0.04 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1p3i h LEU 700 CO -0.02 1.22 0.00 0.58 0.09 0.00 0.00 178.44 180.31 1p3i h VAL 701 N 0.79 1.02 -0.41 1.22 2.07 -0.90 0.39 116.25 120.43 1p3i h VAL 701 Ca 0.08 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 1p3i h VAL 701 Cb 0.90 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1p3i h VAL 701 CO 0.08 0.02 0.10 0.00 0.02 0.00 0.00 177.57 177.79 1p3i h ALA 702 N 0.98 1.41 -0.44 1.67 0.00 -1.24 -1.81 119.26 119.82 1p3i h ALA 702 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1p3i h ALA 702 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1p3i h ALA 702 CO -0.00 0.43 -0.10 1.25 0.00 0.00 0.00 179.25 180.83 1p3i h LEU 703 N 0.59 0.77 -1.43 0.00 5.85 -0.52 -2.39 115.31 118.19 1p3i h LEU 703 Ca 0.14 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.57 1p3i h LEU 703 Cb 0.23 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1p3i h LEU 703 CO -0.00 0.90 -0.27 -0.26 -0.34 0.00 0.00 178.44 178.46 1p3i h PHE 704 N 0.71 0.02 0.32 1.25 0.05 -0.11 -0.31 116.94 118.87 1p3i h PHE 704 Ca 0.12 -0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.89 1p3i h PHE 704 Cb 0.58 -0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.52 1p3i h PHE 704 CO 0.03 0.29 -0.16 0.93 -0.18 0.00 0.00 178.31 179.22 1p3i h GLU 705 N 0.02 -0.42 -0.71 1.51 5.08 -0.91 0.37 114.58 119.51 1p3i h GLU 705 Ca 0.00 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1p3i h GLU 705 Cb 0.49 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1p3i h GLU 705 CO 0.04 -0.25 0.31 -0.44 -1.00 0.00 0.00 179.01 177.67 1p3i h ASP 706 N -0.48 0.93 -0.39 1.42 3.32 -1.27 -1.16 116.42 118.80 1p3i h ASP 706 Ca -0.04 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1p3i h ASP 706 Cb 0.36 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1p3i h ASP 706 CO 0.07 0.80 0.20 0.74 -1.72 0.00 0.00 179.24 179.33 1p3i h THR 707 N 1.01 1.16 -1.00 0.35 2.02 -0.74 -0.05 112.91 115.66 1p3i h THR 707 Ca 0.24 -0.45 0.04 0.00 0.77 0.00 0.00 66.41 67.01 1p3i h THR 707 Cb 0.14 0.75 -0.06 0.00 -1.74 0.00 0.00 68.15 67.24 1p3i h THR 707 CO -0.03 0.17 0.65 -1.13 0.37 0.00 0.00 175.52 175.56 1p3i h ASN 708 N 0.49 1.09 0.52 4.18 -1.24 0.22 -0.04 115.58 120.80 1p3i h ASN 708 Ca 0.13 -0.01 -0.11 0.00 0.71 0.00 0.00 56.30 57.03 1p3i h ASN 708 Cb 0.10 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.88 1p3i h ASN 708 CO -0.02 0.74 -0.52 -0.07 -1.29 0.00 0.00 177.43 176.28 1p3i h LEU 709 N 1.26 0.00 -0.40 0.34 3.38 -0.44 -1.97 115.31 117.47 1p3i h LEU 709 Ca 0.40 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.20 1p3i h LEU 709 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1p3i h LEU 709 CO -0.13 0.52 -0.43 0.00 0.09 0.00 0.00 178.44 178.49 1p3i h ALA 711 N 0.80 -0.17 -0.74 0.00 0.00 -0.94 -2.73 119.26 115.48 1p3i h ALA 711 Ca 0.05 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1p3i h ALA 711 Cb 1.02 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 1p3i h ALA 711 CO 0.10 -0.46 0.49 0.82 0.00 0.00 0.00 179.25 180.20 1p3i h ILE 712 N -0.43 0.89 -0.12 0.00 2.04 -1.34 0.28 117.51 118.84 1p3i h ILE 712 Ca -0.02 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1p3i h ILE 712 Cb 0.35 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1p3i h ILE 712 CO 0.03 0.11 -0.02 -0.74 0.00 0.00 0.00 178.15 177.52 1p3i h HIS 713 N 0.58 0.17 -0.27 1.37 2.76 -0.91 0.53 115.15 119.39 1p3i h HIS 713 Ca 0.35 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.51 1p3i h HIS 713 Cb 0.57 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.48 1p3i h HIS 713 CO -0.00 0.20 0.00 0.00 -1.30 0.00 0.00 177.93 176.83 1p3i n ALA 714 N -2.51 2.61 -2.16 5.26 0.00 0.95 -4.89 120.51 119.77 1p3i n ALA 714 Ca -0.01 -0.56 -0.15 0.00 0.00 0.00 0.00 53.44 52.72 1p3i n ALA 714 Cb 0.17 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.60 1p3i n ALA 714 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1p3i n LYS 715 N 0.31 -1.17 -4.23 0.00 5.02 0.18 -5.02 118.16 113.24 1p3i n LYS 715 Ca 0.10 0.77 -0.28 0.00 -2.02 0.00 0.00 58.31 56.88 1p3i n LYS 715 Cb 0.34 -5.08 -0.05 0.00 -0.02 0.00 0.00 35.03 30.22 1p3i n LYS 715 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1p3i s ARG 716 N -4.52 2.22 0.00 1.97 0.52 -0.93 -5.00 118.95 113.21 1p3i s ARG 716 Ca 0.00 -2.07 0.00 0.00 -0.52 0.00 0.00 55.73 53.14 1p3i s ARG 716 Cb 0.00 -1.89 0.00 0.00 0.52 0.00 0.00 34.95 33.58 1p3i s ARG 716 CO 0.00 -0.35 0.63 1.33 0.02 0.00 0.00 175.30 176.92 1p3i n VAL 717 N -1.42 0.32 -4.20 3.52 0.24 -1.26 -3.25 118.33 112.28 1p3i n VAL 717 Ca -0.06 -0.34 -0.33 0.00 -2.04 0.00 0.00 64.34 61.56 1p3i n VAL 717 Cb 0.65 0.91 -0.16 0.00 -1.47 0.00 0.00 33.84 33.77 1p3i n VAL 717 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1p3i s THR 718 N -0.32 2.25 0.26 3.34 2.01 -1.26 -5.00 115.64 116.91 1p3i s THR 718 Ca 0.00 -0.88 -0.30 0.00 0.31 0.00 0.00 61.69 60.82 1p3i s THR 718 Cb 0.00 -1.95 -0.09 0.00 0.01 0.00 0.00 72.50 70.47 1p3i s THR 718 CO 0.00 0.53 1.05 0.27 -0.69 0.00 0.00 174.62 175.77 1p3i s ILE 719 N 1.22 3.71 0.30 1.82 -4.36 -1.26 -4.87 121.20 117.75 1p3i s ILE 719 Ca 0.03 1.70 0.06 0.00 -0.26 0.00 0.00 60.65 62.18 1p3i s ILE 719 Cb -0.14 -4.08 -0.06 0.00 1.25 0.00 0.00 42.46 39.43 1p3i s ILE 719 CO -0.10 0.40 -0.03 -0.04 0.24 0.00 0.00 174.94 175.41 1p3i s MET 720 N -1.28 1.61 0.35 0.37 -1.94 -1.26 -5.03 119.30 112.12 1p3i s MET 720 Ca 0.44 -1.84 0.10 0.00 -1.71 0.00 0.00 55.69 52.68 1p3i s MET 720 Cb -0.30 -1.15 0.85 0.00 2.01 0.00 0.00 34.83 36.25 1p3i s MET 720 CO 0.38 -0.01 1.82 -1.35 -0.01 0.00 0.00 175.02 175.85 1p3i h PRO 721 N 2.20 0.64 0.00 2.03 0.11 -2.01 0.04 132.00 135.02 1p3i h PRO 721 Ca -0.40 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 1p3i h PRO 721 Cb 1.24 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1p3i h PRO 721 CO 0.69 0.42 -0.07 1.57 -0.21 0.00 0.00 178.00 180.40 1p3i h LYS 722 N 0.66 0.00 -0.00 1.05 2.10 -1.99 -1.19 116.57 117.20 1p3i h LYS 722 Ca 0.51 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 59.10 1p3i h LYS 722 Cb 0.92 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 1p3i h LYS 722 CO -0.27 0.07 -0.22 -0.44 -2.00 0.00 0.00 179.45 176.59 1p3i h ASP 723 N 0.00 0.20 -0.36 7.07 3.32 -1.33 -1.62 116.42 123.70 1p3i h ASP 723 Ca -0.00 -0.78 0.06 0.00 0.02 0.00 0.00 57.03 56.34 1p3i h ASP 723 Cb 0.18 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.61 1p3i h ASP 723 CO 0.01 0.95 -0.00 0.40 -1.72 0.00 0.00 179.24 178.88 1p3i h ILE 724 N -0.53 0.73 -0.58 0.35 2.04 -1.36 0.02 117.51 118.18 1p3i h ILE 724 Ca -0.03 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 65.83 1p3i h ILE 724 Cb 0.98 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 1p3i h ILE 724 CO 0.04 0.02 0.35 1.56 0.00 0.00 0.00 178.15 180.12 1p3i h GLN 725 N 0.10 0.67 -0.67 2.37 4.20 -1.26 -0.78 115.11 119.74 1p3i h GLN 725 Ca 0.17 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 1p3i h GLN 725 Cb 0.24 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 1p3i h GLN 725 CO -0.29 0.44 0.21 1.25 -0.67 0.00 0.00 178.83 179.77 1p3i h LEU 726 N 0.69 0.97 -0.53 1.46 5.85 -0.67 0.11 115.31 123.18 1p3i h LEU 726 Ca 0.23 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1p3i h LEU 726 Cb 0.03 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1p3i h LEU 726 CO -0.10 0.91 0.16 0.00 -0.34 0.00 0.00 178.44 179.08 1p3i h ALA 727 N 1.09 0.70 -0.15 1.25 0.00 -0.50 -0.62 119.26 121.03 1p3i h ALA 727 Ca 0.22 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1p3i h ALA 727 Cb 0.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1p3i h ALA 727 CO -0.01 0.36 -0.45 0.00 0.00 0.00 0.00 179.25 179.16 1p3i h ARG 728 N 0.74 0.37 0.33 0.00 3.08 -0.95 -0.82 114.38 117.13 1p3i h ARG 728 Ca 0.17 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1p3i h ARG 728 Cb 0.28 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1p3i h ARG 728 CO -0.00 0.75 -0.16 -0.09 -1.07 0.00 0.00 179.97 179.40 1p3i h ARG 729 N 0.30 -0.43 -0.48 0.04 2.43 -0.64 0.10 114.38 115.70 1p3i h ARG 729 Ca 0.02 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1p3i h ARG 729 Cb 0.92 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1p3i h ARG 729 CO 0.08 -0.16 0.22 0.82 -1.51 0.00 0.00 179.97 179.41 1p3i h ILE 730 N -0.65 1.17 0.00 1.20 2.04 -1.04 -1.43 117.51 118.79 1p3i h ILE 730 Ca -0.05 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1p3i h ILE 730 Cb 0.46 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1p3i h ILE 730 CO 0.07 0.19 0.00 0.54 0.00 0.00 0.00 178.15 178.96 1p3i n ARG 731 N -4.38 0.08 -0.60 2.37 1.74 -0.32 -4.84 116.66 110.71 1p3i n ARG 731 Ca 0.04 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 1p3i n ARG 731 Cb 0.13 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 1p3i n ARG 731 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p3i n GLY 732 N -0.69 0.69 0.11 -0.13 0.00 -0.54 -4.96 105.19 99.68 1p3i n GLY 732 Ca 0.01 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.06 1p3i n GLY 732 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1p3i n GLU 733 N -2.60 0.58 0.00 1.61 1.02 -0.01 -4.47 120.64 116.77 1p3i n GLU 733 Ca 0.00 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 56.92 1p3i n GLU 733 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1p3i n GLU 733 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1p3i n ARG 734 N -1.02 0.00 0.00 3.49 1.85 -1.22 -4.96 116.66 114.80 1p3i n ARG 734 Ca 0.13 -0.03 0.00 0.00 -1.00 0.00 0.00 57.85 56.95 1p3i n ARG 734 Cb 0.30 -0.22 0.00 0.00 -1.05 0.00 0.00 32.46 31.48 1p3i n ARG 734 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62