#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j1d n SER 602 N 0.00 -1.88 -4.91 4.39 2.88 -1.26 -5.02 113.62 107.83 2j1d n SER 602 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 2j1d n SER 602 Cb 0.00 -0.53 -0.04 0.00 -0.75 0.00 0.00 64.21 62.89 2j1d n SER 602 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2j1d s ILE 603 N -2.69 5.22 0.51 2.46 -5.25 -1.26 -5.00 121.20 115.19 2j1d s ILE 603 Ca 0.00 -0.11 -0.05 0.00 -0.99 0.00 0.00 60.65 59.50 2j1d s ILE 603 Cb 0.00 -3.64 -0.02 0.00 2.95 0.00 0.00 42.46 41.75 2j1d s ILE 603 CO 0.00 0.04 0.81 -2.16 -1.79 0.00 0.00 174.94 171.84 2j1d s PRO 604 N -2.70 3.36 0.15 0.37 0.04 -1.26 -5.11 135.00 129.86 2j1d s PRO 604 Ca 0.39 0.12 0.09 0.00 0.04 0.00 0.00 61.00 61.64 2j1d s PRO 604 Cb -0.12 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.02 2j1d s PRO 604 CO 0.26 -0.34 -0.19 -0.65 0.04 0.00 0.00 177.00 176.12 2j1d s GLN 605 N -4.80 1.25 0.91 4.56 -1.52 -1.26 -5.13 119.66 113.67 2j1d s GLN 605 Ca 0.49 -1.36 -0.11 0.00 -1.95 0.00 0.00 55.36 52.44 2j1d s GLN 605 Cb -0.10 -1.37 0.14 0.00 -0.22 0.00 0.00 33.01 31.46 2j1d s GLN 605 CO 0.45 0.29 1.11 -2.14 -0.25 0.00 0.00 175.29 174.74 2j1d s PRO 606 N -2.59 1.11 -0.01 2.91 0.02 -1.26 -4.99 135.00 130.20 2j1d s PRO 606 Ca 0.14 1.23 -0.24 0.00 0.02 0.00 0.00 61.00 62.15 2j1d s PRO 606 Cb -0.07 -1.76 -0.19 0.00 0.02 0.00 0.00 34.50 32.50 2j1d s PRO 606 CO 0.06 -2.46 1.25 1.79 -0.33 0.00 0.00 177.00 177.31 2j1d h THR 607 N -1.73 1.41 -3.00 0.99 1.35 -2.00 -3.45 112.91 106.47 2j1d h THR 607 Ca -0.47 -1.32 -0.63 0.00 -0.55 0.00 0.00 66.41 63.45 2j1d h THR 607 Cb 1.27 2.19 -0.18 0.00 -1.73 0.00 0.00 68.15 69.70 2j1d h THR 607 CO 0.47 0.36 -0.80 0.20 -0.25 0.00 0.00 175.52 175.50 2j1d s ASN 608 N -5.91 3.36 0.51 5.36 0.01 -1.26 -5.13 114.94 111.88 2j1d s ASN 608 Ca -0.15 -0.90 -0.22 0.00 -0.71 0.00 0.00 52.86 50.88 2j1d s ASN 608 Cb 0.02 -0.25 -0.08 0.00 0.41 0.00 0.00 41.25 41.36 2j1d s ASN 608 CO 0.71 0.08 1.03 0.00 -1.51 0.00 0.00 177.10 177.40 2j1d n ALA 609 N 0.08 0.36 -2.63 0.60 0.00 -1.26 -4.88 120.51 112.77 2j1d n ALA 609 Ca -0.11 0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.23 2j1d n ALA 609 Cb 0.57 -2.12 -0.07 0.00 0.00 0.00 0.00 19.45 17.82 2j1d n ALA 609 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2j1d s LEU 610 N -1.40 3.16 0.58 0.00 1.02 -1.26 -1.38 118.68 119.39 2j1d s LEU 610 Ca 0.69 -0.67 -0.20 0.00 0.02 0.00 0.00 54.13 53.97 2j1d s LEU 610 Cb -0.48 -1.68 -0.04 0.00 0.02 0.00 0.00 46.19 44.01 2j1d s LEU 610 CO 0.53 0.01 1.18 0.29 0.02 0.00 0.00 176.35 178.37 2j1d n LYS 611 N -0.87 1.27 -3.15 1.70 5.02 -0.44 -4.42 118.16 117.26 2j1d n LYS 611 Ca -0.06 0.48 -0.30 0.00 -2.02 0.00 0.00 58.31 56.40 2j1d n LYS 611 Cb 0.59 -2.39 -0.04 0.00 -0.02 0.00 0.00 35.03 33.17 2j1d n LYS 611 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2j1d s SER 612 N -1.11 6.56 -0.28 4.39 1.04 -0.76 -4.98 113.70 118.57 2j1d s SER 612 Ca 0.75 0.99 -0.10 0.00 0.48 0.00 0.00 55.95 58.07 2j1d s SER 612 Cb -0.42 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.40 2j1d s SER 612 CO 0.47 -0.24 0.16 0.12 0.98 0.00 0.00 173.24 174.73 2j1d s PHE 613 N -2.11 3.18 -1.38 5.02 5.36 -1.26 -4.65 117.98 122.14 2j1d s PHE 613 Ca 0.49 -0.12 -0.12 0.00 -0.96 0.00 0.00 56.93 56.22 2j1d s PHE 613 Cb -0.11 -2.35 -0.05 0.00 -0.34 0.00 0.00 43.02 40.18 2j1d s PHE 613 CO 0.27 -0.26 2.48 -1.71 -1.46 0.00 0.00 175.22 174.54 2j1d n ASN 614 N 5.02 5.89 -4.88 6.13 5.15 -1.26 -4.93 115.26 126.39 2j1d n ASN 614 Ca -0.14 -2.64 -0.23 0.00 -0.60 0.00 0.00 54.58 50.97 2j1d n ASN 614 Cb 0.51 -1.48 0.06 0.00 -0.53 0.00 0.00 39.78 38.35 2j1d n ASN 614 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 2j1d s TRP 615 N 3.00 2.58 -0.23 1.20 -2.14 -1.26 -5.08 118.94 117.01 2j1d s TRP 615 Ca 0.56 0.07 0.02 0.00 2.66 0.00 0.00 56.10 59.42 2j1d s TRP 615 Cb 0.15 -2.97 0.04 0.00 -3.10 0.00 0.00 33.47 27.60 2j1d s TRP 615 CO -0.05 -1.25 -0.14 -1.12 -2.66 0.00 0.00 176.95 171.73 2j1d s SER 616 N -4.53 3.90 0.41 -2.66 0.01 -1.26 -5.12 113.70 104.45 2j1d s SER 616 Ca 0.60 -1.09 -0.24 0.00 1.31 0.00 0.00 55.95 56.53 2j1d s SER 616 Cb -0.09 -1.50 -0.08 0.00 0.21 0.00 0.00 66.02 64.55 2j1d s SER 616 CO 0.42 -0.12 1.12 -0.54 0.41 0.00 0.00 173.24 174.53 2j1d s LYS 617 N 1.19 4.03 -0.06 12.44 1.02 -1.26 -5.01 119.74 132.09 2j1d s LYS 617 Ca -0.03 1.70 -0.26 0.00 0.02 0.00 0.00 55.97 57.40 2j1d s LYS 617 Cb -0.17 -2.57 -0.03 0.00 -0.52 0.00 0.00 37.83 34.54 2j1d s LYS 617 CO -0.08 -0.30 0.82 -0.51 -0.92 0.00 0.00 175.35 174.36 2j1d s LEU 618 N -2.66 4.31 0.50 3.17 1.43 -1.26 -5.04 118.68 119.13 2j1d s LEU 618 Ca 0.59 1.36 -0.22 0.00 -1.03 0.00 0.00 54.13 54.82 2j1d s LEU 618 Cb -0.27 -3.29 -0.08 0.00 0.03 0.00 0.00 46.19 42.58 2j1d s LEU 618 CO 0.34 -0.22 1.08 -2.65 0.23 0.00 0.00 176.35 175.13 2j1d n PRO 619 N 4.06 1.35 0.23 1.29 -0.02 -1.26 -4.89 135.00 135.76 2j1d n PRO 619 Ca 0.02 0.49 0.09 0.00 -2.02 0.00 0.00 63.50 62.09 2j1d n PRO 619 Cb 0.51 -2.21 0.56 0.00 -0.02 0.00 0.00 33.50 32.34 2j1d n PRO 619 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2j1d h GLU 620 N 1.28 0.00 0.00 -0.52 3.07 -2.00 -2.24 114.58 114.16 2j1d h GLU 620 Ca -0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 2j1d h GLU 620 Cb 1.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 2j1d h GLU 620 CO 0.55 0.22 0.00 0.27 -1.40 0.00 0.00 179.01 178.65 2j1d n ASN 621 N -3.66 0.00 -0.76 1.42 0.23 -1.26 -2.33 115.26 108.89 2j1d n ASN 621 Ca -0.01 -0.37 0.07 0.00 -0.53 0.00 0.00 54.58 53.74 2j1d n ASN 621 Cb 0.34 -0.10 0.16 0.00 -2.08 0.00 0.00 39.78 38.10 2j1d n ASN 621 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2j1d n LYS 622 N -1.10 2.35 0.00 -3.83 5.02 -0.84 -4.99 118.16 114.77 2j1d n LYS 622 Ca 0.12 -1.99 0.00 0.00 -2.02 0.00 0.00 58.31 54.42 2j1d n LYS 622 Cb 0.09 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 2j1d n LYS 622 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2j1d n LEU 623 N 0.82 0.00 0.00 -0.35 4.77 -0.99 -4.67 117.00 116.58 2j1d n LEU 623 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2j1d n LEU 623 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2j1d n LEU 623 CO 0.10 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.37 2j1d n GLU 624 N 0.00 0.00 -0.00 3.23 0.00 -1.26 -4.64 120.64 117.97 2j1d n GLU 624 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.23 2j1d n GLU 624 Cb 0.00 -0.34 -0.08 0.00 0.00 0.00 0.00 31.44 31.02 2j1d n GLU 624 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2j1d n GLY 625 N -0.99 -0.38 3.94 8.31 0.00 -1.26 -5.01 105.19 109.80 2j1d n GLY 625 Ca 0.00 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 2j1d n GLY 625 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j1d s THR 626 N -2.40 2.11 0.51 2.61 -4.23 -1.26 -4.99 115.64 107.99 2j1d s THR 626 Ca 0.05 -1.28 0.24 0.00 -1.18 0.00 0.00 61.69 59.52 2j1d s THR 626 Cb 0.11 -2.38 0.40 0.00 1.34 0.00 0.00 72.50 71.96 2j1d s THR 626 CO 0.59 0.00 1.97 -0.37 -0.54 0.00 0.00 174.62 176.27 2j1d h VAL 627 N 0.63 0.72 -0.01 2.29 -1.51 -1.99 -3.15 116.25 113.23 2j1d h VAL 627 Ca -0.36 -0.03 -0.10 0.00 -1.23 0.00 0.00 66.70 64.99 2j1d h VAL 627 Cb 1.29 0.63 -0.01 0.00 -2.13 0.00 0.00 31.29 31.06 2j1d h VAL 627 CO 0.51 0.02 -0.45 -0.50 -1.23 0.00 0.00 177.57 175.92 2j1d h TRP 628 N 0.09 0.02 -1.21 5.19 4.06 -1.94 0.16 115.95 122.32 2j1d h TRP 628 Ca 0.30 -0.01 0.37 0.00 2.06 0.00 0.00 58.89 61.61 2j1d h TRP 628 Cb 1.06 -0.00 -0.11 0.00 -1.00 0.00 0.00 29.16 29.11 2j1d h TRP 628 CO -0.00 0.46 0.78 1.15 -3.56 0.00 0.00 178.44 177.28 2j1d h THR 629 N 0.02 0.28 -0.07 1.49 2.02 -1.94 -1.62 112.91 113.10 2j1d h THR 629 Ca -0.00 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2j1d h THR 629 Cb 0.80 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2j1d h THR 629 CO 0.06 0.04 0.00 -0.62 0.37 0.00 0.00 175.52 175.37 2j1d n GLU 630 N -4.65 2.18 -4.33 6.66 1.02 0.54 -4.96 120.64 117.10 2j1d n GLU 630 Ca 0.32 -1.72 -0.31 0.00 -0.02 0.00 0.00 57.16 55.44 2j1d n GLU 630 Cb 1.22 -1.47 -0.10 0.00 -0.02 0.00 0.00 31.44 31.07 2j1d n GLU 630 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2j1d s ILE 631 N -1.94 3.49 -0.28 -3.67 1.01 -0.61 -5.11 121.20 114.09 2j1d s ILE 631 Ca 0.31 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.91 2j1d s ILE 631 Cb 0.20 -2.59 0.16 0.00 0.01 0.00 0.00 42.46 40.25 2j1d s ILE 631 CO 0.31 0.22 0.44 -0.62 0.00 0.00 0.00 174.94 175.29 2j1d s ASP 632 N -1.90 -0.05 0.19 3.58 2.15 -1.26 -4.94 116.67 114.43 2j1d s ASP 632 Ca 0.20 -0.06 0.24 0.00 0.43 0.00 0.00 52.55 53.35 2j1d s ASP 632 Cb -0.11 1.31 0.91 0.00 -0.30 0.00 0.00 42.92 44.73 2j1d s ASP 632 CO 0.12 -0.33 1.72 -0.90 -0.17 0.00 0.00 175.17 175.60 2j1d n ASP 633 N 5.37 0.57 0.30 -0.34 3.85 -1.26 -3.59 116.55 121.44 2j1d n ASP 633 Ca 0.00 0.60 0.18 0.00 -0.71 0.00 0.00 54.79 54.87 2j1d n ASP 633 Cb 0.50 -0.74 0.88 0.00 -1.35 0.00 0.00 41.12 40.42 2j1d n ASP 633 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 2j1d h THR 634 N 0.00 0.13 0.00 2.12 1.35 -1.95 -1.88 112.91 112.68 2j1d h THR 634 Ca 0.00 -0.35 -0.23 0.00 -0.55 0.00 0.00 66.41 65.28 2j1d h THR 634 Cb 0.47 1.30 -0.03 0.00 -1.73 0.00 0.00 68.15 68.15 2j1d h THR 634 CO 0.00 0.03 -1.17 0.07 -0.25 0.00 0.00 175.52 174.20 2j1d h LYS 635 N 0.00 0.00 -0.69 4.72 2.10 -2.00 -3.33 116.57 117.38 2j1d h LYS 635 Ca -0.00 -0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.72 2j1d h LYS 635 Cb 0.30 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.59 2j1d h LYS 635 CO 0.00 0.88 0.46 0.28 -2.00 0.00 0.00 179.45 179.07 2j1d h VAL 636 N 0.00 1.00 -0.40 0.07 2.07 -1.55 -2.92 116.25 114.51 2j1d h VAL 636 Ca -0.08 -0.24 -0.06 0.00 0.82 0.00 0.00 66.70 67.15 2j1d h VAL 636 Cb 1.83 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 2j1d h VAL 636 CO 0.12 0.13 -0.00 -0.26 0.02 0.00 0.00 177.57 177.57 2j1d h PHE 637 N 0.69 0.68 -0.11 1.57 0.05 -1.66 0.21 116.94 118.37 2j1d h PHE 637 Ca 0.30 -0.08 -0.11 0.00 3.82 0.00 0.00 57.97 61.91 2j1d h PHE 637 Cb 0.31 -0.19 -0.01 0.00 2.00 0.00 0.00 35.95 38.05 2j1d h PHE 637 CO -0.00 0.65 -0.41 0.87 -0.18 0.00 0.00 178.31 179.23 2j1d h LYS 638 N 0.61 0.23 0.13 1.51 1.57 -1.71 -3.33 116.57 115.59 2j1d h LYS 638 Ca 0.13 -0.11 -0.24 0.00 -1.87 0.00 0.00 60.65 58.55 2j1d h LYS 638 Cb 0.39 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.71 2j1d h LYS 638 CO 0.01 0.61 -1.18 0.82 -0.57 0.00 0.00 179.45 179.14 2j1d h ILE 639 N 0.20 1.23 -3.99 1.86 2.04 -1.12 -3.47 117.51 114.26 2j1d h ILE 639 Ca 0.02 -2.47 -0.52 0.00 1.00 0.00 0.00 64.86 62.89 2j1d h ILE 639 Cb 0.82 2.92 0.09 0.00 -0.74 0.00 0.00 36.82 39.90 2j1d h ILE 639 CO 0.06 0.71 0.56 -0.76 0.00 0.00 0.00 178.15 178.73 2j1d s LEU 640 N -7.68 4.06 -1.02 1.44 1.02 0.61 -4.95 118.68 112.16 2j1d s LEU 640 Ca -0.17 2.55 -0.23 0.00 0.02 0.00 0.00 54.13 56.30 2j1d s LEU 640 Cb 0.03 -4.11 0.04 0.00 0.02 0.00 0.00 46.19 42.17 2j1d s LEU 640 CO 0.80 -1.04 1.49 -0.62 0.02 0.00 0.00 176.35 177.00 2j1d s ASP 641 N -1.02 6.42 0.17 2.29 -1.08 -1.26 -4.85 116.67 117.35 2j1d s ASP 641 Ca 0.63 -1.44 -0.11 0.00 -0.52 0.00 0.00 52.55 51.11 2j1d s ASP 641 Cb -0.35 -2.57 0.05 0.00 -1.46 0.00 0.00 42.92 38.59 2j1d s ASP 641 CO 0.43 -1.58 1.64 -0.07 0.52 0.00 0.00 175.17 176.11 2j1d h LEU 642 N 13.12 0.97 -1.04 -1.34 3.38 -1.92 -2.71 115.31 125.77 2j1d h LEU 642 Ca 0.20 -0.29 0.19 0.00 0.09 0.00 0.00 57.88 58.08 2j1d h LEU 642 Cb 1.00 -0.26 -0.10 0.00 0.09 0.00 0.00 40.66 41.39 2j1d h LEU 642 CO 1.42 1.02 0.61 -0.08 0.09 0.00 0.00 178.44 181.50 2j1d h GLU 643 N 0.88 0.72 -0.24 1.13 4.81 -2.00 -0.12 114.58 119.77 2j1d h GLU 643 Ca 0.17 -0.04 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 2j1d h GLU 643 Cb 0.50 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2j1d h GLU 643 CO 0.02 0.48 -0.51 0.22 -0.73 0.00 0.00 179.01 178.49 2j1d h ASP 644 N 0.74 0.73 -0.08 1.04 -0.00 -1.90 -2.34 116.42 114.61 2j1d h ASP 644 Ca 0.58 -0.38 -0.00 0.00 -0.00 0.00 0.00 57.03 57.23 2j1d h ASP 644 Cb 0.93 -0.21 -0.00 0.00 -0.00 0.00 0.00 39.33 40.04 2j1d h ASP 644 CO -0.37 1.11 0.04 0.25 -0.00 0.00 0.00 179.24 180.27 2j1d h LEU 645 N 0.52 0.10 -0.56 2.28 6.46 -0.94 -2.00 115.31 121.17 2j1d h LEU 645 Ca 0.02 -0.08 0.01 0.00 -0.12 0.00 0.00 57.88 57.71 2j1d h LEU 645 Cb 1.07 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.94 2j1d h LEU 645 CO 0.10 0.14 0.36 -0.33 -0.62 0.00 0.00 178.44 178.10 2j1d h GLU 646 N 0.04 0.72 -0.23 1.25 5.08 -1.06 -0.96 114.58 119.42 2j1d h GLU 646 Ca 0.03 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2j1d h GLU 646 Cb 0.07 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2j1d h GLU 646 CO -0.00 0.47 0.14 0.00 -1.00 0.00 0.00 179.01 178.62 2j1d h ARG 647 N 0.74 0.32 0.00 2.33 3.08 -1.37 -1.66 114.38 117.82 2j1d h ARG 647 Ca 0.21 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 2j1d h ARG 647 Cb -0.06 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 2j1d h ARG 647 CO -0.06 0.25 -0.16 0.00 -1.07 0.00 0.00 179.97 178.93 2j1d h THR 648 N 0.29 0.02 -0.77 2.04 1.03 -1.13 -3.28 112.91 111.11 2j1d h THR 648 Ca 0.08 -1.03 -0.43 0.00 -0.01 0.00 0.00 66.41 65.03 2j1d h THR 648 Cb 0.01 1.93 -0.42 0.00 -1.07 0.00 0.00 68.15 68.61 2j1d h THR 648 CO -0.02 0.01 -0.95 0.49 -0.01 0.00 0.00 175.52 175.05 2j1d n PHE 649 N -3.04 2.17 -2.07 0.00 3.01 -0.38 -5.09 117.46 112.06 2j1d n PHE 649 Ca 0.03 -2.37 -0.36 0.00 1.01 0.00 0.00 57.45 55.77 2j1d n PHE 649 Cb 0.54 -0.27 0.02 0.00 -0.01 0.00 0.00 39.48 39.76 2j1d n PHE 649 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2j1d s SER 650 N -3.62 5.36 0.33 4.37 1.04 -0.62 -1.33 113.70 119.23 2j1d s SER 650 Ca 0.40 2.36 0.04 0.00 0.48 0.00 0.00 55.95 59.23 2j1d s SER 650 Cb 0.38 -2.60 0.58 0.00 0.10 0.00 0.00 66.02 64.48 2j1d s SER 650 CO -0.02 -1.48 1.86 0.00 0.98 0.00 0.00 173.24 174.59 2j1d h ALA 651 N 1.06 1.34 -2.37 5.32 0.00 -1.44 -3.37 119.26 119.80 2j1d h ALA 651 Ca -0.50 -0.21 -0.60 0.00 0.00 0.00 0.00 54.91 53.59 2j1d h ALA 651 Cb 1.29 -0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 2j1d h ALA 651 CO 0.56 0.45 0.31 0.71 0.00 0.00 0.00 179.25 181.28 2j1d s TYR 652 N -4.93 3.28 0.06 0.00 1.51 -1.26 -0.24 117.35 115.77 2j1d s TYR 652 Ca -0.08 0.94 0.00 0.00 -1.01 0.00 0.00 57.07 56.93 2j1d s TYR 652 Cb 0.15 -2.97 0.00 0.00 -0.11 0.00 0.00 41.96 39.04 2j1d s TYR 652 CO 0.77 -0.38 0.00 1.04 -1.11 0.00 0.00 175.55 175.87 2j1d n GLN 653 N 5.88 -3.26 -3.87 -0.62 1.13 -1.26 -4.90 117.38 110.48 2j1d n GLN 653 Ca 0.02 2.53 -0.36 0.00 -1.94 0.00 0.00 57.00 57.26 2j1d n GLN 653 Cb 0.48 -2.85 -0.12 0.00 0.11 0.00 0.00 30.24 27.87 2j1d n GLN 653 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2j1d s LYS 683 N -1.35 3.74 0.18 -1.09 -2.85 -1.26 -4.70 119.74 112.40 2j1d s LYS 683 Ca 0.00 -0.45 -0.12 0.00 -1.00 0.00 0.00 55.97 54.41 2j1d s LYS 683 Cb 0.00 -3.27 -0.07 0.00 -2.06 0.00 0.00 37.83 32.43 2j1d s LYS 683 CO 0.00 -0.04 0.53 -1.83 0.10 0.00 0.00 175.35 174.11 2j1d s GLU 684 N 1.22 3.87 -0.17 1.78 -1.05 -1.26 -4.95 118.70 118.14 2j1d s GLU 684 Ca 0.04 0.36 -0.27 0.00 -0.15 0.00 0.00 54.97 54.95 2j1d s GLU 684 Cb -0.14 -2.81 -0.01 0.00 -0.44 0.00 0.00 34.13 30.72 2j1d s GLU 684 CO 0.03 0.42 0.90 -1.17 0.95 0.00 0.00 175.26 176.38 2j1d s LEU 685 N -2.33 4.17 -0.13 1.83 0.20 0.17 -4.26 118.68 118.33 2j1d s LEU 685 Ca 0.41 1.26 -0.04 0.00 0.69 0.00 0.00 54.13 56.46 2j1d s LEU 685 Cb -0.13 -3.34 0.05 0.00 -0.43 0.00 0.00 46.19 42.34 2j1d s LEU 685 CO 0.20 -0.46 0.08 -0.55 -0.29 0.00 0.00 176.35 175.33 2j1d s SER 686 N 1.16 1.93 0.00 3.68 0.15 0.67 -0.04 113.70 121.25 2j1d s SER 686 Ca 0.41 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.68 2j1d s SER 686 Cb -0.17 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 2j1d s SER 686 CO 0.12 -0.32 0.00 0.52 1.20 0.00 0.00 173.24 174.77 2j1d n VAL 687 N 5.28 0.00 -1.60 4.45 0.31 -1.26 -4.55 118.33 120.96 2j1d n VAL 687 Ca -0.06 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.83 2j1d n VAL 687 Cb 0.49 -0.84 -0.02 0.00 -0.91 0.00 0.00 33.84 32.56 2j1d n VAL 687 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2j1d n ILE 688 N -2.58 1.84 -0.82 2.52 2.08 -1.26 -1.82 119.36 119.32 2j1d n ILE 688 Ca 0.00 -0.46 -0.31 0.00 0.56 0.00 0.00 62.75 62.54 2j1d n ILE 688 Cb 0.36 -1.05 0.15 0.00 -0.75 0.00 0.00 39.64 38.35 2j1d n ILE 688 CO 0.00 0.00 0.00 1.51 0.56 0.00 0.00 176.55 178.62 2j1d s ASP 689 N -0.44 3.22 0.25 4.38 1.47 -1.26 -4.73 116.67 119.55 2j1d s ASP 689 Ca 0.60 2.15 0.01 0.00 1.18 0.00 0.00 52.55 56.49 2j1d s ASP 689 Cb -0.70 -2.56 0.32 0.00 -0.34 0.00 0.00 42.92 39.64 2j1d s ASP 689 CO 0.59 -2.91 1.65 1.23 0.68 0.00 0.00 175.17 176.42 2j1d h GLY 690 N -1.68 0.51 0.82 2.12 0.00 -1.94 -0.32 103.07 102.58 2j1d h GLY 690 Ca -0.43 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.40 2j1d h GLY 690 CO 0.43 0.43 -0.24 -0.09 0.00 0.00 0.00 176.54 177.07 2j1d h ARG 691 N 0.40 -0.66 -0.70 4.80 2.43 -1.99 0.76 114.38 119.42 2j1d h ARG 691 Ca 0.04 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2j1d h ARG 691 Cb 0.82 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 2j1d h ARG 691 CO 0.07 -0.36 0.40 0.00 -1.51 0.00 0.00 179.97 178.56 2j1d h ARG 692 N -0.87 0.97 -0.16 0.20 3.08 -1.92 -1.50 114.38 114.18 2j1d h ARG 692 Ca -0.07 -0.10 0.02 0.00 0.07 0.00 0.00 59.98 59.89 2j1d h ARG 692 Cb 0.59 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2j1d h ARG 692 CO 0.11 0.71 0.04 0.00 -1.07 0.00 0.00 179.97 179.77 2j1d h ALA 693 N 1.20 0.16 -0.51 0.04 0.00 -1.03 -1.96 119.26 117.17 2j1d h ALA 693 Ca 0.25 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 2j1d h ALA 693 Cb 0.01 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2j1d h ALA 693 CO -0.04 -0.40 0.17 0.37 0.00 0.00 0.00 179.25 179.34 2j1d h GLN 694 N 0.11 0.75 -0.99 0.00 5.75 -0.64 -1.48 115.11 118.61 2j1d h GLN 694 Ca 0.07 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.45 2j1d h GLN 694 Cb 0.05 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.43 2j1d h GLN 694 CO -0.09 0.64 0.64 -0.91 -2.65 0.00 0.00 178.83 176.47 2j1d h ASN 695 N 0.73 1.15 -0.02 -0.69 2.35 -0.92 -1.90 115.58 116.28 2j1d h ASN 695 Ca 0.17 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2j1d h ASN 695 Cb 0.20 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 2j1d h ASN 695 CO -0.01 0.85 0.01 0.00 -1.65 0.00 0.00 177.43 176.62 2j1d h ASN 697 N -0.15 0.29 -0.04 0.00 -0.26 -1.04 0.22 115.58 114.61 2j1d h ASN 697 Ca 0.01 -0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.73 2j1d h ASN 697 Cb 0.19 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 37.37 2j1d h ASN 697 CO -0.00 0.21 0.01 0.40 -1.06 0.00 0.00 177.43 176.99 2j1d h ILE 698 N 0.35 1.19 -0.74 2.81 2.04 -1.33 -1.97 117.51 119.85 2j1d h ILE 698 Ca 0.10 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.34 2j1d h ILE 698 Cb -0.03 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2j1d h ILE 698 CO -0.02 0.16 0.31 0.25 0.00 0.00 0.00 178.15 178.85 2j1d h LEU 699 N -0.16 1.00 -0.74 1.44 5.85 -1.00 -2.55 115.31 119.14 2j1d h LEU 699 Ca 0.01 -0.16 -0.13 0.00 0.84 0.00 0.00 57.88 58.44 2j1d h LEU 699 Cb 0.24 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 2j1d h LEU 699 CO 0.00 0.89 -0.49 -0.07 -0.34 0.00 0.00 178.44 178.44 2j1d h LEU 700 N 1.05 0.38 -0.91 2.25 3.38 -0.62 0.80 115.31 121.64 2j1d h LEU 700 Ca 0.25 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2j1d h LEU 700 Cb 0.19 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2j1d h LEU 700 CO -0.02 0.81 0.00 0.77 0.09 0.00 0.00 178.44 180.09 2j1d h SER 701 N 0.28 0.00 0.08 -0.43 4.64 -1.19 -1.28 113.55 115.65 2j1d h SER 701 Ca 0.01 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.99 2j1d h SER 701 Cb 0.96 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.02 2j1d h SER 701 CO 0.08 0.00 -1.93 -1.14 -0.87 0.00 0.00 176.83 172.97 2j1d n ARG 702 N -2.85 0.70 -0.03 4.77 0.63 -0.98 -4.31 116.66 114.60 2j1d n ARG 702 Ca 0.02 0.31 -0.07 0.00 -0.92 0.00 0.00 57.85 57.19 2j1d n ARG 702 Cb 0.34 -1.68 0.11 0.00 0.45 0.00 0.00 32.46 31.68 2j1d n ARG 702 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 2j1d h LEU 703 N -0.21 0.64 2.62 6.15 6.46 -0.80 -3.47 115.31 126.69 2j1d h LEU 703 Ca -0.44 -0.26 -0.42 0.00 -0.12 0.00 0.00 57.88 56.64 2j1d h LEU 703 Cb 1.85 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 41.55 2j1d h LEU 703 CO -0.02 0.93 -0.51 0.29 -0.62 0.00 0.00 178.44 178.51 2j1d n LYS 704 N -4.06 -1.63 -4.35 1.25 5.02 -0.49 -5.00 118.16 108.90 2j1d n LYS 704 Ca -0.01 1.05 -0.31 0.00 -2.02 0.00 0.00 58.31 57.03 2j1d n LYS 704 Cb 0.48 -5.66 -0.10 0.00 -0.02 0.00 0.00 35.03 29.73 2j1d n LYS 704 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2j1d s LEU 705 N -5.78 3.02 0.77 -0.35 1.43 -1.26 -5.11 118.68 111.40 2j1d s LEU 705 Ca 0.00 -0.32 -0.09 0.00 -1.03 0.00 0.00 54.13 52.69 2j1d s LEU 705 Cb 0.00 -1.79 0.08 0.00 0.03 0.00 0.00 46.19 44.51 2j1d s LEU 705 CO 0.00 0.22 1.10 -0.94 0.23 0.00 0.00 176.35 176.96 2j1d s SER 706 N -1.89 4.53 0.40 2.29 1.04 -1.26 -4.86 113.70 113.95 2j1d s SER 706 Ca 0.19 0.51 0.10 0.00 0.48 0.00 0.00 55.95 57.24 2j1d s SER 706 Cb -0.11 -1.04 0.82 0.00 0.10 0.00 0.00 66.02 65.79 2j1d s SER 706 CO 0.11 -1.82 1.93 0.78 0.98 0.00 0.00 173.24 175.22 2j1d h ASN 707 N -0.85 0.20 -0.01 7.02 2.35 -1.99 -0.45 115.58 121.85 2j1d h ASN 707 Ca -0.45 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2j1d h ASN 707 Cb 1.31 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 39.63 2j1d h ASN 707 CO 0.59 0.35 0.00 0.44 -1.65 0.00 0.00 177.43 177.16 2j1d h ASP 708 N 0.20 0.01 -0.39 5.81 3.32 -2.00 -1.43 116.42 121.96 2j1d h ASP 708 Ca 0.04 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 56.93 2j1d h ASP 708 Cb 0.34 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2j1d h ASP 708 CO 0.02 0.19 0.22 -0.33 -1.72 0.00 0.00 179.24 177.62 2j1d h GLU 709 N -0.16 0.43 -0.09 3.56 5.08 -1.86 -1.87 114.58 119.66 2j1d h GLU 709 Ca 0.00 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2j1d h GLU 709 Cb 0.18 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2j1d h GLU 709 CO -0.00 0.28 -0.05 0.82 -1.00 0.00 0.00 179.01 179.07 2j1d h ILE 710 N 0.44 0.84 -0.89 3.13 2.04 -0.97 -0.76 117.51 121.35 2j1d h ILE 710 Ca 0.16 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.09 2j1d h ILE 710 Cb 0.02 0.84 -0.07 0.00 -0.74 0.00 0.00 36.82 36.88 2j1d h ILE 710 CO -0.08 0.00 0.55 0.50 0.00 0.00 0.00 178.15 179.11 2j1d h LYS 711 N -0.04 0.94 -0.55 2.37 3.64 -0.98 -0.90 116.57 121.05 2j1d h LYS 711 Ca 0.05 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2j1d h LYS 711 Cb 0.12 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2j1d h LYS 711 CO -0.12 0.62 0.25 0.00 -2.27 0.00 0.00 179.45 177.92 2j1d h ARG 712 N 0.97 0.80 -0.58 1.90 3.08 -0.96 -0.19 114.38 119.40 2j1d h ARG 712 Ca 0.40 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 2j1d h ARG 712 Cb 0.24 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 2j1d h ARG 712 CO -0.20 0.67 0.32 0.00 -1.07 0.00 0.00 179.97 179.70 2j1d h ALA 713 N 1.09 0.74 0.21 0.04 0.00 -0.58 -0.96 119.26 119.79 2j1d h ALA 713 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2j1d h ALA 713 Cb 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2j1d h ALA 713 CO -0.02 0.25 -0.10 0.82 0.00 0.00 0.00 179.25 180.20 2j1d h ILE 714 N 0.78 0.85 -0.68 0.00 1.08 -1.07 0.75 117.51 119.21 2j1d h ILE 714 Ca 0.20 -0.29 -0.05 0.00 -0.39 0.00 0.00 64.86 64.33 2j1d h ILE 714 Cb 0.03 1.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.77 2j1d h ILE 714 CO -0.03 0.07 0.23 -0.07 -0.69 0.00 0.00 178.15 177.65 2j1d h LEU 715 N -0.43 0.96 -1.40 1.44 -0.00 -0.87 -1.84 115.31 113.18 2j1d h LEU 715 Ca -0.03 -0.16 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 2j1d h LEU 715 Cb 0.33 -0.25 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 2j1d h LEU 715 CO 0.05 0.89 0.00 0.35 -0.00 0.00 0.00 178.44 179.73 2j1d n THR 716 N -4.27 0.57 -4.06 0.22 -2.24 -0.38 -1.55 114.28 102.57 2j1d n THR 716 Ca 0.06 -0.49 -0.28 0.00 -2.27 0.00 0.00 64.05 61.06 2j1d n THR 716 Cb 0.21 0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 2j1d n THR 716 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2j1d n MET 717 N 0.49 -2.95 -3.57 -0.78 2.81 -0.69 -3.32 117.12 109.11 2j1d n MET 717 Ca 0.12 0.35 -0.25 0.00 -1.81 0.00 0.00 57.70 56.12 2j1d n MET 717 Cb 0.35 -4.52 0.05 0.00 -0.71 0.00 0.00 33.22 28.38 2j1d n MET 717 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2j1d n ASP 718 N -2.90 -4.75 0.24 7.83 2.03 0.26 -4.92 116.55 114.35 2j1d n ASP 718 Ca -0.23 -0.89 0.13 0.00 0.52 0.00 0.00 54.79 54.32 2j1d n ASP 718 Cb 0.65 -4.04 0.56 0.00 -0.72 0.00 0.00 41.12 37.57 2j1d n ASP 718 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2j1d h GLU 719 N -1.66 0.00 -0.11 -0.67 4.11 -1.82 -2.44 114.58 111.99 2j1d h GLU 719 Ca -0.64 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.79 2j1d h GLU 719 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 2j1d h GLU 719 CO 0.49 0.14 0.00 1.04 0.07 0.00 0.00 179.01 180.75 2j1d n GLN 720 N -3.30 1.92 -3.39 1.06 1.13 -1.26 -4.98 117.38 108.56 2j1d n GLN 720 Ca 0.00 -1.35 -0.17 0.00 -1.94 0.00 0.00 57.00 53.54 2j1d n GLN 720 Cb 0.37 -1.46 0.08 0.00 0.11 0.00 0.00 30.24 29.35 2j1d n GLN 720 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2j1d n GLU 721 N 0.61 -6.51 0.00 -1.09 1.02 -0.92 -4.92 120.64 108.83 2j1d n GLU 721 Ca 0.17 0.80 0.12 0.00 -0.02 0.00 0.00 57.16 58.23 2j1d n GLU 721 Cb 0.43 -5.69 0.15 0.00 -0.02 0.00 0.00 31.44 26.31 2j1d n GLU 721 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2j1d n ASP 722 N -2.97 1.85 -3.87 1.62 8.00 -1.26 -4.71 116.55 115.21 2j1d n ASP 722 Ca -0.22 -1.41 -0.28 0.00 0.71 0.00 0.00 54.79 53.58 2j1d n ASP 722 Cb 0.64 0.29 -0.12 0.00 -0.02 0.00 0.00 41.12 41.91 2j1d n ASP 722 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2j1d s LEU 723 N -2.39 4.39 1.00 0.64 1.43 -1.26 -5.04 118.68 117.45 2j1d s LEU 723 Ca 0.23 -3.57 -0.11 0.00 -1.03 0.00 0.00 54.13 49.65 2j1d s LEU 723 Cb 0.19 -1.53 0.19 0.00 0.03 0.00 0.00 46.19 45.07 2j1d s LEU 723 CO 0.50 -0.13 1.10 -2.84 0.23 0.00 0.00 176.35 175.21 2j1d s PRO 724 N -1.02 0.36 0.25 1.29 0.02 -1.26 -4.69 135.00 129.95 2j1d s PRO 724 Ca 0.23 1.25 -0.04 0.00 0.02 0.00 0.00 61.00 62.47 2j1d s PRO 724 Cb -0.09 -1.67 0.49 0.00 0.02 0.00 0.00 34.50 33.24 2j1d s PRO 724 CO -0.12 -2.98 1.70 0.87 -0.33 0.00 0.00 177.00 176.13 2j1d h LYS 725 N -2.11 0.31 0.00 5.54 1.57 -1.98 -0.89 116.57 119.01 2j1d h LYS 725 Ca -0.50 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.15 2j1d h LYS 725 Cb 1.29 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 2j1d h LYS 725 CO 0.46 0.21 -0.55 0.38 -0.57 0.00 0.00 179.45 179.37 2j1d h ASP 726 N 0.32 0.00 0.03 0.86 2.03 -2.00 -1.66 116.42 116.00 2j1d h ASP 726 Ca 0.43 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.51 2j1d h ASP 726 Cb 0.73 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.24 2j1d h ASP 726 CO -0.49 0.55 -0.81 0.24 -1.03 0.00 0.00 179.24 177.70 2j1d h MET 727 N 0.00 0.64 -0.80 4.15 2.86 -1.78 -2.84 114.93 117.16 2j1d h MET 727 Ca -0.01 -0.55 -0.05 0.00 -2.06 0.00 0.00 59.70 57.03 2j1d h MET 727 Cb 1.08 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.83 2j1d h MET 727 CO 0.07 1.17 0.31 -0.07 1.06 0.00 0.00 176.91 179.45 2j1d h LEU 728 N 0.42 1.11 0.13 1.22 3.38 -0.87 0.18 115.31 120.88 2j1d h LEU 728 Ca -0.06 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.75 2j1d h LEU 728 Cb 1.42 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 2j1d h LEU 728 CO 0.16 0.99 -0.27 -0.08 0.09 0.00 0.00 178.44 179.32 2j1d h GLU 729 N 1.17 -0.47 -0.89 1.13 4.81 -1.37 0.92 114.58 119.87 2j1d h GLU 729 Ca 0.26 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 2j1d h GLU 729 Cb 0.23 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 2j1d h GLU 729 CO -0.02 -0.31 0.46 1.96 -0.73 0.00 0.00 179.01 180.37 2j1d h GLN 730 N -0.49 1.25 -0.15 1.92 1.08 -1.24 -2.51 115.11 114.98 2j1d h GLN 730 Ca 0.03 -0.16 -0.04 0.00 -1.45 0.00 0.00 58.65 57.03 2j1d h GLN 730 Cb 0.51 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2j1d h GLN 730 CO -0.15 0.93 -0.09 1.25 -0.95 0.00 0.00 178.83 179.83 2j1d h LEU 731 N 1.25 0.21 -1.06 1.46 5.85 -0.38 -1.91 115.31 120.73 2j1d h LEU 731 Ca 0.31 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.99 2j1d h LEU 731 Cb 0.06 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2j1d h LEU 731 CO -0.05 0.33 0.00 -0.07 -0.34 0.00 0.00 178.44 178.31 2j1d h LEU 732 N 0.22 0.00 0.13 2.25 3.38 -0.37 -3.02 115.31 117.91 2j1d h LEU 732 Ca 0.05 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.72 2j1d h LEU 732 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2j1d h LEU 732 CO 0.02 0.00 -1.40 0.11 0.09 0.00 0.00 178.44 177.26 2j1d h LYS 733 N 0.00 0.28 -2.02 1.13 1.57 -1.21 -3.36 116.57 112.96 2j1d h LYS 733 Ca 0.00 -0.48 -0.72 0.00 -1.87 0.00 0.00 60.65 57.58 2j1d h LYS 733 Cb 0.56 0.18 -0.25 0.00 0.08 0.00 0.00 32.23 32.80 2j1d h LYS 733 CO 0.00 1.19 0.96 1.19 -0.57 0.00 0.00 179.45 182.21 2j1d n PHE 734 N -3.51 2.70 -3.26 -1.35 3.01 -1.10 -4.96 117.46 108.99 2j1d n PHE 734 Ca -0.13 -2.26 -0.38 0.00 1.01 0.00 0.00 57.45 55.68 2j1d n PHE 734 Cb 1.04 -1.23 -0.06 0.00 -0.01 0.00 0.00 39.48 39.22 2j1d n PHE 734 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2j1d s VAL 735 N -4.47 5.06 0.26 -4.37 1.01 -1.24 -4.99 120.40 111.66 2j1d s VAL 735 Ca 0.53 1.11 -0.30 0.00 0.00 0.00 0.00 61.98 63.32 2j1d s VAL 735 Cb 0.41 -3.88 -0.10 0.00 0.00 0.00 0.00 36.38 32.82 2j1d s VAL 735 CO -0.37 0.37 1.33 -2.84 0.00 0.00 0.00 175.10 173.60 2j1d s PRO 736 N 0.21 4.36 0.38 2.72 0.02 -1.26 -5.00 135.00 136.43 2j1d s PRO 736 Ca 0.29 2.17 -0.00 0.00 0.02 0.00 0.00 61.00 63.47 2j1d s PRO 736 Cb -0.17 -3.13 -0.03 0.00 0.02 0.00 0.00 34.50 31.20 2j1d s PRO 736 CO 0.14 -0.25 0.61 -1.21 -0.33 0.00 0.00 177.00 175.96 2j1d s GLU 737 N -0.87 3.44 0.31 5.54 2.02 -1.26 -4.91 118.70 122.96 2j1d s GLU 737 Ca 0.54 -0.26 0.07 0.00 0.02 0.00 0.00 54.97 55.33 2j1d s GLU 737 Cb -0.39 -2.60 0.84 0.00 0.10 0.00 0.00 34.13 32.09 2j1d s GLU 737 CO 0.45 0.03 1.67 -0.22 0.02 0.00 0.00 175.26 177.22 2j1d h LYS 738 N 0.61 0.32 0.03 1.61 1.63 -1.99 -0.26 116.57 118.52 2j1d h LYS 738 Ca -0.49 -0.02 -0.22 0.00 -0.85 0.00 0.00 60.65 59.08 2j1d h LYS 738 Cb 1.22 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 32.76 2j1d h LYS 738 CO 0.61 0.21 -1.01 0.66 -3.45 0.00 0.00 179.45 176.47 2j1d h SER 739 N 0.33 0.13 -0.48 4.20 4.64 -1.99 -1.76 113.55 118.62 2j1d h SER 739 Ca 0.62 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.79 2j1d h SER 739 Cb 1.27 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 2j1d h SER 739 CO -0.59 1.05 0.23 0.44 -0.87 0.00 0.00 176.83 177.10 2j1d h ASP 740 N 0.03 0.63 -0.14 4.97 3.32 -1.53 -2.60 116.42 121.10 2j1d h ASP 740 Ca -0.04 -0.13 -0.18 0.00 0.02 0.00 0.00 57.03 56.70 2j1d h ASP 740 Cb 1.73 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 41.13 2j1d h ASP 740 CO 0.14 0.58 -0.62 0.16 -1.72 0.00 0.00 179.24 177.79 2j1d h ILE 741 N 0.64 1.32 -0.80 0.35 3.07 -1.02 -2.01 117.51 119.06 2j1d h ILE 741 Ca 0.17 -1.87 0.18 0.00 1.55 0.00 0.00 64.86 64.89 2j1d h ILE 741 Cb 0.11 2.06 -0.12 0.00 -0.27 0.00 0.00 36.82 38.61 2j1d h ILE 741 CO -0.02 0.58 0.26 0.44 -1.05 0.00 0.00 178.15 178.36 2j1d h ASP 742 N 0.33 0.13 0.08 2.16 3.32 -1.34 0.20 116.42 121.30 2j1d h ASP 742 Ca -0.04 0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 2j1d h ASP 742 Cb 1.25 0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.98 2j1d h ASP 742 CO 0.13 -0.03 -0.04 0.25 -1.72 0.00 0.00 179.24 177.83 2j1d h LEU 743 N 0.32 -0.09 -1.05 1.55 5.85 -1.32 -3.06 115.31 117.50 2j1d h LEU 743 Ca 0.47 -0.29 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 2j1d h LEU 743 Cb 0.85 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 2j1d h LEU 743 CO -0.52 0.24 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.43 2j1d h LEU 744 N -0.44 0.28 -1.27 2.25 3.38 -0.93 -2.03 115.31 116.55 2j1d h LEU 744 Ca -0.01 -0.10 0.28 0.00 0.09 0.00 0.00 57.88 58.14 2j1d h LEU 744 Cb 0.38 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.94 2j1d h LEU 744 CO 0.02 0.59 0.67 -0.08 0.09 0.00 0.00 178.44 179.73 2j1d h GLU 745 N 0.24 0.38 0.00 1.13 4.57 -0.62 0.18 114.58 120.47 2j1d h GLU 745 Ca 0.03 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 2j1d h GLU 745 Cb 0.68 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2j1d h GLU 745 CO 0.05 0.25 0.00 0.93 -1.18 0.00 0.00 179.01 179.07 2j1d h GLU 746 N 0.40 0.00 0.00 1.92 4.39 -1.25 -3.05 114.58 116.98 2j1d h GLU 746 Ca 0.64 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 60.26 2j1d h GLU 746 Cb 1.57 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 30.05 2j1d h GLU 746 CO -0.37 0.00 -0.70 0.72 -1.16 0.00 0.00 179.01 177.50 2j1d n HIS 747 N -2.55 0.00 0.29 4.33 8.25 0.62 -4.85 115.22 121.31 2j1d n HIS 747 Ca -0.02 -0.91 0.14 0.00 -0.26 0.00 0.00 57.72 56.67 2j1d n HIS 747 Cb 0.05 -0.18 0.66 0.00 1.12 0.00 0.00 29.99 31.64 2j1d n HIS 747 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 2j1d h LYS 748 N 0.85 0.00 -0.41 -0.41 2.10 -1.39 0.63 116.57 117.95 2j1d h LYS 748 Ca -0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 2j1d h LYS 748 Cb 1.43 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.76 2j1d h LYS 748 CO 0.04 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 178.21 2j1d n HIS 749 N -2.50 0.54 -2.00 0.07 8.25 -1.26 -4.20 115.22 114.12 2j1d n HIS 749 Ca -0.00 -0.27 0.05 0.00 -0.26 0.00 0.00 57.72 57.24 2j1d n HIS 749 Cb 0.15 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.37 2j1d n HIS 749 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2j1d n GLU 750 N 1.00 0.80 -0.30 -0.41 1.02 0.21 -4.86 120.64 118.10 2j1d n GLU 750 Ca 0.18 -2.61 0.10 0.00 -0.02 0.00 0.00 57.16 54.81 2j1d n GLU 750 Cb 0.46 -0.84 0.33 0.00 -0.02 0.00 0.00 31.44 31.37 2j1d n GLU 750 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2j1d h LEU 751 N 0.92 0.75 -0.85 -4.62 3.38 -1.73 -0.66 115.31 112.51 2j1d h LEU 751 Ca -0.10 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2j1d h LEU 751 Cb 1.42 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2j1d h LEU 751 CO 0.05 0.40 0.00 -2.24 0.09 0.00 0.00 178.44 176.73 2j1d h ASP 752 N 0.80 0.00 0.64 -0.43 3.04 -1.94 -2.14 116.42 116.39 2j1d h ASP 752 Ca 0.45 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.24 2j1d h ASP 752 Cb 0.60 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.89 2j1d h ASP 752 CO -0.22 0.00 -0.91 0.54 -2.04 0.00 0.00 179.24 176.61 2j1d n ARG 753 N -2.38 0.34 -1.98 4.15 5.12 -0.27 -4.99 116.66 116.64 2j1d n ARG 753 Ca 0.02 0.04 -0.41 0.00 -1.93 0.00 0.00 57.85 55.56 2j1d n ARG 753 Cb 0.24 -1.65 -0.02 0.00 -1.16 0.00 0.00 32.46 29.87 2j1d n ARG 753 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2j1d s MET 754 N -3.22 4.25 0.96 5.56 -1.94 -0.81 0.43 119.30 124.53 2j1d s MET 754 Ca 0.04 2.35 -0.11 0.00 -1.71 0.00 0.00 55.69 56.26 2j1d s MET 754 Cb 0.13 -3.06 0.14 0.00 2.01 0.00 0.00 34.83 34.06 2j1d s MET 754 CO 0.78 -0.38 0.97 0.00 -0.01 0.00 0.00 175.02 176.38 2j1d n ALA 755 N 1.31 -1.44 -0.05 3.03 0.00 0.94 -4.69 120.51 119.62 2j1d n ALA 755 Ca 0.03 -0.65 -0.08 0.00 0.00 0.00 0.00 53.44 52.74 2j1d n ALA 755 Cb 0.40 -2.09 -0.01 0.00 0.00 0.00 0.00 19.45 17.75 2j1d n ALA 755 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2j1d h LYS 756 N -1.93 -0.13 -0.67 0.00 3.64 -1.94 -1.06 116.57 114.47 2j1d h LYS 756 Ca -0.45 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 58.86 2j1d h LYS 756 Cb 1.28 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.10 2j1d h LYS 756 CO 0.41 -0.09 0.11 0.00 -2.27 0.00 0.00 179.45 177.61 2j1d h ALA 757 N 1.03 0.93 -0.19 5.00 0.00 -1.92 -0.27 119.26 123.83 2j1d h ALA 757 Ca 0.14 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2j1d h ALA 757 Cb 0.34 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2j1d h ALA 757 CO -0.33 0.67 0.05 -0.44 0.00 0.00 0.00 179.25 179.20 2j1d h ASP 758 N 1.04 0.29 -0.60 0.00 3.32 -1.81 -0.62 116.42 118.04 2j1d h ASP 758 Ca 0.21 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 2j1d h ASP 758 Cb 0.43 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 2j1d h ASP 758 CO 0.01 0.44 0.07 -0.09 -1.72 0.00 0.00 179.24 177.96 2j1d h ARG 759 N 0.13 1.01 0.19 3.56 9.65 -1.08 -1.25 114.38 126.59 2j1d h ARG 759 Ca 0.06 -0.28 0.01 0.00 -1.10 0.00 0.00 59.98 58.66 2j1d h ARG 759 Cb 0.26 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 2j1d h ARG 759 CO 0.00 0.96 -0.24 0.35 2.80 0.00 0.00 179.97 183.84 2j1d h PHE 760 N 0.91 -0.64 -0.53 2.20 3.57 -0.96 0.68 116.94 122.17 2j1d h PHE 760 Ca 0.18 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 2j1d h PHE 760 Cb 0.46 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.43 2j1d h PHE 760 CO 0.03 -0.35 0.29 -0.07 -2.23 0.00 0.00 178.31 175.98 2j1d h LEU 761 N -0.49 0.65 -0.08 0.59 3.38 -1.01 -0.51 115.31 117.85 2j1d h LEU 761 Ca 0.01 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2j1d h LEU 761 Cb 0.47 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 2j1d h LEU 761 CO -0.09 0.53 -0.09 0.15 0.09 0.00 0.00 178.44 179.03 2j1d h PHE 762 N 0.74 0.25 -0.54 1.13 3.57 -0.98 -2.50 116.94 118.62 2j1d h PHE 762 Ca 0.19 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.63 2j1d h PHE 762 Cb 0.03 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2j1d h PHE 762 CO 0.00 0.65 0.34 0.93 -2.23 0.00 0.00 178.31 178.00 2j1d h GLU 763 N -0.22 0.66 -0.20 1.11 4.39 -0.58 -2.11 114.58 117.63 2j1d h GLU 763 Ca 0.01 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2j1d h GLU 763 Cb 0.61 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 2j1d h GLU 763 CO 0.02 0.44 0.06 0.52 -1.16 0.00 0.00 179.01 178.89 2j1d h MET 764 N 0.68 0.27 0.00 2.33 2.86 -1.12 -1.68 114.93 118.27 2j1d h MET 764 Ca 0.21 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.78 2j1d h MET 764 Cb -0.02 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 2j1d h MET 764 CO -0.07 0.24 -0.20 0.66 1.06 0.00 0.00 176.91 178.59 2j1d h SER 765 N 0.27 0.00 0.81 1.22 4.64 -0.92 -3.03 113.55 116.54 2j1d h SER 765 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2j1d h SER 765 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2j1d h SER 765 CO -0.01 0.20 0.00 0.03 -0.87 0.00 0.00 176.83 176.19 2j1d h ARG 766 N 0.00 0.00 -6.24 4.77 2.47 -0.91 -3.45 114.38 111.01 2j1d h ARG 766 Ca -0.00 0.00 -0.55 0.00 -1.26 0.00 0.00 59.98 58.17 2j1d h ARG 766 Cb 0.77 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.05 2j1d h ARG 766 CO 0.03 0.00 0.22 0.42 0.56 0.00 0.00 179.97 181.19 2j1d s ILE 767 N -3.37 4.91 0.12 2.04 1.01 -1.15 -4.96 121.20 119.80 2j1d s ILE 767 Ca 0.04 1.73 -0.34 0.00 0.00 0.00 0.00 60.65 62.09 2j1d s ILE 767 Cb 0.09 -4.17 -0.13 0.00 0.01 0.00 0.00 42.46 38.26 2j1d s ILE 767 CO 0.43 0.23 1.64 -3.20 0.00 0.00 0.00 174.94 174.04 2j1d n ASN 768 N 3.65 3.20 -3.85 3.58 2.85 -1.26 -2.96 115.26 120.47 2j1d n ASN 768 Ca 0.02 1.06 -0.31 0.00 -0.11 0.00 0.00 54.58 55.24 2j1d n ASN 768 Cb 0.51 -1.43 0.01 0.00 1.24 0.00 0.00 39.78 40.12 2j1d n ASN 768 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 2j1d n HIS 769 N 4.00 -1.73 0.24 1.20 8.25 -1.26 -4.86 115.22 121.07 2j1d n HIS 769 Ca 0.18 0.53 -0.15 0.00 -0.26 0.00 0.00 57.72 58.01 2j1d n HIS 769 Cb 0.29 -3.47 -0.08 0.00 1.12 0.00 0.00 29.99 27.85 2j1d n HIS 769 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2j1d h TYR 770 N -1.96 -0.54 -0.52 4.41 5.03 -1.83 -1.36 116.97 120.20 2j1d h TYR 770 Ca -0.66 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 60.68 2j1d h TYR 770 Cb 1.37 0.18 -0.04 0.00 1.55 0.00 0.00 36.73 39.79 2j1d h TYR 770 CO 0.41 -0.28 0.28 0.37 -1.32 0.00 0.00 178.16 177.62 2j1d h GLN 771 N -0.69 0.54 0.00 1.82 4.15 -1.90 -0.03 115.11 119.00 2j1d h GLN 771 Ca -0.06 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2j1d h GLN 771 Cb 0.51 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.07 2j1d h GLN 771 CO 0.10 0.36 -0.21 -0.56 -1.93 0.00 0.00 178.83 176.59 2j1d h GLN 772 N 0.55 0.00 -0.15 1.69 -0.00 -1.94 0.11 115.11 115.37 2j1d h GLN 772 Ca 0.22 0.00 -0.23 0.00 -0.00 0.00 0.00 58.65 58.64 2j1d h GLN 772 Cb 0.09 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 27.58 2j1d h GLN 772 CO -0.13 0.00 -0.79 0.00 -0.00 0.00 0.00 178.83 177.91 2j1d h ARG 773 N 0.00 0.80 -0.48 0.06 3.08 -0.95 -2.65 114.38 114.24 2j1d h ARG 773 Ca 0.00 -0.66 -0.10 0.00 0.07 0.00 0.00 59.98 59.29 2j1d h ARG 773 Cb 0.90 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 31.08 2j1d h ARG 773 CO 0.00 1.26 -0.11 1.25 -1.07 0.00 0.00 179.97 181.30 2j1d h LEU 774 N 0.54 0.93 -0.44 3.04 5.85 -0.68 -0.98 115.31 123.57 2j1d h LEU 774 Ca -0.06 -0.36 -0.05 0.00 0.84 0.00 0.00 57.88 58.25 2j1d h LEU 774 Cb 1.42 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2j1d h LEU 774 CO 0.16 1.07 0.06 -0.61 -0.34 0.00 0.00 178.44 178.78 2j1d h GLN 775 N 0.77 0.73 -0.58 1.25 5.75 -0.90 -2.22 115.11 119.92 2j1d h GLN 775 Ca 0.12 -0.20 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 2j1d h GLN 775 Cb 0.66 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.10 2j1d h GLN 775 CO 0.05 0.77 0.31 0.77 -2.65 0.00 0.00 178.83 178.07 2j1d h SER 776 N 0.59 0.73 -0.53 -0.69 0.02 -1.36 -0.61 113.55 111.70 2j1d h SER 776 Ca 0.13 -0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 2j1d h SER 776 Cb 0.40 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2j1d h SER 776 CO 0.01 0.62 0.22 0.25 -1.14 0.00 0.00 176.83 176.79 2j1d h LEU 777 N 0.78 0.72 -0.01 5.07 5.85 -1.06 -1.11 115.31 125.54 2j1d h LEU 777 Ca 0.20 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 2j1d h LEU 777 Cb 0.06 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 2j1d h LEU 777 CO -0.03 0.68 0.01 0.22 -0.34 0.00 0.00 178.44 178.98 2j1d h TYR 778 N 0.71 0.02 -0.51 1.25 3.20 -1.25 -1.60 116.97 118.79 2j1d h TYR 778 Ca 0.18 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.12 2j1d h TYR 778 Cb 0.18 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.38 2j1d h TYR 778 CO 0.00 0.08 0.16 0.35 -1.64 0.00 0.00 178.16 177.12 2j1d h PHE 779 N -0.05 0.28 -0.40 -3.82 3.57 -1.00 -1.30 116.94 114.22 2j1d h PHE 779 Ca 0.00 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.56 2j1d h PHE 779 Cb 0.07 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2j1d h PHE 779 CO -0.05 0.07 0.20 -0.22 -2.23 0.00 0.00 178.31 176.08 2j1d h LYS 780 N 0.33 0.40 0.00 1.11 3.64 -0.95 -1.80 116.57 119.29 2j1d h LYS 780 Ca 0.25 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.53 2j1d h LYS 780 Cb 0.29 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2j1d h LYS 780 CO -0.27 0.26 -0.36 0.87 -2.27 0.00 0.00 179.45 177.68 2j1d h LYS 781 N 0.41 0.00 -0.08 1.90 1.57 -0.80 -3.09 116.57 116.47 2j1d h LYS 781 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2j1d h LYS 781 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2j1d h LYS 781 CO -0.12 0.36 0.00 1.63 -0.57 0.00 0.00 179.45 180.75 2j1d n LYS 782 N -3.77 2.04 -0.05 3.15 5.02 -0.53 -4.54 118.16 119.48 2j1d n LYS 782 Ca -0.01 -1.52 -0.14 0.00 -2.02 0.00 0.00 58.31 54.62 2j1d n LYS 782 Cb 0.44 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 33.91 2j1d n LYS 782 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2j1d h PHE 783 N 3.52 0.58 -0.40 2.13 3.57 -1.25 -2.10 116.94 122.98 2j1d h PHE 783 Ca 0.00 -0.22 0.00 0.00 3.53 0.00 0.00 57.97 61.28 2j1d h PHE 783 Cb 0.75 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 2j1d h PHE 783 CO 0.04 0.94 0.25 0.00 -2.23 0.00 0.00 178.31 177.32 2j1d h ALA 784 N 0.53 0.51 -0.11 2.41 0.00 -1.80 -0.73 119.26 120.08 2j1d h ALA 784 Ca -0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 2j1d h ALA 784 Cb 0.92 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2j1d h ALA 784 CO 0.07 -0.02 -0.58 1.05 0.00 0.00 0.00 179.25 179.77 2j1d h GLU 785 N 0.54 0.34 -0.43 0.00 4.11 -1.85 -1.74 114.58 115.55 2j1d h GLU 785 Ca 0.15 -0.23 -0.12 0.00 0.07 0.00 0.00 59.36 59.23 2j1d h GLU 785 Cb -0.03 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2j1d h GLU 785 CO -0.03 0.83 -0.21 0.00 0.07 0.00 0.00 179.01 179.67 2j1d h ARG 786 N 0.26 0.85 -0.38 1.06 3.08 -1.16 -0.78 114.38 117.30 2j1d h ARG 786 Ca -0.00 -0.34 -0.11 0.00 0.07 0.00 0.00 59.98 59.59 2j1d h ARG 786 Cb 1.10 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 2j1d h ARG 786 CO 0.10 0.98 -0.20 0.28 -1.07 0.00 0.00 179.97 180.05 2j1d h VAL 787 N 0.74 1.28 0.00 2.04 2.07 -1.08 -2.82 116.25 118.47 2j1d h VAL 787 Ca 0.10 -1.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 2j1d h VAL 787 Cb 0.74 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2j1d h VAL 787 CO 0.06 0.44 -0.07 0.00 0.02 0.00 0.00 177.57 178.02 2j1d h ALA 788 N 0.80 1.32 0.02 1.67 0.00 -1.20 -1.11 119.26 120.75 2j1d h ALA 788 Ca 0.08 -0.06 -0.22 0.00 0.00 0.00 0.00 54.91 54.71 2j1d h ALA 788 Cb 0.76 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.56 2j1d h ALA 788 CO 0.06 0.09 -0.88 1.49 0.00 0.00 0.00 179.25 180.01 2j1d h GLU 789 N 0.00 0.57 0.15 0.00 4.81 -1.03 -3.39 114.58 115.68 2j1d h GLU 789 Ca -0.00 -0.63 -0.34 0.00 -0.13 0.00 0.00 59.36 58.25 2j1d h GLU 789 Cb 0.22 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2j1d h GLU 789 CO 0.01 1.24 -1.78 -0.24 -0.73 0.00 0.00 179.01 177.51 2j1d h VAL 790 N 0.16 0.88 -0.13 0.32 3.04 -1.24 -3.40 116.25 115.88 2j1d h VAL 790 Ca -0.11 -2.53 0.03 0.00 -1.01 0.00 0.00 66.70 63.08 2j1d h VAL 790 Cb 1.57 2.67 -0.03 0.00 -2.01 0.00 0.00 31.29 33.49 2j1d h VAL 790 CO 0.17 0.84 -0.05 0.11 -1.01 0.00 0.00 177.57 177.64 2j1d h LYS 791 N 0.08 -0.02 -0.33 4.17 1.57 -1.41 -2.33 116.57 118.31 2j1d h LYS 791 Ca -0.35 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.53 2j1d h LYS 791 Cb 2.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.36 2j1d h LYS 791 CO 0.15 -0.01 0.27 -1.35 -0.57 0.00 0.00 179.45 177.93 2j1d h PRO 792 N -0.02 0.00 0.01 3.15 0.11 -1.76 -1.44 132.00 132.04 2j1d h PRO 792 Ca 0.07 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.94 2j1d h PRO 792 Cb 0.12 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.24 2j1d h PRO 792 CO -0.15 0.00 -0.99 0.87 -0.21 0.00 0.00 178.00 177.52 2j1d h LYS 793 N 0.00 0.51 -0.06 1.05 1.57 -1.63 -2.00 116.57 116.01 2j1d h LYS 793 Ca 0.15 -0.55 -0.11 0.00 -1.87 0.00 0.00 60.65 58.27 2j1d h LYS 793 Cb 0.68 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 2j1d h LYS 793 CO -0.00 1.19 -0.47 0.28 -0.57 0.00 0.00 179.45 179.88 2j1d h VAL 794 N 0.28 1.34 -0.09 0.50 2.07 -1.02 -2.69 116.25 116.64 2j1d h VAL 794 Ca -0.10 -1.65 -0.23 0.00 0.82 0.00 0.00 66.70 65.54 2j1d h VAL 794 Cb 1.63 1.82 0.01 0.00 -1.52 0.00 0.00 31.29 33.24 2j1d h VAL 794 CO 0.18 0.48 -0.84 -0.08 0.02 0.00 0.00 177.57 177.33 2j1d h GLU 795 N 0.11 0.73 -0.19 1.57 4.22 -1.26 -2.29 114.58 117.48 2j1d h GLU 795 Ca 0.00 -0.66 -0.00 0.00 0.08 0.00 0.00 59.36 58.78 2j1d h GLU 795 Cb 0.88 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2j1d h GLU 795 CO 0.07 1.26 0.11 0.00 -2.18 0.00 0.00 179.01 178.27 2j1d h ALA 796 N 0.48 0.24 -0.69 2.92 0.00 -1.31 0.90 119.26 121.80 2j1d h ALA 796 Ca -0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2j1d h ALA 796 Cb 1.48 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 2j1d h ALA 796 CO 0.17 -0.26 0.33 0.82 0.00 0.00 0.00 179.25 180.32 2j1d h ILE 797 N 0.23 1.23 -0.36 0.00 2.04 -1.52 0.22 117.51 119.35 2j1d h ILE 797 Ca 0.07 -0.64 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 2j1d h ILE 797 Cb 0.01 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2j1d h ILE 797 CO -0.01 0.27 0.01 -0.09 0.00 0.00 0.00 178.15 178.32 2j1d h ARG 798 N 0.96 0.63 0.10 2.37 2.43 -1.16 -1.76 114.38 117.95 2j1d h ARG 798 Ca 0.24 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2j1d h ARG 798 Cb 0.11 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2j1d h ARG 798 CO -0.03 0.73 -0.05 1.03 -1.51 0.00 0.00 179.97 180.14 2j1d h SER 799 N 0.44 -0.11 -0.90 -3.80 0.87 -0.77 -2.45 113.55 106.82 2j1d h SER 799 Ca 0.10 -0.47 0.10 0.00 -1.23 0.00 0.00 61.79 60.29 2j1d h SER 799 Cb 0.44 0.03 -0.08 0.00 -0.44 0.00 0.00 62.40 62.36 2j1d h SER 799 CO 0.02 0.49 0.55 1.23 -0.53 0.00 0.00 176.83 178.58 2j1d h GLY 800 N -0.81 1.43 1.01 5.77 0.00 -1.03 0.61 103.07 110.06 2j1d h GLY 800 Ca -0.01 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 2j1d h GLY 800 CO 0.02 0.17 0.27 1.76 0.00 0.00 0.00 176.54 178.76 2j1d h SER 801 N 0.91 0.92 -0.18 0.19 0.02 -1.37 -1.44 113.55 112.60 2j1d h SER 801 Ca 0.43 -0.17 -0.07 0.00 -0.84 0.00 0.00 61.79 61.14 2j1d h SER 801 Cb 0.37 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 2j1d h SER 801 CO -0.24 0.84 -0.14 -0.08 -1.14 0.00 0.00 176.83 176.06 2j1d h GLU 802 N 0.94 0.42 0.12 3.45 4.81 -0.98 -2.92 114.58 120.42 2j1d h GLU 802 Ca 0.22 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2j1d h GLU 802 Cb 0.21 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2j1d h GLU 802 CO -0.02 0.76 -0.14 0.93 -0.73 0.00 0.00 179.01 179.81 2j1d h GLU 803 N 0.09 -0.29 -0.72 1.92 5.08 -0.76 -1.53 114.58 118.37 2j1d h GLU 803 Ca 0.03 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.48 2j1d h GLU 803 Cb 0.66 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 2j1d h GLU 803 CO 0.04 -0.19 0.47 -0.24 -1.00 0.00 0.00 179.01 178.09 2j1d h VAL 804 N -0.30 1.01 -0.10 3.13 3.04 -1.38 0.06 116.25 121.72 2j1d h VAL 804 Ca 0.01 -0.25 -0.17 0.00 -1.01 0.00 0.00 66.70 65.27 2j1d h VAL 804 Cb 0.29 0.22 -0.01 0.00 -2.01 0.00 0.00 31.29 29.78 2j1d h VAL 804 CO -0.05 0.13 -0.68 0.15 -1.01 0.00 0.00 177.57 176.12 2j1d h PHE 805 N 0.73 0.54 -0.01 3.17 3.57 -1.25 -3.36 116.94 120.34 2j1d h PHE 805 Ca 0.31 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2j1d h PHE 805 Cb 0.28 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.93 2j1d h PHE 805 CO -0.00 0.96 -0.05 2.89 -2.23 0.00 0.00 178.31 179.89 2j1d n ARG 806 N -3.87 0.75 -1.63 1.11 1.85 -0.62 -4.98 116.66 109.28 2j1d n ARG 806 Ca -0.04 -0.80 -0.43 0.00 -1.00 0.00 0.00 57.85 55.59 2j1d n ARG 806 Cb 0.67 -1.09 -0.03 0.00 -1.05 0.00 0.00 32.46 30.96 2j1d n ARG 806 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2j1d s SER 807 N -0.77 5.87 0.28 2.89 0.15 -0.02 -4.87 113.70 117.23 2j1d s SER 807 Ca 0.08 2.24 0.12 0.00 0.70 0.00 0.00 55.95 59.09 2j1d s SER 807 Cb 0.06 -2.52 0.34 0.00 -1.71 0.00 0.00 66.02 62.19 2j1d s SER 807 CO 0.12 -1.58 1.59 1.23 1.20 0.00 0.00 173.24 175.80 2j1d h GLY 808 N 13.18 0.00 1.28 9.45 0.00 -1.93 -2.93 103.07 122.12 2j1d h GLY 808 Ca -0.45 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 2j1d h GLY 808 CO 0.95 0.00 0.21 0.00 0.00 0.00 0.00 176.54 177.70 2j1d h ALA 809 N 1.39 1.22 -0.08 3.60 0.00 -1.89 -2.34 119.26 121.16 2j1d h ALA 809 Ca -0.01 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 2j1d h ALA 809 Cb 1.15 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.71 2j1d h ALA 809 CO 0.08 0.56 -0.62 1.25 0.00 0.00 0.00 179.25 180.52 2j1d h LEU 810 N 0.89 0.69 -1.15 0.00 5.85 -1.87 -2.15 115.31 117.58 2j1d h LEU 810 Ca 0.20 -0.67 -0.07 0.00 0.84 0.00 0.00 57.88 58.19 2j1d h LEU 810 Cb 0.22 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2j1d h LEU 810 CO -0.01 1.25 -0.14 0.50 -0.34 0.00 0.00 178.44 179.70 2j1d h LYS 811 N 0.18 0.42 -0.05 1.25 3.64 -1.48 -1.08 116.57 119.45 2j1d h LYS 811 Ca -0.05 -0.12 -0.20 0.00 -1.27 0.00 0.00 60.65 59.00 2j1d h LYS 811 Cb 1.27 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2j1d h LYS 811 CO 0.13 0.57 -0.81 0.37 -2.27 0.00 0.00 179.45 177.43 2j1d h GLN 812 N 0.39 0.43 -0.42 1.90 5.75 -1.44 -2.98 115.11 118.73 2j1d h GLN 812 Ca 0.07 -0.39 -0.05 0.00 -0.15 0.00 0.00 58.65 58.13 2j1d h GLN 812 Cb 0.49 0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.12 2j1d h GLN 812 CO 0.03 1.04 0.07 1.25 -2.65 0.00 0.00 178.83 178.57 2j1d h LEU 813 N 0.27 0.67 -1.09 -2.39 6.46 -1.06 -2.15 115.31 116.03 2j1d h LEU 813 Ca -0.05 -0.26 0.02 0.00 -0.12 0.00 0.00 57.88 57.47 2j1d h LEU 813 Cb 1.42 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 41.12 2j1d h LEU 813 CO 0.14 0.77 0.62 -0.07 -0.62 0.00 0.00 178.44 179.27 2j1d h LEU 814 N 0.56 1.04 -0.58 2.25 3.38 -1.23 0.17 115.31 120.91 2j1d h LEU 814 Ca 0.13 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 2j1d h LEU 814 Cb 0.38 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2j1d h LEU 814 CO 0.01 0.73 -0.15 -0.08 0.09 0.00 0.00 178.44 179.05 2j1d h GLU 815 N 1.22 0.98 -0.32 1.13 4.81 -1.43 0.04 114.58 121.01 2j1d h GLU 815 Ca 0.36 -0.38 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 2j1d h GLU 815 Cb -0.06 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2j1d h GLU 815 CO -0.10 1.05 -0.15 0.28 -0.73 0.00 0.00 179.01 179.37 2j1d h VAL 816 N 0.86 1.29 -0.38 0.32 2.07 -0.92 -2.41 116.25 117.08 2j1d h VAL 816 Ca 0.13 -1.25 -0.09 0.00 0.82 0.00 0.00 66.70 66.31 2j1d h VAL 816 Cb 0.71 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 2j1d h VAL 816 CO 0.05 0.40 -0.13 0.58 0.02 0.00 0.00 177.57 178.50 2j1d h VAL 817 N 0.42 1.25 0.11 2.57 2.07 -0.95 -0.52 116.25 121.21 2j1d h VAL 817 Ca 0.07 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 2j1d h VAL 817 Cb 0.67 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2j1d h VAL 817 CO 0.04 0.39 -0.09 0.25 0.02 0.00 0.00 177.57 178.18 2j1d h LEU 818 N 0.62 -0.22 -0.59 2.57 5.85 -0.96 -1.26 115.31 121.32 2j1d h LEU 818 Ca 0.11 0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.96 2j1d h LEU 818 Cb 0.58 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 41.57 2j1d h LEU 818 CO 0.04 -0.14 -0.14 0.00 -0.34 0.00 0.00 178.44 177.86 2j1d h ALA 819 N 0.67 0.39 -0.34 1.25 0.00 -1.14 -0.54 119.26 119.55 2j1d h ALA 819 Ca -0.00 0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2j1d h ALA 819 Cb 0.19 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2j1d h ALA 819 CO -0.01 -0.43 0.05 0.74 0.00 0.00 0.00 179.25 179.60 2j1d h PHE 820 N 0.00 0.07 -0.43 0.00 -1.00 -0.45 -1.87 116.94 113.27 2j1d h PHE 820 Ca 0.28 0.02 -0.14 0.00 2.81 0.00 0.00 57.97 60.94 2j1d h PHE 820 Cb 0.43 0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 2j1d h PHE 820 CO -0.48 -0.01 -0.29 0.78 -1.61 0.00 0.00 178.31 176.70 2j1d h GLY 821 N 0.16 1.04 2.00 -1.45 0.00 -0.74 -0.29 103.07 103.78 2j1d h GLY 821 Ca 0.16 -0.98 -0.06 0.00 0.00 0.00 0.00 47.33 46.46 2j1d h GLY 821 CO -0.23 0.88 -0.27 3.43 0.00 0.00 0.00 176.54 180.36 2j1d h ASN 822 N 0.80 0.00 0.16 0.19 2.35 -0.91 0.27 115.58 118.44 2j1d h ASN 822 Ca 0.09 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.59 2j1d h ASN 822 Cb 0.87 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.26 2j1d h ASN 822 CO 0.08 0.27 -1.14 0.22 -1.65 0.00 0.00 177.43 175.21 2j1d h TYR 823 N 0.00 0.61 0.00 1.19 3.20 -1.26 -3.39 116.97 117.32 2j1d h TYR 823 Ca -0.00 -0.44 -0.21 0.00 3.14 0.00 0.00 58.73 61.21 2j1d h TYR 823 Cb 0.52 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.74 2j1d h TYR 823 CO 0.00 1.44 -1.02 0.52 -1.64 0.00 0.00 178.16 177.45 2j1d h MET 824 N -0.24 0.00 -3.70 1.82 2.86 -0.89 -3.39 114.93 111.39 2j1d h MET 824 Ca -0.22 0.00 -0.77 0.00 -2.06 0.00 0.00 59.70 56.65 2j1d h MET 824 Cb 1.79 0.00 -0.21 0.00 0.06 0.00 0.00 31.60 33.24 2j1d h MET 824 CO 0.15 0.97 1.30 0.09 1.06 0.00 0.00 176.91 180.49 2j1d n ASN 825 N -3.33 5.51 -4.64 1.22 3.02 0.93 -4.99 115.26 112.97 2j1d n ASN 825 Ca -0.01 -3.14 -0.54 0.00 -0.03 0.00 0.00 54.58 50.86 2j1d n ASN 825 Cb 0.94 -1.44 -0.06 0.00 -0.61 0.00 0.00 39.78 38.61 2j1d n ASN 825 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2j1d n LYS 826 N 3.53 1.14 0.00 3.52 5.02 -1.26 -3.11 118.16 127.00 2j1d n LYS 826 Ca 0.33 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 2j1d n LYS 826 Cb 0.38 -2.07 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 2j1d n LYS 826 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2j1d n GLY 827 N 3.23 1.37 3.94 0.72 0.00 -1.26 -4.55 105.19 108.63 2j1d n GLY 827 Ca 0.22 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 2j1d n GLY 827 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2j1d s GLN 828 N 0.00 3.02 0.00 1.61 -0.44 -1.26 -3.68 119.66 118.91 2j1d s GLN 828 Ca 0.00 -0.29 0.00 0.00 -2.50 0.00 0.00 55.36 52.57 2j1d s GLN 828 Cb 0.00 -2.45 0.00 0.00 -1.64 0.00 0.00 33.01 28.92 2j1d s GLN 828 CO 0.00 -0.43 0.00 0.54 0.50 0.00 0.00 175.29 175.90 2j1d n ARG 829 N -2.27 0.00 -2.71 1.67 5.12 -1.26 -4.90 116.66 112.30 2j1d n ARG 829 Ca 0.03 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.87 2j1d n ARG 829 Cb 0.58 -1.05 0.11 0.00 -1.16 0.00 0.00 32.46 30.93 2j1d n ARG 829 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2j1d n GLY 830 N -2.00 1.15 2.69 -0.13 0.00 -1.18 -4.81 105.19 100.91 2j1d n GLY 830 Ca 0.00 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.67 2j1d n GLY 830 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2j1d n ASN 831 N -0.37 3.79 -4.82 1.61 5.15 -1.25 -4.54 115.26 114.84 2j1d n ASN 831 Ca -0.01 -3.52 -0.35 0.00 -0.60 0.00 0.00 54.58 50.10 2j1d n ASN 831 Cb 0.81 -0.60 -0.06 0.00 -0.53 0.00 0.00 39.78 39.40 2j1d n ASN 831 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2j1d s ALA 832 N -2.99 3.31 -1.19 5.20 0.00 -1.26 -4.96 121.76 119.86 2j1d s ALA 832 Ca 0.45 0.24 0.15 0.00 0.00 0.00 0.00 51.96 52.81 2j1d s ALA 832 Cb 0.24 -2.93 -0.06 0.00 0.00 0.00 0.00 23.12 20.38 2j1d s ALA 832 CO -0.09 0.27 0.77 0.66 0.00 0.00 0.00 175.76 177.37 2j1d n TYR 833 N 0.30 0.00 -3.62 0.00 4.01 -1.26 -5.01 117.16 111.59 2j1d n TYR 833 Ca 0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.73 2j1d n TYR 833 Cb 0.52 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 2j1d n TYR 833 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2j1d s GLY 834 N -2.05 -0.28 0.17 2.72 0.00 -1.26 -5.15 107.32 101.46 2j1d s GLY 834 Ca 0.11 1.61 0.01 0.00 0.00 0.00 0.00 44.72 46.45 2j1d s GLY 834 CO 0.47 0.51 0.03 -0.11 0.00 0.00 0.00 173.10 174.00 2j1d s PHE 835 N -2.19 1.15 0.36 1.90 -0.12 -1.26 -5.14 117.98 112.68 2j1d s PHE 835 Ca 0.12 -1.10 -0.26 0.00 -0.05 0.00 0.00 56.93 55.63 2j1d s PHE 835 Cb 0.00 -0.65 -0.09 0.00 -0.63 0.00 0.00 43.02 41.65 2j1d s PHE 835 CO -0.04 -0.31 1.15 0.15 -0.05 0.00 0.00 175.22 176.13 2j1d s LYS 836 N -3.96 4.24 0.61 1.99 1.02 -1.26 -4.92 119.74 117.44 2j1d s LYS 836 Ca 0.25 1.83 0.35 0.00 0.02 0.00 0.00 55.97 58.43 2j1d s LYS 836 Cb 0.07 -2.82 1.98 0.00 -0.52 0.00 0.00 37.83 36.54 2j1d s LYS 836 CO 0.04 -0.16 2.26 -0.84 -0.92 0.00 0.00 175.35 175.74 2j1d h ILE 837 N 2.57 0.31 0.00 2.17 3.07 -1.98 -0.50 117.51 123.15 2j1d h ILE 837 Ca -0.48 -0.10 -0.01 0.00 1.55 0.00 0.00 64.86 65.81 2j1d h ILE 837 Cb 1.23 1.07 -0.00 0.00 -0.27 0.00 0.00 36.82 38.85 2j1d h ILE 837 CO 0.64 0.02 -0.06 0.77 -1.05 0.00 0.00 178.15 178.46 2j1d h SER 838 N 0.00 0.00 -0.25 2.16 4.64 -1.96 -2.54 113.55 115.61 2j1d h SER 838 Ca -0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 2j1d h SER 838 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2j1d h SER 838 CO 0.00 0.06 0.18 0.28 -0.87 0.00 0.00 176.83 176.48 2j1d h SER 839 N 0.00 0.00 -0.92 4.97 0.02 -1.46 -1.16 113.55 115.01 2j1d h SER 839 Ca -0.00 0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.09 2j1d h SER 839 Cb 0.21 -0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.67 2j1d h SER 839 CO 0.01 0.00 0.59 -0.07 -1.14 0.00 0.00 176.83 176.22 2j1d h LEU 840 N 0.00 0.71 -0.24 5.07 3.38 -1.63 -0.90 115.31 121.70 2j1d h LEU 840 Ca 0.12 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2j1d h LEU 840 Cb 0.47 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2j1d h LEU 840 CO -0.00 0.35 0.00 0.59 0.09 0.00 0.00 178.44 179.47 2j1d n ASN 841 N -4.58 0.36 -0.31 -0.43 3.02 -0.44 -2.81 115.26 110.07 2j1d n ASN 841 Ca 0.18 -1.69 0.06 0.00 -0.03 0.00 0.00 54.58 53.10 2j1d n ASN 841 Cb 0.46 -0.03 0.01 0.00 -0.61 0.00 0.00 39.78 39.61 2j1d n ASN 841 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2j1d n LYS 842 N -0.45 1.69 -0.20 3.52 4.76 -0.35 -4.68 118.16 122.45 2j1d n LYS 842 Ca 0.10 -0.77 -0.08 0.00 -2.87 0.00 0.00 58.31 54.68 2j1d n LYS 842 Cb 0.09 -1.15 0.02 0.00 -1.84 0.00 0.00 35.03 32.16 2j1d n LYS 842 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2j1d h ILE 843 N 1.50 1.24 0.00 -0.18 2.04 -1.49 -2.62 117.51 118.00 2j1d h ILE 843 Ca 0.00 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.04 2j1d h ILE 843 Cb 0.41 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2j1d h ILE 843 CO 0.00 0.30 0.00 0.00 0.00 0.00 0.00 178.15 178.45 2j1d n ALA 844 N -2.39 1.87 0.15 1.87 0.00 -1.26 -2.45 120.51 118.30 2j1d n ALA 844 Ca 0.03 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2j1d n ALA 844 Cb 0.21 -1.39 0.27 0.00 0.00 0.00 0.00 19.45 18.54 2j1d n ALA 844 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2j1d h ASP 845 N 0.00 0.07 -3.02 0.00 5.19 -1.76 -3.42 116.42 113.48 2j1d h ASP 845 Ca 0.00 -0.03 -0.55 0.00 -0.62 0.00 0.00 57.03 55.83 2j1d h ASP 845 Cb 0.44 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 2j1d h ASP 845 CO 0.00 0.52 0.75 -0.89 -3.12 0.00 0.00 179.24 176.50 2j1d s THR 846 N -4.02 4.09 0.02 0.35 2.01 -1.02 -5.00 115.64 112.06 2j1d s THR 846 Ca -0.03 1.43 0.03 0.00 0.31 0.00 0.00 61.69 63.43 2j1d s THR 846 Cb 0.14 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2j1d s THR 846 CO 0.75 -0.01 -0.06 -0.54 -0.69 0.00 0.00 174.62 174.07 2j1d s LYS 847 N 2.33 2.54 0.33 4.92 -0.14 -1.26 -0.55 119.74 127.91 2j1d s LYS 847 Ca 0.58 -0.74 -0.29 0.00 -1.36 0.00 0.00 55.97 54.16 2j1d s LYS 847 Cb -0.27 -2.50 -0.10 0.00 -1.68 0.00 0.00 37.83 33.28 2j1d s LYS 847 CO 0.23 0.59 1.30 0.45 -0.76 0.00 0.00 175.35 177.16 2j1d s SER 848 N -1.55 6.79 0.00 2.83 0.15 0.63 -4.90 113.70 117.65 2j1d s SER 848 Ca 0.18 2.68 0.28 0.00 0.70 0.00 0.00 55.95 59.78 2j1d s SER 848 Cb -0.11 -2.65 1.30 0.00 -1.71 0.00 0.00 66.02 62.85 2j1d s SER 848 CO 0.09 -0.52 1.92 -1.54 1.20 0.00 0.00 173.24 174.39 2j1d n SER 849 N 0.82 0.00 -0.05 5.45 3.41 -1.26 -3.72 113.62 118.27 2j1d n SER 849 Ca -0.00 0.15 -0.03 0.00 -0.26 0.00 0.00 58.87 58.73 2j1d n SER 849 Cb 0.42 -0.38 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 2j1d n SER 849 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2j1d n ILE 850 N -1.38 0.92 -4.90 -1.33 5.41 -1.26 -4.93 119.36 111.89 2j1d n ILE 850 Ca 0.10 0.31 -0.31 0.00 1.00 0.00 0.00 62.75 63.85 2j1d n ILE 850 Cb 0.26 -2.07 -0.17 0.00 -0.71 0.00 0.00 39.64 36.96 2j1d n ILE 850 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2j1d s ASP 851 N -4.97 2.93 0.08 4.38 3.68 -1.26 -5.04 116.67 116.47 2j1d s ASP 851 Ca -0.11 -0.54 0.23 0.00 2.13 0.00 0.00 52.55 54.26 2j1d s ASP 851 Cb 0.01 -1.34 0.93 0.00 -1.45 0.00 0.00 42.92 41.07 2j1d s ASP 851 CO 0.16 0.11 1.72 0.29 0.13 0.00 0.00 175.17 177.58 2j1d n LYS 852 N 3.81 0.08 0.00 4.34 4.76 -1.24 -2.38 118.16 127.52 2j1d n LYS 852 Ca -0.20 0.19 0.12 0.00 -2.87 0.00 0.00 58.31 55.55 2j1d n LYS 852 Cb 0.52 -1.62 0.20 0.00 -1.84 0.00 0.00 35.03 32.29 2j1d n LYS 852 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2j1d n ASN 853 N -1.77 0.60 -4.53 4.39 4.13 -1.26 -4.61 115.26 112.21 2j1d n ASN 853 Ca 0.05 -0.39 -0.43 0.00 1.68 0.00 0.00 54.58 55.49 2j1d n ASN 853 Cb 0.29 0.35 -0.04 0.00 -1.54 0.00 0.00 39.78 38.83 2j1d n ASN 853 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2j1d s ILE 854 N -2.97 4.47 0.82 2.41 1.01 -1.00 -5.01 121.20 120.93 2j1d s ILE 854 Ca 0.11 0.34 -0.07 0.00 0.00 0.00 0.00 60.65 61.04 2j1d s ILE 854 Cb 0.17 -4.47 0.16 0.00 0.01 0.00 0.00 42.46 38.33 2j1d s ILE 854 CO 0.72 -0.98 1.12 0.42 0.00 0.00 0.00 174.94 176.22 2j1d s THR 855 N 3.73 2.07 -0.19 2.92 -4.23 -1.26 -0.27 115.64 118.42 2j1d s THR 855 Ca 0.31 -0.36 0.29 0.00 -1.18 0.00 0.00 61.69 60.74 2j1d s THR 855 Cb -0.12 -2.71 0.33 0.00 1.34 0.00 0.00 72.50 71.33 2j1d s THR 855 CO 0.21 0.00 1.85 0.25 -0.54 0.00 0.00 174.62 176.39 2j1d h LEU 856 N -0.97 0.00 0.07 4.79 6.46 -0.92 -2.29 115.31 122.45 2j1d h LEU 856 Ca -0.39 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.23 2j1d h LEU 856 Cb 1.25 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.19 2j1d h LEU 856 CO 0.39 0.00 -0.65 0.25 -0.62 0.00 0.00 178.44 177.81 2j1d h LEU 857 N 0.00 0.22 -0.70 2.25 6.46 -1.83 -1.96 115.31 119.74 2j1d h LEU 857 Ca 0.00 -0.90 0.15 0.00 -0.12 0.00 0.00 57.88 57.00 2j1d h LEU 857 Cb 0.48 -0.07 -0.10 0.00 -0.73 0.00 0.00 40.66 40.23 2j1d h LEU 857 CO 0.00 1.29 0.16 0.45 -0.62 0.00 0.00 178.44 179.72 2j1d h HIS 858 N -0.68 0.26 -0.66 1.25 3.86 -1.89 -0.75 115.15 116.55 2j1d h HIS 858 Ca -0.14 0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.05 2j1d h HIS 858 Cb 1.37 -0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.81 2j1d h HIS 858 CO 0.21 -0.07 0.16 -0.92 0.86 0.00 0.00 177.93 178.17 2j1d h TYR 859 N 0.27 1.11 0.22 2.45 5.03 -1.47 -2.04 116.97 122.55 2j1d h TYR 859 Ca 0.39 -0.13 -0.01 0.00 2.58 0.00 0.00 58.73 61.55 2j1d h TYR 859 Cb 0.63 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.60 2j1d h TYR 859 CO -0.26 0.92 -0.11 1.25 -1.32 0.00 0.00 178.16 178.65 2j1d h LEU 860 N 0.98 -0.25 -1.64 2.82 6.46 -0.71 -1.13 115.31 121.85 2j1d h LEU 860 Ca 0.21 -0.07 0.08 0.00 -0.12 0.00 0.00 57.88 57.98 2j1d h LEU 860 Cb 0.37 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.33 2j1d h LEU 860 CO 0.00 -0.09 0.38 0.40 -0.62 0.00 0.00 178.44 178.52 2j1d h ILE 861 N -0.40 0.92 0.03 4.05 2.04 -1.04 -1.53 117.51 121.58 2j1d h ILE 861 Ca -0.03 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 2j1d h ILE 861 Cb 0.31 0.47 0.01 0.00 -0.74 0.00 0.00 36.82 36.86 2j1d h ILE 861 CO 0.05 0.08 -0.27 0.74 0.00 0.00 0.00 178.15 178.74 2j1d h THR 862 N 0.42 1.62 -0.96 -0.27 2.02 -1.15 -3.28 112.91 111.32 2j1d h THR 862 Ca 0.26 -2.19 0.13 0.00 0.77 0.00 0.00 66.41 65.38 2j1d h THR 862 Cb 0.46 3.06 -0.08 0.00 -1.74 0.00 0.00 68.15 69.85 2j1d h THR 862 CO -0.07 0.59 0.61 0.40 0.37 0.00 0.00 175.52 177.42 2j1d h ILE 863 N -0.65 0.87 0.00 3.11 1.08 -0.97 -2.92 117.51 118.04 2j1d h ILE 863 Ca -0.04 -0.30 -0.13 0.00 -0.39 0.00 0.00 64.86 64.01 2j1d h ILE 863 Cb 1.12 -0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 2j1d h ILE 863 CO 0.05 0.16 -0.61 0.58 -0.69 0.00 0.00 178.15 177.64 2j1d h VAL 864 N 0.86 1.44 -0.57 1.67 2.07 -1.37 -2.92 116.25 117.43 2j1d h VAL 864 Ca 0.48 -2.09 0.09 0.00 0.82 0.00 0.00 66.70 66.01 2j1d h VAL 864 Cb 0.61 2.13 -0.11 0.00 -1.52 0.00 0.00 31.29 32.39 2j1d h VAL 864 CO -0.25 0.60 -0.39 -0.33 0.02 0.00 0.00 177.57 177.22 2j1d h GLU 865 N 0.00 -0.20 -0.02 1.57 5.08 -1.57 0.13 114.58 119.56 2j1d h GLU 865 Ca -0.01 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2j1d h GLU 865 Cb 1.08 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2j1d h GLU 865 CO 0.08 -0.13 -0.04 0.09 -1.00 0.00 0.00 179.01 178.01 2j1d n ASN 866 N -5.42 2.52 -0.03 1.42 3.02 -1.23 -4.10 115.26 111.45 2j1d n ASN 866 Ca 0.03 -1.82 -0.04 0.00 -0.03 0.00 0.00 54.58 52.71 2j1d n ASN 866 Cb 0.35 0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.53 2j1d n ASN 866 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2j1d n LYS 867 N 0.93 0.13 -3.21 3.52 4.76 -1.03 -4.91 118.16 118.36 2j1d n LYS 867 Ca 0.15 0.04 -0.24 0.00 -2.87 0.00 0.00 58.31 55.38 2j1d n LYS 867 Cb 0.53 -0.97 -0.07 0.00 -1.84 0.00 0.00 35.03 32.68 2j1d n LYS 867 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2j1d n TYR 868 N -2.86 -0.27 0.19 2.13 4.02 0.38 -5.00 117.16 115.75 2j1d n TYR 868 Ca -0.10 -3.57 0.07 0.00 -0.01 0.00 0.00 57.90 54.29 2j1d n TYR 868 Cb 0.59 -0.33 0.56 0.00 -0.02 0.00 0.00 39.34 40.15 2j1d n TYR 868 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2j1d h PRO 869 N 4.07 0.15 -0.67 -0.72 0.13 -1.51 -2.74 132.00 130.72 2j1d h PRO 869 Ca 0.08 -0.01 0.19 0.00 -0.87 0.00 0.00 66.00 65.39 2j1d h PRO 869 Cb 0.87 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.95 2j1d h PRO 869 CO 0.47 0.12 0.48 0.66 -0.23 0.00 0.00 178.00 179.50 2j1d h SER 870 N 0.15 0.00 -0.07 1.44 4.64 -1.93 -1.15 113.55 116.63 2j1d h SER 870 Ca 0.04 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.38 2j1d h SER 870 Cb 0.02 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2j1d h SER 870 CO -0.01 0.00 0.05 0.58 -0.87 0.00 0.00 176.83 176.59 2j1d h VAL 871 N 0.00 0.97 0.00 0.95 2.07 -1.73 -2.75 116.25 115.76 2j1d h VAL 871 Ca 0.32 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.83 2j1d h VAL 871 Cb 1.27 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 2j1d h VAL 871 CO -0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 2j1d n LEU 872 N -4.52 0.00 -0.15 2.57 4.77 -0.43 -2.30 117.00 116.93 2j1d n LEU 872 Ca -0.01 0.34 0.06 0.00 -0.03 0.00 0.00 56.01 56.37 2j1d n LEU 872 Cb 0.16 -0.34 0.29 0.00 -2.33 0.00 0.00 43.42 41.20 2j1d n LEU 872 CO 0.34 -0.12 0.70 -3.20 -1.33 0.00 0.00 177.39 173.78 2j1d n ASN 873 N -1.34 0.45 -0.24 -1.43 5.15 -1.04 -4.40 115.26 112.41 2j1d n ASN 873 Ca 0.08 -1.72 -0.06 0.00 -0.60 0.00 0.00 54.58 52.27 2j1d n ASN 873 Cb 0.17 -0.04 0.05 0.00 -0.53 0.00 0.00 39.78 39.43 2j1d n ASN 873 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2j1d h LEU 874 N 0.55 0.85 -1.39 1.20 7.12 -1.69 0.01 115.31 121.97 2j1d h LEU 874 Ca 0.00 -0.11 -0.06 0.00 0.13 0.00 0.00 57.88 57.85 2j1d h LEU 874 Cb 0.12 -0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.02 2j1d h LEU 874 CO 0.00 0.72 -0.22 -0.55 -0.13 0.00 0.00 178.44 178.26 2j1d h ASN 875 N 0.93 0.13 0.04 1.25 -1.07 -1.86 -1.68 115.58 113.31 2j1d h ASN 875 Ca 0.24 -0.03 -0.14 0.00 0.07 0.00 0.00 56.30 56.44 2j1d h ASN 875 Cb 0.06 -0.03 0.01 0.00 -2.07 0.00 0.00 38.32 36.29 2j1d h ASN 875 CO -0.04 0.35 -0.57 -0.08 0.07 0.00 0.00 177.43 177.17 2j1d h GLU 876 N 0.12 0.32 0.00 4.14 4.57 -1.73 -3.16 114.58 118.84 2j1d h GLU 876 Ca 0.02 -0.39 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2j1d h GLU 876 Cb 0.46 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2j1d h GLU 876 CO 0.03 1.10 0.00 0.93 -1.18 0.00 0.00 179.01 179.89 2j1d h GLU 877 N -0.28 0.00 -0.68 1.92 5.08 -0.80 -2.98 114.58 116.83 2j1d h GLU 877 Ca -0.08 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.78 2j1d h GLU 877 Cb 1.33 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 30.21 2j1d h GLU 877 CO 0.11 0.00 -0.65 1.28 -1.00 0.00 0.00 179.01 178.75 2j1d n LEU 878 N -3.00 4.88 0.23 1.33 4.77 -0.65 -4.69 117.00 119.87 2j1d n LEU 878 Ca 0.01 -4.61 0.07 0.00 -0.03 0.00 0.00 56.01 51.45 2j1d n LEU 878 Cb 0.34 -0.41 0.54 0.00 -2.33 0.00 0.00 43.42 41.56 2j1d n LEU 878 CO 0.28 1.98 0.90 0.08 -1.33 0.00 0.00 177.39 179.29 2j1d h ARG 879 N 2.02 0.00 -0.30 3.23 0.11 -1.48 -2.70 114.38 115.25 2j1d h ARG 879 Ca 0.35 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.43 2j1d h ARG 879 Cb 1.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.52 2j1d h ARG 879 CO 0.73 0.19 0.00 -0.25 0.10 0.00 0.00 179.97 180.75 2j1d n ASP 880 N -4.14 2.56 -0.16 0.08 8.00 -1.26 -4.34 116.55 117.29 2j1d n ASP 880 Ca -0.02 -1.87 -0.09 0.00 0.71 0.00 0.00 54.79 53.51 2j1d n ASP 880 Cb 0.26 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 2j1d n ASP 880 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2j1d h ILE 881 N 3.27 1.23 -0.81 0.53 5.03 -1.83 -1.91 117.51 123.01 2j1d h ILE 881 Ca 0.00 -0.77 0.05 0.00 -0.12 0.00 0.00 64.86 64.02 2j1d h ILE 881 Cb 0.72 0.86 -0.05 0.00 -3.03 0.00 0.00 36.82 35.33 2j1d h ILE 881 CO 0.00 0.28 0.53 -0.65 -0.68 0.00 0.00 178.15 177.63 2j1d h PRO 882 N 0.61 0.93 0.03 2.37 0.11 -1.80 0.16 132.00 134.40 2j1d h PRO 882 Ca 0.15 -0.06 -0.25 0.00 0.11 0.00 0.00 66.00 65.96 2j1d h PRO 882 Cb 0.29 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.20 2j1d h PRO 882 CO -0.00 0.62 -1.02 1.96 -0.21 0.00 0.00 178.00 179.34 2j1d h GLN 883 N 0.96 0.46 -0.02 1.05 1.08 -1.84 -3.16 115.11 113.63 2j1d h GLN 883 Ca 0.33 -0.53 -0.08 0.00 -1.45 0.00 0.00 58.65 56.93 2j1d h GLN 883 Cb 0.12 0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2j1d h GLN 883 CO -0.11 1.18 -0.35 0.00 -0.95 0.00 0.00 178.83 178.60 2j1d h ALA 884 N 0.63 1.39 0.00 3.87 0.00 -1.01 -2.80 119.26 121.34 2j1d h ALA 884 Ca -0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2j1d h ALA 884 Cb 1.68 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.40 2j1d h ALA 884 CO 0.18 0.46 -0.08 0.00 0.00 0.00 0.00 179.25 179.81 2j1d h ALA 885 N 1.62 1.85 -0.00 0.00 0.00 -0.94 -2.75 119.26 119.04 2j1d h ALA 885 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2j1d h ALA 885 Cb 0.64 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2j1d h ALA 885 CO 0.05 0.10 -0.22 1.63 0.00 0.00 0.00 179.25 180.81 2j1d n LYS 886 N -4.43 0.64 -2.51 0.00 5.02 -1.05 -4.16 118.16 111.67 2j1d n LYS 886 Ca -0.03 -0.31 -0.43 0.00 -2.02 0.00 0.00 58.31 55.52 2j1d n LYS 886 Cb 0.16 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 2j1d n LYS 886 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2j1d s VAL 887 N -2.57 4.16 -0.20 -0.18 1.01 -1.04 -4.99 120.40 116.59 2j1d s VAL 887 Ca 0.24 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 63.17 2j1d s VAL 887 Cb 0.19 -4.40 0.00 0.00 0.00 0.00 0.00 36.38 32.18 2j1d s VAL 887 CO 0.52 -0.77 1.01 0.21 0.00 0.00 0.00 175.10 176.07 2j1d s ASN 888 N 2.76 7.12 0.14 3.32 3.04 -1.26 -3.43 114.94 126.64 2j1d s ASN 888 Ca 0.52 1.39 0.01 0.00 0.04 0.00 0.00 52.86 54.83 2j1d s ASN 888 Cb -0.11 -2.54 -0.08 0.00 -1.54 0.00 0.00 41.25 36.98 2j1d s ASN 888 CO 0.28 -0.60 1.32 -0.03 -3.04 0.00 0.00 177.10 175.03 2j1d h MET 889 N 7.37 0.20 -0.66 0.43 1.85 -1.98 -1.11 114.93 121.04 2j1d h MET 889 Ca -0.23 -0.25 0.02 0.00 -0.61 0.00 0.00 59.70 58.63 2j1d h MET 889 Cb 1.09 0.08 -0.04 0.00 0.43 0.00 0.00 31.60 33.16 2j1d h MET 889 CO 0.94 1.01 0.42 1.15 -0.40 0.00 0.00 176.91 180.03 2j1d h THR 890 N 0.10 1.12 -0.02 -0.77 2.02 -1.99 -1.02 112.91 112.36 2j1d h THR 890 Ca -0.06 -0.29 -0.22 0.00 0.77 0.00 0.00 66.41 66.61 2j1d h THR 890 Cb 1.61 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2j1d h THR 890 CO 0.15 0.15 -0.90 -0.08 0.37 0.00 0.00 175.52 175.21 2j1d h GLU 891 N 0.84 0.44 0.58 6.66 4.81 -1.97 -1.94 114.58 124.00 2j1d h GLU 891 Ca 0.25 -0.45 -0.03 0.00 -0.13 0.00 0.00 59.36 59.01 2j1d h GLU 891 Cb -0.04 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2j1d h GLU 891 CO -0.08 1.10 -0.31 1.25 -0.73 0.00 0.00 179.01 180.23 2j1d h LEU 892 N 0.26 -0.77 -1.87 1.64 6.46 -1.10 -1.52 115.31 118.42 2j1d h LEU 892 Ca -0.07 0.04 0.02 0.00 -0.12 0.00 0.00 57.88 57.74 2j1d h LEU 892 Cb 1.53 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.66 2j1d h LEU 892 CO 0.16 -0.51 0.13 0.44 -0.62 0.00 0.00 178.44 178.04 2j1d h ASP 893 N -0.83 0.15 -0.12 1.25 3.32 -1.22 -0.81 116.42 118.17 2j1d h ASP 893 Ca -0.08 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.83 2j1d h ASP 893 Cb 0.66 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2j1d h ASP 893 CO 0.10 0.11 -0.41 0.50 -1.72 0.00 0.00 179.24 177.82 2j1d h LYS 894 N 0.18 0.65 -0.27 3.56 3.64 -1.15 0.72 116.57 123.90 2j1d h LYS 894 Ca 0.08 -0.34 -0.11 0.00 -1.27 0.00 0.00 60.65 59.01 2j1d h LYS 894 Cb 0.11 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2j1d h LYS 894 CO -0.01 0.94 -0.26 0.93 -2.27 0.00 0.00 179.45 178.78 2j1d h GLU 895 N 0.53 0.65 -0.17 1.90 5.08 -0.40 -2.47 114.58 119.70 2j1d h GLU 895 Ca 0.04 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 57.98 2j1d h GLU 895 Cb 0.94 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2j1d h GLU 895 CO 0.08 0.95 -0.27 0.82 -1.00 0.00 0.00 179.01 179.59 2j1d h ILE 896 N 0.37 1.26 -0.36 3.13 1.08 -1.09 -2.39 117.51 119.51 2j1d h ILE 896 Ca 0.04 -1.21 -0.06 0.00 -0.39 0.00 0.00 64.86 63.25 2j1d h ILE 896 Cb 0.83 1.42 -0.01 0.00 -3.07 0.00 0.00 36.82 35.98 2j1d h ILE 896 CO 0.07 0.37 0.00 -1.28 -0.69 0.00 0.00 178.15 176.62 2j1d h SER 897 N 0.29 0.62 0.52 1.72 0.87 -0.81 -0.63 113.55 116.13 2j1d h SER 897 Ca 0.04 -0.30 -0.16 0.00 -1.23 0.00 0.00 61.79 60.14 2j1d h SER 897 Cb 0.63 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 2j1d h SER 897 CO 0.05 0.77 -0.70 0.71 -0.53 0.00 0.00 176.83 177.13 2j1d h THR 898 N 0.45 1.45 -0.18 2.23 1.35 -1.38 -1.93 112.91 114.89 2j1d h THR 898 Ca 0.10 -2.25 -0.03 0.00 -0.55 0.00 0.00 66.41 63.68 2j1d h THR 898 Cb 0.45 2.20 -0.01 0.00 -1.73 0.00 0.00 68.15 69.07 2j1d h THR 898 CO 0.02 0.66 -0.00 0.25 -0.25 0.00 0.00 175.52 176.19 2j1d h LEU 899 N 0.11 0.31 0.27 3.87 5.85 -1.36 -1.74 115.31 122.62 2j1d h LEU 899 Ca -0.02 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 2j1d h LEU 899 Cb 1.24 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.19 2j1d h LEU 899 CO 0.10 0.55 -0.13 -0.09 -0.34 0.00 0.00 178.44 178.53 2j1d h ARG 900 N 0.07 -0.35 -0.08 1.25 2.43 -1.05 -1.96 114.38 114.70 2j1d h ARG 900 Ca 0.05 0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.10 2j1d h ARG 900 Cb 0.39 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2j1d h ARG 900 CO 0.01 -0.10 -0.58 0.66 -1.51 0.00 0.00 179.97 178.45 2j1d h SER 901 N -0.55 0.27 0.17 -3.80 4.64 -1.45 -2.28 113.55 110.55 2j1d h SER 901 Ca -0.04 -0.15 -0.12 0.00 -0.47 0.00 0.00 61.79 61.01 2j1d h SER 901 Cb 0.40 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 2j1d h SER 901 CO 0.06 0.79 -0.43 1.23 -0.87 0.00 0.00 176.83 177.61 2j1d h GLY 902 N 1.44 0.36 1.06 -0.77 0.00 -1.35 -1.87 103.07 101.94 2j1d h GLY 902 Ca -0.00 -0.36 -0.18 0.00 0.00 0.00 0.00 47.33 46.78 2j1d h GLY 902 CO 0.09 0.33 -0.61 -2.00 0.00 0.00 0.00 176.54 174.35 2j1d h LEU 903 N 0.28 0.84 -1.44 3.11 5.85 -1.19 -2.28 115.31 120.48 2j1d h LEU 903 Ca 0.02 -0.60 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 2j1d h LEU 903 Cb 0.87 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 2j1d h LEU 903 CO 0.07 1.30 0.24 0.50 -0.34 0.00 0.00 178.44 180.21 2j1d h LYS 904 N 0.44 0.62 -0.16 1.25 3.64 -1.39 -0.99 116.57 119.98 2j1d h LYS 904 Ca -0.03 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.15 2j1d h LYS 904 Cb 1.23 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2j1d h LYS 904 CO 0.13 0.46 -0.52 0.00 -2.27 0.00 0.00 179.45 177.25 2j1d h ALA 905 N 1.64 0.79 -0.15 5.00 0.00 -1.20 -1.18 119.26 124.16 2j1d h ALA 905 Ca 0.16 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 2j1d h ALA 905 Cb 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2j1d h ALA 905 CO -0.03 0.68 -0.17 0.28 0.00 0.00 0.00 179.25 180.01 2j1d h VAL 906 N 0.36 1.35 -0.98 0.00 2.07 -1.14 -2.20 116.25 115.72 2j1d h VAL 906 Ca 0.01 -1.36 0.11 0.00 0.82 0.00 0.00 66.70 66.29 2j1d h VAL 906 Cb 1.04 1.90 -0.08 0.00 -1.52 0.00 0.00 31.29 32.63 2j1d h VAL 906 CO 0.09 0.40 0.62 -0.33 0.02 0.00 0.00 177.57 178.38 2j1d h GLU 907 N 0.01 0.94 -0.24 1.57 5.08 -1.17 0.11 114.58 120.88 2j1d h GLU 907 Ca 0.02 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 2j1d h GLU 907 Cb 0.72 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2j1d h GLU 907 CO 0.04 0.62 -0.06 1.15 -1.00 0.00 0.00 179.01 179.77 2j1d h THR 908 N 0.97 1.28 0.00 1.13 2.02 -1.15 -2.01 112.91 115.15 2j1d h THR 908 Ca 0.47 -1.06 -0.07 0.00 0.77 0.00 0.00 66.41 66.53 2j1d h THR 908 Cb 0.47 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 2j1d h THR 908 CO -0.24 0.33 -0.34 -0.08 0.37 0.00 0.00 175.52 175.56 2j1d h GLU 909 N 0.21 0.00 -0.38 6.66 4.57 -1.10 -1.79 114.58 122.75 2j1d h GLU 909 Ca 0.06 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.10 2j1d h GLU 909 Cb 0.52 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 2j1d h GLU 909 CO 0.02 0.34 -0.32 1.25 -1.18 0.00 0.00 179.01 179.12 2j1d h LEU 910 N 0.00 0.89 -0.44 1.64 5.85 -0.65 -1.31 115.31 121.30 2j1d h LEU 910 Ca -0.00 -0.37 -0.05 0.00 0.84 0.00 0.00 57.88 58.29 2j1d h LEU 910 Cb 0.65 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2j1d h LEU 910 CO 0.04 1.13 0.06 -0.33 -0.34 0.00 0.00 178.44 179.01 2j1d h GLU 911 N 0.71 0.73 -0.05 1.25 4.39 -0.95 -0.05 114.58 120.61 2j1d h GLU 911 Ca 0.07 -0.20 0.02 0.00 0.34 0.00 0.00 59.36 59.59 2j1d h GLU 911 Cb 0.88 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.43 2j1d h GLU 911 CO 0.08 0.76 -0.05 -0.92 -1.16 0.00 0.00 179.01 177.72 2j1d h TYR 912 N 0.58 -0.12 -0.29 4.33 3.20 -1.32 -2.80 116.97 120.56 2j1d h TYR 912 Ca 0.13 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 2j1d h TYR 912 Cb 0.39 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2j1d h TYR 912 CO 0.03 -0.08 -0.29 0.37 -1.64 0.00 0.00 178.16 176.55 2j1d h GLN 913 N -0.06 0.60 -0.34 1.82 5.75 -1.10 -2.07 115.11 119.71 2j1d h GLN 913 Ca 0.04 -0.26 -0.02 0.00 -0.15 0.00 0.00 58.65 58.27 2j1d h GLN 913 Cb 0.12 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 2j1d h GLN 913 CO -0.09 0.83 0.13 0.87 -2.65 0.00 0.00 178.83 177.91 2j1d h LYS 914 N 0.52 0.47 -1.03 1.69 1.57 -1.00 -3.04 116.57 115.75 2j1d h LYS 914 Ca 0.07 -0.06 -0.20 0.00 -1.87 0.00 0.00 60.65 58.59 2j1d h LYS 914 Cb 0.76 -0.09 -0.11 0.00 0.08 0.00 0.00 32.23 32.87 2j1d h LYS 914 CO 0.06 0.40 0.25 -1.13 -0.57 0.00 0.00 179.45 178.46 2j1d n SER 915 N -4.40 3.43 -3.95 0.86 3.41 -0.78 -4.82 113.62 107.38 2j1d n SER 915 Ca 0.02 -2.61 -0.14 0.00 -0.26 0.00 0.00 58.87 55.87 2j1d n SER 915 Cb 0.14 -0.65 -0.14 0.00 -0.26 0.00 0.00 64.21 63.30 2j1d n SER 915 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2j1d s GLN 916 N -1.23 0.32 0.24 4.33 -1.52 -1.15 -5.05 119.66 115.60 2j1d s GLN 916 Ca 0.21 -0.21 -0.30 0.00 -1.95 0.00 0.00 55.36 53.11 2j1d s GLN 916 Cb 0.18 -0.27 -0.10 0.00 -0.22 0.00 0.00 33.01 32.59 2j1d s GLN 916 CO 0.04 0.07 1.52 -1.25 -0.25 0.00 0.00 175.29 175.42 2j1d s PRO 917 N -0.28 4.21 0.09 2.91 0.04 -1.26 -4.90 135.00 135.81 2j1d s PRO 917 Ca -0.00 2.41 -0.34 0.00 0.04 0.00 0.00 61.00 63.10 2j1d s PRO 917 Cb -0.03 -3.09 -0.14 0.00 0.04 0.00 0.00 34.50 31.29 2j1d s PRO 917 CO -0.00 -0.53 1.63 -2.30 0.04 0.00 0.00 177.00 175.84 2j1d n PRO 918 N 2.66 2.06 -4.70 0.56 -0.02 -1.26 -5.00 135.00 129.30 2j1d n PRO 918 Ca 0.09 0.75 -0.32 0.00 -2.02 0.00 0.00 63.50 61.99 2j1d n PRO 918 Cb 0.39 -2.52 -0.12 0.00 -0.02 0.00 0.00 33.50 31.23 2j1d n PRO 918 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2j1d s GLN 919 N 1.64 2.39 0.45 -0.52 -1.52 -1.26 -5.10 119.66 115.73 2j1d s GLN 919 Ca 0.83 -0.79 -0.25 0.00 -1.95 0.00 0.00 55.36 53.20 2j1d s GLN 919 Cb -0.71 -2.36 -0.09 0.00 -0.22 0.00 0.00 33.01 29.64 2j1d s GLN 919 CO 0.42 0.59 1.36 -0.35 -0.25 0.00 0.00 175.29 177.06 2j1d n PRO 920 N 1.86 2.07 -0.94 2.91 -0.04 -1.26 -2.46 135.00 137.14 2j1d n PRO 920 Ca -0.16 0.74 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 2j1d n PRO 920 Cb 0.52 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 2j1d n PRO 920 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2j1d n GLY 921 N 0.69 0.67 3.37 0.55 0.00 -1.26 -4.98 105.19 104.23 2j1d n GLY 921 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2j1d n GLY 921 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j1d s ASP 922 N -2.52 5.90 -0.22 1.61 3.68 -1.03 -4.02 116.67 120.06 2j1d s ASP 922 Ca 0.00 -1.21 0.14 0.00 2.13 0.00 0.00 52.55 53.61 2j1d s ASP 922 Cb 0.00 -2.08 0.54 0.00 -1.45 0.00 0.00 42.92 39.92 2j1d s ASP 922 CO 0.00 -0.51 1.47 0.29 0.13 0.00 0.00 175.17 176.54 2j1d n LYS 923 N 5.07 2.66 0.13 4.34 5.02 -0.60 -4.75 118.16 130.03 2j1d n LYS 923 Ca -0.11 -2.95 -0.13 0.00 -2.02 0.00 0.00 58.31 53.10 2j1d n LYS 923 Cb 0.45 -1.87 -0.08 0.00 -0.02 0.00 0.00 35.03 33.51 2j1d n LYS 923 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2j1d h PHE 924 N 1.61 -0.33 -0.94 2.13 3.57 -1.92 -2.08 116.94 118.98 2j1d h PHE 924 Ca 0.09 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.58 2j1d h PHE 924 Cb 1.58 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 40.39 2j1d h PHE 924 CO 0.70 0.02 0.60 0.28 -2.23 0.00 0.00 178.31 177.69 2j1d h VAL 925 N -0.76 1.25 -0.67 1.41 2.07 -1.91 0.20 116.25 117.84 2j1d h VAL 925 Ca -0.04 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 2j1d h VAL 925 Cb 0.50 -0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.12 2j1d h VAL 925 CO 0.06 0.25 0.29 -1.28 0.02 0.00 0.00 177.57 176.91 2j1d h SER 926 N 1.29 0.88 0.06 0.57 0.87 -1.89 -2.96 113.55 112.37 2j1d h SER 926 Ca 0.34 -0.11 -0.35 0.00 -1.23 0.00 0.00 61.79 60.45 2j1d h SER 926 Cb -0.11 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.58 2j1d h SER 926 CO -0.07 0.77 -1.94 0.52 -0.53 0.00 0.00 176.83 175.57 2j1d n VAL 927 N -4.32 1.65 0.10 2.23 0.31 -0.78 -3.99 118.33 113.53 2j1d n VAL 927 Ca 0.06 -0.46 -0.00 0.00 -0.01 0.00 0.00 64.34 63.93 2j1d n VAL 927 Cb 0.15 -1.78 0.29 0.00 -0.91 0.00 0.00 33.84 31.59 2j1d n VAL 927 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2j1d h VAL 928 N -0.32 1.26 -0.19 2.52 2.07 -0.73 -2.03 116.25 118.83 2j1d h VAL 928 Ca -0.46 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 65.79 2j1d h VAL 928 Cb 1.79 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 2j1d h VAL 928 CO -0.07 0.38 0.05 0.28 0.02 0.00 0.00 177.57 178.24 2j1d h SER 929 N 0.21 0.28 -0.82 0.57 0.02 -1.71 0.99 113.55 113.08 2j1d h SER 929 Ca 0.03 -0.21 0.10 0.00 -0.84 0.00 0.00 61.79 60.87 2j1d h SER 929 Cb 0.65 -0.07 -0.08 0.00 0.14 0.00 0.00 62.40 63.04 2j1d h SER 929 CO 0.05 0.42 0.46 1.56 -1.14 0.00 0.00 176.83 178.18 2j1d h GLN 930 N 0.13 0.73 -0.01 3.45 7.50 -1.65 -2.43 115.11 122.82 2j1d h GLN 930 Ca 0.06 -0.04 -0.00 0.00 0.50 0.00 0.00 58.65 59.16 2j1d h GLN 930 Cb 0.24 -0.16 -0.00 0.00 0.05 0.00 0.00 27.48 27.61 2j1d h GLN 930 CO -0.00 0.48 -0.01 0.35 -1.50 0.00 0.00 178.83 178.15 2j1d h PHE 931 N 0.75 0.03 -0.88 2.96 3.57 -1.13 -3.20 116.94 119.04 2j1d h PHE 931 Ca 0.41 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.98 2j1d h PHE 931 Cb 0.42 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.09 2j1d h PHE 931 CO -0.07 0.51 0.57 0.82 -2.23 0.00 0.00 178.31 177.92 2j1d h ILE 932 N -0.47 1.02 -0.10 1.41 5.03 -0.77 0.51 117.51 124.15 2j1d h ILE 932 Ca 0.00 -0.32 0.03 0.00 -0.12 0.00 0.00 64.86 64.44 2j1d h ILE 932 Cb 0.51 -0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 34.27 2j1d h ILE 932 CO 0.00 0.17 -0.06 0.74 -0.68 0.00 0.00 178.15 178.32 2j1d h THR 933 N 0.95 0.80 0.02 -0.27 2.02 -1.45 0.51 112.91 115.49 2j1d h THR 933 Ca 0.39 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.45 2j1d h THR 933 Cb 0.28 0.80 0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2j1d h THR 933 CO -0.15 0.00 -0.49 1.62 0.37 0.00 0.00 175.52 176.86 2j1d h VAL 934 N -0.07 1.49 -0.75 3.16 3.04 -1.47 -3.17 116.25 118.49 2j1d h VAL 934 Ca 0.06 -2.11 -0.01 0.00 -1.01 0.00 0.00 66.70 63.63 2j1d h VAL 934 Cb 0.16 2.76 -0.04 0.00 -2.01 0.00 0.00 31.29 32.16 2j1d h VAL 934 CO -0.14 0.60 0.41 0.00 -1.01 0.00 0.00 177.57 177.43 2j1d h ALA 935 N 0.26 1.32 -0.05 3.17 0.00 0.14 0.13 119.26 124.22 2j1d h ALA 935 Ca -0.07 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 2j1d h ALA 935 Cb 1.25 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2j1d h ALA 935 CO 0.10 0.56 -0.78 1.03 0.00 0.00 0.00 179.25 180.16 2j1d h SER 936 N 1.04 0.41 -0.12 0.00 0.87 -0.11 -1.01 113.55 114.63 2j1d h SER 936 Ca 0.27 -0.29 -0.05 0.00 -1.23 0.00 0.00 61.79 60.49 2j1d h SER 936 Cb 0.02 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2j1d h SER 936 CO -0.04 1.04 -0.10 0.15 -0.53 0.00 0.00 176.83 177.34 2j1d h PHE 937 N 0.22 0.33 -0.52 2.24 3.57 -1.48 -2.44 116.94 118.86 2j1d h PHE 937 Ca -0.04 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.32 2j1d h PHE 937 Cb 1.37 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.01 2j1d h PHE 937 CO 0.04 0.68 0.15 1.03 -2.23 0.00 0.00 178.31 177.98 2j1d h SER 938 N -0.11 0.77 0.20 0.41 0.87 -0.73 -2.59 113.55 112.38 2j1d h SER 938 Ca 0.02 -0.21 -0.21 0.00 -1.23 0.00 0.00 61.79 60.16 2j1d h SER 938 Cb 0.62 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 2j1d h SER 938 CO 0.03 0.78 -0.82 0.15 -0.53 0.00 0.00 176.83 176.43 2j1d h PHE 939 N 0.71 0.68 -0.70 2.24 3.57 -1.28 -2.30 116.94 119.86 2j1d h PHE 939 Ca 0.17 -0.33 0.11 0.00 3.53 0.00 0.00 57.97 61.45 2j1d h PHE 939 Cb 0.29 -0.09 -0.08 0.00 2.79 0.00 0.00 35.95 38.86 2j1d h PHE 939 CO 0.02 1.12 0.29 1.03 -2.23 0.00 0.00 178.31 178.54 2j1d h SER 940 N 0.31 0.32 -0.29 0.41 0.87 -1.39 0.58 113.55 114.36 2j1d h SER 940 Ca -0.05 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.54 2j1d h SER 940 Cb 1.43 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.42 2j1d h SER 940 CO 0.15 0.16 -0.00 -0.78 -0.53 0.00 0.00 176.83 175.83 2j1d h ASP 941 N 0.48 0.51 -0.54 6.23 3.58 -1.39 -2.25 116.42 123.04 2j1d h ASP 941 Ca 0.36 -0.31 0.08 0.00 0.42 0.00 0.00 57.03 57.58 2j1d h ASP 941 Cb 0.47 -0.14 -0.07 0.00 1.72 0.00 0.00 39.33 41.31 2j1d h ASP 941 CO -0.33 0.69 0.18 0.58 -2.88 0.00 0.00 179.24 177.48 2j1d h VAL 942 N 0.31 0.78 0.00 2.25 2.07 -1.03 -0.81 116.25 119.83 2j1d h VAL 942 Ca 0.08 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2j1d h VAL 942 Cb 0.43 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2j1d h VAL 942 CO 0.02 0.06 -0.04 -0.33 0.02 0.00 0.00 177.57 177.30 2j1d h GLU 943 N 0.35 0.00 0.02 1.57 5.08 -0.75 -0.96 114.58 119.88 2j1d h GLU 943 Ca 0.27 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2j1d h GLU 943 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2j1d h GLU 943 CO -0.29 0.04 -0.01 -0.44 -1.00 0.00 0.00 179.01 177.32 2j1d h ASP 944 N 0.00 -0.02 -0.80 1.42 3.32 -0.71 -2.03 116.42 117.60 2j1d h ASP 944 Ca -0.00 -0.76 0.12 0.00 0.02 0.00 0.00 57.03 56.42 2j1d h ASP 944 Cb 0.08 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 2j1d h ASP 944 CO 0.01 0.79 0.52 -0.07 -1.72 0.00 0.00 179.24 178.77 2j1d h LEU 945 N -0.86 0.58 -0.14 1.55 3.38 -1.09 -1.76 115.31 116.97 2j1d h LEU 945 Ca -0.00 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 2j1d h LEU 945 Cb 0.77 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.44 2j1d h LEU 945 CO 0.00 0.32 -0.50 0.25 0.09 0.00 0.00 178.44 178.60 2j1d h LEU 946 N 0.63 0.68 -0.70 1.67 5.85 -1.22 -1.61 115.31 120.60 2j1d h LEU 946 Ca 0.38 -0.61 0.00 0.00 0.84 0.00 0.00 57.88 58.50 2j1d h LEU 946 Cb 0.62 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 2j1d h LEU 946 CO -0.15 1.18 0.45 0.00 -0.34 0.00 0.00 178.44 179.58 2j1d h ALA 947 N 0.52 0.88 -0.03 1.25 0.00 -1.05 -2.17 119.26 118.66 2j1d h ALA 947 Ca -0.02 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 2j1d h ALA 947 Cb 1.13 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2j1d h ALA 947 CO 0.11 0.32 -0.85 1.05 0.00 0.00 0.00 179.25 179.87 2j1d h GLU 948 N 0.95 0.36 -0.61 0.00 4.11 -1.37 -2.82 114.58 115.20 2j1d h GLU 948 Ca 0.25 -0.35 -0.03 0.00 0.07 0.00 0.00 59.36 59.31 2j1d h GLU 948 Cb -0.09 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2j1d h GLU 948 CO -0.05 1.02 0.28 0.00 0.07 0.00 0.00 179.01 180.32 2j1d h ALA 949 N 0.86 0.79 0.00 1.06 0.00 -1.12 -1.97 119.26 118.88 2j1d h ALA 949 Ca -0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2j1d h ALA 949 Cb 1.46 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2j1d h ALA 949 CO 0.14 0.37 -0.29 0.87 0.00 0.00 0.00 179.25 180.34 2j1d h LYS 950 N 0.84 0.00 0.00 0.00 1.57 -1.41 -1.38 116.57 116.20 2j1d h LYS 950 Ca 0.21 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2j1d h LYS 950 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2j1d h LYS 950 CO -0.02 0.29 -0.00 -0.44 -0.57 0.00 0.00 179.45 178.70 2j1d h ASP 951 N 0.00 -0.01 -0.88 0.86 5.19 -1.19 -2.36 116.42 118.03 2j1d h ASP 951 Ca -0.00 -0.43 -0.02 0.00 -0.62 0.00 0.00 57.03 55.96 2j1d h ASP 951 Cb 0.53 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.00 2j1d h ASP 951 CO 0.04 0.43 0.48 -0.07 -3.12 0.00 0.00 179.24 176.99 2j1d h LEU 952 N -0.44 1.11 -0.40 1.55 3.38 -1.29 -1.76 115.31 117.45 2j1d h LEU 952 Ca -0.00 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.88 2j1d h LEU 952 Cb 0.43 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2j1d h LEU 952 CO 0.00 0.89 0.26 0.15 0.09 0.00 0.00 178.44 179.83 2j1d h PHE 953 N 1.24 0.49 -0.83 1.13 3.57 -1.28 0.10 116.94 121.36 2j1d h PHE 953 Ca 0.31 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.89 2j1d h PHE 953 Cb 0.03 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.56 2j1d h PHE 953 CO 0.01 0.30 0.54 1.15 -2.23 0.00 0.00 178.31 178.08 2j1d h THR 954 N 0.53 1.04 -0.09 4.41 2.02 -1.03 0.28 112.91 120.06 2j1d h THR 954 Ca 0.15 -0.31 -0.19 0.00 0.77 0.00 0.00 66.41 66.83 2j1d h THR 954 Cb -0.04 0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.42 2j1d h THR 954 CO -0.04 0.16 -0.73 0.11 0.37 0.00 0.00 175.52 175.39 2j1d h LYS 955 N 0.90 0.46 -0.10 6.66 1.57 -0.77 -2.76 116.57 122.53 2j1d h LYS 955 Ca 0.36 -0.37 -0.21 0.00 -1.87 0.00 0.00 60.65 58.56 2j1d h LYS 955 Cb 0.25 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2j1d h LYS 955 CO -0.13 1.00 -0.79 0.00 -0.57 0.00 0.00 179.45 178.96 2j1d h ALA 956 N 0.89 0.42 0.09 3.86 0.00 -0.23 -1.24 119.26 123.05 2j1d h ALA 956 Ca -0.03 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 2j1d h ALA 956 Cb 1.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2j1d h ALA 956 CO 0.13 0.73 -0.05 0.28 0.00 0.00 0.00 179.25 180.34 2j1d h VAL 957 N 0.39 1.00 -0.37 0.00 2.07 -0.48 -2.93 116.25 115.93 2j1d h VAL 957 Ca -0.05 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 2j1d h VAL 957 Cb 1.40 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 2j1d h VAL 957 CO 0.15 0.08 0.19 0.11 0.02 0.00 0.00 177.57 178.11 2j1d h LYS 958 N -0.27 0.51 -0.00 1.57 1.57 -1.50 -2.54 116.57 115.91 2j1d h LYS 958 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2j1d h LYS 958 Cb 0.23 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 2j1d h LYS 958 CO 0.02 0.39 0.00 1.25 -0.57 0.00 0.00 179.45 180.54 2j1d h HIS 959 N 0.51 0.00 -0.27 -1.35 2.76 -1.03 -1.94 115.15 113.83 2j1d h HIS 959 Ca 0.13 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.26 2j1d h HIS 959 Cb 0.04 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 2j1d h HIS 959 CO 0.00 0.00 -0.01 1.19 -1.30 0.00 0.00 177.93 177.81 2j1d n PHE 960 N -4.15 0.92 -1.78 5.26 3.72 -1.01 -4.98 117.46 115.44 2j1d n PHE 960 Ca -0.03 -1.06 -0.09 0.00 -0.05 0.00 0.00 57.45 56.22 2j1d n PHE 960 Cb 0.08 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 38.26 2j1d n PHE 960 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2j1d n GLY 961 N -0.73 0.47 3.94 1.37 0.00 -0.73 -4.59 105.19 104.92 2j1d n GLY 961 Ca 0.24 -0.54 -0.24 0.00 0.00 0.00 0.00 46.02 45.48 2j1d n GLY 961 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j1d s GLU 962 N -3.74 3.50 -0.23 1.61 0.41 -0.99 -5.02 118.70 114.23 2j1d s GLU 962 Ca 0.00 -0.34 -0.24 0.00 -0.41 0.00 0.00 54.97 53.98 2j1d s GLU 962 Cb 0.00 -2.70 -0.01 0.00 -1.78 0.00 0.00 34.13 29.65 2j1d s GLU 962 CO 0.00 0.20 0.82 -1.21 -0.49 0.00 0.00 175.26 174.58 2j1d s GLU 963 N -4.13 4.20 0.26 1.61 0.41 -1.26 -4.24 118.70 115.55 2j1d s GLU 963 Ca 0.40 0.94 -0.30 0.00 -0.41 0.00 0.00 54.97 55.60 2j1d s GLU 963 Cb -0.10 -3.63 -0.10 0.00 -1.78 0.00 0.00 34.13 28.52 2j1d s GLU 963 CO 0.34 -0.48 1.33 0.00 -0.49 0.00 0.00 175.26 175.96 2j1d s ALA 964 N 2.72 3.54 0.00 5.21 0.00 -1.26 -2.17 121.76 129.80 2j1d s ALA 964 Ca 0.35 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.52 2j1d s ALA 964 Cb -0.15 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2j1d s ALA 964 CO 0.08 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.64 2j1d n GLY 965 N 1.73 2.90 0.49 0.00 0.00 -1.26 -4.87 105.19 104.18 2j1d n GLY 965 Ca 0.04 -0.71 0.12 0.00 0.00 0.00 0.00 46.02 45.47 2j1d n GLY 965 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2j1d n LYS 966 N 0.00 1.65 -3.79 1.61 5.02 -0.92 -4.84 118.16 116.88 2j1d n LYS 966 Ca 0.00 -0.97 -0.13 0.00 -2.02 0.00 0.00 58.31 55.19 2j1d n LYS 966 Cb 0.00 -1.42 -0.13 0.00 -0.02 0.00 0.00 35.03 33.46 2j1d n LYS 966 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 2j1d s ILE 967 N -1.87 -0.02 0.24 -0.18 2.07 -1.25 -4.99 121.20 115.20 2j1d s ILE 967 Ca 0.34 0.07 0.05 0.00 -1.41 0.00 0.00 60.65 59.71 2j1d s ILE 967 Cb 0.18 -0.22 -0.03 0.00 0.13 0.00 0.00 42.46 42.52 2j1d s ILE 967 CO 0.29 0.03 0.36 -1.10 -1.91 0.00 0.00 174.94 172.60 2j1d s GLN 968 N 0.53 3.41 0.22 3.50 -1.52 -1.26 -4.94 119.66 119.60 2j1d s GLN 968 Ca -0.04 -0.78 -0.07 0.00 -1.95 0.00 0.00 55.36 52.52 2j1d s GLN 968 Cb -0.05 -2.87 0.34 0.00 -0.22 0.00 0.00 33.01 30.20 2j1d s GLN 968 CO -0.02 0.41 1.75 -1.35 -0.25 0.00 0.00 175.29 175.83 2j1d h PRO 969 N 1.17 0.47 -0.99 2.91 0.11 -1.90 0.07 132.00 133.83 2j1d h PRO 969 Ca -0.52 -0.03 0.22 0.00 0.11 0.00 0.00 66.00 65.78 2j1d h PRO 969 Cb 1.23 -0.10 -0.10 0.00 0.11 0.00 0.00 31.00 32.14 2j1d h PRO 969 CO 0.61 0.31 0.62 0.38 -0.21 0.00 0.00 178.00 179.70 2j1d h ASP 970 N 0.48 0.64 0.00 -2.05 3.04 -1.72 -0.18 116.42 116.63 2j1d h ASP 970 Ca 0.35 0.09 -0.09 0.00 -3.24 0.00 0.00 57.03 54.14 2j1d h ASP 970 Cb 0.43 -0.02 -0.01 0.00 -1.04 0.00 0.00 39.33 38.69 2j1d h ASP 970 CO -0.32 0.20 -0.50 -0.08 -2.04 0.00 0.00 179.24 176.50 2j1d h GLU 971 N 0.60 0.00 0.58 4.15 4.81 -1.60 -2.70 114.58 120.42 2j1d h GLU 971 Ca 0.57 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.78 2j1d h GLU 971 Cb 1.11 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 2j1d h GLU 971 CO -0.34 0.94 -0.34 0.35 -0.73 0.00 0.00 179.01 178.90 2j1d h PHE 972 N -1.00 -0.89 0.00 0.92 3.04 -0.86 -1.69 116.94 116.45 2j1d h PHE 972 Ca -0.14 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.80 2j1d h PHE 972 Cb 1.07 0.31 0.00 0.00 2.56 0.00 0.00 35.95 39.90 2j1d h PHE 972 CO 0.19 -0.52 0.00 0.74 -2.02 0.00 0.00 178.31 176.70 2j1d h PHE 973 N -0.86 0.00 -0.05 0.41 -1.00 -1.23 -2.59 116.94 111.62 2j1d h PHE 973 Ca -0.07 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.58 2j1d h PHE 973 Cb 0.69 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.24 2j1d h PHE 973 CO -0.09 0.00 -0.56 0.78 -1.61 0.00 0.00 178.31 176.83 2j1d h GLY 974 N 2.40 0.17 0.94 -1.45 0.00 -1.08 0.95 103.07 104.99 2j1d h GLY 974 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 2j1d h GLY 974 CO 0.00 0.18 -0.28 -2.22 0.00 0.00 0.00 176.54 174.21 2j1d h ILE 975 N 0.12 0.42 -0.62 2.60 2.04 -0.91 -2.24 117.51 118.92 2j1d h ILE 975 Ca -0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 2j1d h ILE 975 Cb 1.03 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2j1d h ILE 975 CO 0.08 0.00 0.23 -0.26 0.00 0.00 0.00 178.15 178.20 2j1d h PHE 976 N -0.74 0.92 -0.43 1.37 -1.00 -1.53 -2.33 116.94 113.20 2j1d h PHE 976 Ca -0.06 -0.06 -0.14 0.00 2.81 0.00 0.00 57.97 60.52 2j1d h PHE 976 Cb 0.59 -0.28 -0.01 0.00 3.61 0.00 0.00 35.95 39.86 2j1d h PHE 976 CO -0.07 0.72 -0.27 0.22 -1.61 0.00 0.00 178.31 177.31 2j1d h ASP 977 N 0.89 0.99 -0.67 2.17 3.58 -0.79 -0.96 116.42 121.63 2j1d h ASP 977 Ca 0.21 -0.42 -0.07 0.00 0.42 0.00 0.00 57.03 57.17 2j1d h ASP 977 Cb 0.21 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 40.95 2j1d h ASP 977 CO -0.02 1.19 0.17 1.56 -2.88 0.00 0.00 179.24 179.27 2j1d h GLN 978 N 0.78 1.08 -0.39 0.28 4.20 -1.30 -0.95 115.11 118.81 2j1d h GLN 978 Ca 0.09 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.53 2j1d h GLN 978 Cb 0.85 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 2j1d h GLN 978 CO 0.08 0.96 0.18 0.35 -0.67 0.00 0.00 178.83 179.72 2j1d h PHE 979 N 1.03 0.58 -0.81 2.96 3.57 -1.10 -0.23 116.94 122.94 2j1d h PHE 979 Ca 0.22 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 2j1d h PHE 979 Cb 0.36 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 2j1d h PHE 979 CO 0.03 0.49 0.38 -0.07 -2.23 0.00 0.00 178.31 176.91 2j1d h LEU 980 N 0.50 1.07 -1.15 0.59 3.38 -0.98 0.30 115.31 119.01 2j1d h LEU 980 Ca 0.13 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2j1d h LEU 980 Cb 0.14 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 2j1d h LEU 980 CO -0.02 0.91 0.59 1.56 0.09 0.00 0.00 178.44 181.57 2j1d h GLN 981 N 1.15 0.98 -0.01 1.13 4.20 -0.95 -0.47 115.11 121.14 2j1d h GLN 981 Ca 0.28 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.78 2j1d h GLN 981 Cb 0.13 -0.22 0.01 0.00 0.30 0.00 0.00 27.48 27.70 2j1d h GLN 981 CO -0.03 0.65 -0.58 0.00 -0.67 0.00 0.00 178.83 178.20 2j1d h ALA 982 N 1.51 0.09 -0.92 3.87 0.00 0.49 -1.61 119.26 122.69 2j1d h ALA 982 Ca 0.39 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2j1d h ALA 982 Cb 0.23 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2j1d h ALA 982 CO -0.15 0.35 0.56 0.28 0.00 0.00 0.00 179.25 180.29 2j1d h VAL 983 N -0.09 1.25 -0.19 0.00 2.07 -0.45 -0.13 116.25 118.71 2j1d h VAL 983 Ca -0.07 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 2j1d h VAL 983 Cb 1.28 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2j1d h VAL 983 CO 0.11 0.26 0.11 -1.28 0.02 0.00 0.00 177.57 176.80 2j1d h SER 984 N 1.26 0.23 -0.52 0.57 0.87 -1.09 -0.75 113.55 114.12 2j1d h SER 984 Ca 0.33 -0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.83 2j1d h SER 984 Cb -0.07 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 2j1d h SER 984 CO -0.06 0.22 0.31 -0.33 -0.53 0.00 0.00 176.83 176.44 2j1d h GLU 985 N 0.23 0.71 -0.38 2.24 5.08 -0.99 -2.78 114.58 118.68 2j1d h GLU 985 Ca 0.07 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2j1d h GLU 985 Cb 0.03 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2j1d h GLU 985 CO -0.01 0.53 0.17 0.00 -1.00 0.00 0.00 179.01 178.69 2j1d h ALA 986 N 1.15 0.50 -0.52 3.43 0.00 -0.97 -1.87 119.26 120.98 2j1d h ALA 986 Ca 0.19 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.08 2j1d h ALA 986 Cb 0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 17.79 17.54 2j1d h ALA 986 CO -0.03 0.08 -0.16 0.87 0.00 0.00 0.00 179.25 180.00 2j1d h LYS 987 N 0.48 -0.04 0.80 0.00 1.57 -1.03 0.39 116.57 118.74 2j1d h LYS 987 Ca 0.13 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.87 2j1d h LYS 987 Cb 0.15 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.48 2j1d h LYS 987 CO -0.01 -0.03 -0.38 0.37 -0.57 0.00 0.00 179.45 178.83 2j1d h GLN 988 N -0.04 -1.03 -0.91 3.15 5.75 -1.36 -1.73 115.11 118.94 2j1d h GLN 988 Ca 0.25 0.07 0.19 0.00 -0.15 0.00 0.00 58.65 59.01 2j1d h GLN 988 Cb 0.42 0.24 -0.11 0.00 1.07 0.00 0.00 27.48 29.09 2j1d h GLN 988 CO -0.55 -0.68 0.46 0.93 -2.65 0.00 0.00 178.83 176.34 2j1d h GLU 989 N -1.25 0.55 -0.38 1.69 5.08 -1.12 0.55 114.58 119.69 2j1d h GLU 989 Ca -0.11 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2j1d h GLU 989 Cb 0.83 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 2j1d h GLU 989 CO 0.18 0.36 0.15 -0.91 -1.00 0.00 0.00 179.01 177.80 2j1d h ASN 990 N 0.56 0.19 -0.32 1.42 -0.26 -0.89 -2.25 115.58 114.04 2j1d h ASN 990 Ca 0.53 0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 56.29 2j1d h ASN 990 Cb 0.89 0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 38.14 2j1d h ASN 990 CO -0.44 0.15 0.14 -0.08 -1.06 0.00 0.00 177.43 176.14 2j1d h GLU 991 N 0.32 0.53 0.00 0.81 4.81 0.95 -0.05 114.58 121.96 2j1d h GLU 991 Ca 0.17 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.21 2j1d h GLU 991 Cb 0.13 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2j1d h GLU 991 CO -0.16 0.45 -0.59 -0.91 -0.73 0.00 0.00 179.01 177.07 2j1d h ASN 992 N 0.53 0.00 -0.07 1.04 -0.26 -0.79 -2.85 115.58 113.18 2j1d h ASN 992 Ca 0.13 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.84 2j1d h ASN 992 Cb 0.13 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.39 2j1d h ASN 992 CO -0.01 0.59 -0.07 0.24 -1.06 0.00 0.00 177.43 177.12 2j1d h MET 993 N 0.00 0.16 -0.78 0.81 2.86 -0.64 -3.17 114.93 114.16 2j1d h MET 993 Ca -0.01 -0.09 0.13 0.00 -2.06 0.00 0.00 59.70 57.68 2j1d h MET 993 Cb 1.10 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.71 2j1d h MET 993 CO 0.08 0.61 0.52 -0.09 1.06 0.00 0.00 176.91 179.08 2j1d h ARG 994 N -0.28 0.54 0.00 1.72 2.43 -1.00 -0.70 114.38 117.09 2j1d h ARG 994 Ca 0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2j1d h ARG 994 Cb 0.58 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2j1d h ARG 994 CO 0.02 0.36 0.00 1.63 -1.51 0.00 0.00 179.97 180.47 2j1d n LYS 995 N -4.51 0.16 0.07 0.20 5.02 -1.08 -1.98 118.16 116.05 2j1d n LYS 995 Ca 0.14 0.14 -0.17 0.00 -2.02 0.00 0.00 58.31 56.41 2j1d n LYS 995 Cb 0.45 -1.69 -0.09 0.00 -0.02 0.00 0.00 35.03 33.68 2j1d n LYS 995 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2j1d h LYS 996 N 0.00 0.50 -0.07 1.97 1.79 -1.12 -2.89 116.57 116.75 2j1d h LYS 996 Ca 0.00 -0.59 0.00 0.00 -2.18 0.00 0.00 60.65 57.88 2j1d h LYS 996 Cb 0.64 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2j1d h LYS 996 CO 0.00 1.22 0.00 1.63 -1.08 0.00 0.00 179.45 181.22 2j1d n LYS 997 N -3.75 1.26 -0.06 3.15 5.02 -0.88 -0.51 118.16 122.38 2j1d n LYS 997 Ca -0.09 -0.39 -0.09 0.00 -2.02 0.00 0.00 58.31 55.72 2j1d n LYS 997 Cb 0.90 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 34.57 2j1d n LYS 997 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2j1d n GLU 998 N -0.34 0.64 -0.27 1.97 1.02 -0.84 -3.98 120.64 118.84 2j1d n GLU 998 Ca 0.12 0.06 0.08 0.00 -0.02 0.00 0.00 57.16 57.40 2j1d n GLU 998 Cb 0.14 -1.26 0.31 0.00 -0.02 0.00 0.00 31.44 30.61 2j1d n GLU 998 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2j1d h GLU 999 N 0.00 0.82 -0.02 3.49 4.81 -1.37 -2.23 114.58 120.08 2j1d h GLU 999 Ca -0.29 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2j1d h GLU 999 Cb 1.48 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2j1d h GLU 999 CO -0.04 0.54 -0.15 0.39 -0.73 0.00 0.00 179.01 179.02 2j1d n GLU 1000N -4.53 1.73 0.05 1.92 1.02 0.33 -3.71 120.64 117.46 2j1d n GLU 1000Ca 0.15 -1.44 -0.02 0.00 -0.02 0.00 0.00 57.16 55.83 2j1d n GLU 1000Cb 0.32 -1.40 -0.07 0.00 -0.02 0.00 0.00 31.44 30.27 2j1d n GLU 1000CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2j1d h GLU 1001N 3.40 0.00 0.00 3.49 4.22 -1.65 -3.19 114.58 120.85 2j1d h GLU 1001Ca 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.36 2j1d h GLU 1001Cb 0.80 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2j1d h GLU 1001CO 0.00 0.45 -0.39 0.00 -2.18 0.00 0.00 179.01 176.89 2j1d h ARG 1002N 0.00 0.00 -0.62 1.92 3.08 -1.53 0.97 114.38 118.20 2j1d h ARG 1002Ca -0.13 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.83 2j1d h ARG 1002Cb 1.63 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.66 2j1d h ARG 1002CO 0.07 0.39 0.02 0.00 -1.07 0.00 0.00 179.97 179.37 2j1d h ARG 1003N 0.00 1.08 0.00 0.04 2.47 -1.64 0.68 114.38 117.01 2j1d h ARG 1003Ca -0.00 -0.33 -0.05 0.00 -1.26 0.00 0.00 59.98 58.34 2j1d h ARG 1003Cb 0.75 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.96 2j1d h ARG 1003CO 0.05 1.04 -0.35 0.00 0.56 0.00 0.00 179.97 181.28 2j1d h ALA 1004N 1.01 0.82 0.15 0.04 0.00 -1.49 -2.22 119.26 117.57 2j1d h ALA 1004Ca 0.18 -0.21 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 2j1d h ALA 1004Cb 0.54 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.33 2j1d h ALA 1004CO 0.03 0.28 -1.07 0.07 0.00 0.00 0.00 179.25 178.55 2j1d h ARG 1005N 0.00 0.32 -0.07 0.00 -0.00 -0.74 -3.13 114.38 110.75 2j1d h ARG 1005Ca -0.01 -0.54 -0.05 0.00 -0.00 0.00 0.00 59.98 59.38 2j1d h ARG 1005Cb 1.17 0.20 0.00 0.00 -0.00 0.00 0.00 29.97 31.34 2j1d h ARG 1005CO 0.03 1.26 -0.16 1.98 -0.00 0.00 0.00 179.97 183.08 2j1d h MET 1006N -0.29 0.23 0.00 0.08 -1.53 -0.97 -2.98 114.93 109.48 2j1d h MET 1006Ca -0.20 -0.15 0.00 0.00 -3.44 0.00 0.00 59.70 55.90 2j1d h MET 1006Cb 1.75 0.02 0.00 0.00 -0.55 0.00 0.00 31.60 32.82 2j1d h MET 1006CO 0.14 0.75 0.00 1.49 0.14 0.00 0.00 176.91 179.44 2j1d h GLU 1007N -0.27 0.00 -0.14 0.39 4.81 -1.58 0.41 114.58 118.21 2j1d h GLU 1007Ca -0.00 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.01 2j1d h GLU 1007Cb 0.76 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.15 2j1d h GLU 1007CO 0.03 0.00 -0.75 0.00 -0.73 0.00 0.00 179.01 177.56 2j1d h ALA 1008N 2.03 0.28 0.03 2.92 0.00 -1.56 -2.62 119.26 120.34 2j1d h ALA 1008Ca 0.00 -0.59 -0.26 0.00 0.00 0.00 0.00 54.91 54.06 2j1d h ALA 1008Cb 0.42 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2j1d h ALA 1008CO 0.00 0.63 -1.35 -0.56 0.00 0.00 0.00 179.25 177.98 2j1d h GLN 1009N 0.47 0.06 0.00 0.00 3.07 -1.25 -3.20 115.11 114.27 2j1d h GLN 1009Ca -0.06 -0.11 -0.13 0.00 0.09 0.00 0.00 58.65 58.44 2j1d h GLN 1009Cb 1.39 0.04 -0.02 0.00 0.08 0.00 0.00 27.48 28.97 2j1d h GLN 1009CO 0.16 0.87 -0.63 1.25 0.09 0.00 0.00 178.83 180.57 2j1d h LEU 1010N 0.02 0.00 -0.30 0.06 5.85 -0.32 -2.38 115.31 118.24 2j1d h LEU 1010Ca -0.15 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.46 2j1d h LEU 1010Cb 1.91 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.93 2j1d h LEU 1010CO 0.12 0.63 -0.25 0.50 -0.34 0.00 0.00 178.44 179.11 2j1d h LYS 1011N 0.00 0.69 0.00 1.25 3.64 -1.59 -3.25 116.57 117.32 2j1d h LYS 1011Ca -0.01 -0.35 -0.04 0.00 -1.27 0.00 0.00 60.65 58.98 2j1d h LYS 1011Cb 1.42 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.24 2j1d h LYS 1011CO 0.08 0.96 -0.20 0.93 -2.27 0.00 0.00 179.45 178.95 2j1d h GLU 1012N 0.44 0.00 -0.25 1.90 5.08 -1.54 -2.82 114.58 117.38 2j1d h GLU 1012Ca 0.05 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 2j1d h GLU 1012Cb 0.81 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.06 2j1d h GLU 1012CO 0.06 0.20 -0.26 0.37 -1.00 0.00 0.00 179.01 178.39 2j1d h GLN 1013N 0.00 0.62 0.00 2.33 4.15 -1.47 -1.61 115.11 119.12 2j1d h GLN 1013Ca -0.00 -0.33 -0.06 0.00 0.77 0.00 0.00 58.65 59.03 2j1d h GLN 1013Cb 0.90 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.59 2j1d h GLN 1013CO 0.03 0.93 -0.29 0.00 -1.93 0.00 0.00 178.83 177.57 2j1d h ARG 1014N 0.33 0.00 -0.05 1.69 3.08 -1.59 -2.89 114.38 114.95 2j1d h ARG 1014Ca 0.04 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.95 2j1d h ARG 1014Cb 0.82 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 2j1d h ARG 1014CO 0.06 0.29 -0.59 1.49 -1.07 0.00 0.00 179.97 180.15 2j1d h GLU 1015N 0.00 0.17 0.00 0.04 4.81 -1.34 -2.36 114.58 115.90 2j1d h GLU 1015Ca -0.00 -0.11 -0.13 0.00 -0.13 0.00 0.00 59.36 58.98 2j1d h GLU 1015Cb 0.87 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.24 2j1d h GLU 1015CO 0.04 0.71 -0.63 0.00 -0.73 0.00 0.00 179.01 178.39 2j1d h ARG 1016N 0.12 0.00 -0.01 1.92 3.08 -1.15 -2.55 114.38 115.80 2j1d h ARG 1016Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2j1d h ARG 1016Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 2j1d h ARG 1016CO 0.09 0.63 -0.13 0.39 -1.07 0.00 0.00 179.97 179.88 2j1d n GLU 1017N -3.54 1.13 -0.10 0.04 1.02 -1.11 -2.50 120.64 115.58 2j1d n GLU 1017Ca -0.00 -0.61 -0.17 0.00 -0.02 0.00 0.00 57.16 56.36 2j1d n GLU 1017Cb 0.69 -1.49 -0.13 0.00 -0.02 0.00 0.00 31.44 30.49 2j1d n GLU 1017CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2j1d n ARG 1018N -0.40 0.67 0.22 3.49 0.63 -0.89 -3.06 116.66 117.31 2j1d n ARG 1018Ca 0.16 0.14 0.10 0.00 -0.92 0.00 0.00 57.85 57.33 2j1d n ARG 1018Cb 0.33 -1.56 0.48 0.00 0.45 0.00 0.00 32.46 32.16 2j1d n ARG 1018CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 2j1d h LYS 1019N 0.01 0.00 -0.11 -0.14 1.57 -1.56 0.34 116.57 116.68 2j1d h LYS 1019Ca -0.54 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.05 2j1d h LYS 1019Cb 1.99 0.00 0.01 0.00 0.08 0.00 0.00 32.23 34.31 2j1d h LYS 1019CO -0.04 0.22 -0.68 1.98 -0.57 0.00 0.00 179.45 180.37 2j1d h MET 1020N 0.00 0.66 0.00 3.15 4.05 -1.66 -2.53 114.93 118.60 2j1d h MET 1020Ca -0.00 -0.56 -0.07 0.00 -0.28 0.00 0.00 59.70 58.79 2j1d h MET 1020Cb 0.71 0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.63 2j1d h MET 1020CO 0.03 1.17 -0.32 0.00 0.23 0.00 0.00 176.91 178.02 2j1d h ARG 1021N 0.32 0.00 0.03 0.39 -0.00 -1.40 0.52 114.38 114.25 2j1d h ARG 1021Ca -0.05 0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.43 2j1d h ARG 1021Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.29 2j1d h ARG 1021CO 0.14 0.32 -0.01 1.57 0.00 0.00 0.00 179.97 181.98 2j1d h LYS 1022N 0.00 -0.03 0.10 0.04 2.10 -0.38 -3.35 116.57 115.05 2j1d h LYS 1022Ca -0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2j1d h LYS 1022Cb 0.78 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 2j1d h LYS 1022CO 0.04 0.58 -0.05 0.00 -2.00 0.00 0.00 179.45 178.02 2j1d h ALA 1023N 0.25 -0.14 -2.40 0.07 0.00 -1.43 -3.43 119.26 112.19 2j1d h ALA 1023Ca -0.00 -0.10 -0.52 0.00 0.00 0.00 0.00 54.91 54.29 2j1d h ALA 1023Cb 0.63 0.05 0.13 0.00 0.00 0.00 0.00 17.79 18.60 2j1d h ALA 1023CO 0.01 -0.49 0.34 0.21 0.00 0.00 0.00 179.25 179.31 2j1d s LYS 1024N -5.50 2.30 0.00 0.00 2.20 0.17 -5.10 119.74 113.81 2j1d s LYS 1024Ca -0.14 1.36 0.00 0.00 -0.36 0.00 0.00 55.97 56.83 2j1d s LYS 1024Cb 0.04 -1.89 0.00 0.00 -1.51 0.00 0.00 37.83 34.47 2j1d s LYS 1024CO 0.65 -1.64 0.00 0.39 -0.36 0.00 0.00 175.35 174.39