#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mb4 n LYS 621 N 0.00 0.18 -2.94 -1.46 2.85 -1.26 -4.78 118.16 110.75 3mb4 n LYS 621 Ca 0.00 0.10 -0.42 0.00 -1.05 0.00 0.00 58.31 56.93 3mb4 n LYS 621 Cb 0.00 -1.66 -0.05 0.00 -0.65 0.00 0.00 35.03 32.67 3mb4 n LYS 621 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3mb4 s TYR 622 N -3.09 3.10 0.36 5.58 2.02 -1.26 -5.04 117.35 119.03 3mb4 s TYR 622 Ca 0.10 0.55 -0.25 0.00 -0.37 0.00 0.00 57.07 57.10 3mb4 s TYR 622 Cb 0.15 -3.44 -0.09 0.00 -0.40 0.00 0.00 41.96 38.18 3mb4 s TYR 622 CO 0.64 -0.76 1.01 -1.64 -1.57 0.00 0.00 175.55 173.24 3mb4 s MET 623 N 3.14 4.37 0.84 -0.62 -1.94 -1.26 -5.06 119.30 118.76 3mb4 s MET 623 Ca 0.32 1.46 -0.10 0.00 -1.71 0.00 0.00 55.69 55.66 3mb4 s MET 623 Cb -0.13 -2.69 0.10 0.00 2.01 0.00 0.00 34.83 34.12 3mb4 s MET 623 CO 0.17 0.05 1.11 0.95 -0.01 0.00 0.00 175.02 177.30 3mb4 s THR 624 N -1.61 2.79 0.24 2.05 -4.23 -1.26 -4.77 115.64 108.85 3mb4 s THR 624 Ca 0.54 0.26 -0.06 0.00 -1.18 0.00 0.00 61.69 61.24 3mb4 s THR 624 Cb -0.21 -2.55 0.25 0.00 1.34 0.00 0.00 72.50 71.32 3mb4 s THR 624 CO 0.27 -0.33 1.66 -0.65 -0.54 0.00 0.00 174.62 175.03 3mb4 h PRO 625 N -1.46 0.18 -0.41 3.99 0.11 -1.99 0.88 132.00 133.30 3mb4 h PRO 625 Ca -0.44 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 3mb4 h PRO 625 Cb 1.25 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3mb4 h PRO 625 CO 0.48 0.12 0.12 1.98 -0.21 0.00 0.00 178.00 180.48 3mb4 h MET 626 N 0.18 0.65 -0.89 1.05 1.85 -1.99 0.13 114.93 115.90 3mb4 h MET 626 Ca 0.41 -0.15 0.06 0.00 -0.61 0.00 0.00 59.70 59.42 3mb4 h MET 626 Cb 0.72 -0.09 -0.06 0.00 0.43 0.00 0.00 31.60 32.60 3mb4 h MET 626 CO -0.58 0.65 0.58 1.96 -0.40 0.00 0.00 176.91 179.12 3mb4 h GLN 627 N 0.52 0.98 -0.24 0.39 4.20 -1.77 -0.85 115.11 118.35 3mb4 h GLN 627 Ca 0.13 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.63 3mb4 h GLN 627 Cb 0.28 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3mb4 h GLN 627 CO -0.00 0.65 -0.46 1.96 -0.67 0.00 0.00 178.83 180.31 3mb4 h GLN 628 N 1.01 0.62 -0.23 1.46 4.20 -0.29 -0.93 115.11 120.96 3mb4 h GLN 628 Ca 0.38 -0.35 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 3mb4 h GLN 628 Cb 0.19 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 3mb4 h GLN 628 CO -0.14 0.95 -0.01 -0.22 -0.67 0.00 0.00 178.83 178.74 3mb4 h LYS 629 N 0.50 0.40 -0.17 1.46 3.64 -0.36 0.39 116.57 122.43 3mb4 h LYS 629 Ca 0.03 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 3mb4 h LYS 629 Cb 0.99 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.73 3mb4 h LYS 629 CO 0.09 0.60 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.69 3mb4 h LEU 630 N 0.16 -0.37 -0.64 5.20 3.38 -1.09 -1.34 115.31 120.62 3mb4 h LEU 630 Ca 0.06 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.18 3mb4 h LEU 630 Cb 0.42 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 3mb4 h LEU 630 CO 0.01 -0.15 0.34 -1.13 0.09 0.00 0.00 178.44 177.60 3mb4 h ASN 631 N -0.11 0.48 -0.71 -0.43 -0.73 -1.02 -1.16 115.58 111.89 3mb4 h ASN 631 Ca 0.10 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.29 3mb4 h ASN 631 Cb 0.26 -0.05 -0.03 0.00 0.27 0.00 0.00 38.32 38.77 3mb4 h ASN 631 CO -0.24 0.31 0.35 -0.08 -0.37 0.00 0.00 177.43 177.39 3mb4 h GLU 632 N 0.62 1.02 -0.18 6.67 4.81 -0.53 0.99 114.58 127.97 3mb4 h GLU 632 Ca 0.29 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3mb4 h GLU 632 Cb 0.22 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3mb4 h GLU 632 CO -0.20 0.79 0.09 0.28 -0.73 0.00 0.00 179.01 179.24 3mb4 h VAL 633 N 0.99 1.13 -0.11 0.32 2.07 -1.06 -0.43 116.25 119.16 3mb4 h VAL 633 Ca 0.24 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 3mb4 h VAL 633 Cb 0.10 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3mb4 h VAL 633 CO -0.03 0.12 0.06 0.22 0.02 0.00 0.00 177.57 177.96 3mb4 h TYR 634 N 0.16 0.14 -0.18 1.57 3.20 -0.99 -2.42 116.97 118.47 3mb4 h TYR 634 Ca 0.06 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 3mb4 h TYR 634 Cb 0.12 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 3mb4 h TYR 634 CO -0.03 0.15 -0.12 0.93 -1.64 0.00 0.00 178.16 177.46 3mb4 h GLU 635 N 0.10 0.28 -0.52 1.82 4.39 -0.73 -1.27 114.58 118.64 3mb4 h GLU 635 Ca 0.04 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 3mb4 h GLU 635 Cb 0.05 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3mb4 h GLU 635 CO -0.01 0.41 0.18 0.00 -1.16 0.00 0.00 179.01 178.43 3mb4 h ALA 636 N 1.62 0.67 -0.13 3.43 0.00 -0.58 0.22 119.26 124.49 3mb4 h ALA 636 Ca 0.05 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 3mb4 h ALA 636 Cb 0.38 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3mb4 h ALA 636 CO 0.02 0.31 -0.18 0.28 0.00 0.00 0.00 179.25 179.69 3mb4 h VAL 637 N 0.70 1.36 -0.56 0.00 2.07 -1.22 -2.40 116.25 116.20 3mb4 h VAL 637 Ca 0.17 -1.38 0.02 0.00 0.82 0.00 0.00 66.70 66.33 3mb4 h VAL 637 Cb 0.24 1.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 3mb4 h VAL 637 CO -0.01 0.40 0.34 0.50 0.02 0.00 0.00 177.57 178.83 3mb4 h LYS 638 N -0.04 0.66 -0.00 1.57 3.64 -1.07 -3.20 116.57 118.14 3mb4 h LYS 638 Ca 0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3mb4 h LYS 638 Cb 0.73 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3mb4 h LYS 638 CO 0.04 0.44 -0.59 0.09 -2.27 0.00 0.00 179.45 177.16 3mb4 n ASN 639 N -4.76 0.73 -4.67 4.20 3.02 0.76 -4.54 115.26 110.00 3mb4 n ASN 639 Ca 0.04 -0.54 -0.54 0.00 -0.03 0.00 0.00 54.58 53.52 3mb4 n ASN 639 Cb 0.07 0.42 -0.06 0.00 -0.61 0.00 0.00 39.78 39.60 3mb4 n ASN 639 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mb4 n TYR 640 N -1.36 1.94 -5.14 3.10 9.36 -0.90 -4.98 117.16 119.19 3mb4 n TYR 640 Ca 0.06 0.47 -0.29 0.00 3.32 0.00 0.00 57.90 61.46 3mb4 n TYR 640 Cb 0.34 -2.45 -0.16 0.00 -0.63 0.00 0.00 39.34 36.43 3mb4 n TYR 640 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 3mb4 s THR 641 N 2.42 1.84 0.66 2.97 -4.23 -1.26 -3.40 115.64 114.64 3mb4 s THR 641 Ca 0.92 -0.97 -0.11 0.00 -1.18 0.00 0.00 61.69 60.35 3mb4 s THR 641 Cb -0.95 -1.55 0.15 0.00 1.34 0.00 0.00 72.50 71.50 3mb4 s THR 641 CO 0.55 0.52 0.84 -0.90 -0.54 0.00 0.00 174.62 175.09 3mb4 n ASP 642 N 2.82 -0.22 0.29 3.99 5.68 -0.68 -4.84 116.55 123.59 3mb4 n ASP 642 Ca -0.17 -1.25 0.17 0.00 -0.50 0.00 0.00 54.79 53.04 3mb4 n ASP 642 Cb 0.52 -0.66 0.82 0.00 -1.14 0.00 0.00 41.12 40.67 3mb4 n ASP 642 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 3mb4 h LYS 643 N 0.00 0.00 -0.06 0.11 1.57 -2.01 -1.15 116.57 115.02 3mb4 h LYS 643 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 3mb4 h LYS 643 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.09 3mb4 h LYS 643 CO 0.19 0.04 0.00 0.54 -0.57 0.00 0.00 179.45 179.66 3mb4 n ARG 644 N -3.24 1.71 -0.46 3.15 1.74 -1.26 -4.94 116.66 113.36 3mb4 n ARG 644 Ca -0.01 -1.04 0.00 0.00 -0.77 0.00 0.00 57.85 56.03 3mb4 n ARG 644 Cb 0.24 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 3mb4 n ARG 644 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mb4 n GLY 645 N 1.17 0.75 3.70 -0.13 0.00 -0.44 -5.05 105.19 105.19 3mb4 n GLY 645 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3mb4 n GLY 645 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mb4 s ARG 646 N -0.54 4.44 -0.57 1.61 3.52 -1.26 -4.74 118.95 121.41 3mb4 s ARG 646 Ca 0.00 1.19 -0.20 0.00 -0.13 0.00 0.00 55.73 56.59 3mb4 s ARG 646 Cb 0.00 -3.50 0.08 0.00 -1.56 0.00 0.00 34.95 29.96 3mb4 s ARG 646 CO 0.00 -0.15 0.73 0.50 -0.81 0.00 0.00 175.30 175.57 3mb4 s ARG 647 N 1.46 3.10 0.43 5.12 3.52 -1.26 -1.68 118.95 129.64 3mb4 s ARG 647 Ca 0.44 -1.01 0.15 0.00 -0.13 0.00 0.00 55.73 55.19 3mb4 s ARG 647 Cb -0.19 -4.18 0.96 0.00 -1.56 0.00 0.00 34.95 29.99 3mb4 s ARG 647 CO 0.20 -1.46 1.95 -0.07 -0.81 0.00 0.00 175.30 175.11 3mb4 h LEU 648 N 10.14 0.00 -1.28 -0.88 4.07 -1.89 -3.05 115.31 122.43 3mb4 h LEU 648 Ca -0.28 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.68 3mb4 h LEU 648 Cb 1.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.83 3mb4 h LEU 648 CO 1.06 0.24 0.00 0.77 -1.08 0.00 0.00 178.44 179.43 3mb4 h SER 649 N 0.00 0.00 -1.03 -0.43 4.64 -1.80 -3.31 113.55 111.62 3mb4 h SER 649 Ca -0.00 0.00 0.26 0.00 -0.47 0.00 0.00 61.79 61.58 3mb4 h SER 649 Cb 0.43 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.42 3mb4 h SER 649 CO 0.03 0.00 0.64 0.00 -0.87 0.00 0.00 176.83 176.63 3mb4 h ALA 650 N 2.12 2.06 -0.03 5.18 0.00 -1.85 0.39 119.26 127.13 3mb4 h ALA 650 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3mb4 h ALA 650 Cb 0.30 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3mb4 h ALA 650 CO 0.00 -0.50 0.00 0.44 0.00 0.00 0.00 179.25 179.19 3mb4 n ILE 651 N -4.74 0.02 0.64 0.00 -5.35 -1.25 -3.84 119.36 104.84 3mb4 n ILE 651 Ca 0.26 -0.23 0.07 0.00 -0.27 0.00 0.00 62.75 62.58 3mb4 n ILE 651 Cb 0.84 0.38 0.02 0.00 -1.74 0.00 0.00 39.64 39.15 3mb4 n ILE 651 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3mb4 n PHE 652 N 0.07 0.00 0.00 4.28 3.72 0.12 -4.66 117.46 120.98 3mb4 n PHE 652 Ca 0.19 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.46 3mb4 n PHE 652 Cb 0.33 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.78 3mb4 n PHE 652 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3mb4 h LEU 653 N 2.13 0.01 -7.42 4.37 3.38 -1.64 -0.12 115.31 116.01 3mb4 h LEU 653 Ca 0.00 -0.35 -0.30 0.00 0.09 0.00 0.00 57.88 57.32 3mb4 h LEU 653 Cb 0.55 -0.00 -0.35 0.00 0.09 0.00 0.00 40.66 40.95 3mb4 h LEU 653 CO 0.00 0.36 -0.68 -0.60 0.09 0.00 0.00 178.44 177.60 3mb4 s ARG 654 N -4.80 -0.00 0.71 1.13 6.06 -1.26 -0.99 118.95 119.80 3mb4 s ARG 654 Ca -0.15 0.33 -0.14 0.00 -2.50 0.00 0.00 55.73 53.27 3mb4 s ARG 654 Cb 0.03 -0.28 0.03 0.00 0.06 0.00 0.00 34.95 34.78 3mb4 s ARG 654 CO 0.67 -0.22 1.12 -0.51 -2.50 0.00 0.00 175.30 173.87 3mb4 s LEU 655 N 1.48 3.26 0.74 -0.88 1.43 -1.26 -5.02 118.68 118.43 3mb4 s LEU 655 Ca -0.05 2.02 -0.15 0.00 -1.03 0.00 0.00 54.13 54.93 3mb4 s LEU 655 Cb -0.12 -4.55 0.04 0.00 0.03 0.00 0.00 46.19 41.59 3mb4 s LEU 655 CO -0.04 -1.92 1.19 -2.16 0.23 0.00 0.00 176.35 173.65 3mb4 s PRO 656 N -4.29 2.13 0.86 1.29 0.04 -1.26 -5.01 135.00 128.77 3mb4 s PRO 656 Ca 0.67 1.69 -0.11 0.00 0.04 0.00 0.00 61.00 63.29 3mb4 s PRO 656 Cb -0.21 -1.84 0.11 0.00 0.04 0.00 0.00 34.50 32.60 3mb4 s PRO 656 CO 0.46 -1.83 1.11 -1.54 0.04 0.00 0.00 177.00 175.24 3mb4 s SER 657 N -2.17 3.58 0.53 6.66 1.04 -1.26 -4.85 113.70 117.23 3mb4 s SER 657 Ca 0.73 1.87 0.23 0.00 0.48 0.00 0.00 55.95 59.26 3mb4 s SER 657 Cb -0.27 -2.47 1.43 0.00 0.10 0.00 0.00 66.02 64.81 3mb4 s SER 657 CO 0.46 -2.63 2.13 0.03 0.98 0.00 0.00 173.24 174.21 3mb4 h ARG 658 N -1.54 0.00 0.00 4.02 3.08 -1.95 -1.94 114.38 116.05 3mb4 h ARG 658 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 3mb4 h ARG 658 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 3mb4 h ARG 658 CO 0.48 0.07 -0.89 0.43 -1.07 0.00 0.00 179.97 179.00 3mb4 n SER 659 N -4.05 0.72 0.08 7.04 7.64 -1.26 -2.02 113.62 121.77 3mb4 n SER 659 Ca -0.03 0.12 -0.13 0.00 1.01 0.00 0.00 58.87 59.85 3mb4 n SER 659 Cb 0.16 0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 63.75 3mb4 n SER 659 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 3mb4 h GLU 660 N 0.00 0.30 -1.26 1.43 5.08 -1.73 -3.42 114.58 114.99 3mb4 h GLU 660 Ca 0.00 -0.37 -0.43 0.00 -1.00 0.00 0.00 59.36 57.56 3mb4 h GLU 660 Cb 0.84 0.12 -0.30 0.00 0.50 0.00 0.00 28.75 29.91 3mb4 h GLU 660 CO 0.00 1.09 -0.89 -0.11 -1.00 0.00 0.00 179.01 178.10 3mb4 n LEU 661 N -3.66 -0.87 -0.35 1.33 7.94 -0.90 -4.99 117.00 115.50 3mb4 n LEU 661 Ca -0.06 -4.23 0.07 0.00 -1.11 0.00 0.00 56.01 50.67 3mb4 n LEU 661 Cb 0.88 0.73 0.24 0.00 0.53 0.00 0.00 43.42 45.80 3mb4 n LEU 661 CO 0.51 2.07 1.24 1.55 -1.11 0.00 0.00 177.39 181.65 3mb4 h PRO 662 N 3.84 0.98 -0.93 1.96 0.13 -1.66 -1.74 132.00 134.58 3mb4 h PRO 662 Ca -0.01 -0.06 0.18 0.00 -0.87 0.00 0.00 66.00 65.25 3mb4 h PRO 662 Cb 0.95 -0.22 -0.08 0.00 0.13 0.00 0.00 31.00 31.78 3mb4 h PRO 662 CO 0.40 0.65 0.60 0.22 -0.23 0.00 0.00 178.00 179.64 3mb4 h ASP 663 N 1.00 0.58 -0.19 1.44 3.58 -1.95 -1.75 116.42 119.14 3mb4 h ASP 663 Ca 0.47 0.06 0.04 0.00 0.42 0.00 0.00 57.03 58.02 3mb4 h ASP 663 Cb 0.43 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 3mb4 h ASP 663 CO -0.24 0.25 -0.05 0.22 -2.88 0.00 0.00 179.24 176.54 3mb4 h TYR 664 N 0.59 -0.12 0.00 0.28 3.20 -1.70 -2.11 116.97 117.11 3mb4 h TYR 664 Ca 0.49 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.38 3mb4 h TYR 664 Cb 0.97 0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.32 3mb4 h TYR 664 CO -0.00 -0.09 0.00 1.88 -1.64 0.00 0.00 178.16 178.31 3mb4 h TYR 665 N -0.01 0.00 -0.02 -3.82 0.05 -1.43 0.83 116.97 112.57 3mb4 h TYR 665 Ca 0.09 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.68 3mb4 h TYR 665 Cb 0.15 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 3mb4 h TYR 665 CO -0.22 0.00 -0.82 -0.07 -1.05 0.00 0.00 178.16 176.00 3mb4 h LEU 666 N 0.00 0.32 0.15 3.88 3.38 -1.21 -3.37 115.31 118.46 3mb4 h LEU 666 Ca 0.00 -0.24 -0.34 0.00 0.09 0.00 0.00 57.88 57.39 3mb4 h LEU 666 Cb 0.76 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3mb4 h LEU 666 CO 0.00 1.01 -1.74 0.74 0.09 0.00 0.00 178.44 178.53 3mb4 h THR 667 N 0.15 0.93 -3.60 0.22 2.02 -0.78 -3.45 112.91 108.40 3mb4 h THR 667 Ca -0.04 -2.56 -0.70 0.00 0.77 0.00 0.00 66.41 63.88 3mb4 h THR 667 Cb 1.42 2.71 -0.24 0.00 -1.74 0.00 0.00 68.15 70.30 3mb4 h THR 667 CO 0.13 0.84 -0.52 -0.63 0.37 0.00 0.00 175.52 175.71 3mb4 s ILE 668 N -2.58 4.57 0.22 3.11 -1.09 0.23 -4.98 121.20 120.68 3mb4 s ILE 668 Ca -0.15 -0.78 -0.06 0.00 -2.23 0.00 0.00 60.65 57.43 3mb4 s ILE 668 Cb 0.06 -3.51 0.11 0.00 -1.58 0.00 0.00 42.46 37.54 3mb4 s ILE 668 CO 0.84 -0.18 1.73 0.50 -1.23 0.00 0.00 174.94 176.60 3mb4 h LYS 669 N 8.42 0.99 -2.77 2.79 3.64 -1.88 -3.37 116.57 124.37 3mb4 h LYS 669 Ca -0.27 -0.26 -0.61 0.00 -1.27 0.00 0.00 60.65 58.25 3mb4 h LYS 669 Cb 1.11 -0.12 -0.40 0.00 -0.41 0.00 0.00 32.23 32.41 3mb4 h LYS 669 CO 0.66 0.92 -0.77 0.21 -2.27 0.00 0.00 179.45 178.20 3mb4 s LYS 670 N -5.14 1.62 0.38 1.90 2.20 -1.26 -5.11 119.74 114.33 3mb4 s LYS 670 Ca -0.11 -2.61 -0.28 0.00 -0.36 0.00 0.00 55.97 52.62 3mb4 s LYS 670 Cb 0.15 -2.41 -0.11 0.00 -1.51 0.00 0.00 37.83 33.94 3mb4 s LYS 670 CO 0.83 -1.31 1.49 -2.30 -0.36 0.00 0.00 175.35 173.71 3mb4 n PRO 671 N 2.61 2.68 -3.76 4.03 -0.02 -1.26 -4.90 135.00 134.38 3mb4 n PRO 671 Ca 0.22 0.94 -0.12 0.00 -2.02 0.00 0.00 63.50 62.51 3mb4 n PRO 671 Cb 0.40 -2.67 -0.12 0.00 -0.02 0.00 0.00 33.50 31.09 3mb4 n PRO 671 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 3mb4 s MET 672 N -2.08 0.27 0.25 -0.52 1.75 -1.26 -5.07 119.30 112.64 3mb4 s MET 672 Ca 0.53 0.46 -0.01 0.00 -1.25 0.00 0.00 55.69 55.42 3mb4 s MET 672 Cb -0.48 0.03 -0.03 0.00 2.84 0.00 0.00 34.83 37.20 3mb4 s MET 672 CO 0.64 -0.09 0.24 0.16 -0.65 0.00 0.00 175.02 175.31 3mb4 s ASP 673 N 0.65 0.49 0.31 1.11 1.47 -1.26 -4.75 116.67 114.69 3mb4 s ASP 673 Ca -0.04 -1.41 0.05 0.00 1.18 0.00 0.00 52.55 52.33 3mb4 s ASP 673 Cb -0.06 0.47 0.51 0.00 -0.34 0.00 0.00 42.92 43.51 3mb4 s ASP 673 CO -0.04 -0.97 1.77 0.24 0.68 0.00 0.00 175.17 176.85 3mb4 h MET 674 N 2.43 0.38 -0.73 2.11 2.86 -0.79 -2.17 114.93 119.02 3mb4 h MET 674 Ca -0.32 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.18 3mb4 h MET 674 Cb 1.25 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.84 3mb4 h MET 674 CO 0.46 0.60 0.40 1.49 1.06 0.00 0.00 176.91 180.92 3mb4 h GLU 675 N 0.34 1.01 -0.39 1.72 4.57 -1.31 0.39 114.58 120.91 3mb4 h GLU 675 Ca 0.05 -0.11 -0.09 0.00 -1.18 0.00 0.00 59.36 58.04 3mb4 h GLU 675 Cb 0.61 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 3mb4 h GLU 675 CO 0.04 0.74 -0.10 -0.22 -1.18 0.00 0.00 179.01 178.29 3mb4 h LYS 676 N 1.01 0.76 0.36 1.92 3.64 -1.71 -0.26 116.57 122.29 3mb4 h LYS 676 Ca 0.26 -0.30 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 3mb4 h LYS 676 Cb 0.03 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3mb4 h LYS 676 CO -0.04 0.90 -0.18 0.82 -2.27 0.00 0.00 179.45 178.68 3mb4 h ILE 677 N 0.57 0.64 -0.33 2.00 2.04 -0.99 -1.52 117.51 119.91 3mb4 h ILE 677 Ca 0.10 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.99 3mb4 h ILE 677 Cb 0.63 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 3mb4 h ILE 677 CO 0.04 0.00 0.13 -0.09 0.00 0.00 0.00 178.15 178.23 3mb4 h ARG 678 N -0.49 0.28 -0.60 2.37 2.43 -0.10 -0.49 114.38 117.78 3mb4 h ARG 678 Ca -0.05 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.19 3mb4 h ARG 678 Cb 0.38 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.80 3mb4 h ARG 678 CO 0.08 0.19 0.25 1.03 -1.51 0.00 0.00 179.97 180.00 3mb4 h SER 679 N 0.29 0.29 -0.57 -3.80 0.87 -0.88 0.74 113.55 110.49 3mb4 h SER 679 Ca 0.14 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.73 3mb4 h SER 679 Cb 0.09 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 3mb4 h SER 679 CO -0.13 0.18 0.21 0.45 -0.53 0.00 0.00 176.83 177.01 3mb4 h HIS 680 N 0.46 0.88 -0.26 2.24 3.86 -0.65 -1.24 115.15 120.44 3mb4 h HIS 680 Ca 0.29 -0.08 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 3mb4 h HIS 680 Cb 0.32 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 3mb4 h HIS 680 CO -0.15 0.73 0.09 1.98 0.86 0.00 0.00 177.93 181.45 3mb4 h MET 681 N 0.78 0.39 0.00 2.45 -1.53 -0.72 -1.38 114.93 114.92 3mb4 h MET 681 Ca 0.19 -0.08 -0.03 0.00 -3.44 0.00 0.00 59.70 56.34 3mb4 h MET 681 Cb 0.24 -0.06 -0.00 0.00 -0.55 0.00 0.00 31.60 31.22 3mb4 h MET 681 CO -0.01 0.44 -0.13 0.52 0.14 0.00 0.00 176.91 177.88 3mb4 h MET 682 N 0.26 0.00 -0.01 0.39 2.86 -0.63 -0.62 114.93 117.18 3mb4 h MET 682 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3mb4 h MET 682 Cb 0.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.86 3mb4 h MET 682 CO -0.01 0.13 0.00 0.00 1.06 0.00 0.00 176.91 178.09 3mb4 n ALA 683 N -2.40 2.64 -2.94 6.32 0.00 -0.49 -4.92 120.51 118.72 3mb4 n ALA 683 Ca -0.02 -0.26 -0.20 0.00 0.00 0.00 0.00 53.44 52.95 3mb4 n ALA 683 Cb 0.21 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.31 3mb4 n ALA 683 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mb4 n ASN 684 N -0.64 -5.70 -0.14 0.00 3.02 -0.24 -4.92 115.26 106.64 3mb4 n ASN 684 Ca 0.21 -0.26 0.12 0.00 -0.03 0.00 0.00 54.58 54.62 3mb4 n ASN 684 Cb 0.17 -4.53 0.15 0.00 -0.61 0.00 0.00 39.78 34.96 3mb4 n ASN 684 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3mb4 n LYS 685 N -3.71 0.40 -3.37 3.52 5.02 -0.56 -4.76 118.16 114.69 3mb4 n LYS 685 Ca -0.10 -0.28 -0.39 0.00 -2.02 0.00 0.00 58.31 55.52 3mb4 n LYS 685 Cb 0.61 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 34.04 3mb4 n LYS 685 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3mb4 s TYR 686 N -2.80 3.29 -0.49 2.13 2.02 -1.26 -4.97 117.35 115.27 3mb4 s TYR 686 Ca 0.15 0.51 0.23 0.00 -0.37 0.00 0.00 57.07 57.59 3mb4 s TYR 686 Cb 0.18 -2.57 0.15 0.00 -0.40 0.00 0.00 41.96 39.31 3mb4 s TYR 686 CO 0.68 -0.15 1.14 1.04 -1.57 0.00 0.00 175.55 176.69 3mb4 n GLN 687 N 5.04 0.40 -3.96 -0.62 1.13 -1.26 -4.97 117.38 113.14 3mb4 n GLN 687 Ca -0.08 0.07 -0.10 0.00 -1.94 0.00 0.00 57.00 54.95 3mb4 n GLN 687 Cb 0.51 -1.70 -0.03 0.00 0.11 0.00 0.00 30.24 29.12 3mb4 n GLN 687 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 3mb4 s ASP 688 N -4.51 0.11 0.22 1.08 1.47 -1.26 -5.06 116.67 108.72 3mb4 s ASP 688 Ca 0.03 -1.04 -0.02 0.00 1.18 0.00 0.00 52.55 52.71 3mb4 s ASP 688 Cb 0.12 0.67 0.21 0.00 -0.34 0.00 0.00 42.92 43.59 3mb4 s ASP 688 CO 0.77 -1.31 1.60 0.40 0.68 0.00 0.00 175.17 177.31 3mb4 h ILE 689 N 2.14 1.29 -0.24 2.11 1.08 -1.95 -2.93 117.51 119.02 3mb4 h ILE 689 Ca -0.27 -1.54 -0.02 0.00 -0.39 0.00 0.00 64.86 62.65 3mb4 h ILE 689 Cb 1.25 1.51 -0.01 0.00 -3.07 0.00 0.00 36.82 36.50 3mb4 h ILE 689 CO 0.35 0.49 0.04 0.44 -0.69 0.00 0.00 178.15 178.78 3mb4 h ASP 690 N 0.49 0.30 -0.57 1.72 3.32 -1.99 -0.26 116.42 119.44 3mb4 h ASP 690 Ca 0.05 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 3mb4 h ASP 690 Cb 0.88 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 3mb4 h ASP 690 CO 0.08 0.33 -0.04 0.28 -1.72 0.00 0.00 179.24 178.16 3mb4 h SER 691 N 0.33 1.03 -0.41 6.45 0.02 -1.94 -0.63 113.55 118.41 3mb4 h SER 691 Ca 0.08 -0.32 -0.07 0.00 -0.84 0.00 0.00 61.79 60.63 3mb4 h SER 691 Cb 0.16 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 3mb4 h SER 691 CO -0.00 1.11 -0.03 -0.03 -1.14 0.00 0.00 176.83 176.73 3mb4 h MET 692 N 0.93 0.74 -0.88 3.45 1.85 -1.35 -2.94 114.93 116.73 3mb4 h MET 692 Ca 0.16 -0.25 -0.01 0.00 -0.61 0.00 0.00 59.70 58.99 3mb4 h MET 692 Cb 0.60 -0.06 -0.04 0.00 0.43 0.00 0.00 31.60 32.53 3mb4 h MET 692 CO 0.04 0.84 0.53 0.28 -0.40 0.00 0.00 176.91 178.19 3mb4 h VAL 693 N 0.57 1.24 -0.80 -5.77 2.07 -0.84 -1.65 116.25 111.08 3mb4 h VAL 693 Ca 0.11 -0.54 0.06 0.00 0.82 0.00 0.00 66.70 67.16 3mb4 h VAL 693 Cb 0.52 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.24 3mb4 h VAL 693 CO 0.03 0.26 0.48 -0.08 0.02 0.00 0.00 177.57 178.28 3mb4 h GLU 694 N 1.21 0.86 -0.28 1.57 4.81 -0.99 0.95 114.58 122.71 3mb4 h GLU 694 Ca 0.32 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.33 3mb4 h GLU 694 Cb -0.05 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.13 3mb4 h GLU 694 CO -0.06 0.57 -0.48 -0.44 -0.73 0.00 0.00 179.01 177.87 3mb4 h ASP 695 N 0.89 0.83 -0.49 1.04 3.32 -1.16 -1.43 116.42 119.43 3mb4 h ASP 695 Ca 0.35 -0.42 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3mb4 h ASP 695 Cb 0.17 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3mb4 h ASP 695 CO -0.17 1.18 0.28 -0.26 -1.72 0.00 0.00 179.24 178.54 3mb4 h PHE 696 N 0.60 0.66 -0.57 4.55 0.04 -0.94 -0.69 116.94 120.59 3mb4 h PHE 696 Ca 0.03 -0.01 0.04 0.00 2.80 0.00 0.00 57.97 60.83 3mb4 h PHE 696 Cb 1.06 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 38.95 3mb4 h PHE 696 CO 0.06 0.48 0.32 0.28 -0.60 0.00 0.00 178.31 178.85 3mb4 h VAL 697 N 0.65 1.00 -0.37 -0.55 2.07 -0.69 -0.28 116.25 118.08 3mb4 h VAL 697 Ca 0.17 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.53 3mb4 h VAL 697 Cb 0.03 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 3mb4 h VAL 697 CO -0.03 0.11 0.11 -0.03 0.02 0.00 0.00 177.57 177.75 3mb4 h MET 698 N 0.61 0.24 -0.24 1.57 1.85 -1.04 0.15 114.93 118.07 3mb4 h MET 698 Ca 0.24 -0.01 0.03 0.00 -0.61 0.00 0.00 59.70 59.35 3mb4 h MET 698 Cb 0.11 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.06 3mb4 h MET 698 CO -0.14 0.16 0.06 1.98 -0.40 0.00 0.00 176.91 178.57 3mb4 h MET 699 N 0.25 0.16 -0.36 0.39 -1.53 -0.38 0.17 114.93 113.61 3mb4 h MET 699 Ca 0.17 -0.01 -0.15 0.00 -3.44 0.00 0.00 59.70 56.27 3mb4 h MET 699 Cb 0.17 -0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 31.17 3mb4 h MET 699 CO -0.19 0.11 -0.36 0.74 0.14 0.00 0.00 176.91 177.34 3mb4 h PHE 700 N 0.16 1.01 -0.30 1.39 0.04 -0.83 -2.17 116.94 116.25 3mb4 h PHE 700 Ca 0.11 -0.29 -0.08 0.00 2.80 0.00 0.00 57.97 60.51 3mb4 h PHE 700 Cb 0.09 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 3mb4 h PHE 700 CO -0.14 1.08 -0.17 -0.97 -0.60 0.00 0.00 178.31 177.51 3mb4 h ASN 701 N 0.70 0.52 -0.68 2.17 -0.73 -0.29 -1.17 115.58 116.10 3mb4 h ASN 701 Ca 0.06 -0.15 -0.04 0.00 1.87 0.00 0.00 56.30 58.04 3mb4 h ASN 701 Cb 0.93 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 39.35 3mb4 h ASN 701 CO 0.09 0.71 0.28 0.78 -0.37 0.00 0.00 177.43 178.92 3mb4 h ASN 702 N 0.48 0.94 -0.67 1.15 2.35 -0.41 0.58 115.58 119.99 3mb4 h ASN 702 Ca 0.08 -0.16 -0.06 0.00 -0.55 0.00 0.00 56.30 55.61 3mb4 h ASN 702 Cb 0.58 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 3mb4 h ASN 702 CO 0.04 0.84 0.20 0.00 -1.65 0.00 0.00 177.43 176.86 3mb4 h ALA 703 N 1.13 1.05 0.00 -0.83 0.00 -1.07 -0.38 119.26 119.16 3mb4 h ALA 703 Ca 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3mb4 h ALA 703 Cb 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3mb4 h ALA 703 CO -0.02 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.87 3mb4 h THR 705 N 0.00 0.76 -0.02 0.00 2.02 -0.24 -3.39 112.91 112.04 3mb4 h THR 705 Ca 0.00 -2.30 -0.21 0.00 0.77 0.00 0.00 66.41 64.67 3mb4 h THR 705 Cb 0.58 2.44 -0.00 0.00 -1.74 0.00 0.00 68.15 69.42 3mb4 h THR 705 CO 0.00 0.69 -0.87 0.22 0.37 0.00 0.00 175.52 175.94 3mb4 h TYR 706 N -0.31 0.51 -2.61 3.16 3.20 -1.13 -3.46 116.97 116.34 3mb4 h TYR 706 Ca -0.39 -0.27 -0.56 0.00 3.14 0.00 0.00 58.73 60.66 3mb4 h TYR 706 Cb 1.78 -0.06 -0.06 0.00 1.54 0.00 0.00 36.73 39.93 3mb4 h TYR 706 CO 0.09 1.06 -0.54 -0.80 -1.64 0.00 0.00 178.16 176.34 3mb4 s ASN 707 N -7.01 5.71 0.45 -2.11 0.01 -0.78 -5.10 114.94 106.11 3mb4 s ASN 707 Ca -0.05 -0.07 -0.19 0.00 -0.71 0.00 0.00 52.86 51.84 3mb4 s ASN 707 Cb 0.10 -1.55 -0.10 0.00 0.41 0.00 0.00 41.25 40.11 3mb4 s ASN 707 CO 0.85 0.05 0.95 -0.70 -1.51 0.00 0.00 177.10 176.74 3mb4 s GLU 708 N -3.22 4.11 0.60 -0.60 2.56 -1.26 -4.71 118.70 116.17 3mb4 s GLU 708 Ca 0.32 1.02 0.30 0.00 0.00 0.00 0.00 54.97 56.61 3mb4 s GLU 708 Cb -0.10 -2.18 1.70 0.00 2.00 0.00 0.00 34.13 35.55 3mb4 s GLU 708 CO 0.25 -0.11 2.09 -1.35 -0.56 0.00 0.00 175.26 175.58 3mb4 h PRO 709 N 1.55 0.00 0.00 4.30 0.11 -1.97 -0.44 132.00 135.55 3mb4 h PRO 709 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3mb4 h PRO 709 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3mb4 h PRO 709 CO 0.61 0.00 -0.01 1.05 -0.21 0.00 0.00 178.00 179.45 3mb4 h GLU 710 N 0.00 0.00 -7.22 1.05 -0.00 -2.00 -3.42 114.58 102.99 3mb4 h GLU 710 Ca 0.08 0.00 -0.50 0.00 -0.00 0.00 0.00 59.36 58.94 3mb4 h GLU 710 Cb 0.51 0.00 0.08 0.00 -0.00 0.00 0.00 28.75 29.33 3mb4 h GLU 710 CO -0.00 0.01 0.37 -1.54 -0.00 0.00 0.00 179.01 177.85 3mb4 s SER 711 N -5.90 5.59 0.19 3.06 1.04 -0.17 -4.92 113.70 112.59 3mb4 s SER 711 Ca 0.03 1.82 -0.10 0.00 0.48 0.00 0.00 55.95 58.18 3mb4 s SER 711 Cb 0.08 -2.53 0.12 0.00 0.10 0.00 0.00 66.02 63.78 3mb4 s SER 711 CO 0.59 -1.30 1.76 0.25 0.98 0.00 0.00 173.24 175.53 3mb4 h LEU 712 N 0.19 0.94 -0.58 2.42 5.85 -1.91 -2.13 115.31 120.09 3mb4 h LEU 712 Ca -0.46 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.05 3mb4 h LEU 712 Cb 1.22 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3mb4 h LEU 712 CO 0.57 0.84 0.18 0.40 -0.34 0.00 0.00 178.44 180.09 3mb4 h ILE 713 N 0.98 1.24 -0.28 4.05 2.04 -1.93 0.96 117.51 124.57 3mb4 h ILE 713 Ca 0.23 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.28 3mb4 h ILE 713 Cb 0.18 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 3mb4 h ILE 713 CO -0.02 0.31 0.19 0.22 0.00 0.00 0.00 178.15 178.84 3mb4 h TYR 714 N 0.81 0.36 -0.47 1.37 3.20 -1.77 -0.86 116.97 119.61 3mb4 h TYR 714 Ca 0.19 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.01 3mb4 h TYR 714 Cb 0.29 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3mb4 h TYR 714 CO 0.02 0.23 0.09 0.87 -1.64 0.00 0.00 178.16 177.73 3mb4 h LYS 715 N 0.38 0.77 -0.32 1.82 1.57 -0.89 -2.63 116.57 117.27 3mb4 h LYS 715 Ca 0.10 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.61 3mb4 h LYS 715 Cb -0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 3mb4 h LYS 715 CO -0.02 0.77 -0.13 -0.44 -0.57 0.00 0.00 179.45 179.07 3mb4 h ASP 716 N 0.64 0.53 -0.86 0.86 3.32 -0.69 -2.36 116.42 117.86 3mb4 h ASP 716 Ca 0.14 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3mb4 h ASP 716 Cb 0.37 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 3mb4 h ASP 716 CO 0.01 0.69 0.49 0.00 -1.72 0.00 0.00 179.24 178.71 3mb4 h ALA 717 N 1.37 1.24 -0.57 3.45 0.00 -0.88 -0.41 119.26 123.45 3mb4 h ALA 717 Ca 0.09 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3mb4 h ALA 717 Cb 0.52 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3mb4 h ALA 717 CO 0.03 0.63 0.07 -0.07 0.00 0.00 0.00 179.25 179.91 3mb4 h LEU 718 N 1.20 0.93 0.00 0.00 3.38 -1.09 -0.23 115.31 119.51 3mb4 h LEU 718 Ca 0.31 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3mb4 h LEU 718 Cb -0.00 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3mb4 h LEU 718 CO -0.05 0.97 -0.00 0.58 0.09 0.00 0.00 178.44 180.03 3mb4 h VAL 719 N 0.86 1.20 -0.13 1.22 2.07 -1.08 -2.28 116.25 118.11 3mb4 h VAL 719 Ca 0.17 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.05 3mb4 h VAL 719 Cb 0.45 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3mb4 h VAL 719 CO 0.02 0.16 -0.07 -0.07 0.02 0.00 0.00 177.57 177.62 3mb4 h LEU 720 N -0.26 0.18 -0.81 2.57 3.38 -1.01 -0.52 115.31 118.84 3mb4 h LEU 720 Ca -0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3mb4 h LEU 720 Cb 0.26 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 3mb4 h LEU 720 CO 0.00 0.29 0.42 -0.74 0.09 0.00 0.00 178.44 178.50 3mb4 h HIS 721 N 0.19 1.15 -0.49 1.13 2.76 -0.77 0.68 115.15 119.80 3mb4 h HIS 721 Ca 0.04 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.12 3mb4 h HIS 721 Cb 0.26 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 3mb4 h HIS 721 CO 0.00 0.82 0.09 -0.22 -1.30 0.00 0.00 177.93 177.32 3mb4 h LYS 722 N 1.14 0.79 -0.58 5.26 3.64 -0.75 -1.60 116.57 124.48 3mb4 h LYS 722 Ca 0.28 -0.21 0.03 0.00 -1.27 0.00 0.00 60.65 59.49 3mb4 h LYS 722 Cb 0.07 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.76 3mb4 h LYS 722 CO -0.04 0.79 0.34 0.28 -2.27 0.00 0.00 179.45 178.55 3mb4 h VAL 723 N 0.67 1.05 -0.12 2.00 2.07 -0.55 -0.03 116.25 121.33 3mb4 h VAL 723 Ca 0.15 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.44 3mb4 h VAL 723 Cb 0.37 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3mb4 h VAL 723 CO 0.01 0.12 0.06 0.25 0.02 0.00 0.00 177.57 178.03 3mb4 h LEU 724 N 0.68 0.08 -0.45 2.57 5.85 -0.56 -0.47 115.31 123.01 3mb4 h LEU 724 Ca 0.24 0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.79 3mb4 h LEU 724 Cb 0.04 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 3mb4 h LEU 724 CO -0.11 0.07 -0.57 -0.07 -0.34 0.00 0.00 178.44 177.42 3mb4 h LEU 725 N 0.13 0.70 -0.61 2.25 3.38 -1.04 -1.37 115.31 118.75 3mb4 h LEU 725 Ca 0.05 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 3mb4 h LEU 725 Cb 0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3mb4 h LEU 725 CO -0.04 1.12 0.19 -0.33 0.09 0.00 0.00 178.44 179.47 3mb4 h GLU 726 N 0.47 0.94 -0.03 1.13 5.08 -0.82 -1.38 114.58 119.98 3mb4 h GLU 726 Ca 0.00 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 3mb4 h GLU 726 Cb 1.13 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 3mb4 h GLU 726 CO 0.11 0.83 0.02 1.15 -1.00 0.00 0.00 179.01 180.12 3mb4 h THR 727 N 0.86 1.03 -0.59 1.13 2.02 -0.94 0.11 112.91 116.54 3mb4 h THR 727 Ca 0.20 -0.10 0.06 0.00 0.77 0.00 0.00 66.41 67.34 3mb4 h THR 727 Cb 0.28 1.05 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 3mb4 h THR 727 CO -0.01 0.03 0.30 -0.09 0.37 0.00 0.00 175.52 176.13 3mb4 h ARG 728 N 0.01 0.55 -0.45 6.66 2.43 -1.12 -1.33 114.38 121.12 3mb4 h ARG 728 Ca 0.01 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3mb4 h ARG 728 Cb 0.03 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 3mb4 h ARG 728 CO -0.00 0.37 0.23 -0.09 -1.51 0.00 0.00 179.97 178.96 3mb4 h ARG 729 N 0.57 0.64 -0.26 0.20 9.65 -0.84 -2.66 114.38 121.68 3mb4 h ARG 729 Ca 0.27 -0.09 -0.02 0.00 -1.10 0.00 0.00 59.98 59.04 3mb4 h ARG 729 Cb 0.18 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.63 3mb4 h ARG 729 CO -0.18 0.54 0.07 -0.44 2.80 0.00 0.00 179.97 182.76 3mb4 h ASP 730 N 0.59 0.33 -0.38 -3.80 3.32 -0.39 -2.17 116.42 113.90 3mb4 h ASP 730 Ca 0.16 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3mb4 h ASP 730 Cb 0.10 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3mb4 h ASP 730 CO -0.02 0.33 0.00 0.18 -1.72 0.00 0.00 179.24 178.01 3mb4 n LEU 731 N -4.40 2.33 -0.26 1.55 4.77 -0.54 -4.65 117.00 115.81 3mb4 n LEU 731 Ca 0.01 -1.12 0.07 0.00 -0.03 0.00 0.00 56.01 54.94 3mb4 n LEU 731 Cb 0.15 -0.25 0.20 0.00 -2.33 0.00 0.00 43.42 41.19 3mb4 n LEU 731 CO 0.36 0.56 0.93 -0.33 -1.33 0.00 0.00 177.39 177.58 3mb4 h GLU 732 N 2.69 0.24 -0.32 3.23 4.39 -1.04 0.57 114.58 124.35 3mb4 h GLU 732 Ca 0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3mb4 h GLU 732 Cb 0.61 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 3mb4 h GLU 732 CO 0.00 0.16 0.00 0.41 -1.16 0.00 0.00 179.01 178.42 3mb4 n GLY 733 N -1.36 0.57 3.59 -3.84 0.00 -1.26 -5.11 105.19 97.77 3mb4 n GLY 733 Ca 0.16 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3mb4 n GLY 733 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54