#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u0l s ARG 604 N 0.00 4.37 -0.04 1.96 1.81 -1.26 -4.02 118.95 121.77 1u0l s ARG 604 Ca 0.00 2.18 -0.07 0.00 -1.72 0.00 0.00 55.73 56.12 1u0l s ARG 604 Cb 0.00 -3.09 0.01 0.00 -0.45 0.00 0.00 34.95 31.42 1u0l s ARG 604 CO 0.00 -0.18 0.17 1.03 -0.68 0.00 0.00 175.30 175.64 1u0l s ARG 605 N -1.50 0.34 0.26 3.54 0.52 -1.20 -5.01 118.95 115.89 1u0l s ARG 605 Ca 0.50 -0.01 -0.17 0.00 -0.52 0.00 0.00 55.73 55.54 1u0l s ARG 605 Cb -0.39 0.15 -0.08 0.00 0.52 0.00 0.00 34.95 35.14 1u0l s ARG 605 CO 0.50 -0.07 0.70 1.03 0.02 0.00 0.00 175.30 177.49 1u0l s ARG 606 N -0.52 4.09 0.23 3.54 0.52 -1.26 -1.68 118.95 123.87 1u0l s ARG 606 Ca -0.06 0.71 -0.12 0.00 -0.52 0.00 0.00 55.73 55.74 1u0l s ARG 606 Cb -0.04 -2.67 -0.00 0.00 0.52 0.00 0.00 34.95 32.76 1u0l s ARG 606 CO 0.01 0.29 0.45 0.20 0.02 0.00 0.00 175.30 176.27 1u0l s GLY 607 N -1.97 0.49 -0.05 -3.53 0.00 0.87 -0.28 107.32 102.85 1u0l s GLY 607 Ca 0.48 -0.84 0.05 0.00 0.00 0.00 0.00 44.72 44.42 1u0l s GLY 607 CO 0.19 -0.64 -0.21 -0.42 0.00 0.00 0.00 173.10 172.02 1u0l s ILE 608 N -4.00 1.75 -0.55 0.90 1.01 -0.52 -1.51 121.20 118.28 1u0l s ILE 608 Ca 0.21 -0.90 -0.28 0.00 0.00 0.00 0.00 60.65 59.67 1u0l s ILE 608 Cb 0.00 -1.49 0.03 0.00 0.01 0.00 0.00 42.46 41.01 1u0l s ILE 608 CO 0.07 0.49 1.25 -0.69 0.00 0.00 0.00 174.94 176.06 1u0l s VAL 609 N -0.11 3.99 -0.10 2.92 1.01 -0.80 -0.54 120.40 126.76 1u0l s VAL 609 Ca -0.02 0.91 0.16 0.00 0.00 0.00 0.00 61.98 63.02 1u0l s VAL 609 Cb -0.12 -4.62 -0.15 0.00 0.00 0.00 0.00 36.38 31.49 1u0l s VAL 609 CO 0.03 -1.22 0.81 -0.37 0.00 0.00 0.00 175.10 174.34 1u0l h VAL 610 N 6.24 0.59 -1.89 2.92 -1.51 -1.56 0.75 116.25 121.78 1u0l h VAL 610 Ca -0.25 -2.16 0.25 0.00 -1.23 0.00 0.00 66.70 63.31 1u0l h VAL 610 Cb 1.07 2.13 -0.05 0.00 -2.13 0.00 0.00 31.29 32.31 1u0l h VAL 610 CO 1.17 0.33 0.66 -1.54 -1.23 0.00 0.00 177.57 176.96 1u0l n SER 611 N -2.93 -0.89 -3.96 4.19 3.41 -1.16 -0.91 113.62 111.36 1u0l n SER 611 Ca -0.11 -1.20 -0.29 0.00 -0.26 0.00 0.00 58.87 57.02 1u0l n SER 611 Cb 0.88 1.38 -0.17 0.00 -0.26 0.00 0.00 64.21 66.05 1u0l n SER 611 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1u0l s PHE 612 N -2.33 1.91 0.06 7.33 0.40 -1.26 -0.51 117.98 123.58 1u0l s PHE 612 Ca 0.22 -1.08 0.06 0.00 -0.60 0.00 0.00 56.93 55.53 1u0l s PHE 612 Cb -0.01 -1.45 -0.03 0.00 0.51 0.00 0.00 43.02 42.05 1u0l s PHE 612 CO -0.00 -0.62 -0.16 -1.58 0.70 0.00 0.00 175.22 173.56 1u0l s HIS 613 N 1.57 1.35 -1.27 0.36 2.46 0.32 -4.83 115.29 115.26 1u0l s HIS 613 Ca 0.04 -0.40 -0.06 0.00 0.47 0.00 0.00 55.06 55.11 1u0l s HIS 613 Cb -0.13 -0.78 0.06 0.00 -0.13 0.00 0.00 32.58 31.60 1u0l s HIS 613 CO -0.09 0.07 0.14 -1.13 -2.47 0.00 0.00 174.74 171.26 1u0l n SER 614 N 1.55 0.08 -3.24 9.88 3.41 -1.26 0.43 113.62 124.46 1u0l n SER 614 Ca -0.19 -0.97 -0.16 0.00 -0.26 0.00 0.00 58.87 57.29 1u0l n SER 614 Cb 0.54 -1.22 0.08 0.00 -0.26 0.00 0.00 64.21 63.35 1u0l n SER 614 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1u0l n ASN 615 N -2.01 -2.23 -3.52 4.04 5.03 -1.26 -5.02 115.26 110.30 1u0l n ASN 615 Ca -0.15 -0.58 -0.14 0.00 0.87 0.00 0.00 54.58 54.59 1u0l n ASN 615 Cb 0.48 -4.79 -0.04 0.00 -1.02 0.00 0.00 39.78 34.40 1u0l n ASN 615 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1u0l s MET 616 N -5.22 1.12 -0.02 3.52 -1.94 0.17 -5.04 119.30 111.88 1u0l s MET 616 Ca 0.02 -0.23 -0.18 0.00 -1.71 0.00 0.00 55.69 53.59 1u0l s MET 616 Cb -0.00 0.52 -0.05 0.00 2.01 0.00 0.00 34.83 37.30 1u0l s MET 616 CO 0.68 -0.43 0.51 0.08 -0.01 0.00 0.00 175.02 175.85 1u0l s VAL 617 N -2.67 4.99 -0.33 -6.03 1.01 -1.25 -0.52 120.40 115.60 1u0l s VAL 617 Ca -0.04 1.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.96 1u0l s VAL 617 Cb -0.00 -3.84 0.06 0.00 0.00 0.00 0.00 36.38 32.60 1u0l s VAL 617 CO -0.03 0.45 0.07 -0.89 0.00 0.00 0.00 175.10 174.70 1u0l s THR 618 N -0.32 3.27 0.04 3.92 2.01 0.34 0.04 115.64 124.94 1u0l s THR 618 Ca 0.27 -1.45 0.03 0.00 0.31 0.00 0.00 61.69 60.85 1u0l s THR 618 Cb -0.17 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 1u0l s THR 618 CO 0.14 -0.25 -0.01 0.68 -0.69 0.00 0.00 174.62 174.50 1u0l s VAL 619 N 1.27 4.03 -0.22 3.82 -7.23 -0.92 -1.32 120.40 119.83 1u0l s VAL 619 Ca -0.01 -0.79 -0.10 0.00 -1.81 0.00 0.00 61.98 59.27 1u0l s VAL 619 Cb -0.20 -2.85 -0.05 0.00 0.56 0.00 0.00 36.38 33.84 1u0l s VAL 619 CO -0.01 0.27 0.14 -0.70 -0.31 0.00 0.00 175.10 174.50 1u0l s GLU 620 N -1.86 4.12 0.10 4.82 2.12 0.30 -1.19 118.70 127.11 1u0l s GLU 620 Ca 0.22 -0.25 -0.31 0.00 0.36 0.00 0.00 54.97 54.99 1u0l s GLU 620 Cb -0.12 -3.47 -0.10 0.00 0.26 0.00 0.00 34.13 30.70 1u0l s GLU 620 CO 0.13 0.18 1.89 -3.47 -0.54 0.00 0.00 175.26 173.45 1u0l n ASP 621 N 3.91 4.13 -0.28 -1.70 2.03 -1.19 -1.44 116.55 122.01 1u0l n ASP 621 Ca -0.16 0.96 0.10 0.00 0.52 0.00 0.00 54.79 56.21 1u0l n ASP 621 Cb 0.52 -1.55 0.25 0.00 -0.72 0.00 0.00 41.12 39.62 1u0l n ASP 621 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 1u0l h GLU 622 N 9.28 0.31 0.00 -0.67 4.81 -0.98 -2.03 114.58 125.30 1u0l h GLU 622 Ca -0.48 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1u0l h GLU 622 Cb 1.23 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1u0l h GLU 622 CO 0.95 0.20 0.00 -1.91 -0.73 0.00 0.00 179.01 177.52 1u0l n GLU 623 N -5.12 1.53 -1.50 1.92 4.07 -1.26 -4.56 120.64 115.71 1u0l n GLU 623 Ca 0.19 0.00 -0.35 0.00 -0.06 0.00 0.00 57.16 56.94 1u0l n GLU 623 Cb 0.57 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.88 1u0l n GLU 623 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1u0l n THR 624 N -0.37 1.50 -3.51 6.31 -1.04 -1.26 -4.85 114.28 111.07 1u0l n THR 624 Ca 0.00 -1.45 -0.37 0.00 -2.04 0.00 0.00 64.05 60.19 1u0l n THR 624 Cb 0.00 -2.19 -0.08 0.00 -1.82 0.00 0.00 70.33 66.24 1u0l n THR 624 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1u0l s GLY 625 N 6.14 2.08 0.00 3.41 0.00 -0.76 -4.96 107.32 113.24 1u0l s GLY 625 Ca 0.65 -0.62 0.00 0.00 0.00 0.00 0.00 44.72 44.75 1u0l s GLY 625 CO 0.16 0.59 0.00 1.18 0.00 0.00 0.00 173.10 175.03 1u0l n GLU 626 N 4.20 0.24 -2.92 2.90 4.71 -1.26 -4.16 120.64 124.34 1u0l n GLU 626 Ca -0.11 0.00 -0.44 0.00 -0.01 0.00 0.00 57.16 56.60 1u0l n GLU 626 Cb 0.52 0.00 -0.04 0.00 -1.01 0.00 0.00 31.44 30.91 1u0l n GLU 626 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 1u0l s ARG 627 N -1.97 3.20 -0.49 3.49 3.52 -1.26 -3.14 118.95 122.29 1u0l s ARG 627 Ca 0.00 -1.13 -0.19 0.00 -0.13 0.00 0.00 55.73 54.28 1u0l s ARG 627 Cb 0.00 -4.38 0.05 0.00 -1.56 0.00 0.00 34.95 29.07 1u0l s ARG 627 CO 0.00 -1.75 0.60 0.42 -0.81 0.00 0.00 175.30 173.76 1u0l s ILE 628 N 3.49 4.90 0.36 4.11 1.09 -0.34 -4.97 121.20 129.84 1u0l s ILE 628 Ca 0.22 -0.44 -0.28 0.00 -1.10 0.00 0.00 60.65 59.05 1u0l s ILE 628 Cb -0.16 -4.26 -0.10 0.00 -1.06 0.00 0.00 42.46 36.87 1u0l s ILE 628 CO 0.05 -0.75 1.36 -0.22 -0.10 0.00 0.00 174.94 175.28 1u0l s LEU 629 N 2.58 4.36 0.00 2.97 0.20 -1.26 -2.17 118.68 125.36 1u0l s LEU 629 Ca 0.15 2.79 0.00 0.00 0.69 0.00 0.00 54.13 57.76 1u0l s LEU 629 Cb -0.19 -3.69 0.00 0.00 -0.43 0.00 0.00 46.19 41.88 1u0l s LEU 629 CO 0.12 -0.68 0.00 0.00 -0.29 0.00 0.00 176.35 175.50 1u0l n LYS 631 N 0.00 0.25 0.00 0.00 0.00 -1.24 -3.91 118.16 113.27 1u0l n LYS 631 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 58.31 57.42 1u0l n LYS 631 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 35.03 34.61 1u0l n LYS 631 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 1u0l n LEU 632 N 1.33 0.00 -4.44 3.14 -0.00 -1.26 -4.50 117.00 111.27 1u0l n LEU 632 Ca 0.01 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 55.64 1u0l n LEU 632 Cb 0.70 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 44.01 1u0l n LEU 632 CO -0.10 0.00 -0.21 0.00 -0.00 0.00 0.00 177.39 177.08 1u0l s ARG 633 N 0.00 3.32 0.00 1.47 1.04 -0.69 -4.91 118.95 119.18 1u0l s ARG 633 Ca 0.00 -0.73 0.00 0.00 -1.04 0.00 0.00 55.73 53.96 1u0l s ARG 633 Cb 0.00 -3.56 0.00 0.00 -2.04 0.00 0.00 34.95 29.35 1u0l s ARG 633 CO 0.00 -0.42 0.00 0.41 -0.04 0.00 0.00 175.30 175.25 1u0l n GLY 634 N 4.98 -1.15 0.51 3.88 0.00 -1.26 -4.60 105.19 107.55 1u0l n GLY 634 Ca -0.14 -1.00 0.02 0.00 0.00 0.00 0.00 46.02 44.90 1u0l n GLY 634 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u0l n LYS 635 N -0.03 1.60 -0.33 1.61 4.76 -1.26 -3.39 118.16 121.12 1u0l n LYS 635 Ca 0.00 -0.66 0.06 0.00 -2.87 0.00 0.00 58.31 54.83 1u0l n LYS 635 Cb 0.00 -1.34 0.25 0.00 -1.84 0.00 0.00 35.03 32.09 1u0l n LYS 635 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1u0l h PHE 636 N 0.98 1.08 -0.00 2.13 0.04 -1.88 0.65 116.94 119.93 1u0l h PHE 636 Ca 0.00 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.80 1u0l h PHE 636 Cb 0.47 -0.35 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 1u0l h PHE 636 CO 0.17 0.50 0.00 -0.09 -0.60 0.00 0.00 178.31 178.29 1u0l h ARG 637 N 1.01 0.00 0.00 1.51 1.12 -1.87 -3.30 114.38 112.84 1u0l h ARG 637 Ca 0.44 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.31 1u0l h ARG 637 Cb 0.35 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.31 1u0l h ARG 637 CO -0.20 0.17 0.00 1.28 -3.11 0.00 0.00 179.97 178.12 1u0l n LEU 638 N -5.01 0.00 0.00 3.80 7.99 0.14 -4.59 117.00 119.33 1u0l n LEU 638 Ca -0.07 0.40 -0.30 0.00 -0.01 0.00 0.00 56.01 56.02 1u0l n LEU 638 Cb 0.11 0.00 0.27 0.00 -0.11 0.00 0.00 43.42 43.68 1u0l n LEU 638 CO 0.33 0.00 0.51 0.00 -1.51 0.00 0.00 177.39 176.72 1u0l n GLN 639 N -0.52 -3.76 -1.00 3.23 0.00 0.18 -4.92 117.38 110.59 1u0l n GLN 639 Ca 0.00 -1.64 -0.12 0.00 0.00 0.00 0.00 57.00 55.24 1u0l n GLN 639 Cb 0.00 -1.72 0.19 0.00 0.00 0.00 0.00 30.24 28.71 1u0l n GLN 639 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1u0l n ASN 640 N -5.20 3.06 -4.66 2.61 4.05 -1.26 -4.56 115.26 109.30 1u0l n ASN 640 Ca 0.15 -3.74 -0.49 0.00 0.45 0.00 0.00 54.58 50.95 1u0l n ASN 640 Cb 0.59 -0.71 -0.05 0.00 1.23 0.00 0.00 39.78 40.84 1u0l n ASN 640 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1u0l n LEU 641 N -1.12 3.33 -4.97 1.20 7.94 -1.24 -4.96 117.00 117.17 1u0l n LEU 641 Ca 0.44 0.90 -0.21 0.00 -1.11 0.00 0.00 56.01 56.02 1u0l n LEU 641 Cb 1.25 -1.37 -0.02 0.00 0.53 0.00 0.00 43.42 43.82 1u0l n LEU 641 CO 0.35 -0.14 -0.01 -0.54 -1.11 0.00 0.00 177.39 175.94 1u0l s LYS 642 N 4.35 3.43 -0.07 1.96 -0.14 -1.26 -4.82 119.74 123.18 1u0l s LYS 642 Ca 0.95 -0.73 0.02 0.00 -1.36 0.00 0.00 55.97 54.84 1u0l s LYS 642 Cb -0.70 -2.86 0.01 0.00 -1.68 0.00 0.00 37.83 32.60 1u0l s LYS 642 CO 0.51 0.38 -0.12 -1.50 -0.76 0.00 0.00 175.35 173.87 1u0l s ILE 643 N -2.02 1.14 0.17 2.17 2.07 -1.26 -5.04 121.20 118.43 1u0l s ILE 643 Ca 0.35 -0.47 0.08 0.00 -1.41 0.00 0.00 60.65 59.20 1u0l s ILE 643 Cb -0.09 -1.05 -0.04 0.00 0.13 0.00 0.00 42.46 41.41 1u0l s ILE 643 CO 0.30 0.36 -0.16 -0.31 -1.91 0.00 0.00 174.94 173.21 1u0l s TYR 644 N 0.74 1.73 0.51 3.50 1.51 -1.26 -5.09 117.35 118.99 1u0l s TYR 644 Ca -0.13 -0.52 -0.22 0.00 -1.01 0.00 0.00 57.07 55.20 1u0l s TYR 644 Cb -0.16 -0.84 -0.08 0.00 -0.11 0.00 0.00 41.96 40.78 1u0l s TYR 644 CO 0.03 0.32 1.06 0.28 -1.11 0.00 0.00 175.55 176.13 1u0l n VAL 645 N 0.08 3.09 -0.18 0.71 0.31 -1.26 -1.66 118.33 119.42 1u0l n VAL 645 Ca -0.12 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.71 1u0l n VAL 645 Cb 0.58 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 1u0l n VAL 645 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u0l n GLY 646 N 1.13 1.65 3.80 2.92 0.00 0.26 -0.90 105.19 114.05 1u0l n GLY 646 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1u0l n GLY 646 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u0l s ASP 647 N -3.22 5.84 -0.22 1.61 1.01 -0.67 -4.35 116.67 116.67 1u0l s ASP 647 Ca 0.00 1.88 -0.09 0.00 0.71 0.00 0.00 52.55 55.04 1u0l s ASP 647 Cb 0.00 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 1u0l s ASP 647 CO 0.00 -1.13 0.12 -0.13 0.21 0.00 0.00 175.17 174.24 1u0l s ARG 648 N -3.86 4.03 0.34 8.23 3.00 -1.26 -1.91 118.95 127.52 1u0l s ARG 648 Ca 0.65 -0.30 0.01 0.00 0.00 0.00 0.00 55.73 56.10 1u0l s ARG 648 Cb -0.17 -3.43 -0.01 0.00 0.00 0.00 0.00 34.95 31.35 1u0l s ARG 648 CO 0.33 0.13 0.40 0.14 0.00 0.00 0.00 175.30 176.30 1u0l s VAL 649 N 0.83 0.00 -0.06 3.52 -7.23 -0.57 -1.47 120.40 115.43 1u0l s VAL 649 Ca 0.06 -1.74 0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1u0l s VAL 649 Cb -0.13 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.23 1u0l s VAL 649 CO 0.02 0.00 -0.09 -1.83 -0.31 0.00 0.00 175.10 172.90 1u0l s GLU 650 N -3.19 1.32 0.00 4.82 -1.05 -0.74 -0.09 118.70 119.77 1u0l s GLU 650 Ca 0.34 -0.27 0.00 0.00 -0.15 0.00 0.00 54.97 54.89 1u0l s GLU 650 Cb 0.01 -1.17 0.00 0.00 -0.44 0.00 0.00 34.13 32.53 1u0l s GLU 650 CO 0.23 -0.03 0.00 2.48 0.95 0.00 0.00 175.26 178.89 1u0l n TYR 651 N 3.97 0.00 -3.31 4.83 -0.00 -0.68 0.17 117.16 122.14 1u0l n TYR 651 Ca -0.23 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.57 1u0l n TYR 651 Cb 0.51 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.79 1u0l n TYR 651 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1u0l s THR 652 N 1.52 -0.60 -0.72 -3.48 2.01 -1.12 -3.27 115.64 109.98 1u0l s THR 652 Ca 0.00 -0.42 -0.26 0.00 0.31 0.00 0.00 61.69 61.32 1u0l s THR 652 Cb 0.00 -0.84 -0.12 0.00 0.01 0.00 0.00 72.50 71.55 1u0l s THR 652 CO 0.00 -0.33 2.41 -2.84 -0.69 0.00 0.00 174.62 173.17 1u0l s PRO 653 N 2.25 1.72 -1.04 4.92 0.02 -1.26 -3.26 135.00 138.35 1u0l s PRO 653 Ca 0.12 0.71 -0.01 0.00 0.02 0.00 0.00 61.00 61.83 1u0l s PRO 653 Cb -0.12 -4.74 0.30 0.00 0.02 0.00 0.00 34.50 29.96 1u0l s PRO 653 CO -0.23 -4.17 1.90 -0.40 -0.33 0.00 0.00 177.00 173.77 1u0l n ASP 654 N 18.01 7.43 0.00 2.53 5.75 -1.20 -4.68 116.55 144.39 1u0l n ASP 654 Ca 0.44 -3.65 0.00 0.00 -0.01 0.00 0.00 54.79 51.57 1u0l n ASP 654 Cb 0.46 -1.18 0.00 0.00 -1.03 0.00 0.00 41.12 39.37 1u0l n ASP 654 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1u0l n GLU 655 N 0.06 0.00 0.00 0.11 -0.00 -1.25 -0.30 120.64 119.26 1u0l n GLU 655 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.65 1u0l n GLU 655 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.70 1u0l n GLU 655 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1u0l n THR 656 N -2.44 0.00 0.00 3.84 -2.24 -1.26 -3.86 114.28 108.32 1u0l n THR 656 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1u0l n THR 656 Cb 0.00 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 67.49 1u0l n THR 656 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u0l n GLY 657 N -0.72 -1.89 7.00 3.38 0.00 0.58 -5.13 105.19 108.41 1u0l n GLY 657 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 46.02 46.89 1u0l n GLY 657 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u0l n SER 658 N 0.00 0.00 -1.38 1.61 3.41 -1.25 -4.79 113.62 111.22 1u0l n SER 658 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 1u0l n SER 658 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1u0l n SER 658 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u0l n GLY 659 N 0.00 1.78 2.89 5.00 0.00 -0.10 -3.26 105.19 111.49 1u0l n GLY 659 Ca 0.00 -1.06 -0.10 0.00 0.00 0.00 0.00 46.02 44.86 1u0l n GLY 659 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u0l s VAL 660 N -2.81 -0.59 0.23 1.61 1.01 -1.20 -3.59 120.40 115.06 1u0l s VAL 660 Ca 0.03 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 1u0l s VAL 660 Cb -0.01 -0.95 -0.15 0.00 0.00 0.00 0.00 36.38 35.27 1u0l s VAL 660 CO 0.03 -0.28 1.08 -0.38 0.00 0.00 0.00 175.10 175.55 1u0l n ILE 661 N 5.35 1.47 -0.07 2.22 5.41 -1.26 -2.79 119.36 129.69 1u0l n ILE 661 Ca -0.01 -0.37 -0.14 0.00 1.00 0.00 0.00 62.75 63.24 1u0l n ILE 661 Cb 0.49 -0.94 -0.05 0.00 -0.71 0.00 0.00 39.64 38.44 1u0l n ILE 661 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1u0l n GLU 662 N 1.25 0.29 -3.78 0.38 -0.58 0.13 -1.71 120.64 116.61 1u0l n GLU 662 Ca 0.12 0.12 -0.13 0.00 -0.42 0.00 0.00 57.16 56.85 1u0l n GLU 662 Cb 0.29 -1.02 -0.09 0.00 -0.57 0.00 0.00 31.44 30.05 1u0l n GLU 662 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1u0l s ASN 663 N -6.08 -0.17 -0.20 1.62 2.47 -1.03 -4.89 114.94 106.65 1u0l s ASN 663 Ca -0.19 0.10 -0.05 0.00 0.42 0.00 0.00 52.86 53.15 1u0l s ASN 663 Cb 0.07 0.34 -0.02 0.00 -1.45 0.00 0.00 41.25 40.18 1u0l s ASN 663 CO 0.24 -0.39 -0.02 -0.69 -3.72 0.00 0.00 177.10 172.53 1u0l s VAL 664 N -1.14 3.75 0.87 -5.21 1.01 -1.26 -1.79 120.40 116.63 1u0l s VAL 664 Ca -0.12 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 61.36 1u0l s VAL 664 Cb -0.05 -2.69 0.11 0.00 0.00 0.00 0.00 36.38 33.75 1u0l s VAL 664 CO 0.03 0.43 1.11 -0.76 0.00 0.00 0.00 175.10 175.91 1u0l s LEU 665 N 1.13 2.23 0.01 3.92 1.02 -0.54 -4.98 118.68 121.48 1u0l s LEU 665 Ca 0.02 1.18 -0.30 0.00 0.02 0.00 0.00 54.13 55.05 1u0l s LEU 665 Cb -0.14 -3.61 -0.06 0.00 0.02 0.00 0.00 46.19 42.40 1u0l s LEU 665 CO 0.01 -2.39 1.42 -1.00 0.02 0.00 0.00 176.35 174.41 1u0l s HIS 666 N -3.16 2.84 0.05 0.29 3.76 -1.26 -4.74 115.29 113.07 1u0l s HIS 666 Ca 0.63 0.79 -0.30 0.00 -0.15 0.00 0.00 55.06 56.03 1u0l s HIS 666 Cb -0.15 -3.68 -0.05 0.00 1.11 0.00 0.00 32.58 29.81 1u0l s HIS 666 CO 0.54 -2.53 1.07 -0.98 -0.85 0.00 0.00 174.74 172.00 1u0l s ARG 667 N 2.38 4.53 0.28 1.40 1.70 -1.26 -4.96 118.95 123.02 1u0l s ARG 667 Ca 0.64 1.59 0.07 0.00 -0.47 0.00 0.00 55.73 57.56 1u0l s ARG 667 Cb -0.32 -3.39 0.40 0.00 -0.57 0.00 0.00 34.95 31.07 1u0l s ARG 667 CO 0.27 -0.09 1.65 1.57 -1.08 0.00 0.00 175.30 177.62 1u0l h LYS 668 N 6.49 0.18 -2.46 3.89 2.10 -1.96 -3.47 116.57 121.35 1u0l h LYS 668 Ca -0.42 -0.10 0.04 0.00 -2.00 0.00 0.00 60.65 58.17 1u0l h LYS 668 Cb 1.22 0.01 -0.15 0.00 -0.90 0.00 0.00 32.23 32.40 1u0l h LYS 668 CO 0.77 0.64 0.36 0.54 -2.00 0.00 0.00 179.45 179.76 1u0l s ASN 669 N -6.88 -0.48 -0.05 7.07 2.20 -1.26 -4.99 114.94 110.55 1u0l s ASN 669 Ca -0.04 0.12 -0.02 0.00 -0.94 0.00 0.00 52.86 51.98 1u0l s ASN 669 Cb 0.13 0.48 0.03 0.00 -2.00 0.00 0.00 41.25 39.89 1u0l s ASN 669 CO 0.77 -0.73 0.08 -0.22 -2.94 0.00 0.00 177.10 174.07 1u0l s LEU 670 N -2.32 0.14 0.17 3.54 1.98 -1.26 -0.96 118.68 119.98 1u0l s LEU 670 Ca 0.01 0.13 -0.22 0.00 -2.89 0.00 0.00 54.13 51.16 1u0l s LEU 670 Cb -0.01 -0.06 -0.08 0.00 0.66 0.00 0.00 46.19 46.71 1u0l s LEU 670 CO -0.07 -0.24 0.71 -0.76 -1.89 0.00 0.00 176.35 174.09 1u0l s LEU 671 N 2.14 4.47 0.00 -0.68 1.43 0.40 -4.96 118.68 121.48 1u0l s LEU 671 Ca 0.04 1.47 0.00 0.00 -1.03 0.00 0.00 54.13 54.61 1u0l s LEU 671 Cb -0.12 -3.35 0.00 0.00 0.03 0.00 0.00 46.19 42.75 1u0l s LEU 671 CO -0.04 0.14 0.00 0.35 0.23 0.00 0.00 176.35 177.04 1u0l n THR 672 N 1.22 0.00 0.00 5.49 -2.24 -1.26 -3.12 114.28 114.37 1u0l n THR 672 Ca -0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1u0l n THR 672 Cb 0.50 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 1u0l n THR 672 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1u0l n LYS 673 N 0.00 0.00 -2.43 -0.78 3.00 -1.26 -1.07 118.16 115.62 1u0l n LYS 673 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.88 1u0l n LYS 673 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.01 1u0l n LYS 673 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.40 175.26 1u0l s PRO 674 N 0.00 3.59 -0.19 1.64 0.02 -1.26 -4.88 135.00 133.93 1u0l s PRO 674 Ca 0.00 0.77 -0.28 0.00 0.02 0.00 0.00 61.00 61.51 1u0l s PRO 674 Cb 0.00 -4.00 -0.05 0.00 0.02 0.00 0.00 34.50 30.47 1u0l s PRO 674 CO 0.00 -1.55 2.16 -1.01 -0.33 0.00 0.00 177.00 176.28 1u0l s HIS 675 N 5.19 1.21 -0.02 6.54 3.76 -0.23 -4.81 115.29 126.94 1u0l s HIS 675 Ca 0.56 0.40 0.00 0.00 -0.15 0.00 0.00 55.06 55.87 1u0l s HIS 675 Cb -0.11 -3.98 0.03 0.00 1.11 0.00 0.00 32.58 29.62 1u0l s HIS 675 CO 0.32 -4.26 0.03 0.08 -0.85 0.00 0.00 174.74 170.06 1u0l s VAL 676 N 7.68 -0.05 0.25 -0.90 1.01 -1.18 -4.11 120.40 123.09 1u0l s VAL 676 Ca 0.98 0.19 0.09 0.00 0.00 0.00 0.00 61.98 63.24 1u0l s VAL 676 Cb -0.34 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 1u0l s VAL 676 CO 0.36 0.08 -0.01 0.00 0.00 0.00 0.00 175.10 175.52 1u0l s ALA 677 N 0.94 3.14 -1.01 5.51 0.00 -0.08 -0.45 121.76 129.81 1u0l s ALA 677 Ca -0.08 -1.60 -0.02 0.00 0.00 0.00 0.00 51.96 50.26 1u0l s ALA 677 Cb -0.11 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 1u0l s ALA 677 CO -0.03 0.31 0.86 0.09 0.00 0.00 0.00 175.76 176.99 1u0l n ASN 678 N -0.71 -3.68 -4.83 0.00 3.02 -0.13 -4.12 115.26 104.81 1u0l n ASN 678 Ca -0.07 -0.58 -0.37 0.00 -0.03 0.00 0.00 54.58 53.52 1u0l n ASN 678 Cb 0.58 -4.65 -0.06 0.00 -0.61 0.00 0.00 39.78 35.04 1u0l n ASN 678 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1u0l s VAL 679 N -3.33 5.30 -0.25 2.41 1.01 -1.26 -4.86 120.40 119.42 1u0l s VAL 679 Ca 0.16 0.49 -0.16 0.00 0.00 0.00 0.00 61.98 62.48 1u0l s VAL 679 Cb -0.02 -3.56 -0.15 0.00 0.00 0.00 0.00 36.38 32.65 1u0l s VAL 679 CO 0.65 0.55 -0.15 0.47 0.00 0.00 0.00 175.10 176.63 1u0l n ASP 680 N 2.30 1.93 -4.37 3.32 8.00 0.50 -4.89 116.55 123.34 1u0l n ASP 680 Ca -0.16 0.35 -0.19 0.00 0.71 0.00 0.00 54.79 55.50 1u0l n ASP 680 Cb 0.53 -0.86 -0.10 0.00 -0.02 0.00 0.00 41.12 40.67 1u0l n ASP 680 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1u0l s GLN 681 N -2.46 1.41 -0.09 -1.24 -0.21 -1.00 -1.10 119.66 114.97 1u0l s GLN 681 Ca -0.35 -1.69 0.03 0.00 0.02 0.00 0.00 55.36 53.37 1u0l s GLN 681 Cb 0.12 -0.96 0.01 0.00 1.00 0.00 0.00 33.01 33.17 1u0l s GLN 681 CO 0.53 0.03 -0.20 0.08 -2.12 0.00 0.00 175.29 173.62 1u0l s VAL 682 N -3.14 1.73 -0.71 1.09 1.01 0.43 0.03 120.40 120.85 1u0l s VAL 682 Ca 0.27 -0.82 -0.12 0.00 0.00 0.00 0.00 61.98 61.31 1u0l s VAL 682 Cb 0.03 -1.52 0.18 0.00 0.00 0.00 0.00 36.38 35.08 1u0l s VAL 682 CO 0.09 0.49 0.62 -0.63 0.00 0.00 0.00 175.10 175.67 1u0l s ILE 683 N 0.49 5.07 -0.61 2.22 1.01 0.88 -1.97 121.20 128.30 1u0l s ILE 683 Ca -0.17 -2.32 -0.27 0.00 0.00 0.00 0.00 60.65 57.89 1u0l s ILE 683 Cb -0.17 -4.19 0.01 0.00 0.01 0.00 0.00 42.46 38.12 1u0l s ILE 683 CO 0.06 -0.95 1.42 -0.22 0.00 0.00 0.00 174.94 175.25 1u0l s LEU 684 N 0.49 3.33 -0.63 2.97 0.20 -0.69 -1.78 118.68 122.57 1u0l s LEU 684 Ca 0.14 0.10 -0.22 0.00 0.69 0.00 0.00 54.13 54.84 1u0l s LEU 684 Cb -0.17 -2.88 0.07 0.00 -0.43 0.00 0.00 46.19 42.78 1u0l s LEU 684 CO -0.05 -1.81 0.92 -0.69 -0.29 0.00 0.00 176.35 174.43 1u0l s VAL 685 N 6.27 4.41 0.07 1.68 1.01 -0.32 0.00 120.40 133.52 1u0l s VAL 685 Ca 0.49 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 1u0l s VAL 685 Cb -0.10 -4.62 -0.05 0.00 0.00 0.00 0.00 36.38 31.61 1u0l s VAL 685 CO 0.22 -1.33 0.28 -0.69 0.00 0.00 0.00 175.10 173.58 1u0l s VAL 686 N 3.84 5.30 0.04 2.92 1.01 0.46 -4.54 120.40 129.43 1u0l s VAL 686 Ca 0.22 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.16 1u0l s VAL 686 Cb -0.17 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 1u0l s VAL 686 CO 0.11 0.19 -0.11 0.28 0.00 0.00 0.00 175.10 175.57 1u0l s THR 687 N -1.48 0.88 -0.11 3.92 -1.32 -1.26 -1.86 115.64 114.40 1u0l s THR 687 Ca 0.34 -1.00 0.12 0.00 -1.21 0.00 0.00 61.69 59.94 1u0l s THR 687 Cb -0.13 -0.84 -0.18 0.00 -1.51 0.00 0.00 72.50 69.85 1u0l s THR 687 CO 0.23 -0.14 0.10 1.33 -2.21 0.00 0.00 174.62 173.93 1u0l n VAL 688 N 1.76 0.73 0.00 5.08 0.24 -1.26 -0.43 118.33 124.45 1u0l n VAL 688 Ca -0.19 -0.52 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 1u0l n VAL 688 Cb 0.55 -0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.44 1u0l n VAL 688 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1u0l n LYS 689 N -2.39 0.00 0.00 7.34 4.81 -1.26 -4.35 118.16 122.30 1u0l n LYS 689 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.26 1u0l n LYS 689 Cb 0.82 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.87 1u0l n LYS 689 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 1u0l n MET 690 N 0.00 0.00 0.06 1.64 2.81 -1.26 0.13 117.12 120.50 1u0l n MET 690 Ca 0.00 0.07 0.17 0.00 -1.81 0.00 0.00 57.70 56.12 1u0l n MET 690 Cb 0.00 -0.25 0.67 0.00 -0.71 0.00 0.00 33.22 32.93 1u0l n MET 690 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1u0l h PRO 691 N 0.00 0.02 -4.53 0.03 0.11 -1.90 -3.47 132.00 122.26 1u0l h PRO 691 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1u0l h PRO 691 Cb 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1u0l h PRO 691 CO 0.00 0.01 -0.69 -1.91 -0.21 0.00 0.00 178.00 175.20 1u0l n GLU 692 N -4.42 -2.46 -3.53 1.05 0.00 0.34 -4.98 120.64 106.64 1u0l n GLU 692 Ca 0.07 2.12 -0.42 0.00 0.00 0.00 0.00 57.16 58.92 1u0l n GLU 692 Cb 0.47 -4.17 -0.10 0.00 0.00 0.00 0.00 31.44 27.64 1u0l n GLU 692 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1u0l s THR 693 N -1.23 4.82 1.01 6.31 2.01 0.43 -4.99 115.64 124.00 1u0l s THR 693 Ca 0.01 -0.91 -0.12 0.00 0.31 0.00 0.00 61.69 60.98 1u0l s THR 693 Cb -0.00 -3.76 0.20 0.00 0.01 0.00 0.00 72.50 68.95 1u0l s THR 693 CO 0.56 -0.35 1.08 -0.94 -0.69 0.00 0.00 174.62 174.28 1u0l s SER 694 N 1.82 2.32 0.23 3.53 1.04 -1.26 -4.80 113.70 116.58 1u0l s SER 694 Ca 0.03 1.62 0.25 0.00 0.48 0.00 0.00 55.95 58.34 1u0l s SER 694 Cb -0.20 -2.28 0.89 0.00 0.10 0.00 0.00 66.02 64.52 1u0l s SER 694 CO 0.07 -3.38 1.75 0.35 0.98 0.00 0.00 173.24 173.01 1u0l n THR 695 N -4.38 0.69 -0.05 2.02 -2.24 -1.26 -2.70 114.28 106.36 1u0l n THR 695 Ca 0.06 -0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 1u0l n THR 695 Cb 0.54 -0.84 -0.07 0.00 -2.10 0.00 0.00 70.33 67.86 1u0l n THR 695 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1u0l h TYR 696 N 0.00 0.45 -0.28 4.78 3.20 -1.91 -1.44 116.97 121.77 1u0l h TYR 696 Ca 0.00 -0.14 -0.10 0.00 3.14 0.00 0.00 58.73 61.62 1u0l h TYR 696 Cb 0.57 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 1u0l h TYR 696 CO 0.00 0.79 -0.26 0.82 -1.64 0.00 0.00 178.16 177.87 1u0l h ILE 697 N -0.02 1.27 0.21 1.81 5.03 -1.87 -2.43 117.51 121.52 1u0l h ILE 697 Ca 0.02 -1.32 -0.01 0.00 -0.12 0.00 0.00 64.86 63.43 1u0l h ILE 697 Cb 0.73 1.34 -0.00 0.00 -3.03 0.00 0.00 36.82 35.86 1u0l h ILE 697 CO 0.04 0.42 -0.12 0.40 -0.68 0.00 0.00 178.15 178.22 1u0l h ILE 698 N 0.48 0.75 -0.94 -0.67 2.04 -1.45 -2.00 117.51 115.73 1u0l h ILE 698 Ca 0.07 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.99 1u0l h ILE 698 Cb 0.71 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1u0l h ILE 698 CO 0.05 0.00 0.61 0.44 0.00 0.00 0.00 178.15 179.25 1u0l h ASP 699 N -0.31 0.96 -0.50 1.72 3.32 -1.16 0.56 116.42 121.01 1u0l h ASP 699 Ca -0.02 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 1u0l h ASP 699 Cb 0.25 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 1u0l h ASP 699 CO 0.03 0.62 0.10 0.50 -1.72 0.00 0.00 179.24 178.78 1u0l h LYS 700 N 1.09 0.80 -0.59 3.56 3.64 -1.22 0.36 116.57 124.22 1u0l h LYS 700 Ca 0.40 -0.20 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 1u0l h LYS 700 Cb 0.16 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1u0l h LYS 700 CO -0.15 0.79 0.23 0.74 -2.27 0.00 0.00 179.45 178.79 1u0l h PHE 701 N 0.69 0.90 -0.45 1.91 -1.00 -0.76 -1.34 116.94 116.88 1u0l h PHE 701 Ca 0.15 -0.07 -0.02 0.00 2.81 0.00 0.00 57.97 60.85 1u0l h PHE 701 Cb 0.36 -0.27 -0.02 0.00 3.61 0.00 0.00 35.95 39.63 1u0l h PHE 701 CO 0.02 0.73 0.22 -0.07 -1.61 0.00 0.00 178.31 177.60 1u0l h LEU 702 N 0.81 0.59 -0.30 1.54 3.38 -0.45 0.25 115.31 121.15 1u0l h LEU 702 Ca 0.20 -0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.11 1u0l h LEU 702 Cb 0.21 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 1u0l h LEU 702 CO -0.01 0.55 -0.17 0.58 0.09 0.00 0.00 178.44 179.48 1u0l h VAL 703 N 0.59 0.51 0.00 1.22 2.07 0.01 0.92 116.25 121.57 1u0l h VAL 703 Ca 0.16 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.66 1u0l h VAL 703 Cb 0.11 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1u0l h VAL 703 CO -0.02 0.00 -0.09 -0.07 0.02 0.00 0.00 177.57 177.41 1u0l h LEU 704 N -0.13 0.00 0.00 2.57 3.38 -0.88 -0.23 115.31 120.03 1u0l h LEU 704 Ca 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1u0l h LEU 704 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1u0l h LEU 704 CO -0.38 0.09 -0.00 0.00 0.09 0.00 0.00 178.44 178.24 1u0l h ALA 705 N 1.91 -0.00 -0.28 1.53 0.00 0.12 -3.01 119.26 119.54 1u0l h ALA 705 Ca -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1u0l h ALA 705 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1u0l h ALA 705 CO 0.01 -0.20 0.07 0.93 0.00 0.00 0.00 179.25 180.06 1u0l h GLU 706 N -0.61 0.44 -0.99 0.00 3.07 -0.60 -1.14 114.58 114.76 1u0l h GLU 706 Ca -0.00 -0.11 0.15 0.00 -0.50 0.00 0.00 59.36 58.91 1u0l h GLU 706 Cb 0.60 -0.06 -0.09 0.00 -0.84 0.00 0.00 28.75 28.36 1u0l h GLU 706 CO 0.00 0.53 0.62 -0.22 -1.40 0.00 0.00 179.01 178.54 1u0l h LYS 707 N 0.28 0.83 -0.72 2.33 3.64 -1.12 0.38 116.57 122.19 1u0l h LYS 707 Ca 0.09 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1u0l h LYS 707 Cb 0.28 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1u0l h LYS 707 CO 0.00 0.55 0.00 0.09 -2.27 0.00 0.00 179.45 177.82 1u0l n ASN 708 N -4.66 3.42 -3.61 4.20 3.02 -1.11 -4.93 115.26 111.58 1u0l n ASN 708 Ca 0.21 -2.44 -0.19 0.00 -0.03 0.00 0.00 54.58 52.12 1u0l n ASN 708 Cb 0.46 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1u0l n ASN 708 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1u0l n GLU 709 N 0.40 -1.43 -4.27 3.52 1.02 0.13 -4.90 120.64 115.10 1u0l n GLU 709 Ca 0.15 0.91 -0.20 0.00 -0.02 0.00 0.00 57.16 58.00 1u0l n GLU 709 Cb 0.72 -3.25 -0.13 0.00 -0.02 0.00 0.00 31.44 28.76 1u0l n GLU 709 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1u0l s LEU 710 N -4.86 2.25 0.26 -4.62 1.43 -0.45 -4.97 118.68 107.72 1u0l s LEU 710 Ca 0.03 -0.58 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 1u0l s LEU 710 Cb -0.02 -0.65 -0.09 0.00 0.03 0.00 0.00 46.19 45.47 1u0l s LEU 710 CO 0.86 -0.00 0.94 -1.61 0.23 0.00 0.00 176.35 176.77 1u0l s GLU 711 N -1.58 4.78 -0.08 1.70 0.41 -0.25 -4.54 118.70 119.13 1u0l s GLU 711 Ca 0.01 1.45 0.01 0.00 -0.41 0.00 0.00 54.97 56.04 1u0l s GLU 711 Cb -0.09 -3.15 0.02 0.00 -1.78 0.00 0.00 34.13 29.13 1u0l s GLU 711 CO 0.02 0.45 -0.11 0.99 -0.49 0.00 0.00 175.26 176.12 1u0l s THR 712 N -1.30 1.13 -0.30 3.63 2.01 -1.26 -0.42 115.64 119.13 1u0l s THR 712 Ca 0.44 -0.44 -0.07 0.00 0.31 0.00 0.00 61.69 61.93 1u0l s THR 712 Cb -0.24 -1.07 0.01 0.00 0.01 0.00 0.00 72.50 71.21 1u0l s THR 712 CO 0.30 0.36 0.08 -0.69 -0.69 0.00 0.00 174.62 173.98 1u0l s VAL 713 N 0.98 3.96 0.05 3.82 1.01 -0.83 -3.82 120.40 125.58 1u0l s VAL 713 Ca -0.08 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 60.92 1u0l s VAL 713 Cb -0.15 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.14 1u0l s VAL 713 CO -0.00 0.08 0.86 -0.32 0.00 0.00 0.00 175.10 175.71 1u0l s MET 714 N 1.50 4.57 -0.27 2.72 1.75 0.16 -1.71 119.30 128.02 1u0l s MET 714 Ca 0.02 1.23 0.01 0.00 -1.25 0.00 0.00 55.69 55.71 1u0l s MET 714 Cb -0.17 -3.39 0.07 0.00 2.84 0.00 0.00 34.83 34.18 1u0l s MET 714 CO 0.02 0.20 -0.01 0.08 -0.65 0.00 0.00 175.02 174.66 1u0l s VAL 715 N 0.18 1.54 -0.64 10.11 1.01 0.10 -1.08 120.40 131.61 1u0l s VAL 715 Ca 0.43 -1.44 -0.25 0.00 0.00 0.00 0.00 61.98 60.73 1u0l s VAL 715 Cb -0.21 -1.92 0.05 0.00 0.00 0.00 0.00 36.38 34.30 1u0l s VAL 715 CO 0.26 -0.29 1.05 -0.63 0.00 0.00 0.00 175.10 175.49 1u0l s ILE 716 N 1.35 4.17 0.63 2.22 1.01 -0.99 -0.40 121.20 129.19 1u0l s ILE 716 Ca -0.00 0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.79 1u0l s ILE 716 Cb -0.19 -4.70 0.10 0.00 0.01 0.00 0.00 42.46 37.68 1u0l s ILE 716 CO -0.10 -1.45 0.88 0.21 0.00 0.00 0.00 174.94 174.48 1u0l s ASN 717 N 3.40 4.78 -1.44 3.58 3.04 -0.78 -1.27 114.94 126.24 1u0l s ASN 717 Ca 0.29 -0.51 0.00 0.00 0.04 0.00 0.00 52.86 52.68 1u0l s ASN 717 Cb -0.13 -0.01 0.00 0.00 -1.54 0.00 0.00 41.25 39.57 1u0l s ASN 717 CO 0.15 -1.55 0.00 0.29 -3.04 0.00 0.00 177.10 172.96 1u0l n LYS 718 N -2.52 -1.26 -0.14 0.43 5.02 -1.00 -4.72 118.16 113.97 1u0l n LYS 718 Ca 0.14 0.83 0.25 0.00 -2.02 0.00 0.00 58.31 57.52 1u0l n LYS 718 Cb 0.61 -5.20 0.69 0.00 -0.02 0.00 0.00 35.03 31.11 1u0l n LYS 718 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1u0l h MET 719 N 0.00 0.05 0.00 1.97 2.86 -1.45 -0.92 114.93 117.43 1u0l h MET 719 Ca -0.37 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 1u0l h MET 719 Cb 1.24 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.89 1u0l h MET 719 CO 0.46 0.03 0.00 -0.40 1.06 0.00 0.00 176.91 178.06 1u0l n ASP 720 N -4.32 0.00 -0.75 1.22 5.75 -1.26 -1.96 116.55 115.22 1u0l n ASP 720 Ca 0.16 0.47 0.11 0.00 -0.01 0.00 0.00 54.79 55.52 1u0l n ASP 720 Cb 0.84 -0.48 0.06 0.00 -1.03 0.00 0.00 41.12 40.51 1u0l n ASP 720 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1u0l n LEU 721 N -1.48 2.54 -4.82 -2.12 4.32 -0.35 -4.98 117.00 110.11 1u0l n LEU 721 Ca 0.03 -0.93 -0.37 0.00 -0.02 0.00 0.00 56.01 54.71 1u0l n LEU 721 Cb 0.11 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.85 1u0l n LEU 721 CO 0.09 0.44 0.33 -0.31 -1.22 0.00 0.00 177.39 176.72 1u0l s TYR 722 N -1.93 3.71 0.27 -1.77 2.02 -0.83 -5.04 117.35 113.79 1u0l s TYR 722 Ca 0.23 1.28 0.01 0.00 -0.37 0.00 0.00 57.07 58.22 1u0l s TYR 722 Cb 0.17 -2.52 0.01 0.00 -0.40 0.00 0.00 41.96 39.22 1u0l s TYR 722 CO 0.34 0.46 0.07 -0.40 -1.57 0.00 0.00 175.55 174.45 1u0l n ASP 723 N 1.15 2.45 -0.27 2.29 3.85 -1.26 -4.88 116.55 119.88 1u0l n ASP 723 Ca -0.06 -2.10 0.06 0.00 -0.71 0.00 0.00 54.79 51.98 1u0l n ASP 723 Cb 0.51 0.11 0.18 0.00 -1.35 0.00 0.00 41.12 40.57 1u0l n ASP 723 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1u0l h GLU 724 N 0.00 0.10 0.70 0.11 4.39 -1.98 0.18 114.58 118.08 1u0l h GLU 724 Ca -0.21 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.45 1u0l h GLU 724 Cb 0.67 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1u0l h GLU 724 CO 0.34 0.07 -0.35 -0.44 -1.16 0.00 0.00 179.01 177.46 1u0l h ASP 725 N 0.10 -0.85 -0.90 1.42 3.32 -1.99 -0.68 116.42 116.83 1u0l h ASP 725 Ca 0.44 0.03 0.20 0.00 0.02 0.00 0.00 57.03 57.72 1u0l h ASP 725 Cb 0.79 0.23 -0.11 0.00 0.22 0.00 0.00 39.33 40.45 1u0l h ASP 725 CO -0.69 -0.59 0.45 0.44 -1.72 0.00 0.00 179.24 177.14 1u0l h ASP 726 N -0.96 0.48 -0.38 6.45 3.32 -1.79 0.58 116.42 124.11 1u0l h ASP 726 Ca -0.10 0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1u0l h ASP 726 Cb 0.74 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 1u0l h ASP 726 CO 0.14 0.11 0.20 -0.07 -1.72 0.00 0.00 179.24 177.90 1u0l h LEU 727 N 0.53 0.51 -0.03 1.55 3.38 -0.45 0.46 115.31 121.25 1u0l h LEU 727 Ca 0.54 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.47 1u0l h LEU 727 Cb 0.94 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1u0l h LEU 727 CO -0.45 0.44 0.02 -0.09 0.09 0.00 0.00 178.44 178.44 1u0l h ARG 728 N 0.57 0.04 -0.26 1.13 2.43 0.17 -0.85 114.38 117.61 1u0l h ARG 728 Ca 0.15 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1u0l h ARG 728 Cb 0.06 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1u0l h ARG 728 CO -0.02 0.08 0.14 0.87 -1.51 0.00 0.00 179.97 179.53 1u0l h LYS 729 N -0.01 0.28 -0.81 0.20 1.57 -0.22 -1.23 116.57 116.35 1u0l h LYS 729 Ca 0.01 -0.02 0.19 0.00 -1.87 0.00 0.00 60.65 58.96 1u0l h LYS 729 Cb 0.05 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.25 1u0l h LYS 729 CO -0.00 0.18 0.55 0.28 -0.57 0.00 0.00 179.45 179.89 1u0l h VAL 730 N 0.29 0.70 -0.25 0.50 2.07 0.22 0.19 116.25 119.97 1u0l h VAL 730 Ca 0.11 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.40 1u0l h VAL 730 Cb 0.02 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1u0l h VAL 730 CO -0.07 0.06 -0.31 0.03 0.02 0.00 0.00 177.57 177.30 1u0l h ARG 731 N 0.30 0.66 -0.68 1.57 3.08 -0.02 -2.83 114.38 116.46 1u0l h ARG 731 Ca 0.41 -0.37 0.09 0.00 0.07 0.00 0.00 59.98 60.18 1u0l h ARG 731 Cb 1.12 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 31.13 1u0l h ARG 731 CO -0.11 0.98 0.32 0.93 -1.07 0.00 0.00 179.97 181.02 1u0l h GLU 732 N 0.38 0.53 -0.58 0.04 5.08 0.17 0.16 114.58 120.35 1u0l h GLU 732 Ca 0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1u0l h GLU 732 Cb 0.88 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 1u0l h GLU 732 CO 0.07 0.35 0.32 -0.07 -1.00 0.00 0.00 179.01 178.69 1u0l h LEU 733 N 0.55 0.73 -0.28 1.33 3.38 -1.26 0.36 115.31 120.12 1u0l h LEU 733 Ca 0.34 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 1u0l h LEU 733 Cb 0.37 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1u0l h LEU 733 CO -0.28 0.61 0.13 -0.33 0.09 0.00 0.00 178.44 178.66 1u0l h GLU 734 N 0.79 0.42 -0.97 1.13 5.08 -1.07 0.34 114.58 120.29 1u0l h GLU 734 Ca 0.21 -0.07 0.13 0.00 -1.00 0.00 0.00 59.36 58.63 1u0l h GLU 734 Cb 0.04 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.13 1u0l h GLU 734 CO -0.03 0.42 0.62 1.49 -1.00 0.00 0.00 179.01 180.50 1u0l h GLU 735 N 0.32 0.88 0.01 2.33 4.57 -0.24 1.43 114.58 123.87 1u0l h GLU 735 Ca 0.10 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1u0l h GLU 735 Cb 0.14 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 1u0l h GLU 735 CO -0.01 0.58 -0.00 0.82 -1.18 0.00 0.00 179.01 179.22 1u0l h ILE 736 N 0.90 1.21 0.00 2.32 2.04 -0.48 -3.41 117.51 120.10 1u0l h ILE 736 Ca 0.49 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1u0l h ILE 736 Cb 0.57 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.93 1u0l h ILE 736 CO -0.26 0.41 -1.18 -1.22 0.00 0.00 0.00 178.15 175.90 1u0l n TYR 737 N -4.68 0.40 -0.35 1.37 4.02 0.12 -4.60 117.16 113.44 1u0l n TYR 737 Ca -0.07 0.12 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1u0l n TYR 737 Cb 0.32 -0.58 0.06 0.00 -0.02 0.00 0.00 39.34 39.12 1u0l n TYR 737 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1u0l n SER 738 N -2.19 -0.55 -0.40 7.72 2.88 0.49 0.07 113.62 121.64 1u0l n SER 738 Ca 0.00 1.61 0.09 0.00 -1.33 0.00 0.00 58.87 59.24 1u0l n SER 738 Cb 0.49 -0.39 0.35 0.00 -0.75 0.00 0.00 64.21 63.90 1u0l n SER 738 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1u0l n GLY 739 N -1.47 -0.05 0.08 0.46 0.00 -1.26 -4.03 105.19 98.92 1u0l n GLY 739 Ca 0.11 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 1u0l n GLY 739 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u0l n LEU 740 N 0.04 2.36 -3.84 0.99 4.77 0.11 -5.06 117.00 116.37 1u0l n LEU 740 Ca 0.14 -0.07 -0.10 0.00 -0.03 0.00 0.00 56.01 55.94 1u0l n LEU 740 Cb 0.24 -0.39 -0.08 0.00 -2.33 0.00 0.00 43.42 40.85 1u0l n LEU 740 CO 0.11 0.68 -0.09 -0.31 -1.33 0.00 0.00 177.39 176.45 1u0l s TYR 741 N -2.33 0.06 0.25 -1.77 2.02 -0.38 -5.06 117.35 110.15 1u0l s TYR 741 Ca -0.19 -0.30 -0.30 0.00 -0.37 0.00 0.00 57.07 55.91 1u0l s TYR 741 Cb 0.05 -0.03 -0.10 0.00 -0.40 0.00 0.00 41.96 41.49 1u0l s TYR 741 CO 0.41 -0.45 1.36 -2.14 -1.57 0.00 0.00 175.55 173.17 1u0l s PRO 742 N -2.72 4.34 0.07 -1.71 0.02 -1.25 -4.52 135.00 129.22 1u0l s PRO 742 Ca -0.04 2.19 0.07 0.00 0.02 0.00 0.00 61.00 63.25 1u0l s PRO 742 Cb -0.00 -3.13 -0.03 0.00 0.02 0.00 0.00 34.50 31.36 1u0l s PRO 742 CO -0.05 -0.30 -0.20 0.42 -0.33 0.00 0.00 177.00 176.54 1u0l s ILE 743 N -0.26 1.64 -0.11 2.83 1.01 -1.26 0.37 121.20 125.42 1u0l s ILE 743 Ca 0.56 -1.34 -0.04 0.00 0.00 0.00 0.00 60.65 59.83 1u0l s ILE 743 Cb -0.39 -1.46 0.06 0.00 0.01 0.00 0.00 42.46 40.67 1u0l s ILE 743 CO 0.44 0.07 0.17 0.68 0.00 0.00 0.00 174.94 176.29 1u0l s VAL 744 N -0.97 -0.27 0.35 2.92 -7.23 -0.24 -4.96 120.40 110.01 1u0l s VAL 744 Ca 0.06 0.25 -0.25 0.00 -1.81 0.00 0.00 61.98 60.22 1u0l s VAL 744 Cb -0.09 -0.38 -0.09 0.00 0.56 0.00 0.00 36.38 36.37 1u0l s VAL 744 CO 0.03 0.06 1.01 -0.54 -0.31 0.00 0.00 175.10 175.35 1u0l s LYS 745 N 2.29 4.39 0.34 4.82 1.02 -1.26 -2.34 119.74 129.01 1u0l s LYS 745 Ca 0.04 1.47 -0.12 0.00 0.02 0.00 0.00 55.97 57.38 1u0l s LYS 745 Cb -0.13 -2.72 0.03 0.00 -0.52 0.00 0.00 37.83 34.49 1u0l s LYS 745 CO -0.07 0.07 0.64 0.95 -0.92 0.00 0.00 175.35 176.02 1u0l s THR 746 N -1.59 0.00 -0.30 2.17 -4.23 -0.40 -3.67 115.64 107.62 1u0l s THR 746 Ca 0.53 -1.25 0.00 0.00 -1.18 0.00 0.00 61.69 59.80 1u0l s THR 746 Cb -0.22 -2.62 0.19 0.00 1.34 0.00 0.00 72.50 71.19 1u0l s THR 746 CO 0.27 0.00 0.62 -0.55 -0.54 0.00 0.00 174.62 174.43 1u0l s SER 747 N -3.10 -1.40 0.20 3.99 0.15 -0.66 -1.34 113.70 111.53 1u0l s SER 747 Ca 0.21 0.65 0.14 0.00 0.70 0.00 0.00 55.95 57.65 1u0l s SER 747 Cb -0.03 2.08 0.74 0.00 -1.71 0.00 0.00 66.02 67.10 1u0l s SER 747 CO 0.14 -0.26 1.43 0.00 1.20 0.00 0.00 173.24 175.74 1u0l n ALA 748 N 5.42 1.08 -0.03 5.45 0.00 -1.26 -0.11 120.51 131.06 1u0l n ALA 748 Ca 0.01 0.12 -0.02 0.00 0.00 0.00 0.00 53.44 53.54 1u0l n ALA 748 Cb 0.52 -1.21 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 1u0l n ALA 748 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1u0l n LYS 749 N -1.97 0.19 -0.29 0.00 4.76 -1.26 -4.53 118.16 115.06 1u0l n LYS 749 Ca -0.01 0.34 0.04 0.00 -2.87 0.00 0.00 58.31 55.82 1u0l n LYS 749 Cb 0.04 -1.12 0.18 0.00 -1.84 0.00 0.00 35.03 32.29 1u0l n LYS 749 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1u0l h THR 750 N -0.41 0.84 0.00 -0.18 2.02 -1.95 -3.46 112.91 109.77 1u0l h THR 750 Ca 0.00 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1u0l h THR 750 Cb 0.22 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1u0l h THR 750 CO 0.00 0.13 0.00 0.61 0.37 0.00 0.00 175.52 176.63 1u0l n GLY 751 N -1.32 1.46 3.63 2.16 0.00 0.84 -5.05 105.19 106.91 1u0l n GLY 751 Ca 0.14 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.69 1u0l n GLY 751 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1u0l n MET 752 N -0.75 1.65 0.00 1.61 0.00 -1.22 -2.31 117.12 116.10 1u0l n MET 752 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 57.70 58.29 1u0l n MET 752 Cb 0.00 -2.22 0.00 0.00 0.00 0.00 0.00 33.22 31.00 1u0l n MET 752 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1u0l n GLY 753 N 2.41 2.36 0.25 -5.12 0.00 -1.24 -1.65 105.19 102.19 1u0l n GLY 753 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1u0l n GLY 753 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1u0l h ILE 754 N 0.00 0.36 0.03 -0.61 5.03 -1.75 0.58 117.51 121.15 1u0l h ILE 754 Ca 0.00 -0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.73 1u0l h ILE 754 Cb 0.00 0.35 0.00 0.00 -3.03 0.00 0.00 36.82 34.14 1u0l h ILE 754 CO 0.00 0.00 -0.02 -0.08 -0.68 0.00 0.00 178.15 177.38 1u0l h GLU 755 N 0.01 -0.04 -0.68 2.37 4.57 -1.88 -1.19 114.58 117.73 1u0l h GLU 755 Ca 0.31 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.56 1u0l h GLU 755 Cb 0.49 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.04 1u0l h GLU 755 CO -0.66 0.12 0.45 1.49 -1.18 0.00 0.00 179.01 179.23 1u0l h GLU 756 N -0.20 0.68 -0.28 1.92 4.81 -1.68 -1.30 114.58 118.53 1u0l h GLU 756 Ca -0.00 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.09 1u0l h GLU 756 Cb 0.18 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1u0l h GLU 756 CO 0.01 0.45 -0.24 1.25 -0.73 0.00 0.00 179.01 179.75 1u0l h LEU 757 N 0.70 0.54 -2.47 1.64 5.85 0.63 -2.54 115.31 119.66 1u0l h LEU 757 Ca 0.29 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1u0l h LEU 757 Cb 0.26 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 1u0l h LEU 757 CO -0.09 0.77 0.03 0.11 -0.34 0.00 0.00 178.44 178.92 1u0l h LYS 758 N 0.47 0.00 0.00 1.25 1.57 -0.01 -2.13 116.57 117.73 1u0l h LYS 758 Ca 0.07 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1u0l h LYS 758 Cb 0.67 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1u0l h LYS 758 CO 0.05 0.00 -0.20 0.93 -0.57 0.00 0.00 179.45 179.66 1u0l h GLU 759 N 0.00 0.00 0.00 3.15 3.07 -1.43 -2.44 114.58 116.93 1u0l h GLU 759 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1u0l h GLU 759 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1u0l h GLU 759 CO -0.00 0.20 -0.76 0.66 -1.40 0.00 0.00 179.01 177.70 1u0l n TYR 760 N -3.60 0.10 0.02 4.33 4.02 -0.80 -4.15 117.16 117.07 1u0l n TYR 760 Ca -0.01 0.03 -0.05 0.00 -0.01 0.00 0.00 57.90 57.86 1u0l n TYR 760 Cb 0.33 -0.27 -0.10 0.00 -0.02 0.00 0.00 39.34 39.28 1u0l n TYR 760 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1u0l h LEU 761 N 0.00 0.00 -9.59 7.72 3.38 -1.42 -3.45 115.31 111.94 1u0l h LEU 761 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1u0l h LEU 761 Cb 0.58 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.40 1u0l h LEU 761 CO 0.00 0.81 0.72 0.29 0.09 0.00 0.00 178.44 180.36 1u0l n LYS 762 N -3.05 2.19 -1.28 1.13 5.02 -1.05 -2.80 118.16 118.32 1u0l n LYS 762 Ca -0.10 0.78 -0.12 0.00 -2.02 0.00 0.00 58.31 56.85 1u0l n LYS 762 Cb 0.94 -2.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.40 1u0l n LYS 762 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u0l n GLY 763 N 2.63 1.10 3.40 0.72 0.00 0.86 -4.90 105.19 109.00 1u0l n GLY 763 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 1u0l n GLY 763 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u0l s LYS 764 N -2.87 1.48 -0.40 1.61 1.02 -1.12 -4.82 119.74 114.64 1u0l s LYS 764 Ca 0.00 -1.76 -0.06 0.00 0.02 0.00 0.00 55.97 54.17 1u0l s LYS 764 Cb 0.00 -0.94 0.08 0.00 -0.52 0.00 0.00 37.83 36.45 1u0l s LYS 764 CO 0.00 -0.03 0.20 0.42 -0.92 0.00 0.00 175.35 175.02 1u0l s ILE 765 N -3.18 3.76 0.32 2.17 1.01 -1.26 0.64 121.20 124.66 1u0l s ILE 765 Ca 0.30 -1.59 0.07 0.00 0.00 0.00 0.00 60.65 59.43 1u0l s ILE 765 Cb 0.05 -3.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 1u0l s ILE 765 CO 0.11 -0.50 0.31 -0.44 0.00 0.00 0.00 174.94 174.42 1u0l s SER 766 N 1.90 5.49 -0.03 3.58 0.01 0.18 -0.37 113.70 124.46 1u0l s SER 766 Ca 0.03 -0.38 0.03 0.00 1.31 0.00 0.00 55.95 56.94 1u0l s SER 766 Cb -0.22 -1.13 0.00 0.00 0.21 0.00 0.00 66.02 64.88 1u0l s SER 766 CO -0.00 -0.30 -0.11 0.28 0.41 0.00 0.00 173.24 173.52 1u0l s THR 767 N -2.24 0.95 0.09 1.44 -1.32 0.10 -2.32 115.64 112.36 1u0l s THR 767 Ca 0.40 -0.45 -0.13 0.00 -1.21 0.00 0.00 61.69 60.30 1u0l s THR 767 Cb -0.07 -0.84 -0.06 0.00 -1.51 0.00 0.00 72.50 70.02 1u0l s THR 767 CO 0.27 0.29 0.48 -0.04 -2.21 0.00 0.00 174.62 173.41 1u0l s MET 768 N 0.20 3.91 0.11 7.08 -1.94 -1.26 -0.08 119.30 127.31 1u0l s MET 768 Ca -0.04 0.39 -0.03 0.00 -1.71 0.00 0.00 55.69 54.29 1u0l s MET 768 Cb -0.10 -3.02 -0.03 0.00 2.01 0.00 0.00 34.83 33.69 1u0l s MET 768 CO 0.01 0.55 0.09 0.00 -0.01 0.00 0.00 175.02 175.67 1u0l s ALA 769 N -1.35 0.50 0.00 3.03 0.00 -0.73 0.27 121.76 123.48 1u0l s ALA 769 Ca 0.33 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1u0l s ALA 769 Cb -0.15 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.66 1u0l s ALA 769 CO 0.18 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.85 1u0l n GLY 770 N -0.07 4.04 3.37 0.00 0.00 -1.26 -1.17 105.19 110.10 1u0l n GLY 770 Ca -0.09 -1.46 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 1u0l n GLY 770 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u0l n LEU 771 N 0.00 -1.42 -4.72 0.99 4.77 -1.26 -4.87 117.00 110.49 1u0l n LEU 771 Ca 0.00 0.84 -0.33 0.00 -0.03 0.00 0.00 56.01 56.48 1u0l n LEU 771 Cb 0.00 -1.00 0.11 0.00 -2.33 0.00 0.00 43.42 40.20 1u0l n LEU 771 CO 0.00 -3.59 0.76 -0.94 -1.33 0.00 0.00 177.39 172.29 1u0l s SER 772 N -1.00 3.96 0.00 -1.43 1.04 -1.26 -2.83 113.70 112.19 1u0l s SER 772 Ca 0.62 2.26 0.00 0.00 0.48 0.00 0.00 55.95 59.31 1u0l s SER 772 Cb -0.60 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 62.94 1u0l s SER 772 CO 0.60 -2.41 0.00 0.61 0.98 0.00 0.00 173.24 173.02 1u0l n GLY 773 N 0.18 0.26 0.03 7.32 0.00 -1.26 -4.83 105.19 106.89 1u0l n GLY 773 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1u0l n GLY 773 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1u0l n VAL 774 N -2.47 0.15 0.00 1.61 3.14 -1.13 -4.61 118.33 115.03 1u0l n VAL 774 Ca 0.00 -0.08 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 1u0l n VAL 774 Cb 0.24 -0.28 0.00 0.00 -1.06 0.00 0.00 33.84 32.74 1u0l n VAL 774 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u0l n GLY 775 N 1.45 1.03 0.35 7.55 0.00 -1.26 -4.81 105.19 109.49 1u0l n GLY 775 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.11 1u0l n GLY 775 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u0l n LYS 776 N -0.61 -0.14 0.04 1.61 5.02 -1.26 -0.02 118.16 122.81 1u0l n LYS 776 Ca 0.00 1.46 -0.07 0.00 -2.02 0.00 0.00 58.31 57.68 1u0l n LYS 776 Cb 0.00 -2.17 0.10 0.00 -0.02 0.00 0.00 35.03 32.94 1u0l n LYS 776 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1u0l h SER 777 N 0.00 0.46 -0.17 4.39 0.87 -1.97 -2.92 113.55 114.20 1u0l h SER 777 Ca 0.40 -0.24 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 1u0l h SER 777 Cb 0.64 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1u0l h SER 777 CO -0.95 0.91 -0.14 0.28 -0.53 0.00 0.00 176.83 176.40 1u0l h SER 778 N 0.32 0.42 -0.50 6.23 0.02 -1.04 -2.54 113.55 116.45 1u0l h SER 778 Ca 0.01 -0.46 0.11 0.00 -0.84 0.00 0.00 61.79 60.61 1u0l h SER 778 Cb 1.05 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.45 1u0l h SER 778 CO 0.09 0.78 0.34 -0.07 -1.14 0.00 0.00 176.83 176.84 1u0l h LEU 779 N 0.05 0.18 0.11 5.07 3.38 -0.43 -1.10 115.31 122.57 1u0l h LEU 779 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1u0l h LEU 779 Cb 0.65 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1u0l h LEU 779 CO 0.04 0.11 -0.05 0.25 0.09 0.00 0.00 178.44 178.87 1u0l h LEU 780 N 0.20 -0.12 -2.22 1.67 5.85 -1.30 -2.67 115.31 116.71 1u0l h LEU 780 Ca 0.23 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1u0l h LEU 780 Cb 0.66 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.72 1u0l h LEU 780 CO -0.04 0.35 0.00 -1.13 -0.34 0.00 0.00 178.44 177.28 1u0l h ASN 781 N -0.63 0.00 1.58 1.25 -0.73 -0.95 0.26 115.58 116.36 1u0l h ASN 781 Ca -0.01 0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.12 1u0l h ASN 781 Cb 0.50 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.08 1u0l h ASN 781 CO 0.02 0.00 -0.43 0.00 -0.37 0.00 0.00 177.43 176.66 1u0l h ALA 782 N 2.02 0.80 0.06 1.57 0.00 -1.09 -3.07 119.26 119.54 1u0l h ALA 782 Ca 0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 54.91 54.42 1u0l h ALA 782 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1u0l h ALA 782 CO 0.00 0.21 -1.85 -0.89 0.00 0.00 0.00 179.25 176.72 1u0l n ILE 783 N -3.02 1.69 -3.37 0.00 5.41 0.71 -4.78 119.36 116.00 1u0l n ILE 783 Ca 0.02 -0.73 -0.16 0.00 1.00 0.00 0.00 62.75 62.88 1u0l n ILE 783 Cb 0.60 -1.37 -0.08 0.00 -0.71 0.00 0.00 39.64 38.09 1u0l n ILE 783 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1u0l s ASN 784 N -6.54 1.24 0.16 4.38 0.02 -0.09 -5.00 114.94 109.12 1u0l s ASN 784 Ca -0.13 -1.18 -0.33 0.00 -1.02 0.00 0.00 52.86 50.20 1u0l s ASN 784 Cb 0.07 0.61 -0.16 0.00 0.02 0.00 0.00 41.25 41.79 1u0l s ASN 784 CO 0.80 -0.31 1.13 -2.65 0.02 0.00 0.00 177.10 176.08 1u0l n PRO 785 N 4.72 1.03 0.00 -0.60 -0.02 -1.16 -1.19 135.00 137.78 1u0l n PRO 785 Ca 0.06 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1u0l n PRO 785 Cb 0.46 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1u0l n PRO 785 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u0l n GLY 786 N 1.98 2.99 3.75 -1.23 0.00 -1.26 -5.05 105.19 106.36 1u0l n GLY 786 Ca 0.15 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1u0l n GLY 786 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u0l n LEU 787 N 0.00 4.31 -3.54 0.99 4.77 -0.33 -5.01 117.00 118.19 1u0l n LEU 787 Ca 0.00 1.21 -0.17 0.00 -0.03 0.00 0.00 56.01 57.02 1u0l n LEU 787 Cb 0.00 -1.57 -0.06 0.00 -2.33 0.00 0.00 43.42 39.46 1u0l n LEU 787 CO 0.00 -0.06 0.41 -1.59 -1.33 0.00 0.00 177.39 174.81 1u0l s LYS 788 N -1.84 1.04 0.71 3.23 -2.85 -1.26 -3.46 119.74 115.30 1u0l s LYS 788 Ca 0.55 0.20 -0.07 0.00 -1.00 0.00 0.00 55.97 55.65 1u0l s LYS 788 Cb -0.51 0.49 0.06 0.00 -2.06 0.00 0.00 37.83 35.80 1u0l s LYS 788 CO 0.62 -0.33 1.02 -0.51 0.10 0.00 0.00 175.35 176.25 1u0l s LEU 789 N -1.25 2.82 0.00 2.77 1.43 -1.26 -5.00 118.68 118.18 1u0l s LEU 789 Ca -0.11 0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 1u0l s LEU 789 Cb -0.00 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 43.06 1u0l s LEU 789 CO 0.09 -1.59 0.00 0.54 0.23 0.00 0.00 176.35 175.62 1u0l n ARG 790 N -2.93 1.84 0.00 1.70 5.12 -0.81 -5.04 116.66 116.53 1u0l n ARG 790 Ca 0.08 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.00 1u0l n ARG 790 Cb 0.60 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.90 1u0l n ARG 790 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1u0l n THR 804 N 0.00 0.00 -2.83 0.55 -1.04 -1.26 -5.09 114.28 104.62 1u0l n THR 804 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.86 1u0l n THR 804 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1u0l n THR 804 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1u0l n THR 805 N 0.00 0.95 0.98 12.58 -2.24 -1.26 -4.86 114.28 120.43 1u0l n THR 805 Ca 0.00 -3.96 0.00 0.00 -2.27 0.00 0.00 64.05 57.82 1u0l n THR 805 Cb 0.00 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1u0l n THR 805 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1u0l n THR 806 N -0.02 0.78 -4.10 4.28 -2.24 -1.26 -4.80 114.28 106.93 1u0l n THR 806 Ca 0.19 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.66 1u0l n THR 806 Cb 0.72 -0.89 -0.07 0.00 -2.10 0.00 0.00 70.33 67.99 1u0l n THR 806 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1u0l s THR 807 N -0.19 4.43 0.51 4.28 -4.23 -1.26 -4.95 115.64 114.24 1u0l s THR 807 Ca 0.00 -0.73 -0.09 0.00 -1.18 0.00 0.00 61.69 59.69 1u0l s THR 807 Cb 0.00 -3.09 -0.05 0.00 1.34 0.00 0.00 72.50 70.70 1u0l s THR 807 CO 0.00 0.19 0.88 0.00 -0.54 0.00 0.00 174.62 175.15 1u0l s ALA 808 N -1.31 3.26 0.30 3.99 0.00 -1.26 -4.99 121.76 121.75 1u0l s ALA 808 Ca 0.26 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.02 1u0l s ALA 808 Cb -0.12 -2.83 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 1u0l s ALA 808 CO 0.19 -0.37 0.09 -0.65 0.00 0.00 0.00 175.76 175.02 1u0l s GLN 809 N -4.61 1.57 -0.28 0.00 -0.21 -1.26 -4.60 119.66 110.27 1u0l s GLN 809 Ca 0.52 -1.88 0.02 0.00 0.02 0.00 0.00 55.36 54.04 1u0l s GLN 809 Cb -0.10 -0.53 0.08 0.00 1.00 0.00 0.00 33.01 33.45 1u0l s GLN 809 CO 0.43 -0.28 -0.02 -0.51 -2.12 0.00 0.00 175.29 172.80 1u0l s LEU 810 N -3.42 3.39 0.19 2.90 1.43 -0.08 0.13 118.68 123.21 1u0l s LEU 810 Ca 0.36 -1.58 -0.28 0.00 -1.03 0.00 0.00 54.13 51.59 1u0l s LEU 810 Cb 0.07 -1.36 -0.08 0.00 0.03 0.00 0.00 46.19 44.86 1u0l s LEU 810 CO 0.15 -0.29 0.89 -0.76 0.23 0.00 0.00 176.35 176.57 1u0l s LEU 811 N 1.21 4.60 -0.26 1.79 1.43 -0.06 -4.91 118.68 122.49 1u0l s LEU 811 Ca 0.01 1.81 -0.18 0.00 -1.03 0.00 0.00 54.13 54.74 1u0l s LEU 811 Cb -0.19 -3.50 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 1u0l s LEU 811 CO -0.09 0.13 0.50 -0.75 0.23 0.00 0.00 176.35 176.36 1u0l s LYS 812 N -0.90 4.08 0.65 1.70 2.20 -1.26 -1.98 119.74 124.23 1u0l s LYS 812 Ca 0.40 0.30 -0.14 0.00 -0.36 0.00 0.00 55.97 56.17 1u0l s LYS 812 Cb -0.24 -3.64 -0.01 0.00 -1.51 0.00 0.00 37.83 32.43 1u0l s LYS 812 CO 0.30 -0.32 1.09 -0.06 -0.36 0.00 0.00 175.35 175.99 1u0l s PHE 813 N 2.21 2.78 0.07 4.03 2.99 -0.10 -4.97 117.98 124.98 1u0l s PHE 813 Ca 0.21 1.53 -0.36 0.00 0.00 0.00 0.00 56.93 58.30 1u0l s PHE 813 Cb -0.16 -3.08 -0.20 0.00 0.00 0.00 0.00 43.02 39.58 1u0l s PHE 813 CO 0.09 -1.47 1.59 -0.44 -0.00 0.00 0.00 175.22 174.99 1u0l h ASP 814 N -0.00 -1.03 0.00 1.36 3.32 -1.94 -2.86 116.42 115.26 1u0l h ASP 814 Ca -0.46 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1u0l h ASP 814 Cb 1.23 0.27 0.00 0.00 0.22 0.00 0.00 39.33 41.06 1u0l h ASP 814 CO 0.55 -0.72 0.00 2.22 -1.72 0.00 0.00 179.24 179.57 1u0l n PHE 815 N -5.61 0.00 -0.01 4.55 1.16 -1.26 -4.89 117.46 111.40 1u0l n PHE 815 Ca -0.16 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.42 1u0l n PHE 815 Cb 0.48 -0.01 0.00 0.00 -1.61 0.00 0.00 39.48 38.33 1u0l n PHE 815 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1u0l n GLY 816 N 0.04 -2.72 0.00 4.97 0.00 -1.08 -4.35 105.19 102.04 1u0l n GLY 816 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1u0l n GLY 816 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u0l n GLY 817 N -0.07 3.32 3.33 -0.02 0.00 -1.26 -0.10 105.19 110.39 1u0l n GLY 817 Ca 0.00 -1.94 -0.18 0.00 0.00 0.00 0.00 46.02 43.90 1u0l n GLY 817 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u0l s TYR 818 N -2.83 1.66 -0.01 1.61 1.51 0.21 -0.93 117.35 118.57 1u0l s TYR 818 Ca 0.00 -0.60 0.02 0.00 -1.01 0.00 0.00 57.07 55.49 1u0l s TYR 818 Cb 0.00 -0.78 -0.01 0.00 -0.11 0.00 0.00 41.96 41.07 1u0l s TYR 818 CO 0.00 0.33 -0.08 0.54 -1.11 0.00 0.00 175.55 175.23 1u0l s VAL 819 N -3.01 0.64 0.45 0.71 0.11 -0.84 -0.64 120.40 117.82 1u0l s VAL 819 Ca 0.22 -0.34 -0.21 0.00 -2.93 0.00 0.00 61.98 58.71 1u0l s VAL 819 Cb -0.00 -0.54 -0.09 0.00 -1.53 0.00 0.00 36.38 34.21 1u0l s VAL 819 CO 0.06 0.18 1.01 -0.69 -3.33 0.00 0.00 175.10 172.34 1u0l s VAL 820 N -0.15 3.98 0.50 2.04 1.01 -0.98 -0.88 120.40 125.92 1u0l s VAL 820 Ca 0.03 1.29 0.20 0.00 0.00 0.00 0.00 61.98 63.50 1u0l s VAL 820 Cb -0.04 -3.55 0.36 0.00 0.00 0.00 0.00 36.38 33.15 1u0l s VAL 820 CO -0.00 -0.21 2.02 -0.78 0.00 0.00 0.00 175.10 176.12 1u0l h ASP 821 N 1.88 0.11 -4.51 3.32 3.58 -0.68 -3.44 116.42 116.68 1u0l h ASP 821 Ca -0.49 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 56.68 1u0l h ASP 821 Cb 1.21 -0.02 -0.17 0.00 1.72 0.00 0.00 39.33 42.06 1u0l h ASP 821 CO 0.60 0.06 -0.72 0.42 -2.88 0.00 0.00 179.24 176.73 1u0l s THR 822 N -5.13 0.79 0.49 2.25 -4.23 -1.26 -1.93 115.64 106.62 1u0l s THR 822 Ca -0.06 -1.65 -0.21 0.00 -1.18 0.00 0.00 61.69 58.59 1u0l s THR 822 Cb 0.19 -1.35 -0.09 0.00 1.34 0.00 0.00 72.50 72.60 1u0l s THR 822 CO 0.73 -0.64 0.85 -2.65 -0.54 0.00 0.00 174.62 172.37 1u0l n PRO 823 N 0.50 0.99 0.00 3.99 -0.02 -1.26 -4.61 135.00 134.59 1u0l n PRO 823 Ca -0.16 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1u0l n PRO 823 Cb 0.58 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1u0l n PRO 823 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u0l n GLY 824 N 1.39 -2.07 2.48 -1.23 0.00 0.77 -4.42 105.19 102.12 1u0l n GLY 824 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1u0l n GLY 824 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1u0l n PHE 825 N 0.00 2.17 -0.26 1.61 3.01 -1.26 -4.73 117.46 118.00 1u0l n PHE 825 Ca 0.00 -2.45 0.00 0.00 1.01 0.00 0.00 57.45 56.02 1u0l n PHE 825 Cb 0.00 -1.64 0.07 0.00 -0.01 0.00 0.00 39.48 37.90 1u0l n PHE 825 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1u0l h ALA 826 N 3.92 0.39 0.00 4.37 0.00 -1.94 0.90 119.26 126.90 1u0l h ALA 826 Ca 0.57 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.73 1u0l h ALA 826 Cb 0.48 0.63 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1u0l h ALA 826 CO 1.22 -0.47 -0.10 -2.95 0.00 0.00 0.00 179.25 176.95 1u0l h ASN 827 N -0.03 0.00 -6.14 0.00 7.08 -1.97 -3.47 115.58 111.05 1u0l h ASN 827 Ca 0.34 0.00 -0.44 0.00 -3.08 0.00 0.00 56.30 53.12 1u0l h ASN 827 Cb 0.56 0.00 0.03 0.00 -2.08 0.00 0.00 38.32 36.82 1u0l h ASN 827 CO -0.78 0.10 -0.76 0.18 -2.08 0.00 0.00 177.43 174.09 1u0l n LEU 828 N -3.47 -2.90 -4.65 6.14 4.77 0.31 -4.93 117.00 112.27 1u0l n LEU 828 Ca -0.01 -0.74 -0.41 0.00 -0.03 0.00 0.00 56.01 54.82 1u0l n LEU 828 Cb 0.25 -2.70 -0.05 0.00 -2.33 0.00 0.00 43.42 38.58 1u0l n LEU 828 CO 0.29 0.49 0.44 -1.61 -1.33 0.00 0.00 177.39 175.67 1u0l s GLU 829 N -6.37 4.20 -0.69 3.23 2.02 -1.26 -5.00 118.70 114.83 1u0l s GLU 829 Ca 0.47 0.70 0.05 0.00 0.02 0.00 0.00 54.97 56.22 1u0l s GLU 829 Cb -0.23 -3.60 0.20 0.00 0.10 0.00 0.00 34.13 30.60 1u0l s GLU 829 CO 0.80 -0.31 0.58 -0.89 0.02 0.00 0.00 175.26 175.46 1u0l n ILE 830 N 4.85 1.89 0.00 -1.63 2.08 -1.26 -4.79 119.36 120.50 1u0l n ILE 830 Ca 0.00 -4.99 0.00 0.00 0.56 0.00 0.00 62.75 58.32 1u0l n ILE 830 Cb 0.49 -2.16 0.00 0.00 -0.75 0.00 0.00 39.64 37.22 1u0l n ILE 830 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1u0l n ASN 831 N 1.60 2.67 0.00 4.38 3.02 -1.26 -4.62 115.26 121.04 1u0l n ASN 831 Ca 0.23 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.80 1u0l n ASN 831 Cb 0.37 0.06 0.13 0.00 -0.61 0.00 0.00 39.78 39.73 1u0l n ASN 831 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1u0l n ASP 832 N -2.01 0.00 -4.35 6.41 9.92 -1.26 -4.45 116.55 120.81 1u0l n ASP 832 Ca 0.00 -0.34 -0.36 0.00 -0.53 0.00 0.00 54.79 53.56 1u0l n ASP 832 Cb 0.32 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.67 1u0l n ASP 832 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1u0l s ILE 833 N -2.00 3.86 0.34 0.53 1.01 -1.26 -5.09 121.20 118.58 1u0l s ILE 833 Ca 0.07 -0.55 -0.26 0.00 0.00 0.00 0.00 60.65 59.90 1u0l s ILE 833 Cb 0.03 -2.90 -0.09 0.00 0.01 0.00 0.00 42.46 39.51 1u0l s ILE 833 CO 0.05 0.22 1.05 -0.70 0.00 0.00 0.00 174.94 175.56 1u0l s GLU 834 N 1.51 4.41 0.11 2.79 2.56 -1.26 -4.91 118.70 123.92 1u0l s GLU 834 Ca 0.04 1.60 -0.22 0.00 0.00 0.00 0.00 54.97 56.39 1u0l s GLU 834 Cb -0.16 -2.84 -0.05 0.00 2.00 0.00 0.00 34.13 33.08 1u0l s GLU 834 CO 0.01 0.06 1.30 -2.30 -0.56 0.00 0.00 175.26 173.77 1u0l n PRO 835 N 0.53 -0.31 0.00 4.30 -0.02 -1.26 0.14 135.00 138.38 1u0l n PRO 835 Ca 0.02 1.28 0.05 0.00 -2.02 0.00 0.00 63.50 62.83 1u0l n PRO 835 Cb 0.48 -1.89 0.30 0.00 -0.02 0.00 0.00 33.50 32.37 1u0l n PRO 835 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1u0l n GLU 836 N -4.64 0.30 0.02 -0.52 0.00 -1.26 -1.37 120.64 113.17 1u0l n GLU 836 Ca 0.01 0.01 0.11 0.00 0.00 0.00 0.00 57.16 57.30 1u0l n GLU 836 Cb 0.18 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.09 1u0l n GLU 836 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1u0l n GLU 837 N -1.02 0.28 0.23 3.44 2.13 0.37 -4.58 120.64 121.49 1u0l n GLU 837 Ca 0.07 -0.03 -0.09 0.00 0.66 0.00 0.00 57.16 57.77 1u0l n GLU 837 Cb 0.04 -1.56 -0.04 0.00 0.27 0.00 0.00 31.44 30.14 1u0l n GLU 837 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1u0l h LEU 838 N 0.00 -0.50 -0.59 4.31 3.38 -0.92 -3.22 115.31 117.79 1u0l h LEU 838 Ca 0.00 0.02 0.23 0.00 0.09 0.00 0.00 57.88 58.21 1u0l h LEU 838 Cb 0.72 0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.49 1u0l h LEU 838 CO 0.00 -0.31 0.24 2.29 0.09 0.00 0.00 178.44 180.75 1u0l n LYS 839 N -3.80 -0.04 0.24 1.13 2.85 -1.26 0.27 118.16 117.55 1u0l n LYS 839 Ca -0.07 0.83 0.16 0.00 -1.05 0.00 0.00 58.31 58.18 1u0l n LYS 839 Cb 0.23 -1.44 0.87 0.00 -0.65 0.00 0.00 35.03 34.04 1u0l n LYS 839 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1u0l h HIS 840 N 0.00 0.00 -0.65 5.58 3.86 -1.84 0.27 115.15 122.37 1u0l h HIS 840 Ca 0.46 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.67 1u0l h HIS 840 Cb 1.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.64 1u0l h HIS 840 CO -0.08 0.00 0.00 0.66 0.86 0.00 0.00 177.93 179.37 1u0l n TYR 841 N -2.62 1.46 -3.90 2.45 0.53 0.76 -4.65 117.16 111.19 1u0l n TYR 841 Ca -0.02 -0.58 -0.30 0.00 -1.02 0.00 0.00 57.90 55.97 1u0l n TYR 841 Cb 0.05 -0.23 -0.14 0.00 -1.03 0.00 0.00 39.34 37.99 1u0l n TYR 841 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 1u0l s PHE 842 N -1.80 2.98 0.07 -0.72 0.40 0.08 -4.39 117.98 114.59 1u0l s PHE 842 Ca 0.51 -2.78 -0.13 0.00 -0.60 0.00 0.00 56.93 53.93 1u0l s PHE 842 Cb 0.32 -2.54 -0.03 0.00 0.51 0.00 0.00 43.02 41.28 1u0l s PHE 842 CO 0.25 -0.84 1.00 1.63 0.70 0.00 0.00 175.22 177.95 1u0l n LYS 843 N 3.85 -0.18 -0.27 0.44 5.02 -1.26 -1.73 118.16 124.03 1u0l n LYS 843 Ca 0.04 0.99 0.08 0.00 -2.02 0.00 0.00 58.31 57.40 1u0l n LYS 843 Cb 0.38 -1.46 0.16 0.00 -0.02 0.00 0.00 35.03 34.09 1u0l n LYS 843 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1u0l n GLU 844 N -3.93 -0.07 -2.02 1.97 4.71 -1.26 -4.35 120.64 115.69 1u0l n GLU 844 Ca 0.01 1.18 -0.41 0.00 -0.01 0.00 0.00 57.16 57.93 1u0l n GLU 844 Cb 0.11 -1.82 -0.01 0.00 -1.01 0.00 0.00 31.44 28.71 1u0l n GLU 844 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1u0l s PHE 845 N -5.85 2.90 0.00 -0.32 0.40 -0.70 -4.19 117.98 110.21 1u0l s PHE 845 Ca -0.11 1.34 0.00 0.00 -0.60 0.00 0.00 56.93 57.57 1u0l s PHE 845 Cb 0.22 -3.78 0.00 0.00 0.51 0.00 0.00 43.02 39.97 1u0l s PHE 845 CO 0.60 -2.20 0.00 0.41 0.70 0.00 0.00 175.22 174.73 1u0l n GLY 846 N 0.69 2.49 0.00 4.36 0.00 -1.26 -4.83 105.19 106.64 1u0l n GLY 846 Ca 0.01 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.57 1u0l n GLY 846 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1u0l n ASP 847 N 0.00 0.00 -4.67 1.61 5.75 -1.26 -4.50 116.55 113.48 1u0l n ASP 847 Ca 0.00 -0.57 -0.36 0.00 -0.01 0.00 0.00 54.79 53.85 1u0l n ASP 847 Cb 0.00 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.00 1u0l n ASP 847 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1u0l s LYS 848 N -2.00 4.08 -0.14 0.11 3.01 -1.26 -5.09 119.74 118.45 1u0l s LYS 848 Ca 0.17 -0.27 -0.10 0.00 -1.01 0.00 0.00 55.97 54.75 1u0l s LYS 848 Cb 0.08 -3.48 -0.05 0.00 -1.01 0.00 0.00 37.83 33.37 1u0l s LYS 848 CO 0.13 0.13 0.20 -0.65 0.51 0.00 0.00 175.35 175.67 1u0l s GLN 849 N 0.85 3.91 0.05 1.68 1.11 -1.26 -4.77 119.66 121.23 1u0l s GLN 849 Ca 0.07 -0.04 0.09 0.00 0.01 0.00 0.00 55.36 55.49 1u0l s GLN 849 Cb -0.13 -3.32 -0.03 0.00 -1.01 0.00 0.00 33.01 28.53 1u0l s GLN 849 CO 0.03 0.50 -0.26 0.00 0.01 0.00 0.00 175.29 175.56 1u0l h PHE 851 N 4.74 -1.45 -3.69 0.00 3.57 -1.59 -3.42 116.94 115.10 1u0l h PHE 851 Ca -0.47 0.02 -0.52 0.00 3.53 0.00 0.00 57.97 60.53 1u0l h PHE 851 Cb 1.14 0.59 0.05 0.00 2.79 0.00 0.00 35.95 40.52 1u0l h PHE 851 CO 0.49 -0.64 0.65 -0.06 -2.23 0.00 0.00 178.31 176.52 1u0l s PHE 852 N -5.84 3.12 0.11 0.41 0.40 -1.26 -4.95 117.98 109.97 1u0l s PHE 852 Ca -0.17 1.33 -0.31 0.00 -0.60 0.00 0.00 56.93 57.18 1u0l s PHE 852 Cb 0.05 -3.66 -0.09 0.00 0.51 0.00 0.00 43.02 39.84 1u0l s PHE 852 CO 0.61 -1.90 1.54 0.45 0.70 0.00 0.00 175.22 176.61 1u0l s SER 853 N -0.21 6.67 -1.23 1.36 0.15 -1.26 -2.63 113.70 116.55 1u0l s SER 853 Ca 0.52 2.47 -0.05 0.00 0.70 0.00 0.00 55.95 59.59 1u0l s SER 853 Cb -0.39 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.33 1u0l s SER 853 CO 0.47 -0.79 0.76 -0.67 1.20 0.00 0.00 173.24 174.21 1u0l n ASP 854 N 4.55 -2.80 -4.76 5.45 2.03 -1.26 -4.92 116.55 114.84 1u0l n ASP 854 Ca 0.14 -0.84 -0.41 0.00 0.52 0.00 0.00 54.79 54.20 1u0l n ASP 854 Cb 0.40 -4.12 -0.03 0.00 -0.72 0.00 0.00 41.12 36.66 1u0l n ASP 854 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1u0l n ASN 856 N 1.39 0.62 0.00 0.00 3.02 -1.26 -4.93 115.26 114.11 1u0l n ASN 856 Ca 0.02 -0.57 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 1u0l n ASN 856 Cb 0.43 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 1u0l n ASN 856 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1u0l n HIS 857 N -0.96 0.00 0.00 3.10 8.25 -1.26 -4.84 115.22 119.51 1u0l n HIS 857 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 1u0l n HIS 857 Cb 0.31 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.14 1u0l n HIS 857 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1u0l n VAL 858 N -1.69 0.00 -0.05 1.59 0.31 -1.26 -4.53 118.33 112.69 1u0l n VAL 858 Ca 0.00 1.17 0.00 0.00 -0.01 0.00 0.00 64.34 65.50 1u0l n VAL 858 Cb 0.00 -2.12 -0.16 0.00 -0.91 0.00 0.00 33.84 30.65 1u0l n VAL 858 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1u0l n ASP 859 N -1.29 0.20 -3.62 4.52 8.00 -1.26 -5.03 116.55 118.07 1u0l n ASP 859 Ca 0.00 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.12 1u0l n ASP 859 Cb 0.00 1.46 -0.02 0.00 -0.02 0.00 0.00 41.12 42.55 1u0l n ASP 859 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1u0l n GLU 860 N -2.48 0.00 0.21 -1.24 4.71 -1.26 -4.94 120.64 115.63 1u0l n GLU 860 Ca -0.18 0.00 -0.14 0.00 -0.01 0.00 0.00 57.16 56.83 1u0l n GLU 860 Cb 0.84 -0.83 -0.08 0.00 -1.01 0.00 0.00 31.44 30.37 1u0l n GLU 860 CO 0.00 0.00 0.00 -1.35 0.09 0.00 0.00 177.13 175.87 1u0l h PRO 861 N 0.69 -0.50 -2.37 3.49 0.11 -1.96 -3.39 132.00 128.07 1u0l h PRO 861 Ca -0.25 0.03 -0.63 0.00 0.11 0.00 0.00 66.00 65.26 1u0l h PRO 861 Cb 1.19 0.11 -0.40 0.00 0.11 0.00 0.00 31.00 32.02 1u0l h PRO 861 CO 0.45 -0.21 -0.37 -1.91 -0.21 0.00 0.00 178.00 175.74 1u0l n GLU 862 N -5.22 2.80 -3.14 1.05 2.13 -1.26 -5.05 120.64 111.95 1u0l n GLU 862 Ca -0.10 -4.65 -0.40 0.00 0.66 0.00 0.00 57.16 52.67 1u0l n GLU 862 Cb 0.27 -2.30 -0.06 0.00 0.27 0.00 0.00 31.44 29.62 1u0l n GLU 862 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1u0l h GLY 864 N 8.46 0.00 0.31 0.00 0.00 -1.78 -2.09 103.07 107.97 1u0l h GLY 864 Ca -0.30 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1u0l h GLY 864 CO 0.77 0.00 -0.04 -2.08 0.00 0.00 0.00 176.54 175.18 1u0l h VAL 865 N 0.00 1.13 -0.79 4.60 2.07 -1.86 -0.15 116.25 121.25 1u0l h VAL 865 Ca -0.00 -1.37 0.09 0.00 0.82 0.00 0.00 66.70 66.24 1u0l h VAL 865 Cb 0.62 1.93 -0.07 0.00 -1.52 0.00 0.00 31.29 32.25 1u0l h VAL 865 CO 0.04 0.31 0.44 0.11 0.02 0.00 0.00 177.57 178.48 1u0l h LYS 866 N -0.80 0.72 -0.14 1.57 1.57 -1.84 -0.95 116.57 116.70 1u0l h LYS 866 Ca -0.01 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1u0l h LYS 866 Cb 0.59 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1u0l h LYS 866 CO 0.02 0.47 0.04 1.49 -0.57 0.00 0.00 179.45 180.90 1u0l h GLU 867 N 0.74 0.10 -0.17 3.15 4.81 -1.37 -1.79 114.58 120.04 1u0l h GLU 867 Ca 0.38 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.66 1u0l h GLU 867 Cb 0.36 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 1u0l h GLU 867 CO -0.25 0.07 0.12 0.00 -0.73 0.00 0.00 179.01 178.22 1u0l h ALA 868 N 1.09 2.15 -0.05 2.92 0.00 0.15 -1.87 119.26 123.66 1u0l h ALA 868 Ca 0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1u0l h ALA 868 Cb 0.04 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1u0l h ALA 868 CO -0.07 -0.20 -0.03 0.28 0.00 0.00 0.00 179.25 179.23 1u0l h VAL 869 N 0.01 1.36 -0.01 0.00 2.07 -0.40 -1.60 116.25 117.67 1u0l h VAL 869 Ca 0.08 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1u0l h VAL 869 Cb 0.32 2.01 -0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1u0l h VAL 869 CO -0.00 0.30 0.06 -0.33 0.02 0.00 0.00 177.57 177.62 1u0l h GLU 870 N -0.32 0.00 0.02 1.57 5.08 -0.69 -2.17 114.58 118.06 1u0l h GLU 870 Ca 0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1u0l h GLU 870 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1u0l h GLU 870 CO 0.01 0.00 -0.01 -0.91 -1.00 0.00 0.00 179.01 177.10 1u0l h ASN 871 N 0.00 -0.02 0.00 1.42 -0.26 -1.20 -3.48 115.58 112.04 1u0l h ASN 871 Ca 0.01 -0.61 0.00 0.00 -0.56 0.00 0.00 56.30 55.14 1u0l h ASN 871 Cb 0.11 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1u0l h ASN 871 CO -0.00 0.76 0.00 0.61 -1.06 0.00 0.00 177.43 177.74 1u0l n GLY 872 N 1.51 1.00 0.37 2.83 0.00 -0.82 -4.97 105.19 105.11 1u0l n GLY 872 Ca -0.07 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.14 1u0l n GLY 872 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1u0l h GLU 873 N 0.00 0.00 -4.94 1.61 5.08 -1.54 -3.38 114.58 111.41 1u0l h GLU 873 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1u0l h GLU 873 Cb 0.00 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 28.93 1u0l h GLU 873 CO 0.00 0.00 -0.82 0.42 -1.00 0.00 0.00 179.01 177.61 1u0l s ILE 874 N -4.50 1.27 0.34 3.13 1.01 -0.99 -4.95 121.20 116.52 1u0l s ILE 874 Ca -0.04 -0.60 -0.29 0.00 0.00 0.00 0.00 60.65 59.72 1u0l s ILE 874 Cb 0.14 -1.12 -0.11 0.00 0.01 0.00 0.00 42.46 41.38 1u0l s ILE 874 CO 0.48 0.38 1.44 0.00 0.00 0.00 0.00 174.94 177.24 1u0l s ALA 875 N 0.30 3.57 0.07 9.38 0.00 -1.26 -4.53 121.76 129.30 1u0l s ALA 875 Ca -0.08 1.45 -0.23 0.00 0.00 0.00 0.00 51.96 53.10 1u0l s ALA 875 Cb -0.13 -3.57 -0.15 0.00 0.00 0.00 0.00 23.12 19.27 1u0l s ALA 875 CO 0.03 -0.89 1.66 0.93 0.00 0.00 0.00 175.76 177.49 1u0l h GLU 876 N 3.53 0.03 -0.42 0.00 5.08 -1.93 -2.42 114.58 118.44 1u0l h GLU 876 Ca -0.49 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 57.97 1u0l h GLU 876 Cb 1.23 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 1u0l h GLU 876 CO 0.68 0.10 0.30 0.66 -1.00 0.00 0.00 179.01 179.74 1u0l h SER 877 N -0.06 0.10 0.50 1.42 4.64 -1.98 0.10 113.55 118.27 1u0l h SER 877 Ca 0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1u0l h SER 877 Cb 0.08 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1u0l h SER 877 CO -0.00 0.06 -0.24 0.03 -0.87 0.00 0.00 176.83 175.81 1u0l h ARG 878 N 0.11 -0.64 -0.34 4.77 2.47 -1.84 -0.98 114.38 117.92 1u0l h ARG 878 Ca 0.20 0.04 0.05 0.00 -1.26 0.00 0.00 59.98 59.01 1u0l h ARG 878 Cb 0.64 0.15 -0.08 0.00 -1.65 0.00 0.00 29.97 29.03 1u0l h ARG 878 CO -0.02 -0.43 -0.55 -0.92 0.56 0.00 0.00 179.97 178.61 1u0l h TYR 879 N -0.93 -1.66 -0.29 3.04 3.20 -0.95 0.14 116.97 119.53 1u0l h TYR 879 Ca -0.07 0.08 0.04 0.00 3.14 0.00 0.00 58.73 61.92 1u0l h TYR 879 Cb 0.51 0.77 -0.08 0.00 1.54 0.00 0.00 36.73 39.48 1u0l h TYR 879 CO 0.04 -0.50 -0.53 1.49 -1.64 0.00 0.00 178.16 177.01 1u0l h GLU 880 N -0.44 -0.45 -0.85 1.82 4.81 -0.88 -0.10 114.58 118.49 1u0l h GLU 880 Ca 0.07 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.45 1u0l h GLU 880 Cb 0.62 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.04 1u0l h GLU 880 CO -0.56 -0.30 0.55 -0.91 -0.73 0.00 0.00 179.01 177.06 1u0l h ASN 881 N -0.47 0.65 0.07 1.04 2.35 -0.60 0.27 115.58 118.89 1u0l h ASN 881 Ca 0.07 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1u0l h ASN 881 Cb 0.63 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1u0l h ASN 881 CO -0.52 0.35 -0.04 0.22 -1.65 0.00 0.00 177.43 175.80 1u0l h TYR 882 N 0.70 -0.09 -0.64 1.19 3.20 0.63 -0.52 116.97 121.43 1u0l h TYR 882 Ca 0.41 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.32 1u0l h TYR 882 Cb 0.61 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.86 1u0l h TYR 882 CO -0.00 0.04 0.38 0.28 -1.64 0.00 0.00 178.16 177.22 1u0l h VAL 883 N -0.21 1.04 -0.05 1.81 2.07 0.35 0.42 116.25 121.68 1u0l h VAL 883 Ca -0.01 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.29 1u0l h VAL 883 Cb 0.18 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 1u0l h VAL 883 CO 0.02 0.13 -0.18 0.50 0.02 0.00 0.00 177.57 178.06 1u0l h LYS 884 N 0.73 -0.25 -0.53 1.57 1.63 -0.26 -1.87 116.57 117.58 1u0l h LYS 884 Ca 0.27 0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 60.02 1u0l h LYS 884 Cb 0.08 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.75 1u0l h LYS 884 CO -0.13 -0.17 0.05 0.52 -3.45 0.00 0.00 179.45 176.26 1u0l h MET 885 N -0.26 0.87 -0.27 1.90 2.86 -0.53 -2.74 114.93 116.77 1u0l h MET 885 Ca 0.07 -0.22 0.06 0.00 -2.06 0.00 0.00 59.70 57.55 1u0l h MET 885 Cb 0.36 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 31.85 1u0l h MET 885 CO -0.20 0.84 -0.19 0.35 1.06 0.00 0.00 176.91 178.77 1u0l h PHE 886 N 0.82 -0.48 -0.19 -0.22 3.57 0.54 -0.46 116.94 120.51 1u0l h PHE 886 Ca 0.16 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.67 1u0l h PHE 886 Cb 0.42 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 1u0l h PHE 886 CO 0.02 -0.26 -0.00 1.88 -2.23 0.00 0.00 178.31 177.72 1u0l h TYR 887 N -0.17 0.28 -0.64 0.41 0.99 -1.24 -1.14 116.97 115.45 1u0l h TYR 887 Ca 0.15 -0.01 -0.05 0.00 2.00 0.00 0.00 58.73 60.81 1u0l h TYR 887 Cb 0.39 -0.09 -0.03 0.00 1.00 0.00 0.00 36.73 38.01 1u0l h TYR 887 CO -0.36 0.29 0.19 0.93 -0.00 0.00 0.00 178.16 179.21 1u0l h GLU 888 N 0.27 0.98 -0.24 4.88 5.08 -0.84 -2.32 114.58 122.40 1u0l h GLU 888 Ca 0.06 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.15 1u0l h GLU 888 Cb 0.19 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1u0l h GLU 888 CO 0.00 0.85 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.61 1u0l h LEU 889 N 0.95 0.41 -1.68 1.33 3.38 0.08 -2.77 115.31 117.01 1u0l h LEU 889 Ca 0.21 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1u0l h LEU 889 Cb 0.28 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1u0l h LEU 889 CO -0.01 0.62 0.00 -0.07 0.09 0.00 0.00 178.44 179.07 1u0l h LEU 890 N 0.39 0.00 -7.16 1.67 3.38 -1.02 -3.35 115.31 109.21 1u0l h LEU 890 Ca 0.07 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.47 1u0l h LEU 890 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1u0l h LEU 890 CO 0.04 0.00 2.06 0.61 0.09 0.00 0.00 178.44 181.23 1u0l n GLY 891 N -0.90 2.43 3.25 0.83 0.00 -1.05 -4.69 105.19 105.07 1u0l n GLY 891 Ca -0.01 -1.19 0.04 0.00 0.00 0.00 0.00 46.02 44.85 1u0l n GLY 891 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1u0l s ARG 892 N 4.94 0.19 0.00 1.61 1.04 -1.26 -5.10 118.95 120.38 1u0l s ARG 892 Ca 0.58 0.43 0.00 0.00 -1.04 0.00 0.00 55.73 55.70 1u0l s ARG 892 Cb 0.07 0.25 0.00 0.00 -2.04 0.00 0.00 34.95 33.24 1u0l s ARG 892 CO 0.08 -0.12 0.00 -2.13 -0.04 0.00 0.00 175.30 173.08