#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i82 s TYR 606 N 0.00 2.79 -0.47 1.20 5.04 -1.26 -4.91 117.35 119.74 2i82 s TYR 606 Ca 0.00 0.96 0.05 0.00 -2.44 0.00 0.00 57.07 55.64 2i82 s TYR 606 Cb 0.00 -3.64 0.26 0.00 0.35 0.00 0.00 41.96 38.93 2i82 s TYR 606 CO 0.00 -1.71 0.97 -1.71 -1.34 0.00 0.00 175.55 171.76 2i82 n ASN 607 N 6.98 -2.63 -4.77 4.32 5.15 -1.26 -4.98 115.26 118.06 2i82 n ASN 607 Ca 0.14 -3.18 -0.41 0.00 -0.60 0.00 0.00 54.58 50.53 2i82 n ASN 607 Cb 0.45 1.73 -0.01 0.00 -0.53 0.00 0.00 39.78 41.42 2i82 n ASN 607 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 2i82 s PRO 608 N 0.56 4.17 0.33 1.20 0.02 -1.26 -4.93 135.00 135.10 2i82 s PRO 608 Ca 0.30 2.37 -0.28 0.00 0.02 0.00 0.00 61.00 63.40 2i82 s PRO 608 Cb 0.24 -2.97 -0.12 0.00 0.02 0.00 0.00 34.50 31.67 2i82 s PRO 608 CO -0.20 -0.40 1.29 -0.35 -0.33 0.00 0.00 177.00 177.00 2i82 n PRO 609 N 0.52 2.11 0.16 5.54 -0.04 -1.26 -4.88 135.00 137.14 2i82 n PRO 609 Ca 0.01 0.74 0.13 0.00 -0.04 0.00 0.00 63.50 64.34 2i82 n PRO 609 Cb 0.41 -2.32 0.39 0.00 -0.04 0.00 0.00 33.50 31.94 2i82 n PRO 609 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2i82 h GLN 610 N 2.63 0.00 -4.77 0.54 1.08 -1.96 -3.43 115.11 109.21 2i82 h GLN 610 Ca -0.46 0.00 -0.61 0.00 -1.45 0.00 0.00 58.65 56.14 2i82 h GLN 610 Cb 1.28 0.00 -0.35 0.00 -0.05 0.00 0.00 27.48 28.36 2i82 h GLN 610 CO 0.63 0.00 -0.84 -1.21 -0.95 0.00 0.00 178.83 176.46 2i82 s GLU 611 N -3.22 2.36 0.68 1.46 0.41 -1.26 -1.97 118.70 117.16 2i82 s GLU 611 Ca 0.08 -0.60 -0.14 0.00 -0.41 0.00 0.00 54.97 53.90 2i82 s GLU 611 Cb 0.10 -2.06 0.01 0.00 -1.78 0.00 0.00 34.13 30.39 2i82 s GLU 611 CO 0.58 -0.14 1.10 -2.14 -0.49 0.00 0.00 175.26 174.16 2i82 s PRO 612 N 1.21 2.74 -0.03 0.39 0.02 -1.26 -5.12 135.00 132.96 2i82 s PRO 612 Ca -0.01 1.30 -0.16 0.00 0.02 0.00 0.00 61.00 62.15 2i82 s PRO 612 Cb -0.14 -1.95 -0.09 0.00 0.02 0.00 0.00 34.50 32.35 2i82 s PRO 612 CO -0.06 -1.28 0.68 2.35 -0.33 0.00 0.00 177.00 178.36 2i82 h TRP 613 N -0.22 -0.52 -3.41 6.54 2.91 -1.72 -3.47 115.95 116.08 2i82 h TRP 613 Ca -0.46 -0.01 -0.20 0.00 1.13 0.00 0.00 58.89 59.35 2i82 h TRP 613 Cb 1.24 0.17 -0.27 0.00 -0.51 0.00 0.00 29.16 29.79 2i82 h TRP 613 CO 0.56 -0.32 -0.56 -0.51 -1.03 0.00 0.00 178.44 176.57 2i82 s LEU 614 N -8.73 1.47 -0.59 0.65 1.43 -1.26 -5.03 118.68 106.62 2i82 s LEU 614 Ca -0.08 0.27 -0.08 0.00 -1.03 0.00 0.00 54.13 53.20 2i82 s LEU 614 Cb 0.01 0.45 0.15 0.00 0.03 0.00 0.00 46.19 46.83 2i82 s LEU 614 CO 0.25 -0.05 0.46 -0.69 0.23 0.00 0.00 176.35 176.55 2i82 s VAL 615 N 0.11 4.35 -0.41 -1.59 1.01 -1.26 -5.05 120.40 117.55 2i82 s VAL 615 Ca -0.00 -2.29 -0.18 0.00 0.00 0.00 0.00 61.98 59.51 2i82 s VAL 615 Cb -0.01 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.57 2i82 s VAL 615 CO -0.00 -0.86 0.50 -0.63 0.00 0.00 0.00 175.10 174.11 2i82 s ILE 616 N 0.68 5.01 0.03 2.22 1.01 -1.26 -0.99 121.20 127.90 2i82 s ILE 616 Ca 0.12 -0.12 -0.19 0.00 0.00 0.00 0.00 60.65 60.46 2i82 s ILE 616 Cb -0.21 -4.06 -0.19 0.00 0.01 0.00 0.00 42.46 38.01 2i82 s ILE 616 CO -0.03 -0.43 1.21 0.25 0.00 0.00 0.00 174.94 175.94 2i82 h LEU 617 N 9.21 0.55 -7.84 2.97 6.46 -1.13 -3.46 115.31 122.07 2i82 h LEU 617 Ca -0.26 -0.65 -0.18 0.00 -0.12 0.00 0.00 57.88 56.67 2i82 h LEU 617 Cb 1.11 -0.16 -0.23 0.00 -0.73 0.00 0.00 40.66 40.65 2i82 h LEU 617 CO 0.81 1.11 -0.64 -0.47 -0.62 0.00 0.00 178.44 178.63 2i82 s TYR 618 N -3.65 0.12 -0.27 1.25 6.14 -1.13 -4.99 117.35 114.82 2i82 s TYR 618 Ca -0.13 -0.25 -0.17 0.00 0.64 0.00 0.00 57.07 57.16 2i82 s TYR 618 Cb 0.05 -0.10 0.08 0.00 0.42 0.00 0.00 41.96 42.41 2i82 s TYR 618 CO 0.81 -0.17 0.68 -1.14 0.64 0.00 0.00 175.55 176.37 2i82 s GLN 619 N -1.04 0.71 0.00 4.97 0.74 -1.26 -0.68 119.66 123.10 2i82 s GLN 619 Ca -0.11 1.18 0.00 0.00 0.05 0.00 0.00 55.36 56.47 2i82 s GLN 619 Cb -0.07 0.17 0.00 0.00 1.10 0.00 0.00 33.01 34.21 2i82 s GLN 619 CO -0.00 -0.14 0.00 -0.40 -0.55 0.00 0.00 175.29 174.20 2i82 n ASP 620 N 4.10 0.08 0.11 6.67 5.68 -0.86 -5.04 116.55 127.29 2i82 n ASP 620 Ca -0.19 -0.41 0.12 0.00 -0.50 0.00 0.00 54.79 53.81 2i82 n ASP 620 Cb 0.58 0.00 0.46 0.00 -1.14 0.00 0.00 41.12 41.02 2i82 n ASP 620 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2i82 n ASP 621 N -1.19 0.64 -0.08 -1.12 8.00 -1.26 -4.19 116.55 117.34 2i82 n ASP 621 Ca 0.00 0.62 -0.16 0.00 0.71 0.00 0.00 54.79 55.96 2i82 n ASP 621 Cb 0.00 -0.77 -0.05 0.00 -0.02 0.00 0.00 41.12 40.28 2i82 n ASP 621 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2i82 n HIS 622 N -2.16 0.00 -2.48 1.24 8.25 -1.26 -4.63 115.22 114.18 2i82 n HIS 622 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2i82 n HIS 622 Cb 0.30 -0.59 0.00 0.00 1.12 0.00 0.00 29.99 30.81 2i82 n HIS 622 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2i82 n ILE 623 N -4.06 0.00 -3.65 1.59 -5.35 -1.26 0.12 119.36 106.75 2i82 n ILE 623 Ca -0.28 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.18 2i82 n ILE 623 Cb 0.62 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.48 2i82 n ILE 623 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2i82 s VAL 625 N 1.40 -0.87 0.11 7.28 1.01 0.15 -2.02 120.40 127.45 2i82 s VAL 625 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2i82 s VAL 625 Cb 0.00 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 2i82 s VAL 625 CO 0.00 0.00 -0.12 -0.69 0.00 0.00 0.00 175.10 174.29 2i82 s VAL 626 N 2.74 3.23 -0.74 2.92 1.01 -0.20 -0.47 120.40 128.88 2i82 s VAL 626 Ca -0.06 -1.32 -0.13 0.00 0.00 0.00 0.00 61.98 60.46 2i82 s VAL 626 Cb -0.11 -2.50 0.19 0.00 0.00 0.00 0.00 36.38 33.96 2i82 s VAL 626 CO -0.19 0.11 0.67 0.21 0.00 0.00 0.00 175.10 175.90 2i82 s ASN 627 N -2.17 6.47 0.15 3.32 3.84 -0.16 -1.65 114.94 124.74 2i82 s ASN 627 Ca 0.20 -2.50 -0.31 0.00 0.21 0.00 0.00 52.86 50.47 2i82 s ASN 627 Cb -0.11 -2.17 -0.08 0.00 -0.55 0.00 0.00 41.25 38.34 2i82 s ASN 627 CO 0.13 -0.61 1.33 -0.75 -2.79 0.00 0.00 177.10 174.40 2i82 s LYS 628 N 0.47 4.37 0.56 0.43 2.20 0.03 -4.53 119.74 123.26 2i82 s LYS 628 Ca 0.14 2.03 -0.13 0.00 -0.36 0.00 0.00 55.97 57.65 2i82 s LYS 628 Cb -0.16 -3.23 -0.06 0.00 -1.51 0.00 0.00 37.83 32.88 2i82 s LYS 628 CO -0.06 -0.32 0.99 -1.25 -0.36 0.00 0.00 175.35 174.35 2i82 s PRO 629 N 0.46 3.77 0.41 4.03 0.04 -1.26 -1.02 135.00 141.42 2i82 s PRO 629 Ca 0.60 0.82 -0.26 0.00 0.04 0.00 0.00 61.00 62.20 2i82 s PRO 629 Cb -0.36 -2.13 -0.09 0.00 0.04 0.00 0.00 34.50 31.97 2i82 s PRO 629 CO 0.34 -0.39 1.27 0.45 0.04 0.00 0.00 177.00 178.71 2i82 s SER 630 N -3.61 6.34 0.00 6.66 0.15 -1.26 -2.95 113.70 119.03 2i82 s SER 630 Ca 0.56 2.59 0.00 0.00 0.70 0.00 0.00 55.95 59.80 2i82 s SER 630 Cb -0.10 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.57 2i82 s SER 630 CO 0.42 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 174.65 2i82 n GLY 631 N 0.67 1.22 3.46 9.45 0.00 -1.26 -5.00 105.19 113.73 2i82 n GLY 631 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2i82 n GLY 631 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i82 s LEU 632 N 0.00 3.30 0.62 0.99 2.96 -1.15 -4.70 118.68 120.69 2i82 s LEU 632 Ca 0.00 -0.18 -0.19 0.00 -0.22 0.00 0.00 54.13 53.54 2i82 s LEU 632 Cb 0.00 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.83 2i82 s LEU 632 CO 0.00 0.07 1.32 0.18 -1.32 0.00 0.00 176.35 176.59 2i82 n LEU 633 N 4.22 5.90 0.10 -0.68 4.77 -1.26 -4.83 117.00 125.21 2i82 n LEU 633 Ca -0.17 0.88 -0.20 0.00 -0.03 0.00 0.00 56.01 56.49 2i82 n LEU 633 Cb 0.52 -1.56 -0.12 0.00 -2.33 0.00 0.00 43.42 39.92 2i82 n LEU 633 CO 0.32 -0.86 -0.04 0.28 -1.33 0.00 0.00 177.39 175.75 2i82 h SER 634 N 0.81 0.73 -3.81 -1.43 0.02 -1.87 -0.72 113.55 107.29 2i82 h SER 634 Ca -0.51 -0.69 -0.35 0.00 -0.84 0.00 0.00 61.79 59.40 2i82 h SER 634 Cb 1.33 -0.23 -0.15 0.00 0.14 0.00 0.00 62.40 63.49 2i82 h SER 634 CO 0.54 1.51 -0.72 0.68 -1.14 0.00 0.00 176.83 177.71 2i82 s VAL 635 N -2.92 1.28 0.59 2.27 -7.23 -1.26 -3.03 120.40 110.11 2i82 s VAL 635 Ca -0.08 -2.09 -0.20 0.00 -1.81 0.00 0.00 61.98 57.80 2i82 s VAL 635 Cb 0.06 -1.91 -0.03 0.00 0.56 0.00 0.00 36.38 35.06 2i82 s VAL 635 CO 0.92 -0.70 1.33 -2.16 -0.31 0.00 0.00 175.10 174.17 2i82 s PRO 636 N -3.73 2.88 0.42 4.82 0.04 -1.26 -4.81 135.00 133.36 2i82 s PRO 636 Ca 0.18 2.15 -0.02 0.00 0.04 0.00 0.00 61.00 63.36 2i82 s PRO 636 Cb 0.02 -2.07 0.09 0.00 0.04 0.00 0.00 34.50 32.57 2i82 s PRO 636 CO 0.02 -1.37 0.58 0.41 0.04 0.00 0.00 177.00 176.68 2i82 n GLY 637 N 0.79 0.38 0.22 0.56 0.00 0.21 -4.97 105.19 102.39 2i82 n GLY 637 Ca 0.13 -1.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.12 2i82 n GLY 637 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2i82 h ARG 638 N 0.00 -0.50 -7.19 1.61 2.43 -1.96 -3.43 114.38 105.33 2i82 h ARG 638 Ca -0.19 0.03 -0.54 0.00 -0.81 0.00 0.00 59.98 58.48 2i82 h ARG 638 Cb 0.67 0.11 0.17 0.00 -0.42 0.00 0.00 29.97 30.50 2i82 h ARG 638 CO 0.19 -0.34 0.37 -0.51 -1.51 0.00 0.00 179.97 178.17 2i82 s LEU 639 N -7.91 3.23 0.20 3.80 1.43 -1.26 -4.92 118.68 113.24 2i82 s LEU 639 Ca -0.08 2.38 -0.09 0.00 -1.03 0.00 0.00 54.13 55.31 2i82 s LEU 639 Cb 0.01 -4.59 0.12 0.00 0.03 0.00 0.00 46.19 41.76 2i82 s LEU 639 CO 0.23 -2.49 1.74 1.05 0.23 0.00 0.00 176.35 177.11 2i82 h GLU 640 N -0.61 1.12 0.00 1.70 -0.00 -2.03 -2.18 114.58 112.58 2i82 h GLU 640 Ca -0.47 -0.24 0.00 0.00 -0.00 0.00 0.00 59.36 58.65 2i82 h GLU 640 Cb 1.30 -0.16 0.00 0.00 -0.00 0.00 0.00 28.75 29.88 2i82 h GLU 640 CO 0.48 0.96 0.00 -0.85 -0.00 0.00 0.00 179.01 179.59 2i82 n GLU 641 N -4.28 0.03 -0.71 1.06 0.28 -1.26 -2.22 120.64 113.54 2i82 n GLU 641 Ca 0.06 0.33 0.01 0.00 -0.16 0.00 0.00 57.16 57.39 2i82 n GLU 641 Cb 0.22 -1.50 0.20 0.00 1.43 0.00 0.00 31.44 31.80 2i82 n GLU 641 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2i82 n HIS 642 N -1.43 0.57 0.05 -1.84 8.25 -0.82 -4.67 115.22 115.33 2i82 n HIS 642 Ca 0.02 -1.55 -0.15 0.00 -0.26 0.00 0.00 57.72 55.78 2i82 n HIS 642 Cb 0.07 -0.38 -0.14 0.00 1.12 0.00 0.00 29.99 30.66 2i82 n HIS 642 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 2i82 h LYS 643 N 1.00 0.19 -6.27 -0.41 1.57 -1.52 0.60 116.57 111.73 2i82 h LYS 643 Ca 0.12 -0.33 -0.62 0.00 -1.87 0.00 0.00 60.65 57.95 2i82 h LYS 643 Cb 1.34 0.12 0.02 0.00 0.08 0.00 0.00 32.23 33.79 2i82 h LYS 643 CO 0.20 1.03 1.11 -3.47 -0.57 0.00 0.00 179.45 177.74 2i82 n ASP 644 N -3.39 3.44 -2.92 0.86 2.03 -1.26 -4.25 116.55 111.05 2i82 n ASP 644 Ca -0.16 0.97 -0.09 0.00 0.52 0.00 0.00 54.79 56.03 2i82 n ASP 644 Cb 1.03 -1.37 0.02 0.00 -0.72 0.00 0.00 41.12 40.09 2i82 n ASP 644 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2i82 s SER 645 N 4.14 0.01 0.00 1.67 1.04 -1.26 -4.38 113.70 114.92 2i82 s SER 645 Ca 0.93 -1.16 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2i82 s SER 645 Cb -0.70 0.85 0.00 0.00 0.10 0.00 0.00 66.02 66.28 2i82 s SER 645 CO 0.52 -1.69 0.02 0.52 0.98 0.00 0.00 173.24 173.59 2i82 n VAL 646 N -0.53 0.00 0.00 5.02 0.31 -0.28 -1.10 118.33 121.76 2i82 n VAL 646 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2i82 n VAL 646 Cb 0.60 -0.18 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 2i82 n VAL 646 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2i82 n THR 648 N 0.13 0.00 -0.06 2.52 -2.24 -1.26 -0.65 114.28 112.72 2i82 n THR 648 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 2i82 n THR 648 Cb 0.01 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.17 2i82 n THR 648 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2i82 h ARG 649 N 0.00 0.45 0.24 -0.78 9.65 -1.45 -3.07 114.38 119.43 2i82 h ARG 649 Ca 0.00 -0.26 -0.01 0.00 -1.10 0.00 0.00 59.98 58.60 2i82 h ARG 649 Cb 0.00 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.60 2i82 h ARG 649 CO 0.00 0.85 -0.12 0.82 2.80 0.00 0.00 179.97 184.32 2i82 h ILE 650 N 0.09 0.78 0.00 1.20 2.04 -1.12 -3.17 117.51 117.34 2i82 h ILE 650 Ca 0.02 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2i82 h ILE 650 Cb 0.80 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2i82 h ILE 650 CO 0.05 0.15 0.33 1.56 0.00 0.00 0.00 178.15 180.24 2i82 h GLN 651 N -0.76 0.00 -0.04 2.37 4.20 -1.69 0.15 115.11 119.34 2i82 h GLN 651 Ca -0.03 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.69 2i82 h GLN 651 Cb 0.50 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 2i82 h GLN 651 CO 0.06 0.00 0.03 -0.09 -0.67 0.00 0.00 178.83 178.15 2i82 h ARG 652 N 0.00 0.00 0.00 1.46 2.43 -1.50 -2.81 114.38 113.96 2i82 h ARG 652 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2i82 h ARG 652 Cb 0.65 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 2i82 h ARG 652 CO 0.00 0.00 -1.13 -0.25 -1.51 0.00 0.00 179.97 177.08 2i82 n ASP 653 N -4.33 4.39 -3.46 -3.80 8.00 0.41 -4.86 116.55 112.90 2i82 n ASP 653 Ca -0.02 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.21 2i82 n ASP 653 Cb 0.13 1.05 -0.10 0.00 -0.02 0.00 0.00 41.12 42.18 2i82 n ASP 653 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2i82 n TYR 654 N -1.65 0.35 -0.29 1.24 4.02 -0.46 -4.98 117.16 115.40 2i82 n TYR 654 Ca -0.01 -3.62 0.23 0.00 -0.01 0.00 0.00 57.90 54.50 2i82 n TYR 654 Cb 0.13 -0.09 0.55 0.00 -0.02 0.00 0.00 39.34 39.92 2i82 n TYR 654 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2i82 h PRO 655 N 5.17 0.31 0.00 -0.72 0.11 -1.77 0.17 132.00 135.28 2i82 h PRO 655 Ca 0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2i82 h PRO 655 Cb 0.85 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.89 2i82 h PRO 655 CO 0.49 0.21 0.00 1.04 -0.21 0.00 0.00 178.00 179.53 2i82 n GLN 656 N -4.51 0.00 -1.81 1.05 3.00 -1.26 -4.80 117.38 109.05 2i82 n GLN 656 Ca 0.23 0.35 -0.41 0.00 -0.01 0.00 0.00 57.00 57.16 2i82 n GLN 656 Cb 0.87 -1.50 -0.00 0.00 0.00 0.00 0.00 30.24 29.61 2i82 n GLN 656 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2i82 s ALA 657 N -2.98 3.59 -0.11 -1.58 0.00 0.58 -4.19 121.76 117.07 2i82 s ALA 657 Ca 0.04 1.57 -0.06 0.00 0.00 0.00 0.00 51.96 53.51 2i82 s ALA 657 Cb 0.06 -3.61 0.04 0.00 0.00 0.00 0.00 23.12 19.61 2i82 s ALA 657 CO 0.16 -1.04 0.25 -1.21 0.00 0.00 0.00 175.76 173.92 2i82 s GLU 658 N -1.91 0.23 0.53 0.00 0.41 0.83 -4.94 118.70 113.84 2i82 s GLU 658 Ca 0.54 0.51 -0.19 0.00 -0.41 0.00 0.00 54.97 55.42 2i82 s GLU 658 Cb -0.46 -0.08 -0.07 0.00 -1.78 0.00 0.00 34.13 31.74 2i82 s GLU 658 CO 0.61 -0.14 1.07 -1.54 -0.49 0.00 0.00 175.26 174.77 2i82 s SER 659 N 1.09 6.04 0.00 -0.19 1.04 -1.26 -1.23 113.70 119.18 2i82 s SER 659 Ca -0.08 1.98 0.00 0.00 0.48 0.00 0.00 55.95 58.33 2i82 s SER 659 Cb -0.09 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.47 2i82 s SER 659 CO -0.07 -0.99 0.00 1.33 0.98 0.00 0.00 173.24 174.48 2i82 n VAL 660 N -1.29 0.00 -3.83 5.02 0.24 -1.26 -4.87 118.33 112.34 2i82 n VAL 660 Ca 0.10 -0.40 -0.07 0.00 -2.04 0.00 0.00 64.34 61.93 2i82 n VAL 660 Cb 0.52 0.91 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 2i82 n VAL 660 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 2i82 s HIS 661 N -1.16 -0.03 -0.01 6.34 -3.43 -1.26 -4.69 115.29 111.04 2i82 s HIS 661 Ca 0.00 -0.50 -0.10 0.00 -0.80 0.00 0.00 55.06 53.66 2i82 s HIS 661 Cb 0.00 0.76 0.01 0.00 -1.43 0.00 0.00 32.58 31.92 2i82 s HIS 661 CO 0.00 -1.31 0.20 1.03 -2.00 0.00 0.00 174.74 172.66 2i82 s ARG 662 N -3.03 0.51 0.12 -0.38 0.52 -1.26 -4.94 118.95 110.49 2i82 s ARG 662 Ca 0.14 -0.25 0.06 0.00 -0.52 0.00 0.00 55.73 55.16 2i82 s ARG 662 Cb -0.05 0.22 -0.04 0.00 0.52 0.00 0.00 34.95 35.60 2i82 s ARG 662 CO 0.08 -0.12 -0.01 -0.51 0.02 0.00 0.00 175.30 174.76 2i82 s LEU 663 N -1.18 3.37 0.00 2.53 1.02 -1.26 -5.10 118.68 118.06 2i82 s LEU 663 Ca -0.13 -0.28 0.00 0.00 0.02 0.00 0.00 54.13 53.75 2i82 s LEU 663 Cb -0.06 -2.08 0.00 0.00 0.02 0.00 0.00 46.19 44.07 2i82 s LEU 663 CO 0.02 0.14 0.00 0.47 0.02 0.00 0.00 176.35 177.01 2i82 n ASP 664 N 0.33 0.00 0.00 2.29 8.00 -1.26 -4.21 116.55 121.70 2i82 n ASP 664 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 2i82 n ASP 664 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 2i82 n ASP 664 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i82 n ALA 666 N -3.00 0.00 -2.07 2.24 0.00 -1.26 -4.74 120.51 111.68 2i82 n ALA 666 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2i82 n ALA 666 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2i82 n ALA 666 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2i82 s THR 667 N 0.00 4.66 0.31 0.00 2.01 -1.26 -4.41 115.64 116.95 2i82 s THR 667 Ca 0.00 0.93 0.08 0.00 0.31 0.00 0.00 61.69 63.02 2i82 s THR 667 Cb 0.00 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.78 2i82 s THR 667 CO 0.00 -0.42 -0.08 -0.94 -0.69 0.00 0.00 174.62 172.49 2i82 s SER 668 N -2.73 3.30 0.00 3.53 1.04 -1.17 -4.06 113.70 113.60 2i82 s SER 668 Ca 0.55 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.79 2i82 s SER 668 Cb -0.10 -0.27 0.00 0.00 0.10 0.00 0.00 66.02 65.75 2i82 s SER 668 CO 0.25 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.82 2i82 n GLY 669 N -0.70 0.47 3.71 7.32 0.00 -0.19 -0.11 105.19 115.69 2i82 n GLY 669 Ca -0.05 -2.19 -0.42 0.00 0.00 0.00 0.00 46.02 43.35 2i82 n GLY 669 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i82 s VAL 670 N -0.60 3.34 -0.06 1.61 1.01 0.38 -0.79 120.40 125.28 2i82 s VAL 670 Ca 0.00 0.90 -0.03 0.00 0.00 0.00 0.00 61.98 62.85 2i82 s VAL 670 Cb 0.00 -3.58 0.03 0.00 0.00 0.00 0.00 36.38 32.84 2i82 s VAL 670 CO 0.00 0.05 0.14 -0.51 0.00 0.00 0.00 175.10 174.78 2i82 s ILE 671 N 1.54 -0.04 -0.12 2.22 2.07 -0.66 -4.87 121.20 121.33 2i82 s ILE 671 Ca 0.66 0.16 -0.07 0.00 -1.41 0.00 0.00 60.65 59.98 2i82 s ILE 671 Cb -0.36 -0.23 -0.04 0.00 0.13 0.00 0.00 42.46 41.96 2i82 s ILE 671 CO 0.30 0.06 0.14 0.54 -1.91 0.00 0.00 174.94 174.07 2i82 s VAL 672 N 1.02 5.50 -0.05 4.00 0.11 -1.26 -1.03 120.40 128.68 2i82 s VAL 672 Ca -0.08 0.21 0.04 0.00 -2.93 0.00 0.00 61.98 59.22 2i82 s VAL 672 Cb -0.10 -3.41 0.00 0.00 -1.53 0.00 0.00 36.38 31.34 2i82 s VAL 672 CO -0.05 0.61 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.48 2i82 s VAL 673 N -0.94 1.36 0.15 2.04 1.01 -1.26 -4.23 120.40 118.53 2i82 s VAL 673 Ca 0.15 -0.65 -0.29 0.00 0.00 0.00 0.00 61.98 61.18 2i82 s VAL 673 Cb -0.12 -1.18 -0.07 0.00 0.00 0.00 0.00 36.38 35.01 2i82 s VAL 673 CO 0.04 0.40 0.93 0.00 0.00 0.00 0.00 175.10 176.47 2i82 s ALA 674 N 0.24 3.29 -0.35 5.51 0.00 -0.37 -4.46 121.76 125.63 2i82 s ALA 674 Ca -0.08 0.56 0.22 0.00 0.00 0.00 0.00 51.96 52.66 2i82 s ALA 674 Cb -0.13 -3.22 -0.28 0.00 0.00 0.00 0.00 23.12 19.48 2i82 s ALA 674 CO 0.03 0.08 0.64 1.28 0.00 0.00 0.00 175.76 177.79 2i82 n LEU 675 N 2.28 0.34 -4.26 0.00 4.77 0.31 -0.12 117.00 120.33 2i82 n LEU 675 Ca 0.00 -0.14 -0.21 0.00 -0.03 0.00 0.00 56.01 55.63 2i82 n LEU 675 Cb 0.48 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.45 2i82 n LEU 675 CO 0.50 0.07 -0.48 0.42 -1.33 0.00 0.00 177.39 176.58 2i82 s THR 676 N -3.35 1.49 0.36 -5.08 -4.23 -1.23 -3.83 115.64 99.77 2i82 s THR 676 Ca -0.03 -1.59 0.08 0.00 -1.18 0.00 0.00 61.69 58.97 2i82 s THR 676 Cb 0.15 -1.48 0.32 0.00 1.34 0.00 0.00 72.50 72.82 2i82 s THR 676 CO 0.89 -0.23 1.89 0.50 -0.54 0.00 0.00 174.62 177.13 2i82 h LYS 677 N 3.85 0.68 -0.60 3.99 1.63 -1.93 -1.64 116.57 122.54 2i82 h LYS 677 Ca -0.43 -0.04 -0.08 0.00 -0.85 0.00 0.00 60.65 59.25 2i82 h LYS 677 Cb 1.19 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.64 2i82 h LYS 677 CO 0.44 0.45 0.05 0.00 -3.45 0.00 0.00 179.45 176.95 2i82 h ALA 678 N 1.60 0.81 -0.46 5.00 0.00 -1.97 -2.83 119.26 121.41 2i82 h ALA 678 Ca 0.41 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 2i82 h ALA 678 Cb 0.61 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2i82 h ALA 678 CO -0.17 0.60 -0.19 0.00 0.00 0.00 0.00 179.25 179.49 2i82 h ALA 679 N 1.00 0.79 0.23 0.00 0.00 -1.67 -3.04 119.26 116.58 2i82 h ALA 679 Ca 0.18 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.72 2i82 h ALA 679 Cb 0.49 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2i82 h ALA 679 CO 0.02 0.66 -0.31 1.49 0.00 0.00 0.00 179.25 181.10 2i82 h GLU 680 N 0.79 -0.58 -0.72 0.00 4.81 -1.23 -0.82 114.58 116.84 2i82 h GLU 680 Ca 0.11 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.45 2i82 h GLU 680 Cb 0.74 0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.19 2i82 h GLU 680 CO 0.06 -0.39 0.40 0.00 -0.73 0.00 0.00 179.01 178.36 2i82 h ARG 681 N -0.60 0.70 -0.47 1.92 3.08 -1.52 -0.09 114.38 117.40 2i82 h ARG 681 Ca 0.00 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 2i82 h ARG 681 Cb 0.58 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2i82 h ARG 681 CO -0.12 0.47 -0.21 1.49 -1.07 0.00 0.00 179.97 180.53 2i82 h GLU 682 N 0.73 0.97 -0.03 0.04 4.57 -1.39 -2.08 114.58 117.38 2i82 h GLU 682 Ca 0.33 -0.42 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 2i82 h GLU 682 Cb 0.23 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2i82 h GLU 682 CO -0.20 1.09 -0.02 -0.07 -1.18 0.00 0.00 179.01 178.63 2i82 h LEU 683 N 0.82 0.07 -2.42 1.64 3.38 -0.81 -1.94 115.31 116.06 2i82 h LEU 683 Ca 0.11 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.67 2i82 h LEU 683 Cb 0.79 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 2i82 h LEU 683 CO 0.07 0.49 0.13 0.11 0.09 0.00 0.00 178.44 179.33 2i82 h LYS 684 N -0.34 0.00 -0.09 1.13 1.57 -1.04 0.94 116.57 118.74 2i82 h LYS 684 Ca 0.01 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 2i82 h LYS 684 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2i82 h LYS 684 CO 0.01 0.00 -0.37 -0.09 -0.57 0.00 0.00 179.45 178.42 2i82 h ARG 685 N 0.00 0.41 -0.48 3.15 2.43 -0.89 -2.53 114.38 116.46 2i82 h ARG 685 Ca 0.04 -0.32 0.07 0.00 -0.81 0.00 0.00 59.98 58.96 2i82 h ARG 685 Cb 0.31 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.86 2i82 h ARG 685 CO -0.00 0.95 0.14 1.96 -1.51 0.00 0.00 179.97 181.52 2i82 h GLN 686 N -0.05 0.29 -0.44 0.20 4.20 -0.07 0.11 115.11 119.36 2i82 h GLN 686 Ca -0.02 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 2i82 h GLN 686 Cb 1.02 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.71 2i82 h GLN 686 CO 0.08 0.19 0.15 0.74 -0.67 0.00 0.00 178.83 179.32 2i82 h PHE 687 N 0.30 0.69 -0.96 2.96 -1.00 -1.47 0.34 116.94 117.79 2i82 h PHE 687 Ca 0.23 -0.06 0.10 0.00 2.81 0.00 0.00 57.97 61.05 2i82 h PHE 687 Cb 0.27 -0.20 -0.08 0.00 3.61 0.00 0.00 35.95 39.55 2i82 h PHE 687 CO -0.18 0.62 0.60 -0.09 -1.61 0.00 0.00 178.31 177.65 2i82 h ARG 688 N 0.57 0.98 -0.26 1.51 2.43 -0.91 0.26 114.38 118.97 2i82 h ARG 688 Ca 0.14 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2i82 h ARG 688 Cb 0.24 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2i82 h ARG 688 CO -0.01 0.65 0.00 0.39 -1.51 0.00 0.00 179.97 179.49 2i82 n GLU 689 N -4.61 1.77 -3.84 0.20 -0.58 0.33 -4.92 120.64 108.99 2i82 n GLU 689 Ca 0.17 -1.18 -0.27 0.00 -0.42 0.00 0.00 57.16 55.45 2i82 n GLU 689 Cb 0.28 -1.34 0.03 0.00 -0.57 0.00 0.00 31.44 29.84 2i82 n GLU 689 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2i82 n ARG 690 N 0.42 -5.38 -0.05 3.49 1.85 0.93 -4.92 116.66 113.00 2i82 n ARG 690 Ca 0.14 0.61 -0.20 0.00 -1.00 0.00 0.00 57.85 57.40 2i82 n ARG 690 Cb 0.31 -5.39 -0.13 0.00 -1.05 0.00 0.00 32.46 26.20 2i82 n ARG 690 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2i82 h GLU 691 N -2.04 0.10 -7.11 2.89 5.08 -0.64 -3.47 114.58 109.38 2i82 h GLU 691 Ca -0.59 -0.17 -0.55 0.00 -1.00 0.00 0.00 59.36 57.04 2i82 h GLU 691 Cb 1.37 0.06 0.17 0.00 0.50 0.00 0.00 28.75 30.85 2i82 h GLU 691 CO 0.64 1.08 0.45 -0.35 -1.00 0.00 0.00 179.01 179.83 2i82 n PRO 692 N -4.27 0.88 -4.42 2.33 -0.04 -1.26 -4.95 135.00 123.26 2i82 n PRO 692 Ca -0.23 0.36 -0.33 0.00 -0.04 0.00 0.00 63.50 63.25 2i82 n PRO 692 Cb 0.72 -2.49 -0.15 0.00 -0.04 0.00 0.00 33.50 31.54 2i82 n PRO 692 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2i82 s LYS 693 N -3.52 3.22 -0.02 0.54 1.02 -0.48 -4.96 119.74 115.54 2i82 s LYS 693 Ca 0.80 -0.74 0.03 0.00 0.02 0.00 0.00 55.97 56.09 2i82 s LYS 693 Cb -0.36 -2.67 -0.03 0.00 -0.52 0.00 0.00 37.83 34.25 2i82 s LYS 693 CO 0.43 -0.02 -0.10 0.15 -0.92 0.00 0.00 175.35 174.89 2i82 s LYS 694 N 0.92 2.51 -0.03 1.68 1.02 -1.26 -1.07 119.74 123.50 2i82 s LYS 694 Ca -0.03 -0.72 -0.00 0.00 0.02 0.00 0.00 55.97 55.24 2i82 s LYS 694 Cb -0.15 -2.44 0.03 0.00 -0.52 0.00 0.00 37.83 34.75 2i82 s LYS 694 CO -0.02 0.61 0.03 -1.14 -0.92 0.00 0.00 175.35 173.91 2i82 s GLN 695 N -1.14 0.07 0.28 1.68 0.74 -1.26 -3.95 119.66 116.07 2i82 s GLN 695 Ca 0.14 0.20 0.12 0.00 0.05 0.00 0.00 55.36 55.87 2i82 s GLN 695 Cb -0.11 -0.40 -0.05 0.00 1.10 0.00 0.00 33.01 33.55 2i82 s GLN 695 CO 0.04 -0.20 -0.17 0.71 -0.55 0.00 0.00 175.29 175.12 2i82 s TYR 696 N 1.34 2.34 0.05 1.67 1.51 0.11 -1.42 117.35 122.96 2i82 s TYR 696 Ca -0.06 -0.32 0.06 0.00 -1.01 0.00 0.00 57.07 55.74 2i82 s TYR 696 Cb -0.13 -1.02 -0.02 0.00 -0.11 0.00 0.00 41.96 40.67 2i82 s TYR 696 CO -0.03 0.70 -0.16 0.54 -1.11 0.00 0.00 175.55 175.49 2i82 s VAL 697 N -2.49 1.30 0.19 0.71 0.11 -0.84 0.53 120.40 119.90 2i82 s VAL 697 Ca 0.30 -1.15 -0.21 0.00 -2.93 0.00 0.00 61.98 58.00 2i82 s VAL 697 Cb -0.05 -1.17 0.05 0.00 -1.53 0.00 0.00 36.38 33.67 2i82 s VAL 697 CO 0.16 0.00 0.58 0.00 -3.33 0.00 0.00 175.10 172.51 2i82 s ALA 698 N -0.94 -1.30 -0.19 1.54 0.00 0.45 -1.92 121.76 119.39 2i82 s ALA 698 Ca 0.03 0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.09 2i82 s ALA 698 Cb -0.09 0.86 -0.00 0.00 0.00 0.00 0.00 23.12 23.89 2i82 s ALA 698 CO 0.02 -0.82 -0.10 1.03 0.00 0.00 0.00 175.76 175.89 2i82 s ARG 699 N -3.82 3.28 0.30 0.00 0.52 -1.06 0.30 118.95 118.47 2i82 s ARG 699 Ca 0.05 -0.69 0.09 0.00 -0.52 0.00 0.00 55.73 54.66 2i82 s ARG 699 Cb -0.02 -2.81 -0.04 0.00 0.52 0.00 0.00 34.95 32.60 2i82 s ARG 699 CO -0.07 -0.10 0.08 0.14 0.02 0.00 0.00 175.30 175.37 2i82 s VAL 700 N 1.16 3.30 0.10 3.52 -7.23 0.97 -1.29 120.40 120.93 2i82 s VAL 700 Ca 0.01 -1.77 -0.29 0.00 -1.81 0.00 0.00 61.98 58.12 2i82 s VAL 700 Cb -0.14 -2.95 -0.06 0.00 0.56 0.00 0.00 36.38 33.79 2i82 s VAL 700 CO -0.03 -0.28 0.92 0.86 -0.31 0.00 0.00 175.10 176.26 2i82 s TRP 701 N -2.36 3.80 0.00 2.82 -0.11 -0.09 -1.08 118.94 121.92 2i82 s TRP 701 Ca 0.35 1.74 0.00 0.00 1.22 0.00 0.00 56.10 59.40 2i82 s TRP 701 Cb -0.04 -3.01 0.00 0.00 -1.50 0.00 0.00 33.47 28.92 2i82 s TRP 701 CO 0.22 0.22 0.00 0.41 -4.62 0.00 0.00 176.95 173.18 2i82 n GLY 702 N 2.27 -2.15 2.92 5.86 0.00 0.76 -4.42 105.19 110.44 2i82 n GLY 702 Ca 0.01 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 2i82 n GLY 702 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2i82 s HIS 703 N -0.19 3.08 0.40 1.61 3.76 -1.26 -3.04 115.29 119.65 2i82 s HIS 703 Ca 0.00 -3.01 -0.25 0.00 -0.15 0.00 0.00 55.06 51.65 2i82 s HIS 703 Cb 0.00 -2.68 -0.11 0.00 1.11 0.00 0.00 32.58 30.89 2i82 s HIS 703 CO 0.00 -0.79 1.01 -0.35 -0.85 0.00 0.00 174.74 173.76 2i82 n PRO 704 N 3.40 1.36 -3.73 8.40 -0.04 -1.26 -5.03 135.00 138.10 2i82 n PRO 704 Ca 0.05 0.48 -0.12 0.00 -0.04 0.00 0.00 63.50 63.88 2i82 n PRO 704 Cb 0.34 -2.01 -0.12 0.00 -0.04 0.00 0.00 33.50 31.67 2i82 n PRO 704 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2i82 s SER 705 N -0.71 -0.35 0.88 3.54 0.15 -1.26 -4.14 113.70 111.82 2i82 s SER 705 Ca 0.62 0.66 -0.11 0.00 0.70 0.00 0.00 55.95 57.82 2i82 s SER 705 Cb -0.58 0.57 0.13 0.00 -1.71 0.00 0.00 66.02 64.43 2i82 s SER 705 CO 0.57 -0.16 1.15 -2.16 1.20 0.00 0.00 173.24 173.85 2i82 s PRO 706 N 1.04 1.24 0.62 5.44 0.04 -1.26 -5.05 135.00 137.06 2i82 s PRO 706 Ca -0.07 1.55 0.39 0.00 0.04 0.00 0.00 61.00 62.91 2i82 s PRO 706 Cb -0.08 -1.75 2.03 0.00 0.04 0.00 0.00 34.50 34.74 2i82 s PRO 706 CO -0.08 -2.47 2.25 0.00 0.04 0.00 0.00 177.00 176.74 2i82 h ALA 707 N -1.64 1.09 -3.53 8.56 0.00 -1.97 -3.41 119.26 118.35 2i82 h ALA 707 Ca -0.44 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.22 2i82 h ALA 707 Cb 1.27 -0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.76 2i82 h ALA 707 CO 0.43 0.02 -0.66 -2.00 0.00 0.00 0.00 179.25 177.04 2i82 s GLU 708 N -4.10 0.04 0.00 0.00 2.12 -1.26 -0.51 118.70 114.99 2i82 s GLU 708 Ca -0.03 0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.44 2i82 s GLU 708 Cb 0.12 -0.06 0.00 0.00 0.26 0.00 0.00 34.13 34.45 2i82 s GLU 708 CO 0.47 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.54 2i82 n GLY 709 N 3.47 1.25 2.91 -1.50 0.00 -1.05 -5.03 105.19 105.24 2i82 n GLY 709 Ca -0.18 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 44.89 2i82 n GLY 709 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i82 s LEU 710 N 0.00 1.54 -0.32 0.99 2.96 -1.26 -1.88 118.68 120.72 2i82 s LEU 710 Ca 0.00 -0.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.73 2i82 s LEU 710 Cb 0.00 -0.36 0.01 0.00 0.50 0.00 0.00 46.19 46.34 2i82 s LEU 710 CO 0.00 -0.02 0.12 -0.69 -1.32 0.00 0.00 176.35 174.45 2i82 s VAL 711 N 0.56 4.23 -0.48 1.68 1.01 0.62 -4.95 120.40 123.07 2i82 s VAL 711 Ca -0.07 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2i82 s VAL 711 Cb -0.10 -3.23 0.12 0.00 0.00 0.00 0.00 36.38 33.18 2i82 s VAL 711 CO -0.00 -0.00 0.21 -0.62 0.00 0.00 0.00 175.10 174.69 2i82 s ASP 712 N 1.53 4.38 -0.05 3.32 3.68 -1.26 -0.60 116.67 127.67 2i82 s ASP 712 Ca 0.03 -2.81 -0.01 0.00 2.13 0.00 0.00 52.55 51.89 2i82 s ASP 712 Cb -0.18 -1.61 0.03 0.00 -1.45 0.00 0.00 42.92 39.71 2i82 s ASP 712 CO 0.04 -0.26 0.01 -0.76 0.13 0.00 0.00 175.17 174.33 2i82 s LEU 713 N -0.01 0.73 0.44 -1.34 1.43 -0.98 -4.97 118.68 113.98 2i82 s LEU 713 Ca 0.16 -0.04 -0.25 0.00 -1.03 0.00 0.00 54.13 52.96 2i82 s LEU 713 Cb -0.24 -0.33 -0.09 0.00 0.03 0.00 0.00 46.19 45.56 2i82 s LEU 713 CO -0.02 -0.17 1.34 -0.81 0.23 0.00 0.00 176.35 176.93 2i82 n PRO 714 N 4.80 2.06 -4.19 1.29 -0.04 -1.26 -3.96 135.00 133.70 2i82 n PRO 714 Ca -0.13 0.73 -0.17 0.00 -0.04 0.00 0.00 63.50 63.89 2i82 n PRO 714 Cb 0.50 -2.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.35 2i82 n PRO 714 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2i82 s LEU 715 N -2.18 2.35 0.04 1.53 1.43 0.44 -2.49 118.68 119.81 2i82 s LEU 715 Ca 0.61 -0.73 -0.24 0.00 -1.03 0.00 0.00 54.13 52.75 2i82 s LEU 715 Cb -0.48 -0.44 0.06 0.00 0.03 0.00 0.00 46.19 45.36 2i82 s LEU 715 CO 0.57 -0.16 0.55 -0.51 0.23 0.00 0.00 176.35 177.04 2i82 s ILE 716 N -1.88 0.02 0.46 -0.59 1.10 -0.57 -4.33 121.20 115.41 2i82 s ILE 716 Ca 0.03 -0.18 -0.23 0.00 -0.51 0.00 0.00 60.65 59.76 2i82 s ILE 716 Cb -0.06 -0.97 -0.07 0.00 0.15 0.00 0.00 42.46 41.50 2i82 s ILE 716 CO 0.02 -0.10 1.21 0.00 -2.11 0.00 0.00 174.94 173.96 2i82 n ASP 718 N -0.46 5.19 -0.31 0.00 -0.08 -0.73 -4.80 116.55 115.37 2i82 n ASP 718 Ca 0.07 -3.17 0.02 0.00 -1.51 0.00 0.00 54.79 50.21 2i82 n ASP 718 Cb 0.47 -1.21 0.08 0.00 2.34 0.00 0.00 41.12 42.80 2i82 n ASP 718 CO 0.00 0.00 0.00 1.87 0.12 0.00 0.00 177.20 179.19 2i82 n TRP 719 N 2.18 0.18 0.27 -0.67 -0.00 -1.26 0.12 117.44 118.25 2i82 n TRP 719 Ca 0.24 1.04 0.16 0.00 -0.00 0.00 0.00 57.50 58.94 2i82 n TRP 719 Cb 0.37 -0.91 0.91 0.00 -0.00 0.00 0.00 31.31 31.68 2i82 n TRP 719 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 2i82 h PRO 720 N 0.00 0.00 -0.32 5.87 0.13 -1.96 -1.48 132.00 134.24 2i82 h PRO 720 Ca 0.36 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.39 2i82 h PRO 720 Cb 0.57 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.64 2i82 h PRO 720 CO -0.86 0.00 -0.00 0.09 -0.23 0.00 0.00 178.00 177.00 2i82 n ASN 721 N -3.77 3.28 -4.62 1.44 3.02 0.31 -5.05 115.26 109.88 2i82 n ASN 721 Ca -0.02 -3.35 -0.39 0.00 -0.03 0.00 0.00 54.58 50.80 2i82 n ASN 721 Cb 0.16 -0.59 0.04 0.00 -0.61 0.00 0.00 39.78 38.78 2i82 n ASN 721 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2i82 n ARG 722 N -0.81 1.03 -0.02 3.52 1.85 -0.56 -1.17 116.66 120.51 2i82 n ARG 722 Ca 0.28 0.39 0.01 0.00 -1.00 0.00 0.00 57.85 57.52 2i82 n ARG 722 Cb 0.98 -2.15 0.02 0.00 -1.05 0.00 0.00 32.46 30.26 2i82 n ARG 722 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2i82 n PRO 723 N -0.71 1.10 -1.71 2.89 -0.04 -1.26 -5.07 135.00 130.19 2i82 n PRO 723 Ca 0.12 -0.14 -0.35 0.00 -0.04 0.00 0.00 63.50 63.09 2i82 n PRO 723 Cb 0.45 -1.11 0.07 0.00 -0.04 0.00 0.00 33.50 32.87 2i82 n PRO 723 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2i82 s LYS 724 N -1.82 2.54 0.38 0.54 1.02 -0.32 -4.89 119.74 117.20 2i82 s LYS 724 Ca 0.03 1.82 0.08 0.00 0.02 0.00 0.00 55.97 57.92 2i82 s LYS 724 Cb 0.01 -1.88 -0.07 0.00 -0.52 0.00 0.00 37.83 35.38 2i82 s LYS 724 CO 0.02 -1.54 0.03 -0.65 -0.92 0.00 0.00 175.35 172.29 2i82 s GLN 725 N -3.62 2.03 0.10 1.68 -1.52 -1.26 -1.77 119.66 115.30 2i82 s GLN 725 Ca 0.77 -1.94 -0.13 0.00 -1.95 0.00 0.00 55.36 52.11 2i82 s GLN 725 Cb -0.31 -1.80 0.02 0.00 -0.22 0.00 0.00 33.01 30.71 2i82 s GLN 725 CO 0.40 0.01 0.31 -1.59 -0.25 0.00 0.00 175.29 174.17 2i82 s LYS 726 N -3.74 0.96 -0.15 2.91 -2.85 -0.22 -4.78 119.74 111.87 2i82 s LYS 726 Ca 0.36 -0.78 -0.24 0.00 -1.00 0.00 0.00 55.97 54.31 2i82 s LYS 726 Cb 0.05 0.41 -0.02 0.00 -2.06 0.00 0.00 37.83 36.21 2i82 s LYS 726 CO 0.19 -0.35 0.77 0.14 0.10 0.00 0.00 175.35 176.20 2i82 s VAL 727 N -3.69 4.94 -0.25 1.79 -7.23 -1.26 -1.52 120.40 113.18 2i82 s VAL 727 Ca 0.03 1.51 -0.02 0.00 -1.81 0.00 0.00 61.98 61.70 2i82 s VAL 727 Cb 0.03 -4.08 0.13 0.00 0.56 0.00 0.00 36.38 33.01 2i82 s VAL 727 CO -0.11 0.09 0.32 0.00 -0.31 0.00 0.00 175.10 175.09 2i82 h TYR 729 N 8.23 0.00 0.00 0.00 -1.99 -1.89 -2.50 116.97 118.81 2i82 h TYR 729 Ca -0.16 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.57 2i82 h TYR 729 Cb 1.13 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.86 2i82 h TYR 729 CO 0.19 0.13 0.00 0.39 -0.00 0.00 0.00 178.16 178.87 2i82 n GLU 730 N -3.57 0.00 -0.64 4.88 1.02 -1.26 -3.07 120.64 118.01 2i82 n GLU 730 Ca -0.01 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.06 2i82 n GLU 730 Cb 0.27 -0.73 -0.10 0.00 -0.02 0.00 0.00 31.44 30.86 2i82 n GLU 730 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2i82 n THR 731 N -0.31 1.99 0.00 2.62 -2.24 -1.24 -4.85 114.28 110.24 2i82 n THR 731 Ca 0.00 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.86 2i82 n THR 731 Cb 0.00 -1.75 0.00 0.00 -2.10 0.00 0.00 70.33 66.48 2i82 n THR 731 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i82 n GLY 732 N 2.44 0.00 1.28 3.38 0.00 -0.94 -4.66 105.19 106.68 2i82 n GLY 732 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2i82 n GLY 732 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2i82 n LYS 733 N 0.00 0.00 -1.73 1.61 4.81 -1.26 -2.95 118.16 118.64 2i82 n LYS 733 Ca 0.00 0.43 -0.37 0.00 -0.87 0.00 0.00 58.31 57.50 2i82 n LYS 733 Cb 0.00 -1.28 0.07 0.00 0.02 0.00 0.00 35.03 33.84 2i82 n LYS 733 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2i82 s PRO 734 N -1.45 2.55 -0.26 1.64 0.04 -1.26 -0.42 135.00 135.84 2i82 s PRO 734 Ca 0.00 2.09 -0.22 0.00 0.04 0.00 0.00 61.00 62.91 2i82 s PRO 734 Cb 0.00 -1.85 0.07 0.00 0.04 0.00 0.00 34.50 32.76 2i82 s PRO 734 CO 0.00 -1.61 0.68 0.00 0.04 0.00 0.00 177.00 176.12 2i82 s ALA 735 N -1.38 -1.73 0.08 8.56 0.00 -1.25 -4.81 121.76 121.23 2i82 s ALA 735 Ca 0.83 2.05 0.08 0.00 0.00 0.00 0.00 51.96 54.92 2i82 s ALA 735 Cb -0.38 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.51 2i82 s ALA 735 CO 0.40 -0.34 -0.22 1.14 0.00 0.00 0.00 175.76 176.75 2i82 s GLN 736 N 0.68 1.28 -0.04 0.00 0.00 -1.26 -2.33 119.66 118.00 2i82 s GLN 736 Ca -0.02 -1.10 0.01 0.00 -0.00 0.00 0.00 55.36 54.24 2i82 s GLN 736 Cb -0.05 -1.52 0.02 0.00 0.00 0.00 0.00 33.01 31.47 2i82 s GLN 736 CO -0.04 0.37 -0.02 0.99 0.00 0.00 0.00 175.29 176.59 2i82 s THR 737 N -1.00 0.30 -0.17 3.63 2.01 0.24 -2.31 115.64 118.33 2i82 s THR 737 Ca 0.08 0.01 -0.11 0.00 0.31 0.00 0.00 61.69 61.98 2i82 s THR 737 Cb -0.10 -0.38 -0.05 0.00 0.01 0.00 0.00 72.50 71.99 2i82 s THR 737 CO 0.03 0.17 0.20 -1.61 -0.69 0.00 0.00 174.62 172.73 2i82 s GLU 738 N 1.00 4.16 0.19 4.92 2.02 -0.61 -0.28 118.70 130.10 2i82 s GLU 738 Ca -0.10 -0.08 0.08 0.00 0.02 0.00 0.00 54.97 54.89 2i82 s GLU 738 Cb -0.14 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.65 2i82 s GLU 738 CO -0.01 0.32 -0.16 1.52 0.02 0.00 0.00 175.26 176.95 2i82 s TYR 739 N 0.27 1.79 -0.24 1.61 -0.85 -0.79 -0.02 117.35 119.13 2i82 s TYR 739 Ca 0.12 -0.51 -0.10 0.00 -0.52 0.00 0.00 57.07 56.06 2i82 s TYR 739 Cb -0.12 -0.85 0.10 0.00 0.38 0.00 0.00 41.96 41.47 2i82 s TYR 739 CO 0.01 0.37 0.53 -2.00 -1.52 0.00 0.00 175.55 172.94 2i82 s GLU 740 N -3.30 0.47 -0.28 -3.49 2.12 -0.66 -2.53 118.70 111.03 2i82 s GLU 740 Ca 0.20 1.16 -0.27 0.00 0.36 0.00 0.00 54.97 56.42 2i82 s GLU 740 Cb -0.03 0.42 0.01 0.00 0.26 0.00 0.00 34.13 34.78 2i82 s GLU 740 CO 0.07 -0.21 0.94 0.08 -0.54 0.00 0.00 175.26 175.60 2i82 s VAL 741 N 2.37 4.69 -2.13 3.70 1.01 0.33 -0.42 120.40 129.95 2i82 s VAL 741 Ca -0.05 1.61 0.23 0.00 0.00 0.00 0.00 61.98 63.77 2i82 s VAL 741 Cb -0.10 -4.26 0.04 0.00 0.00 0.00 0.00 36.38 32.06 2i82 s VAL 741 CO -0.16 -0.27 1.15 1.33 0.00 0.00 0.00 175.10 177.16 2i82 n VAL 742 N 5.53 0.00 -3.64 2.92 0.24 0.10 -4.94 118.33 118.54 2i82 n VAL 742 Ca 0.08 -0.27 -0.04 0.00 -2.04 0.00 0.00 64.34 62.07 2i82 n VAL 742 Cb 0.47 1.20 -0.07 0.00 -1.47 0.00 0.00 33.84 33.98 2i82 n VAL 742 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2i82 s GLU 743 N -2.42 0.41 -0.31 7.34 2.12 -1.09 -4.96 118.70 119.78 2i82 s GLU 743 Ca 0.20 0.67 -0.06 0.00 0.36 0.00 0.00 54.97 56.14 2i82 s GLU 743 Cb 0.18 0.10 0.02 0.00 0.26 0.00 0.00 34.13 34.70 2i82 s GLU 743 CO 0.54 -0.08 0.08 0.71 -0.54 0.00 0.00 175.26 175.96 2i82 s TYR 744 N 1.17 3.19 0.30 5.30 1.51 -1.26 -0.58 117.35 126.98 2i82 s TYR 744 Ca -0.07 -1.22 -0.07 0.00 -1.01 0.00 0.00 57.07 54.70 2i82 s TYR 744 Cb -0.04 -2.24 -0.06 0.00 -0.11 0.00 0.00 41.96 39.51 2i82 s TYR 744 CO -0.14 -0.66 0.59 0.00 -1.11 0.00 0.00 175.55 174.23 2i82 s ALA 745 N 1.44 3.57 -1.34 3.71 0.00 -0.55 -4.97 121.76 123.62 2i82 s ALA 745 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.52 2i82 s ALA 745 Cb -0.18 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.55 2i82 s ALA 745 CO 0.02 0.25 0.57 0.00 0.00 0.00 0.00 175.76 176.60 2i82 n ALA 746 N -0.85 2.29 -1.16 0.00 0.00 -1.26 -2.97 120.51 116.56 2i82 n ALA 746 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.50 2i82 n ALA 746 Cb 0.54 -1.00 0.20 0.00 0.00 0.00 0.00 19.45 19.19 2i82 n ALA 746 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2i82 n ASP 747 N -0.12 2.84 -3.33 0.00 5.75 -1.26 -4.96 116.55 115.47 2i82 n ASP 747 Ca 0.00 -3.26 -0.21 0.00 -0.01 0.00 0.00 54.79 51.31 2i82 n ASP 747 Cb 0.14 -0.51 0.08 0.00 -1.03 0.00 0.00 41.12 39.79 2i82 n ASP 747 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2i82 n ASN 748 N -1.03 -5.35 -4.05 -1.12 5.15 -1.16 -4.94 115.26 102.76 2i82 n ASN 748 Ca 0.21 -0.51 -0.09 0.00 -0.60 0.00 0.00 54.58 53.59 2i82 n ASN 748 Cb 0.80 -4.70 -0.09 0.00 -0.53 0.00 0.00 39.78 35.26 2i82 n ASN 748 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2i82 s THR 749 N -3.30 0.12 0.02 -0.44 -4.23 -1.25 -0.17 115.64 106.39 2i82 s THR 749 Ca 0.45 -1.66 -0.02 0.00 -1.18 0.00 0.00 61.69 59.28 2i82 s THR 749 Cb -0.20 -1.79 -0.02 0.00 1.34 0.00 0.00 72.50 71.84 2i82 s THR 749 CO 0.67 -0.56 0.02 0.00 -0.54 0.00 0.00 174.62 174.21 2i82 s ALA 750 N -3.98 0.04 -0.23 3.99 0.00 -0.24 -1.49 121.76 119.85 2i82 s ALA 750 Ca 0.16 -0.53 -0.11 0.00 0.00 0.00 0.00 51.96 51.48 2i82 s ALA 750 Cb 0.06 0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.29 2i82 s ALA 750 CO -0.03 -0.20 0.16 0.50 0.00 0.00 0.00 175.76 176.20 2i82 s ARG 751 N -1.71 4.10 0.04 0.00 3.52 0.25 -0.02 118.95 125.13 2i82 s ARG 751 Ca -0.13 -0.24 0.06 0.00 -0.13 0.00 0.00 55.73 55.28 2i82 s ARG 751 Cb -0.08 -3.52 -0.02 0.00 -1.56 0.00 0.00 34.95 29.77 2i82 s ARG 751 CO -0.01 0.10 -0.17 0.14 -0.81 0.00 0.00 175.30 174.55 2i82 s VAL 752 N 0.94 1.35 -0.26 7.11 -7.23 0.15 -0.72 120.40 121.74 2i82 s VAL 752 Ca 0.08 -1.09 -0.10 0.00 -1.81 0.00 0.00 61.98 59.06 2i82 s VAL 752 Cb -0.13 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 35.56 2i82 s VAL 752 CO 0.03 0.09 0.15 -0.69 -0.31 0.00 0.00 175.10 174.38 2i82 s VAL 753 N -0.83 5.12 -0.06 1.32 1.01 0.43 -0.41 120.40 126.99 2i82 s VAL 753 Ca 0.04 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.16 2i82 s VAL 753 Cb -0.08 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 2i82 s VAL 753 CO 0.02 0.31 -0.15 -0.76 0.00 0.00 0.00 175.10 174.51 2i82 s LEU 754 N 1.44 2.66 -0.39 3.92 1.43 0.19 -1.64 118.68 126.28 2i82 s LEU 754 Ca 0.07 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.96 2i82 s LEU 754 Cb -0.15 -1.54 0.11 0.00 0.03 0.00 0.00 46.19 44.64 2i82 s LEU 754 CO 0.07 0.32 0.13 -0.54 0.23 0.00 0.00 176.35 176.57 2i82 s LYS 755 N -0.59 1.38 -0.56 1.70 3.01 0.98 0.10 119.74 125.75 2i82 s LYS 755 Ca 0.09 -1.87 -0.28 0.00 -1.01 0.00 0.00 55.97 52.90 2i82 s LYS 755 Cb -0.11 -2.82 0.01 0.00 -1.01 0.00 0.00 37.83 33.90 2i82 s LYS 755 CO 0.01 -1.02 1.42 -1.25 0.51 0.00 0.00 175.35 175.02 2i82 s PRO 756 N 0.73 3.30 0.17 -1.68 0.04 -1.25 -1.57 135.00 134.73 2i82 s PRO 756 Ca 0.13 0.46 -0.11 0.00 0.04 0.00 0.00 61.00 61.51 2i82 s PRO 756 Cb -0.21 -4.13 0.08 0.00 0.04 0.00 0.00 34.50 30.28 2i82 s PRO 756 CO -0.09 -1.94 1.71 0.82 0.04 0.00 0.00 177.00 177.54 2i82 h ILE 757 N 6.38 1.24 -1.11 0.56 1.08 -1.81 -3.42 117.51 120.42 2i82 h ILE 757 Ca -0.27 -0.79 -0.50 0.00 -0.39 0.00 0.00 64.86 62.91 2i82 h ILE 757 Cb 1.09 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.44 2i82 h ILE 757 CO 1.18 0.30 -0.27 0.42 -0.69 0.00 0.00 178.15 179.09 2i82 s THR 758 N -5.46 2.36 -0.35 -0.27 -4.23 -1.23 -4.99 115.64 101.47 2i82 s THR 758 Ca -0.13 -1.24 0.10 0.00 -1.18 0.00 0.00 61.69 59.25 2i82 s THR 758 Cb 0.13 -2.60 0.45 0.00 1.34 0.00 0.00 72.50 71.82 2i82 s THR 758 CO 0.81 0.00 1.11 0.61 -0.54 0.00 0.00 174.62 176.60 2i82 n GLY 759 N -1.81 4.79 3.76 3.99 0.00 -1.26 -4.92 105.19 109.73 2i82 n GLY 759 Ca 0.06 -2.26 -0.40 0.00 0.00 0.00 0.00 46.02 43.42 2i82 n GLY 759 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i82 s ARG 760 N -3.52 4.60 0.17 1.61 3.00 -1.26 -4.94 118.95 118.61 2i82 s ARG 760 Ca 0.42 1.84 -0.33 0.00 0.00 0.00 0.00 55.73 57.67 2i82 s ARG 760 Cb 0.40 -3.16 -0.16 0.00 0.00 0.00 0.00 34.95 32.03 2i82 s ARG 760 CO -0.06 0.16 1.11 0.45 0.00 0.00 0.00 175.30 176.96 2i82 n SER 761 N 1.12 1.09 -1.68 0.23 2.88 -1.26 -0.94 113.62 115.07 2i82 n SER 761 Ca -0.01 1.14 -0.12 0.00 -1.33 0.00 0.00 58.87 58.56 2i82 n SER 761 Cb 0.45 -1.18 -0.04 0.00 -0.75 0.00 0.00 64.21 62.68 2i82 n SER 761 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2i82 n HIS 762 N 1.33 -0.75 0.03 0.66 8.25 -1.26 -4.88 115.22 118.61 2i82 n HIS 762 Ca 0.15 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.48 2i82 n HIS 762 Cb 0.24 -2.49 -0.08 0.00 1.12 0.00 0.00 29.99 28.78 2i82 n HIS 762 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2i82 h GLN 763 N 0.00 -0.52 -0.64 -0.41 4.15 -1.41 -0.11 115.11 116.16 2i82 h GLN 763 Ca -0.25 0.04 0.08 0.00 0.77 0.00 0.00 58.65 59.28 2i82 h GLN 763 Cb 0.90 0.12 -0.06 0.00 0.21 0.00 0.00 27.48 28.65 2i82 h GLN 763 CO 0.35 -0.35 0.31 -0.07 -1.93 0.00 0.00 178.83 177.14 2i82 h LEU 764 N -0.54 0.40 -0.23 -2.39 3.38 -1.90 0.22 115.31 114.25 2i82 h LEU 764 Ca 0.01 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2i82 h LEU 764 Cb 0.59 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2i82 h LEU 764 CO -0.31 0.25 0.07 0.03 0.09 0.00 0.00 178.44 178.57 2i82 h ARG 765 N 0.55 0.36 -0.52 1.13 3.08 -1.92 -3.00 114.38 114.07 2i82 h ARG 765 Ca 0.31 -0.08 -0.11 0.00 0.07 0.00 0.00 59.98 60.17 2i82 h ARG 765 Cb 0.30 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2i82 h ARG 765 CO -0.24 0.44 -0.13 0.28 -1.07 0.00 0.00 179.97 179.25 2i82 h VAL 766 N 0.21 1.27 0.00 2.04 2.07 -0.65 -2.70 116.25 118.49 2i82 h VAL 766 Ca 0.08 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.32 2i82 h VAL 766 Cb 0.23 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2i82 h VAL 766 CO -0.00 0.45 0.00 1.41 0.02 0.00 0.00 177.57 179.45 2i82 n HIS 767 N -4.14 0.00 0.00 1.57 8.25 0.74 -1.02 115.22 120.62 2i82 n HIS 767 Ca 0.01 -0.07 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2i82 n HIS 767 Cb 0.41 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.42 2i82 n HIS 767 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2i82 n LEU 769 N 0.71 0.00 -0.30 2.41 7.94 -1.02 -1.80 117.00 124.94 2i82 n LEU 769 Ca 0.00 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 54.94 2i82 n LEU 769 Cb 0.09 0.00 0.24 0.00 0.53 0.00 0.00 43.42 44.28 2i82 n LEU 769 CO 0.00 0.00 1.25 0.00 -1.11 0.00 0.00 177.39 177.53 2i82 h ALA 770 N 0.00 1.50 0.00 1.96 0.00 -1.36 0.59 119.26 121.96 2i82 h ALA 770 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2i82 h ALA 770 Cb 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2i82 h ALA 770 CO 0.00 0.37 0.00 -0.07 0.00 0.00 0.00 179.25 179.55 2i82 h LEU 771 N 1.04 0.00 0.00 0.00 3.38 -1.63 -3.46 115.31 114.64 2i82 h LEU 771 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 2i82 h LEU 771 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2i82 h LEU 771 CO -0.14 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.00 2i82 n GLY 772 N 0.12 0.87 2.58 0.83 0.00 0.20 -5.02 105.19 104.78 2i82 n GLY 772 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2i82 n GLY 772 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2i82 n HIS 773 N -1.93 2.11 -1.37 1.61 8.25 -1.26 -4.90 115.22 117.73 2i82 n HIS 773 Ca 0.00 -3.98 -0.36 0.00 -0.26 0.00 0.00 57.72 53.12 2i82 n HIS 773 Cb 0.00 -0.40 0.09 0.00 1.12 0.00 0.00 29.99 30.80 2i82 n HIS 773 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2i82 n PRO 774 N 1.74 0.55 -2.53 -0.41 -0.02 -1.26 -4.17 135.00 128.89 2i82 n PRO 774 Ca 0.25 0.25 -0.41 0.00 -2.02 0.00 0.00 63.50 61.56 2i82 n PRO 774 Cb 0.41 -2.30 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 2i82 n PRO 774 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2i82 s ILE 775 N -1.80 3.89 0.34 4.25 1.01 -1.26 -0.91 121.20 126.72 2i82 s ILE 775 Ca 0.75 1.65 -0.29 0.00 0.00 0.00 0.00 60.65 62.76 2i82 s ILE 775 Cb -0.34 -4.05 -0.12 0.00 0.01 0.00 0.00 42.46 37.96 2i82 s ILE 775 CO 0.49 0.29 1.50 0.18 0.00 0.00 0.00 174.94 177.40 2i82 n LEU 776 N 2.32 4.41 0.00 2.97 4.77 -0.41 -2.10 117.00 128.96 2i82 n LEU 776 Ca 0.02 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.20 2i82 n LEU 776 Cb 0.46 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.97 2i82 n LEU 776 CO 0.54 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 2i82 n GLY 777 N 1.15 1.29 3.57 -0.72 0.00 -0.63 -1.21 105.19 108.64 2i82 n GLY 777 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2i82 n GLY 777 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i82 s ASP 778 N -3.15 5.66 0.00 1.61 3.68 -0.89 -3.67 116.67 119.91 2i82 s ASP 778 Ca 0.00 0.70 0.30 0.00 2.13 0.00 0.00 52.55 55.68 2i82 s ASP 778 Cb 0.00 -2.53 1.75 0.00 -1.45 0.00 0.00 42.92 40.69 2i82 s ASP 778 CO 0.00 -2.00 2.11 0.54 0.13 0.00 0.00 175.17 175.95 2i82 n ARG 779 N 8.78 0.85 -0.10 4.34 1.74 -1.26 -1.58 116.66 129.43 2i82 n ARG 779 Ca 0.20 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.14 2i82 n ARG 779 Cb 0.50 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.35 2i82 n ARG 779 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2i82 n PHE 780 N -1.05 0.00 -0.05 -1.55 3.72 -1.26 -4.84 117.46 112.43 2i82 n PHE 780 Ca 0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.61 2i82 n PHE 780 Cb 0.13 -0.76 0.00 0.00 -0.94 0.00 0.00 39.48 37.91 2i82 n PHE 780 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2i82 n TYR 781 N -3.12 0.00 -3.10 1.38 4.02 -1.23 -5.07 117.16 110.04 2i82 n TYR 781 Ca -0.35 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.21 2i82 n TYR 781 Cb 0.87 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 40.12 2i82 n TYR 781 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2i82 s ALA 782 N -0.46 3.30 0.85 -0.72 0.00 -0.62 -4.90 121.76 119.21 2i82 s ALA 782 Ca 0.00 0.09 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 2i82 s ALA 782 Cb 0.00 -2.82 0.10 0.00 0.00 0.00 0.00 23.12 20.41 2i82 s ALA 782 CO 0.00 0.31 1.10 -1.54 0.00 0.00 0.00 175.76 175.63 2i82 s SER 783 N -2.21 3.74 0.28 0.00 1.04 -1.26 -4.64 113.70 110.64 2i82 s SER 783 Ca 0.54 1.87 0.02 0.00 0.48 0.00 0.00 55.95 58.86 2i82 s SER 783 Cb -0.11 -2.47 0.61 0.00 0.10 0.00 0.00 66.02 64.15 2i82 s SER 783 CO 0.17 -2.53 1.77 -0.65 0.98 0.00 0.00 173.24 172.98 2i82 h PRO 784 N -1.47 0.66 -0.30 4.02 0.11 -1.97 0.10 132.00 133.15 2i82 h PRO 784 Ca -0.45 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2i82 h PRO 784 Cb 1.25 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2i82 h PRO 784 CO 0.49 0.43 0.01 0.93 -0.21 0.00 0.00 178.00 179.66 2i82 h GLU 785 N 0.68 0.52 -0.38 1.05 3.07 -1.99 -1.99 114.58 115.53 2i82 h GLU 785 Ca 0.51 -0.16 -0.16 0.00 -0.50 0.00 0.00 59.36 59.05 2i82 h GLU 785 Cb 0.75 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 2i82 h GLU 785 CO -0.37 0.65 -0.38 0.00 -1.40 0.00 0.00 179.01 177.50 2i82 h ALA 786 N 0.85 0.56 -0.97 3.43 0.00 -1.81 -3.09 119.26 118.23 2i82 h ALA 786 Ca 0.09 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.56 2i82 h ALA 786 Cb 0.41 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2i82 h ALA 786 CO 0.01 0.67 0.64 -0.09 0.00 0.00 0.00 179.25 180.48 2i82 h ARG 787 N 0.76 1.26 -3.19 0.00 2.43 -0.95 -1.69 114.38 113.00 2i82 h ARG 787 Ca 0.06 -0.08 -0.60 0.00 -0.81 0.00 0.00 59.98 58.56 2i82 h ARG 787 Cb 0.98 -0.28 0.02 0.00 -0.42 0.00 0.00 29.97 30.27 2i82 h ARG 787 CO 0.10 0.83 3.48 0.00 -1.51 0.00 0.00 179.97 182.86 2i82 n ALA 788 N -2.38 6.66 -0.79 2.80 0.00 -0.75 -3.49 120.51 122.55 2i82 n ALA 788 Ca 0.12 -3.14 -0.26 0.00 0.00 0.00 0.00 53.44 50.15 2i82 n ALA 788 Cb 0.03 -3.29 0.02 0.00 0.00 0.00 0.00 19.45 16.21 2i82 n ALA 788 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i82 n ALA 790 N 3.94 -3.63 0.22 0.00 0.00 -1.26 -5.00 120.51 114.78 2i82 n ALA 790 Ca 0.68 -0.26 0.10 0.00 0.00 0.00 0.00 53.44 53.96 2i82 n ALA 790 Cb 0.22 -0.89 0.38 0.00 0.00 0.00 0.00 19.45 19.16 2i82 n ALA 790 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2i82 h PRO 791 N -0.36 0.00 -4.25 0.00 0.11 -1.93 -3.41 132.00 122.16 2i82 h PRO 791 Ca -0.30 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.65 2i82 h PRO 791 Cb 0.96 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 31.94 2i82 h PRO 791 CO 0.23 0.19 -0.52 -0.98 -0.21 0.00 0.00 178.00 176.71 2i82 s ARG 792 N -3.47 1.07 0.07 1.05 1.70 -1.26 -5.09 118.95 113.01 2i82 s ARG 792 Ca 0.02 -1.38 -0.31 0.00 -0.47 0.00 0.00 55.73 53.59 2i82 s ARG 792 Cb 0.09 0.30 -0.08 0.00 -0.57 0.00 0.00 34.95 34.69 2i82 s ARG 792 CO 0.64 -0.35 1.60 -1.17 -1.08 0.00 0.00 175.30 174.94 2i82 s LEU 793 N -3.04 4.36 -1.34 -1.89 2.96 -1.24 -4.27 118.68 114.22 2i82 s LEU 793 Ca 0.24 2.43 -0.08 0.00 -0.22 0.00 0.00 54.13 56.50 2i82 s LEU 793 Cb 0.06 -3.57 0.12 0.00 0.50 0.00 0.00 46.19 43.30 2i82 s LEU 793 CO 0.03 -0.85 2.17 0.18 -1.32 0.00 0.00 176.35 176.56 2i82 n LEU 794 N 5.39 7.34 -3.95 -0.68 4.77 -0.35 -4.86 117.00 124.67 2i82 n LEU 794 Ca 0.15 -4.68 -0.21 0.00 -0.03 0.00 0.00 56.01 51.24 2i82 n LEU 794 Cb 0.41 -1.46 -0.16 0.00 -2.33 0.00 0.00 43.42 39.88 2i82 n LEU 794 CO 0.62 1.66 -0.43 -0.22 -1.33 0.00 0.00 177.39 177.69 2i82 s LEU 795 N -0.67 1.52 -0.03 2.23 2.96 -1.26 -2.58 118.68 120.85 2i82 s LEU 795 Ca 0.48 -0.19 -0.01 0.00 -0.22 0.00 0.00 54.13 54.19 2i82 s LEU 795 Cb 0.14 -0.57 0.03 0.00 0.50 0.00 0.00 46.19 46.29 2i82 s LEU 795 CO -0.04 -0.00 0.06 -2.28 -1.32 0.00 0.00 176.35 172.77 2i82 s HIS 796 N 0.68 -0.01 -0.67 5.38 5.65 -0.81 -3.05 115.29 122.46 2i82 s HIS 796 Ca -0.11 0.24 -0.27 0.00 0.25 0.00 0.00 55.06 55.17 2i82 s HIS 796 Cb -0.14 -0.25 0.01 0.00 -1.18 0.00 0.00 32.58 31.02 2i82 s HIS 796 CO 0.01 -0.13 1.46 0.00 -0.65 0.00 0.00 174.74 175.43 2i82 s ALA 797 N 1.34 2.61 -2.31 1.58 0.00 0.84 -1.99 121.76 123.83 2i82 s ALA 797 Ca -0.06 -1.06 0.26 0.00 0.00 0.00 0.00 51.96 51.10 2i82 s ALA 797 Cb -0.13 -4.24 1.16 0.00 0.00 0.00 0.00 23.12 19.91 2i82 s ALA 797 CO -0.04 -3.39 1.80 -1.91 0.00 0.00 0.00 175.76 172.22 2i82 n GLU 798 N 9.20 1.49 0.00 0.00 2.13 -0.51 -0.47 120.64 132.49 2i82 n GLU 798 Ca 0.09 -0.72 0.00 0.00 0.66 0.00 0.00 57.16 57.19 2i82 n GLU 798 Cb 0.50 -1.45 0.00 0.00 0.27 0.00 0.00 31.44 30.76 2i82 n GLU 798 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2i82 n LEU 800 N -0.11 0.00 -4.33 4.31 7.94 -0.56 -2.06 117.00 122.20 2i82 n LEU 800 Ca 0.19 0.00 -0.32 0.00 -1.11 0.00 0.00 56.01 54.77 2i82 n LEU 800 Cb 0.28 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 44.07 2i82 n LEU 800 CO 0.16 0.00 -0.50 -0.89 -1.11 0.00 0.00 177.39 175.05 2i82 s THR 801 N 0.00 2.62 0.31 1.96 2.01 -0.24 -0.73 115.64 121.57 2i82 s THR 801 Ca 0.00 -0.84 -0.09 0.00 0.31 0.00 0.00 61.69 61.08 2i82 s THR 801 Cb 0.00 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.48 2i82 s THR 801 CO 0.00 0.55 0.52 0.27 -0.69 0.00 0.00 174.62 175.28 2i82 s ILE 802 N 0.09 0.00 -0.11 1.82 -4.36 -1.26 -1.39 121.20 115.99 2i82 s ILE 802 Ca -0.08 -1.43 -0.02 0.00 -0.26 0.00 0.00 60.65 58.86 2i82 s ILE 802 Cb -0.15 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.03 2i82 s ILE 802 CO 0.05 0.00 -0.03 0.42 0.24 0.00 0.00 174.94 175.62 2i82 s THR 803 N -3.34 3.99 0.19 8.37 -4.23 -1.26 -4.39 115.64 114.97 2i82 s THR 803 Ca 0.25 -0.35 -0.33 0.00 -1.18 0.00 0.00 61.69 60.08 2i82 s THR 803 Cb -0.01 -2.70 -0.13 0.00 1.34 0.00 0.00 72.50 71.00 2i82 s THR 803 CO 0.14 0.55 1.57 1.57 -0.54 0.00 0.00 174.62 177.91 2i82 n HIS 804 N 2.79 2.35 0.25 3.99 -0.00 0.55 -4.81 115.22 120.34 2i82 n HIS 804 Ca -0.18 0.27 0.15 0.00 0.46 0.00 0.00 57.72 58.42 2i82 n HIS 804 Cb 0.53 -2.55 0.85 0.00 -0.12 0.00 0.00 29.99 28.70 2i82 n HIS 804 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2i82 h PRO 805 N 5.69 0.00 0.00 1.57 0.11 -1.92 0.72 132.00 138.17 2i82 h PRO 805 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2i82 h PRO 805 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2i82 h PRO 805 CO 0.87 0.00 -0.31 0.00 -0.21 0.00 0.00 178.00 178.35 2i82 n ALA 806 N -2.36 2.85 -0.22 -0.75 0.00 -1.26 -4.70 120.51 114.07 2i82 n ALA 806 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2i82 n ALA 806 Cb 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2i82 n ALA 806 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2i82 n TYR 807 N -1.15 0.00 -0.58 0.00 4.02 -1.18 -5.02 117.16 113.24 2i82 n TYR 807 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 2i82 n TYR 807 Cb 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.42 2i82 n TYR 807 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2i82 n GLY 808 N 0.28 0.20 3.78 2.72 0.00 0.24 -4.90 105.19 107.50 2i82 n GLY 808 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2i82 n GLY 808 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i82 s ASN 809 N -2.20 6.58 0.75 1.61 4.22 -1.26 -4.46 114.94 120.18 2i82 s ASN 809 Ca 0.00 2.19 -0.11 0.00 -2.14 0.00 0.00 52.86 52.79 2i82 s ASN 809 Cb 0.00 -2.60 0.04 0.00 1.28 0.00 0.00 41.25 39.97 2i82 s ASN 809 CO 0.00 -0.63 1.10 -0.55 -2.04 0.00 0.00 177.10 174.98 2i82 s SER 810 N -1.38 4.99 -0.30 3.54 0.15 -1.26 -0.33 113.70 119.11 2i82 s SER 810 Ca 0.58 1.20 -0.15 0.00 0.70 0.00 0.00 55.95 58.28 2i82 s SER 810 Cb -0.26 -1.96 0.16 0.00 -1.71 0.00 0.00 66.02 62.25 2i82 s SER 810 CO 0.32 -1.64 0.98 -0.89 1.20 0.00 0.00 173.24 173.22 2i82 s THR 812 N -3.27 -0.39 -0.03 6.45 2.01 -1.26 -4.98 115.64 114.17 2i82 s THR 812 Ca 0.59 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.60 2i82 s THR 812 Cb -0.13 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.35 2i82 s THR 812 CO 0.53 0.00 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.08 2i82 s PHE 813 N 2.19 3.04 0.03 4.92 0.40 0.09 -4.97 117.98 123.69 2i82 s PHE 813 Ca -0.04 0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.37 2i82 s PHE 813 Cb -0.06 -1.69 -0.03 0.00 0.51 0.00 0.00 43.02 41.76 2i82 s PHE 813 CO -0.17 0.43 -0.04 0.15 0.70 0.00 0.00 175.22 176.29 2i82 s LYS 814 N -1.26 0.43 -0.29 0.44 1.02 -1.26 -1.49 119.74 117.32 2i82 s LYS 814 Ca 0.17 -0.78 0.02 0.00 0.02 0.00 0.00 55.97 55.39 2i82 s LYS 814 Cb -0.11 0.04 0.18 0.00 -0.52 0.00 0.00 37.83 37.42 2i82 s LYS 814 CO 0.07 -0.04 0.55 0.00 -0.92 0.00 0.00 175.35 175.01 2i82 s ALA 815 N -1.99 -2.08 0.61 5.17 0.00 -0.87 -5.07 121.76 117.53 2i82 s ALA 815 Ca -0.10 1.31 -0.19 0.00 0.00 0.00 0.00 51.96 52.98 2i82 s ALA 815 Cb -0.06 -2.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 2i82 s ALA 815 CO -0.03 -1.54 1.19 -0.35 0.00 0.00 0.00 175.76 175.03 2i82 n PRO 816 N 5.41 1.17 -1.64 0.00 -0.04 -1.26 -4.49 135.00 134.15 2i82 n PRO 816 Ca 0.01 0.45 -0.32 0.00 -0.04 0.00 0.00 63.50 63.59 2i82 n PRO 816 Cb 0.52 -2.41 0.06 0.00 -0.04 0.00 0.00 33.50 31.63 2i82 n PRO 816 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i82 s ALA 817 N -1.40 2.45 -0.64 0.55 0.00 -1.26 -4.93 121.76 116.52 2i82 s ALA 817 Ca 0.78 0.43 0.09 0.00 0.00 0.00 0.00 51.96 53.26 2i82 s ALA 817 Cb -0.41 -3.29 0.49 0.00 0.00 0.00 0.00 23.12 19.91 2i82 s ALA 817 CO 0.45 -1.36 1.26 -0.25 0.00 0.00 0.00 175.76 175.85 2i82 n ASP 818 N -2.72 3.77 0.00 0.00 8.00 -1.26 -5.19 116.55 119.15 2i82 n ASP 818 Ca 0.10 -2.53 0.00 0.00 0.71 0.00 0.00 54.79 53.07 2i82 n ASP 818 Cb 0.52 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 2i82 n ASP 818 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03