#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uj3 s VAL 607 N 0.00 4.36 0.61 2.28 1.01 -1.26 -5.02 120.40 122.38 1uj3 s VAL 607 Ca 0.00 -0.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.63 1uj3 s VAL 607 Cb 0.00 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1uj3 s VAL 607 CO 0.00 0.37 1.03 0.00 0.00 0.00 0.00 175.10 176.50 1uj3 n ALA 608 N 4.63 0.38 -1.78 5.51 0.00 -1.26 -4.86 120.51 123.13 1uj3 n ALA 608 Ca -0.16 0.01 -0.37 0.00 0.00 0.00 0.00 53.44 52.92 1uj3 n ALA 608 Cb 0.52 -2.15 -0.05 0.00 0.00 0.00 0.00 19.45 17.76 1uj3 n ALA 608 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uj3 s ALA 609 N -1.49 3.14 0.27 0.00 0.00 -1.26 -4.69 121.76 117.73 1uj3 s ALA 609 Ca 0.77 0.65 0.02 0.00 0.00 0.00 0.00 51.96 53.40 1uj3 s ALA 609 Cb -0.41 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1uj3 s ALA 609 CO 0.46 -0.09 0.15 1.52 0.00 0.00 0.00 175.76 177.80 1uj3 s TYR 610 N -1.64 1.48 -1.37 0.00 1.13 0.90 -4.75 117.35 113.11 1uj3 s TYR 610 Ca 0.55 -1.37 -0.06 0.00 -1.41 0.00 0.00 57.07 54.78 1uj3 s TYR 610 Cb -0.21 -0.77 0.03 0.00 -1.10 0.00 0.00 41.96 39.91 1uj3 s TYR 610 CO 0.27 -0.55 0.96 0.09 -2.51 0.00 0.00 175.55 173.80 1uj3 n ASN 611 N -0.72 -3.68 -4.64 -0.18 3.02 -1.26 0.41 115.26 108.21 1uj3 n ASN 611 Ca 0.02 -0.70 -0.43 0.00 -0.03 0.00 0.00 54.58 53.44 1uj3 n ASN 611 Cb 0.65 -4.44 -0.02 0.00 -0.61 0.00 0.00 39.78 35.36 1uj3 n ASN 611 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1uj3 s LEU 612 N -6.96 4.00 0.07 3.41 1.02 -1.26 -4.17 118.68 114.79 1uj3 s LEU 612 Ca 0.34 1.63 0.06 0.00 0.02 0.00 0.00 54.13 56.18 1uj3 s LEU 612 Cb -0.16 -3.53 -0.03 0.00 0.02 0.00 0.00 46.19 42.48 1uj3 s LEU 612 CO 0.78 -1.09 -0.15 0.42 0.02 0.00 0.00 176.35 176.33 1uj3 s THR 613 N 4.59 1.21 -0.14 5.49 -4.23 -0.36 -4.37 115.64 117.84 1uj3 s THR 613 Ca 0.66 -1.33 -0.10 0.00 -1.18 0.00 0.00 61.69 59.74 1uj3 s THR 613 Cb -0.24 -1.15 -0.05 0.00 1.34 0.00 0.00 72.50 72.41 1uj3 s THR 613 CO 0.26 -0.18 0.21 0.26 -0.54 0.00 0.00 174.62 174.62 1uj3 s TRP 614 N -1.23 3.53 -0.22 3.99 0.52 -1.26 -0.40 118.94 123.87 1uj3 s TRP 614 Ca -0.00 0.54 -0.01 0.00 0.02 0.00 0.00 56.10 56.65 1uj3 s TRP 614 Cb -0.10 -2.14 0.02 0.00 -1.15 0.00 0.00 33.47 30.10 1uj3 s TRP 614 CO 0.03 0.48 -0.12 0.15 0.02 0.00 0.00 176.95 177.51 1uj3 s LYS 615 N -0.28 2.95 -0.08 4.98 -0.14 0.80 -4.98 119.74 123.00 1uj3 s LYS 615 Ca 0.14 -0.88 -0.04 0.00 -1.36 0.00 0.00 55.97 53.83 1uj3 s LYS 615 Cb -0.12 -2.82 0.04 0.00 -1.68 0.00 0.00 37.83 33.25 1uj3 s LYS 615 CO 0.03 -0.30 0.19 0.45 -0.76 0.00 0.00 175.35 174.97 1uj3 s SER 616 N 1.32 -0.18 -0.04 2.83 0.15 -1.26 -0.43 113.70 116.10 1uj3 s SER 616 Ca 0.02 0.41 -0.01 0.00 0.70 0.00 0.00 55.95 57.07 1uj3 s SER 616 Cb -0.15 0.30 0.03 0.00 -1.71 0.00 0.00 66.02 64.49 1uj3 s SER 616 CO -0.08 -0.15 0.04 -0.89 1.20 0.00 0.00 173.24 173.36 1uj3 s THR 617 N 1.18 -0.02 -1.63 6.45 2.01 -0.85 -0.63 115.64 122.14 1uj3 s THR 617 Ca -0.09 0.30 -0.16 0.00 0.31 0.00 0.00 61.69 62.06 1uj3 s THR 617 Cb -0.11 -0.18 0.13 0.00 0.01 0.00 0.00 72.50 72.35 1uj3 s THR 617 CO -0.07 0.16 0.83 0.59 -0.69 0.00 0.00 174.62 175.44 1uj3 n ASN 618 N 4.84 -3.59 0.00 3.53 4.13 0.66 -1.26 115.26 123.57 1uj3 n ASN 618 Ca -0.13 -0.94 0.00 0.00 1.68 0.00 0.00 54.58 55.19 1uj3 n ASN 618 Cb 0.50 -3.15 0.00 0.00 -1.54 0.00 0.00 39.78 35.59 1uj3 n ASN 618 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1uj3 n PHE 619 N -4.48 0.00 -2.15 3.10 3.72 -1.26 -4.61 117.46 111.78 1uj3 n PHE 619 Ca 0.04 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.01 1uj3 n PHE 619 Cb 0.51 -0.09 -0.02 0.00 -0.94 0.00 0.00 39.48 38.94 1uj3 n PHE 619 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1uj3 s LYS 620 N 0.00 3.85 -0.07 -1.08 2.20 -0.39 -4.76 119.74 119.49 1uj3 s LYS 620 Ca 0.00 1.65 0.04 0.00 -0.36 0.00 0.00 55.97 57.31 1uj3 s LYS 620 Cb 0.00 -4.00 -0.00 0.00 -1.51 0.00 0.00 37.83 32.31 1uj3 s LYS 620 CO 0.00 -1.22 -0.21 0.99 -0.36 0.00 0.00 175.35 174.54 1uj3 s THR 621 N 4.97 1.83 -0.04 3.43 2.01 -1.26 -2.01 115.64 124.56 1uj3 s THR 621 Ca 0.69 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.80 1uj3 s THR 621 Cb -0.24 -1.57 0.02 0.00 0.01 0.00 0.00 72.50 70.71 1uj3 s THR 621 CO 0.28 0.51 -0.04 -0.63 -0.69 0.00 0.00 174.62 174.04 1uj3 s ILE 622 N 0.21 0.54 -0.01 1.82 1.01 0.43 -0.68 121.20 124.52 1uj3 s ILE 622 Ca -0.12 -0.12 -0.20 0.00 0.00 0.00 0.00 60.65 60.20 1uj3 s ILE 622 Cb -0.16 -0.56 -0.05 0.00 0.01 0.00 0.00 42.46 41.70 1uj3 s ILE 622 CO 0.06 0.23 0.59 -0.22 0.00 0.00 0.00 174.94 175.59 1uj3 s LEU 623 N 0.92 4.41 0.28 2.97 2.96 -0.59 -0.14 118.68 129.49 1uj3 s LEU 623 Ca -0.11 1.15 0.09 0.00 -0.22 0.00 0.00 54.13 55.04 1uj3 s LEU 623 Cb -0.14 -2.91 -0.05 0.00 0.50 0.00 0.00 46.19 43.58 1uj3 s LEU 623 CO 0.00 0.10 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.39 1uj3 s GLU 624 N -0.18 1.61 0.20 1.98 2.02 0.47 -0.66 118.70 124.15 1uj3 s GLU 624 Ca 0.31 -1.77 -0.22 0.00 0.02 0.00 0.00 54.97 53.31 1uj3 s GLU 624 Cb -0.18 -1.50 0.07 0.00 0.10 0.00 0.00 34.13 32.62 1uj3 s GLU 624 CO 0.17 0.20 0.99 1.67 0.02 0.00 0.00 175.26 178.31 1uj3 s TRP 625 N -2.73 0.03 0.19 1.61 -2.14 -0.38 -1.22 118.94 114.30 1uj3 s TRP 625 Ca 0.29 -0.44 0.11 0.00 2.66 0.00 0.00 56.10 58.72 1uj3 s TRP 625 Cb -0.01 0.70 -0.04 0.00 -3.10 0.00 0.00 33.47 31.02 1uj3 s TRP 625 CO 0.13 -0.99 -0.24 -1.21 -2.66 0.00 0.00 176.95 171.98 1uj3 s GLU 626 N -2.46 1.50 0.41 3.25 0.41 0.17 -4.78 118.70 117.20 1uj3 s GLU 626 Ca 0.19 -1.51 0.07 0.00 -0.41 0.00 0.00 54.97 53.31 1uj3 s GLU 626 Cb -0.03 -1.85 -0.05 0.00 -1.78 0.00 0.00 34.13 30.43 1uj3 s GLU 626 CO 0.05 0.40 0.19 -1.25 -0.49 0.00 0.00 175.26 174.17 1uj3 s PRO 627 N -2.60 2.25 0.15 0.39 0.04 -1.26 -0.07 135.00 133.89 1uj3 s PRO 627 Ca 0.20 -1.82 -0.34 0.00 0.04 0.00 0.00 61.00 59.07 1uj3 s PRO 627 Cb -0.08 -2.01 -0.15 0.00 0.04 0.00 0.00 34.50 32.30 1uj3 s PRO 627 CO 0.09 -0.12 1.48 1.17 0.04 0.00 0.00 177.00 179.66 1uj3 n LYS 628 N -1.26 1.84 -2.10 4.56 4.81 -1.26 -4.84 118.16 119.90 1uj3 n LYS 628 Ca -0.01 0.66 -0.41 0.00 -0.87 0.00 0.00 58.31 57.68 1uj3 n LYS 628 Cb 0.64 -2.37 -0.02 0.00 0.02 0.00 0.00 35.03 33.30 1uj3 n LYS 628 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1uj3 s PRO 629 N 0.60 4.33 -0.31 1.64 0.04 -1.26 -5.02 135.00 135.03 1uj3 s PRO 629 Ca 0.79 2.22 0.01 0.00 0.04 0.00 0.00 61.00 64.06 1uj3 s PRO 629 Cb -0.75 -3.10 0.09 0.00 0.04 0.00 0.00 34.50 30.77 1uj3 s PRO 629 CO 0.42 -0.27 0.05 0.14 0.04 0.00 0.00 177.00 177.38 1uj3 s VAL 630 N -0.56 1.54 -1.32 -0.36 -7.23 -1.26 -4.73 120.40 106.48 1uj3 s VAL 630 Ca 0.54 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.98 1uj3 s VAL 630 Cb -0.40 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.46 1uj3 s VAL 630 CO 0.47 -0.53 0.00 0.59 -0.31 0.00 0.00 175.10 175.32 1uj3 n ASN 631 N 4.58 -4.52 -3.77 4.85 3.02 -1.26 -4.93 115.26 113.23 1uj3 n ASN 631 Ca -0.02 0.07 -0.10 0.00 -0.03 0.00 0.00 54.58 54.51 1uj3 n ASN 631 Cb 0.42 -3.59 -0.06 0.00 -0.61 0.00 0.00 39.78 35.94 1uj3 n ASN 631 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uj3 s GLN 632 N -4.39 0.90 0.30 3.52 -2.07 -1.26 0.12 119.66 116.78 1uj3 s GLN 632 Ca 0.00 -0.79 0.05 0.00 -1.82 0.00 0.00 55.36 52.80 1uj3 s GLN 632 Cb 0.00 0.38 -0.06 0.00 -1.09 0.00 0.00 33.01 32.24 1uj3 s GLN 632 CO 0.00 -0.31 0.01 0.14 -1.32 0.00 0.00 175.29 173.81 1uj3 s VAL 633 N -3.57 1.39 0.11 3.63 -7.23 0.46 -4.75 120.40 110.44 1uj3 s VAL 633 Ca 0.02 -2.05 0.07 0.00 -1.81 0.00 0.00 61.98 58.22 1uj3 s VAL 633 Cb 0.03 -2.64 -0.04 0.00 0.56 0.00 0.00 36.38 34.30 1uj3 s VAL 633 CO -0.10 -0.14 -0.18 -0.31 -0.31 0.00 0.00 175.10 174.06 1uj3 s TYR 634 N -3.17 1.64 -0.08 2.82 2.02 0.20 -0.64 117.35 120.14 1uj3 s TYR 634 Ca 0.33 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.59 1uj3 s TYR 634 Cb 0.07 -0.88 0.02 0.00 -0.40 0.00 0.00 41.96 40.76 1uj3 s TYR 634 CO 0.14 0.19 -0.10 0.99 -1.57 0.00 0.00 175.55 175.20 1uj3 s THR 635 N -1.46 1.06 -0.11 -0.71 2.01 -0.58 -0.44 115.64 115.41 1uj3 s THR 635 Ca 0.07 -0.38 -0.04 0.00 0.31 0.00 0.00 61.69 61.64 1uj3 s THR 635 Cb -0.09 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 1uj3 s THR 635 CO 0.04 0.35 0.06 -0.69 -0.69 0.00 0.00 174.62 173.69 1uj3 s VAL 636 N 1.10 4.79 0.05 3.82 1.01 0.58 0.26 120.40 132.01 1uj3 s VAL 636 Ca -0.07 -0.06 0.08 0.00 0.00 0.00 0.00 61.98 61.93 1uj3 s VAL 636 Cb -0.14 -3.06 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1uj3 s VAL 636 CO -0.01 0.60 -0.21 -1.10 0.00 0.00 0.00 175.10 174.37 1uj3 s GLN 637 N -0.83 1.40 -0.01 2.72 -0.21 0.86 0.36 119.66 123.95 1uj3 s GLN 637 Ca 0.13 -0.98 0.03 0.00 0.02 0.00 0.00 55.36 54.56 1uj3 s GLN 637 Cb -0.12 -1.54 -0.01 0.00 1.00 0.00 0.00 33.01 32.35 1uj3 s GLN 637 CO 0.03 0.39 -0.10 -1.50 -2.12 0.00 0.00 175.29 171.99 1uj3 s ILE 638 N -0.83 0.78 -0.01 1.08 2.07 -0.14 -0.11 121.20 124.03 1uj3 s ILE 638 Ca 0.08 -0.41 0.03 0.00 -1.41 0.00 0.00 60.65 58.93 1uj3 s ILE 638 Cb -0.09 -0.66 -0.00 0.00 0.13 0.00 0.00 42.46 41.83 1uj3 s ILE 638 CO 0.02 0.22 -0.09 -0.94 -1.91 0.00 0.00 174.94 172.25 1uj3 s SER 639 N -0.17 1.07 0.00 4.50 1.04 0.25 -1.42 113.70 118.97 1uj3 s SER 639 Ca 0.03 -0.17 -0.01 0.00 0.48 0.00 0.00 55.95 56.28 1uj3 s SER 639 Cb -0.04 -0.17 -0.05 0.00 0.10 0.00 0.00 66.02 65.86 1uj3 s SER 639 CO -0.00 0.10 1.83 1.07 0.98 0.00 0.00 173.24 177.21 1uj3 n THR 640 N 2.99 1.68 -0.29 2.02 5.66 -1.26 -1.06 114.28 124.02 1uj3 n THR 640 Ca -0.15 -0.56 0.00 0.00 -3.05 0.00 0.00 64.05 60.29 1uj3 n THR 640 Cb 0.56 -1.50 0.00 0.00 -1.55 0.00 0.00 70.33 67.84 1uj3 n THR 640 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1uj3 n LYS 641 N 1.87 0.00 0.00 1.09 4.81 -1.24 -4.57 118.16 120.13 1uj3 n LYS 641 Ca 0.08 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.67 1uj3 n LYS 641 Cb 0.45 -3.20 0.81 0.00 0.02 0.00 0.00 35.03 33.11 1uj3 n LYS 641 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1uj3 n SER 642 N 0.00 0.08 0.00 3.14 7.64 -1.26 -4.93 113.62 118.29 1uj3 n SER 642 Ca 0.00 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.36 1uj3 n SER 642 Cb 0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 1uj3 n SER 642 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uj3 n GLY 643 N 1.18 1.92 2.27 0.23 0.00 -1.26 -5.01 105.19 104.51 1uj3 n GLY 643 Ca 0.18 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.25 1uj3 n GLY 643 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1uj3 n ASP 644 N 3.40 0.28 -4.87 1.61 5.75 -1.26 -4.79 116.55 116.66 1uj3 n ASP 644 Ca 0.00 0.21 -0.30 0.00 -0.01 0.00 0.00 54.79 54.69 1uj3 n ASP 644 Cb 0.00 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 39.49 1uj3 n ASP 644 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1uj3 s TRP 645 N 5.40 3.60 -0.13 2.11 0.52 -1.26 -4.32 118.94 124.86 1uj3 s TRP 645 Ca 0.87 1.21 -0.04 0.00 0.02 0.00 0.00 56.10 58.16 1uj3 s TRP 645 Cb -0.88 -2.64 0.06 0.00 -1.15 0.00 0.00 33.47 28.86 1uj3 s TRP 645 CO 0.36 -0.58 0.22 0.21 0.02 0.00 0.00 176.95 177.17 1uj3 s LYS 646 N -5.00 0.11 0.17 4.98 2.20 -0.51 -4.94 119.74 116.77 1uj3 s LYS 646 Ca 0.54 0.57 -0.30 0.00 -0.36 0.00 0.00 55.97 56.41 1uj3 s LYS 646 Cb -0.11 -0.37 -0.08 0.00 -1.51 0.00 0.00 37.83 35.77 1uj3 s LYS 646 CO 0.50 -0.37 1.23 -1.12 -0.36 0.00 0.00 175.35 175.23 1uj3 s SER 647 N 2.35 7.04 0.00 1.43 0.01 -1.26 -0.97 113.70 122.31 1uj3 s SER 647 Ca 0.03 2.25 0.00 0.00 1.31 0.00 0.00 55.95 59.54 1uj3 s SER 647 Cb -0.13 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.50 1uj3 s SER 647 CO -0.08 -0.42 0.00 0.29 0.41 0.00 0.00 173.24 173.43 1uj3 n LYS 648 N 2.74 2.04 -4.01 12.44 4.76 0.16 -4.95 118.16 131.33 1uj3 n LYS 648 Ca 0.05 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.16 1uj3 n LYS 648 Cb 0.44 -0.98 -0.15 0.00 -1.84 0.00 0.00 35.03 32.51 1uj3 n LYS 648 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1uj3 s PHE 650 N 1.19 3.47 -0.98 0.00 0.40 -1.26 -0.30 117.98 120.50 1uj3 s PHE 650 Ca -0.05 0.39 -0.23 0.00 -0.60 0.00 0.00 56.93 56.44 1uj3 s PHE 650 Cb -0.19 -2.01 0.03 0.00 0.51 0.00 0.00 43.02 41.36 1uj3 s PHE 650 CO -0.05 0.51 0.43 0.66 0.70 0.00 0.00 175.22 177.47 1uj3 n TYR 651 N 2.66 -1.03 -4.11 0.36 4.01 -0.44 -4.92 117.16 113.69 1uj3 n TYR 651 Ca -0.18 0.11 -0.25 0.00 -0.16 0.00 0.00 57.90 57.42 1uj3 n TYR 651 Cb 0.54 -2.11 -0.05 0.00 -0.31 0.00 0.00 39.34 37.41 1uj3 n TYR 651 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1uj3 s THR 652 N -3.91 4.38 -1.35 -0.72 -1.32 0.42 -4.71 115.64 108.43 1uj3 s THR 652 Ca 0.31 -1.22 0.23 0.00 -1.21 0.00 0.00 61.69 59.80 1uj3 s THR 652 Cb -0.18 -3.27 -0.08 0.00 -1.51 0.00 0.00 72.50 67.46 1uj3 s THR 652 CO 0.75 -0.18 1.11 0.35 -2.21 0.00 0.00 174.62 174.44 1uj3 n THR 653 N -0.58 0.00 -1.04 5.08 -2.24 -1.26 -0.63 114.28 113.61 1uj3 n THR 653 Ca -0.08 -0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.31 1uj3 n THR 653 Cb 0.56 0.87 0.12 0.00 -2.10 0.00 0.00 70.33 69.78 1uj3 n THR 653 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1uj3 s ASP 654 N -2.81 3.90 -0.24 3.42 1.01 -1.26 -4.46 116.67 116.23 1uj3 s ASP 654 Ca 0.13 1.96 0.11 0.00 0.71 0.00 0.00 52.55 55.47 1uj3 s ASP 654 Cb 0.17 -2.54 0.46 0.00 1.01 0.00 0.00 42.92 42.03 1uj3 s ASP 654 CO 0.73 -2.45 1.36 0.35 0.21 0.00 0.00 175.17 175.37 1uj3 n THR 655 N -3.80 2.37 -3.76 -1.27 -2.24 -1.26 -4.84 114.28 99.48 1uj3 n THR 655 Ca 0.10 -2.75 -0.11 0.00 -2.27 0.00 0.00 64.05 59.02 1uj3 n THR 655 Cb 0.53 -0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 68.40 1uj3 n THR 655 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1uj3 s GLU 656 N -3.17 0.83 -0.14 -0.78 -1.05 -1.26 -1.24 118.70 111.88 1uj3 s GLU 656 Ca 0.41 -0.58 -0.04 0.00 -0.15 0.00 0.00 54.97 54.61 1uj3 s GLU 656 Cb 0.38 0.35 0.07 0.00 -0.44 0.00 0.00 34.13 34.49 1uj3 s GLU 656 CO -0.01 -0.27 0.25 0.00 0.95 0.00 0.00 175.26 176.18 1uj3 s ASP 658 N 2.40 6.40 -0.14 0.00 -1.08 -1.26 -1.55 116.67 121.43 1uj3 s ASP 658 Ca 0.03 1.05 0.15 0.00 -0.52 0.00 0.00 52.55 53.27 1uj3 s ASP 658 Cb -0.13 -2.54 0.56 0.00 -1.46 0.00 0.00 42.92 39.36 1uj3 s ASP 658 CO -0.09 -1.34 1.48 0.18 0.52 0.00 0.00 175.17 175.91 1uj3 n LEU 659 N 8.57 4.13 -0.29 -1.34 4.77 0.14 -4.67 117.00 128.32 1uj3 n LEU 659 Ca 0.17 -2.71 0.08 0.00 -0.03 0.00 0.00 56.01 53.52 1uj3 n LEU 659 Cb 0.47 -0.51 0.24 0.00 -2.33 0.00 0.00 43.42 41.29 1uj3 n LEU 659 CO 0.68 0.70 1.07 0.74 -1.33 0.00 0.00 177.39 179.25 1uj3 h THR 660 N 2.57 0.65 -0.58 -5.08 2.02 -1.81 -0.55 112.91 110.13 1uj3 h THR 660 Ca 0.00 -0.18 0.16 0.00 0.77 0.00 0.00 66.41 67.16 1uj3 h THR 660 Cb 1.39 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.85 1uj3 h THR 660 CO 0.22 0.10 0.41 0.44 0.37 0.00 0.00 175.52 177.06 1uj3 h ASP 661 N 0.53 0.06 0.05 4.18 3.32 -1.91 -1.89 116.42 120.75 1uj3 h ASP 661 Ca 0.47 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 57.23 1uj3 h ASP 661 Cb 0.75 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.26 1uj3 h ASP 661 CO -0.41 0.03 -1.63 -0.62 -1.72 0.00 0.00 179.24 174.89 1uj3 n GLU 662 N -4.39 0.64 -0.08 3.56 -0.58 -0.25 -4.31 120.64 115.24 1uj3 n GLU 662 Ca 0.11 0.44 -0.03 0.00 -0.42 0.00 0.00 57.16 57.25 1uj3 n GLU 662 Cb 0.61 -1.72 0.20 0.00 -0.57 0.00 0.00 31.44 29.96 1uj3 n GLU 662 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 1uj3 h ILE 663 N -0.58 1.23 0.00 -3.67 -0.00 -1.32 -2.58 117.51 110.59 1uj3 h ILE 663 Ca -0.40 -0.94 0.00 0.00 -0.00 0.00 0.00 64.86 63.52 1uj3 h ILE 663 Cb 1.60 0.90 0.00 0.00 -0.00 0.00 0.00 36.82 39.32 1uj3 h ILE 663 CO -0.11 0.33 0.00 1.33 -0.00 0.00 0.00 178.15 179.70 1uj3 n VAL 664 N -4.23 0.07 0.39 0.16 0.24 -0.72 -1.75 118.33 112.47 1uj3 n VAL 664 Ca 0.02 0.02 0.13 0.00 -2.04 0.00 0.00 64.34 62.47 1uj3 n VAL 664 Cb 0.28 -0.76 0.31 0.00 -1.47 0.00 0.00 33.84 32.20 1uj3 n VAL 664 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1uj3 h LYS 665 N 0.00 0.00 -0.46 7.34 1.57 -1.64 -3.39 116.57 119.98 1uj3 h LYS 665 Ca 0.00 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1uj3 h LYS 665 Cb 0.02 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.15 1uj3 h LYS 665 CO 0.00 0.00 -0.23 0.34 -0.57 0.00 0.00 179.45 178.99 1uj3 s ASP 666 N -5.44 -0.71 0.61 0.86 -1.08 -0.72 -5.05 116.67 105.14 1uj3 s ASP 666 Ca 0.08 -0.47 0.37 0.00 -0.52 0.00 0.00 52.55 52.02 1uj3 s ASP 666 Cb 0.08 0.91 1.98 0.00 -1.46 0.00 0.00 42.92 44.43 1uj3 s ASP 666 CO 0.62 -0.07 2.24 -0.37 0.52 0.00 0.00 175.17 178.11 1uj3 h VAL 667 N 3.81 0.19 0.00 1.11 -1.51 -1.77 -2.32 116.25 115.76 1uj3 h VAL 667 Ca -0.00 -0.19 -0.01 0.00 -1.23 0.00 0.00 66.70 65.27 1uj3 h VAL 667 Cb 1.20 1.15 -0.00 0.00 -2.13 0.00 0.00 31.29 31.51 1uj3 h VAL 667 CO -0.03 0.02 -0.60 0.11 -1.23 0.00 0.00 177.57 175.84 1uj3 h LYS 668 N 0.00 0.00 -7.20 5.19 1.57 -1.95 -0.39 116.57 113.80 1uj3 h LYS 668 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 1uj3 h LYS 668 Cb 0.15 0.00 0.12 0.00 0.08 0.00 0.00 32.23 32.58 1uj3 h LYS 668 CO 0.00 0.02 0.37 -1.14 -0.57 0.00 0.00 179.45 178.14 1uj3 s GLN 669 N -3.28 2.55 -0.02 3.15 2.00 -0.87 -4.88 119.66 118.31 1uj3 s GLN 669 Ca 0.03 1.49 -0.06 0.00 -2.00 0.00 0.00 55.36 54.81 1uj3 s GLN 669 Cb 0.08 -1.91 -0.04 0.00 0.80 0.00 0.00 33.01 31.93 1uj3 s GLN 669 CO 0.74 -1.46 0.23 0.99 -0.50 0.00 0.00 175.29 175.29 1uj3 s THR 670 N -2.27 5.35 0.10 -0.34 2.01 -1.26 -4.27 115.64 114.96 1uj3 s THR 670 Ca 0.69 0.14 0.10 0.00 0.31 0.00 0.00 61.69 62.93 1uj3 s THR 670 Cb -0.23 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 1uj3 s THR 670 CO 0.43 0.41 -0.27 -0.31 -0.69 0.00 0.00 174.62 174.20 1uj3 s TYR 671 N -1.25 2.29 -0.03 4.92 1.51 0.30 -3.62 117.35 121.46 1uj3 s TYR 671 Ca 0.25 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.97 1uj3 s TYR 671 Cb -0.13 -1.29 -0.01 0.00 -0.11 0.00 0.00 41.96 40.42 1uj3 s TYR 671 CO 0.14 0.26 -0.20 -1.17 -1.11 0.00 0.00 175.55 173.47 1uj3 s LEU 672 N -1.76 2.00 0.20 -1.29 1.98 -0.23 -1.75 118.68 117.83 1uj3 s LEU 672 Ca 0.13 -0.40 0.07 0.00 -2.89 0.00 0.00 54.13 51.04 1uj3 s LEU 672 Cb -0.10 -1.11 -0.05 0.00 0.66 0.00 0.00 46.19 45.60 1uj3 s LEU 672 CO 0.05 0.22 -0.12 0.00 -1.89 0.00 0.00 176.35 174.60 1uj3 s ALA 673 N -0.23 1.92 -0.10 5.97 0.00 -1.26 0.84 121.76 128.90 1uj3 s ALA 673 Ca 0.01 -1.65 -0.14 0.00 0.00 0.00 0.00 51.96 50.19 1uj3 s ALA 673 Cb -0.11 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.03 1uj3 s ALA 673 CO 0.01 0.01 0.35 -0.98 0.00 0.00 0.00 175.76 175.16 1uj3 s ARG 674 N -3.68 0.51 -0.18 0.00 1.70 0.84 0.63 118.95 118.77 1uj3 s ARG 674 Ca 0.22 0.30 -0.01 0.00 -0.47 0.00 0.00 55.73 55.77 1uj3 s ARG 674 Cb 0.00 0.24 0.00 0.00 -0.57 0.00 0.00 34.95 34.63 1uj3 s ARG 674 CO 0.06 -0.09 -0.14 0.08 -1.08 0.00 0.00 175.30 174.13 1uj3 s VAL 675 N -0.28 2.68 -0.03 4.99 1.01 0.27 -0.10 120.40 128.94 1uj3 s VAL 675 Ca -0.04 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.07 1uj3 s VAL 675 Cb -0.03 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 1uj3 s VAL 675 CO 0.02 0.50 0.33 -0.36 0.00 0.00 0.00 175.10 175.59 1uj3 s PHE 676 N 1.13 3.69 -0.15 5.22 0.40 0.14 -2.31 117.98 126.11 1uj3 s PHE 676 Ca 0.01 0.87 -0.06 0.00 -0.60 0.00 0.00 56.93 57.15 1uj3 s PHE 676 Cb -0.14 -2.19 -0.04 0.00 0.51 0.00 0.00 43.02 41.16 1uj3 s PHE 676 CO -0.05 0.67 0.04 -1.12 0.70 0.00 0.00 175.22 175.46 1uj3 s SER 677 N -1.05 5.51 0.02 1.36 0.01 0.19 -1.53 113.70 118.21 1uj3 s SER 677 Ca 0.21 0.11 0.03 0.00 1.31 0.00 0.00 55.95 57.61 1uj3 s SER 677 Cb -0.15 -1.84 -0.02 0.00 0.21 0.00 0.00 66.02 64.22 1uj3 s SER 677 CO 0.11 0.24 -0.10 -0.31 0.41 0.00 0.00 173.24 173.59 1uj3 s TYR 678 N -0.06 0.88 0.51 2.43 2.02 0.19 -3.66 117.35 119.66 1uj3 s TYR 678 Ca 0.06 -0.30 -0.22 0.00 -0.37 0.00 0.00 57.07 56.24 1uj3 s TYR 678 Cb -0.12 -0.54 -0.06 0.00 -0.40 0.00 0.00 41.96 40.84 1uj3 s TYR 678 CO 0.01 -0.01 1.28 -1.25 -1.57 0.00 0.00 175.55 174.01 1uj3 s PRO 679 N -0.85 3.37 0.00 -1.71 0.04 -1.26 -0.40 135.00 134.19 1uj3 s PRO 679 Ca -0.01 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.09 1uj3 s PRO 679 Cb -0.06 -2.30 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 1uj3 s PRO 679 CO 0.00 -0.94 -0.03 0.00 0.04 0.00 0.00 177.00 176.07 1uj3 s ALA 680 N -1.41 0.25 0.00 8.56 0.00 0.32 -4.60 121.76 124.88 1uj3 s ALA 680 Ca 0.69 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1uj3 s ALA 680 Cb -0.35 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 22.74 1uj3 s ALA 680 CO 0.42 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.62 1uj3 n GLY 681 N 2.75 -2.38 3.56 0.00 0.00 -1.26 -4.39 105.19 103.47 1uj3 n GLY 681 Ca -0.14 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 1uj3 n GLY 681 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uj3 s ASN 682 N -2.92 6.00 0.19 1.61 3.04 -1.26 -4.86 114.94 116.74 1uj3 s ASN 682 Ca 0.00 -1.30 -0.00 0.00 0.04 0.00 0.00 52.86 51.60 1uj3 s ASN 682 Cb 0.00 -2.57 0.00 0.00 -1.54 0.00 0.00 41.25 37.14 1uj3 s ASN 682 CO 0.00 -1.98 0.26 1.33 -3.04 0.00 0.00 177.10 173.67 1uj3 n VAL 683 N 7.23 0.00 0.00 -5.21 0.24 -1.26 -5.16 118.33 114.16 1uj3 n VAL 683 Ca 0.37 -1.03 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 1uj3 n VAL 683 Cb 0.49 0.62 0.00 0.00 -1.47 0.00 0.00 33.84 33.48 1uj3 n VAL 683 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1uj3 n GLU 684 N -0.33 0.00 0.00 7.34 4.07 -1.26 -5.06 120.64 125.40 1uj3 n GLU 684 Ca 0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.11 1uj3 n GLU 684 Cb 0.33 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.71 1uj3 n GLU 684 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1uj3 n SER 685 N 0.00 0.00 -0.21 4.31 3.41 -1.26 -5.01 113.62 114.86 1uj3 n SER 685 Ca 0.00 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.81 1uj3 n SER 685 Cb 0.00 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.32 1uj3 n SER 685 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1uj3 n THR 686 N 0.00 -0.27 0.00 6.66 -1.04 -1.26 -4.49 114.28 113.88 1uj3 n THR 686 Ca 0.00 1.30 0.00 0.00 -2.04 0.00 0.00 64.05 63.31 1uj3 n THR 686 Cb 0.00 -2.10 0.00 0.00 -1.82 0.00 0.00 70.33 66.41 1uj3 n THR 686 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uj3 n GLY 687 N -1.18 2.96 1.83 3.41 0.00 -1.26 -5.03 105.19 105.93 1uj3 n GLY 687 Ca 0.24 -0.32 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 1uj3 n GLY 687 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uj3 n SER 688 N 0.00 4.80 -3.81 1.61 2.88 -1.26 -4.91 113.62 112.93 1uj3 n SER 688 Ca 0.00 -3.78 -0.26 0.00 -1.33 0.00 0.00 58.87 53.51 1uj3 n SER 688 Cb 0.00 -0.59 0.03 0.00 -0.75 0.00 0.00 64.21 62.89 1uj3 n SER 688 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1uj3 n ALA 689 N -0.90 -1.65 -2.00 -1.46 0.00 -1.26 -4.94 120.51 108.30 1uj3 n ALA 689 Ca 0.45 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1uj3 n ALA 689 Cb 0.92 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 17.16 1uj3 n ALA 689 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uj3 n GLY 690 N -1.66 0.99 3.57 0.00 0.00 -1.26 -5.01 105.19 101.82 1uj3 n GLY 690 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1uj3 n GLY 690 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1uj3 s GLU 691 N 1.72 3.30 0.88 1.61 -1.05 -1.26 -5.01 118.70 118.89 1uj3 s GLU 691 Ca 0.00 0.23 -0.11 0.00 -0.15 0.00 0.00 54.97 54.94 1uj3 s GLU 691 Cb 0.00 -4.12 0.12 0.00 -0.44 0.00 0.00 34.13 29.69 1uj3 s GLU 691 CO 0.00 -1.96 1.10 -1.25 0.95 0.00 0.00 175.26 174.11 1uj3 s PRO 692 N 5.48 1.36 -0.18 -4.83 0.04 -1.26 -4.97 135.00 130.64 1uj3 s PRO 692 Ca 0.46 1.17 -0.26 0.00 0.04 0.00 0.00 61.00 62.42 1uj3 s PRO 692 Cb -0.09 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 1uj3 s PRO 692 CO 0.22 -2.27 0.87 -0.51 0.04 0.00 0.00 177.00 175.35 1uj3 s LEU 693 N -6.32 4.16 0.00 -3.56 1.43 -1.24 -4.88 118.68 108.27 1uj3 s LEU 693 Ca 0.64 1.21 0.00 0.00 -1.03 0.00 0.00 54.13 54.95 1uj3 s LEU 693 Cb -0.20 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1uj3 s LEU 693 CO 0.58 -0.44 0.00 0.00 0.23 0.00 0.00 176.35 176.71 1uj3 n TYR 694 N 5.41 0.00 -3.65 0.29 -0.00 -1.26 0.54 117.16 118.49 1uj3 n TYR 694 Ca 0.06 0.00 0.01 0.00 -0.00 0.00 0.00 57.90 57.96 1uj3 n TYR 694 Cb 0.48 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.76 1uj3 n TYR 694 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.86 174.86 1uj3 s GLU 695 N -0.48 0.03 0.36 -3.48 2.56 -0.98 -4.56 118.70 112.16 1uj3 s GLU 695 Ca 0.00 0.05 -0.08 0.00 0.00 0.00 0.00 54.97 54.94 1uj3 s GLU 695 Cb 0.00 0.01 -0.06 0.00 2.00 0.00 0.00 34.13 36.08 1uj3 s GLU 695 CO 0.00 -0.01 0.69 -0.80 -0.56 0.00 0.00 175.26 174.59 1uj3 s ASN 696 N 0.67 6.49 0.48 -1.70 0.01 -1.26 -0.56 114.94 119.07 1uj3 s ASN 696 Ca -0.03 0.98 0.06 0.00 -0.71 0.00 0.00 52.86 53.16 1uj3 s ASN 696 Cb -0.03 -2.26 0.03 0.00 0.41 0.00 0.00 41.25 39.40 1uj3 s ASN 696 CO -0.12 -0.33 0.66 -0.94 -1.51 0.00 0.00 177.10 174.86 1uj3 s SER 697 N -3.18 5.46 1.07 -1.22 1.04 0.21 -4.88 113.70 112.20 1uj3 s SER 697 Ca 0.48 -0.36 -0.14 0.00 0.48 0.00 0.00 55.95 56.42 1uj3 s SER 697 Cb -0.10 -0.60 0.22 0.00 0.10 0.00 0.00 66.02 65.64 1uj3 s SER 697 CO 0.31 -0.95 1.09 -2.84 0.98 0.00 0.00 173.24 171.83 1uj3 s PRO 698 N -4.51 -0.11 0.68 4.02 0.02 -1.26 -4.62 135.00 129.22 1uj3 s PRO 698 Ca 0.57 0.37 -0.11 0.00 0.02 0.00 0.00 61.00 61.85 1uj3 s PRO 698 Cb -0.10 -1.69 -0.00 0.00 0.02 0.00 0.00 34.50 32.74 1uj3 s PRO 698 CO 0.35 -3.06 1.06 -1.21 -0.33 0.00 0.00 177.00 173.81 1uj3 s GLU 699 N -5.04 3.07 -0.15 5.54 2.02 -1.26 -4.58 118.70 118.29 1uj3 s GLU 699 Ca 0.67 0.76 -0.06 0.00 0.02 0.00 0.00 54.97 56.36 1uj3 s GLU 699 Cb -0.17 -2.02 0.07 0.00 0.10 0.00 0.00 34.13 32.11 1uj3 s GLU 699 CO 0.58 -0.96 0.33 0.12 0.02 0.00 0.00 175.26 175.35 1uj3 s PHE 700 N -3.16 -0.55 -0.36 1.61 5.36 -0.72 -4.94 117.98 115.23 1uj3 s PHE 700 Ca 0.57 1.16 0.04 0.00 -0.96 0.00 0.00 56.93 57.73 1uj3 s PHE 700 Cb -0.12 0.14 0.10 0.00 -0.34 0.00 0.00 43.02 42.80 1uj3 s PHE 700 CO 0.54 -0.36 0.07 0.99 -1.46 0.00 0.00 175.22 175.00 1uj3 s THR 701 N 2.02 2.20 0.13 0.12 2.01 -1.26 0.11 115.64 120.97 1uj3 s THR 701 Ca -0.04 -2.38 -0.25 0.00 0.31 0.00 0.00 61.69 59.34 1uj3 s THR 701 Cb -0.11 -2.62 -0.06 0.00 0.01 0.00 0.00 72.50 69.72 1uj3 s THR 701 CO -0.11 -0.63 1.35 -2.65 -0.69 0.00 0.00 174.62 171.90 1uj3 n PRO 702 N 4.18 -0.35 -0.31 4.92 -0.02 -1.15 -1.20 135.00 141.06 1uj3 n PRO 702 Ca 0.04 1.33 0.15 0.00 -2.02 0.00 0.00 63.50 63.00 1uj3 n PRO 702 Cb 0.41 -1.96 0.32 0.00 -0.02 0.00 0.00 33.50 32.26 1uj3 n PRO 702 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1uj3 h TYR 703 N 0.00 0.49 0.00 6.00 3.20 -1.41 0.51 116.97 125.76 1uj3 h TYR 703 Ca 0.13 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.04 1uj3 h TYR 703 Cb 0.33 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.53 1uj3 h TYR 703 CO -0.94 -0.18 -0.94 -0.07 -1.64 0.00 0.00 178.16 174.39 1uj3 h LEU 704 N 0.25 0.00 0.00 2.82 3.38 -1.63 -3.41 115.31 116.73 1uj3 h LEU 704 Ca 0.59 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.55 1uj3 h LEU 704 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1uj3 h LEU 704 CO -0.63 0.00 -0.65 -0.62 0.09 0.00 0.00 178.44 176.63 1uj3 n GLU 705 N -2.69 2.30 -1.96 1.13 1.02 -0.35 -5.02 120.64 115.07 1uj3 n GLU 705 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.74 1uj3 n GLU 705 Cb 0.55 -0.82 -0.00 0.00 -0.02 0.00 0.00 31.44 31.14 1uj3 n GLU 705 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1uj3 s THR 706 N -1.61 2.40 0.57 2.62 -1.32 0.17 -4.92 115.64 113.54 1uj3 s THR 706 Ca 0.00 0.37 -0.17 0.00 -1.21 0.00 0.00 61.69 60.68 1uj3 s THR 706 Cb 0.00 -3.23 -0.05 0.00 -1.51 0.00 0.00 72.50 67.72 1uj3 s THR 706 CO 0.00 0.07 1.08 0.20 -2.21 0.00 0.00 174.62 173.75 1uj3 s ASN 707 N -0.53 5.79 -0.21 8.08 0.02 0.19 -4.78 114.94 123.50 1uj3 s ASN 707 Ca 0.56 1.95 -0.22 0.00 -1.02 0.00 0.00 52.86 54.13 1uj3 s ASN 707 Cb -0.41 -2.55 -0.02 0.00 0.02 0.00 0.00 41.25 38.29 1uj3 s ASN 707 CO 0.54 -1.17 0.67 -0.76 0.02 0.00 0.00 177.10 176.41 1uj3 s LEU 708 N -4.18 4.12 1.00 0.60 1.43 -1.26 -0.24 118.68 120.14 1uj3 s LEU 708 Ca 0.67 0.86 -0.11 0.00 -1.03 0.00 0.00 54.13 54.51 1uj3 s LEU 708 Cb -0.18 -2.95 0.19 0.00 0.03 0.00 0.00 46.19 43.28 1uj3 s LEU 708 CO 0.32 -0.33 1.09 -0.83 0.23 0.00 0.00 176.35 176.82 1uj3 s GLY 709 N 1.28 1.62 -0.03 -3.19 0.00 -1.26 -4.48 107.32 101.26 1uj3 s GLY 709 Ca 0.30 0.17 -0.30 0.00 0.00 0.00 0.00 44.72 44.89 1uj3 s GLY 709 CO 0.10 0.71 1.30 1.62 0.00 0.00 0.00 173.10 176.83 1uj3 s GLN 710 N -4.65 4.32 0.94 2.90 0.74 -1.26 -4.68 119.66 117.96 1uj3 s GLN 710 Ca 0.66 1.81 -0.12 0.00 0.05 0.00 0.00 55.36 57.77 1uj3 s GLN 710 Cb -0.22 -3.57 0.15 0.00 1.10 0.00 0.00 33.01 30.47 1uj3 s GLN 710 CO 0.60 -0.51 1.09 -2.14 -0.55 0.00 0.00 175.29 173.78 1uj3 s PRO 711 N 2.31 0.92 -0.04 1.67 0.02 -1.26 -4.95 135.00 133.67 1uj3 s PRO 711 Ca 0.60 0.80 0.01 0.00 0.02 0.00 0.00 61.00 62.43 1uj3 s PRO 711 Cb -0.28 -1.77 0.02 0.00 0.02 0.00 0.00 34.50 32.49 1uj3 s PRO 711 CO 0.24 -2.47 -0.06 0.99 -0.33 0.00 0.00 177.00 175.37 1uj3 s THR 712 N -2.89 0.60 -0.16 0.99 2.01 -1.26 -4.20 115.64 110.73 1uj3 s THR 712 Ca 0.64 -0.20 -0.29 0.00 0.31 0.00 0.00 61.69 62.16 1uj3 s THR 712 Cb -0.19 -0.59 -0.00 0.00 0.01 0.00 0.00 72.50 71.73 1uj3 s THR 712 CO 0.58 0.22 0.99 -0.63 -0.69 0.00 0.00 174.62 175.09 1uj3 s ILE 713 N 0.65 4.76 0.02 1.82 1.01 -1.26 -0.88 121.20 127.32 1uj3 s ILE 713 Ca -0.09 1.97 -0.00 0.00 0.00 0.00 0.00 60.65 62.53 1uj3 s ILE 713 Cb -0.12 -4.28 -0.26 0.00 0.01 0.00 0.00 42.46 37.80 1uj3 s ILE 713 CO 0.01 -0.06 0.91 -0.61 0.00 0.00 0.00 174.94 175.19 1uj3 h GLN 714 N 7.26 0.19 -2.14 2.79 4.15 0.04 -3.45 115.11 123.95 1uj3 h GLN 714 Ca -0.27 -0.32 0.20 0.00 0.77 0.00 0.00 58.65 59.03 1uj3 h GLN 714 Cb 1.11 0.12 -0.10 0.00 0.21 0.00 0.00 27.48 28.82 1uj3 h GLN 714 CO 0.89 1.04 0.56 -1.54 -1.93 0.00 0.00 178.83 177.85 1uj3 s SER 715 N -6.86 -0.18 -0.02 -0.69 1.04 -1.06 -4.99 113.70 100.94 1uj3 s SER 715 Ca -0.07 -0.28 0.03 0.00 0.48 0.00 0.00 55.95 56.12 1uj3 s SER 715 Cb 0.07 0.40 -0.00 0.00 0.10 0.00 0.00 66.02 66.59 1uj3 s SER 715 CO 0.85 -0.72 -0.11 -0.36 0.98 0.00 0.00 173.24 173.87 1uj3 s PHE 716 N -3.07 1.06 -0.23 5.02 0.40 -1.26 -1.24 117.98 118.67 1uj3 s PHE 716 Ca 0.11 -0.25 -0.18 0.00 -0.60 0.00 0.00 56.93 56.01 1uj3 s PHE 716 Cb -0.00 -0.72 0.06 0.00 0.51 0.00 0.00 43.02 42.87 1uj3 s PHE 716 CO -0.01 -0.08 0.59 -2.00 0.70 0.00 0.00 175.22 174.43 1uj3 s GLU 717 N 0.00 0.66 0.19 0.44 2.12 -0.37 -4.96 118.70 116.79 1uj3 s GLU 717 Ca -0.00 0.90 -0.30 0.00 0.36 0.00 0.00 54.97 55.93 1uj3 s GLU 717 Cb -0.07 0.26 -0.08 0.00 0.26 0.00 0.00 34.13 34.49 1uj3 s GLU 717 CO 0.00 -0.11 1.10 -1.14 -0.54 0.00 0.00 175.26 174.58 1uj3 s GLN 718 N 0.70 4.60 -0.19 4.30 0.74 -1.26 0.11 119.66 128.66 1uj3 s GLN 718 Ca -0.03 1.74 -0.04 0.00 0.05 0.00 0.00 55.36 57.07 1uj3 s GLN 718 Cb -0.05 -3.26 0.06 0.00 1.10 0.00 0.00 33.01 30.86 1uj3 s GLN 718 CO -0.05 0.09 0.07 0.08 -0.55 0.00 0.00 175.29 174.93 1uj3 s VAL 719 N -0.36 0.20 0.00 1.34 1.01 0.24 -4.85 120.40 117.98 1uj3 s VAL 719 Ca 0.49 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1uj3 s VAL 719 Cb -0.30 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1uj3 s VAL 719 CO 0.36 -0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.79 1uj3 n GLY 720 N 5.17 3.36 1.27 4.51 0.00 -1.26 -0.76 105.19 117.47 1uj3 n GLY 720 Ca -0.08 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 45.93 1uj3 n GLY 720 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uj3 n THR 721 N 0.00 0.87 -3.83 2.61 -2.24 -1.26 -4.96 114.28 105.46 1uj3 n THR 721 Ca 0.00 -0.90 -0.22 0.00 -2.27 0.00 0.00 64.05 60.65 1uj3 n THR 721 Cb 0.00 0.54 -0.05 0.00 -2.10 0.00 0.00 70.33 68.72 1uj3 n THR 721 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1uj3 s LYS 722 N -1.13 2.41 -0.18 -0.78 -0.14 0.06 -4.78 119.74 115.20 1uj3 s LYS 722 Ca 0.46 -1.65 -0.02 0.00 -1.36 0.00 0.00 55.97 53.40 1uj3 s LYS 722 Cb 0.24 -2.21 -0.01 0.00 -1.68 0.00 0.00 37.83 34.17 1uj3 s LYS 722 CO 0.32 -0.13 -0.09 0.08 -0.76 0.00 0.00 175.35 174.77 1uj3 s VAL 723 N -2.51 3.17 -0.31 3.17 1.01 0.61 -0.59 120.40 124.94 1uj3 s VAL 723 Ca 0.44 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.62 1uj3 s VAL 723 Cb -0.00 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.98 1uj3 s VAL 723 CO 0.25 0.47 0.69 0.21 0.00 0.00 0.00 175.10 176.73 1uj3 s ASN 724 N 1.00 6.55 -0.26 3.32 3.04 0.31 -1.61 114.94 127.29 1uj3 s ASN 724 Ca -0.01 0.48 -0.07 0.00 0.04 0.00 0.00 52.86 53.30 1uj3 s ASN 724 Cb -0.15 -2.36 -0.03 0.00 -1.54 0.00 0.00 41.25 37.18 1uj3 s ASN 724 CO -0.01 -0.54 0.08 -0.69 -3.04 0.00 0.00 177.10 172.90 1uj3 s VAL 725 N 2.76 4.33 -0.17 -5.21 1.01 0.00 -1.23 120.40 121.88 1uj3 s VAL 725 Ca 0.28 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.00 1uj3 s VAL 725 Cb -0.15 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1uj3 s VAL 725 CO 0.12 0.31 -0.00 -0.89 0.00 0.00 0.00 175.10 174.64 1uj3 s THR 726 N 1.61 4.19 0.03 3.92 2.01 -0.37 -1.25 115.64 125.79 1uj3 s THR 726 Ca 0.06 -0.25 -0.16 0.00 0.31 0.00 0.00 61.69 61.65 1uj3 s THR 726 Cb -0.15 -2.86 -0.06 0.00 0.01 0.00 0.00 72.50 69.44 1uj3 s THR 726 CO 0.04 0.48 0.46 -0.69 -0.69 0.00 0.00 174.62 174.21 1uj3 s VAL 727 N 0.42 4.94 0.08 3.82 1.01 0.46 0.74 120.40 131.87 1uj3 s VAL 727 Ca -0.01 0.93 -0.31 0.00 0.00 0.00 0.00 61.98 62.59 1uj3 s VAL 727 Cb -0.14 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.41 1uj3 s VAL 727 CO 0.02 0.55 1.39 -0.70 0.00 0.00 0.00 175.10 176.35 1uj3 s GLU 728 N -1.16 4.32 -1.06 2.72 2.12 -0.06 -4.70 118.70 120.88 1uj3 s GLU 728 Ca 0.26 2.03 -0.18 0.00 0.36 0.00 0.00 54.97 57.44 1uj3 s GLU 728 Cb -0.17 -3.36 0.12 0.00 0.26 0.00 0.00 34.13 30.97 1uj3 s GLU 728 CO 0.15 -0.47 1.34 0.34 -0.54 0.00 0.00 175.26 176.08 1uj3 s ASP 729 N 1.37 6.74 0.11 -1.70 2.15 -1.26 -4.71 116.67 119.36 1uj3 s ASP 729 Ca 0.64 -2.21 -0.32 0.00 0.43 0.00 0.00 52.55 51.09 1uj3 s ASP 729 Cb -0.35 -2.45 -0.12 0.00 -0.30 0.00 0.00 42.92 39.70 1uj3 s ASP 729 CO 0.29 -1.09 1.79 1.21 -0.17 0.00 0.00 175.17 177.20 1uj3 n GLU 730 N 7.00 2.58 -2.84 4.34 2.13 -1.26 -4.77 120.64 127.83 1uj3 n GLU 730 Ca 0.32 0.94 -0.35 0.00 0.66 0.00 0.00 57.16 58.73 1uj3 n GLU 730 Cb 0.48 -2.80 -0.07 0.00 0.27 0.00 0.00 31.44 29.32 1uj3 n GLU 730 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1uj3 s ARG 731 N 2.45 4.38 0.48 5.31 1.70 -1.26 -1.08 118.95 130.93 1uj3 s ARG 731 Ca 0.82 1.18 0.04 0.00 -0.47 0.00 0.00 55.73 57.30 1uj3 s ARG 731 Cb -0.55 -2.52 -0.02 0.00 -0.57 0.00 0.00 34.95 31.29 1uj3 s ARG 731 CO 0.39 0.15 0.14 0.95 -1.08 0.00 0.00 175.30 175.85 1uj3 s THR 732 N -1.87 1.67 -1.44 4.99 -4.23 0.54 -4.86 115.64 110.44 1uj3 s THR 732 Ca 0.55 -1.81 0.30 0.00 -1.18 0.00 0.00 61.69 59.56 1uj3 s THR 732 Cb -0.14 -2.48 0.53 0.00 1.34 0.00 0.00 72.50 71.75 1uj3 s THR 732 CO 0.19 0.00 2.05 0.18 -0.54 0.00 0.00 174.62 176.50 1uj3 n LEU 733 N -1.34 0.01 -4.77 4.79 4.77 -1.26 -4.04 117.00 115.17 1uj3 n LEU 733 Ca -0.09 0.28 -0.39 0.00 -0.03 0.00 0.00 56.01 55.78 1uj3 n LEU 733 Cb 0.66 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.44 1uj3 n LEU 733 CO 0.42 0.00 0.88 -0.69 -1.33 0.00 0.00 177.39 176.67 1uj3 s VAL 734 N -2.57 3.02 -0.03 4.08 1.01 -1.26 -4.90 120.40 119.75 1uj3 s VAL 734 Ca 0.29 0.93 0.01 0.00 0.00 0.00 0.00 61.98 63.20 1uj3 s VAL 734 Cb 0.20 -3.56 0.02 0.00 0.00 0.00 0.00 36.38 33.05 1uj3 s VAL 734 CO 0.46 0.15 -0.01 -0.13 0.00 0.00 0.00 175.10 175.57 1uj3 s ARG 735 N -2.03 0.41 -0.16 2.72 0.52 -1.26 -0.47 118.95 118.67 1uj3 s ARG 735 Ca 0.53 0.02 -0.01 0.00 -0.52 0.00 0.00 55.73 55.76 1uj3 s ARG 735 Cb -0.34 -0.54 -0.01 0.00 0.52 0.00 0.00 34.95 34.59 1uj3 s ARG 735 CO 0.44 -0.11 -0.12 0.50 0.02 0.00 0.00 175.30 176.03 1uj3 s ARG 736 N 0.91 3.31 0.00 3.54 3.52 -0.85 -4.70 118.95 124.68 1uj3 s ARG 736 Ca -0.10 -0.70 0.00 0.00 -0.13 0.00 0.00 55.73 54.80 1uj3 s ARG 736 Cb -0.13 -2.71 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 1uj3 s ARG 736 CO -0.01 0.04 0.00 0.27 -0.81 0.00 0.00 175.30 174.79 1uj3 n ASN 737 N 4.02 0.00 0.00 -2.12 0.23 -1.26 -1.63 115.26 114.49 1uj3 n ASN 737 Ca -0.19 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.86 1uj3 n ASN 737 Cb 0.52 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.22 1uj3 n ASN 737 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1uj3 n ASN 738 N 0.81 0.00 -4.75 0.53 5.15 -1.26 -5.14 115.26 110.59 1uj3 n ASN 738 Ca 0.00 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.59 1uj3 n ASN 738 Cb 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.20 1uj3 n ASN 738 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1uj3 s THR 739 N 0.00 4.87 -0.11 -0.44 2.01 -0.65 -5.02 115.64 116.30 1uj3 s THR 739 Ca 0.00 1.37 -0.29 0.00 0.31 0.00 0.00 61.69 63.07 1uj3 s THR 739 Cb 0.00 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 1uj3 s THR 739 CO 0.00 0.39 1.43 -0.36 -0.69 0.00 0.00 174.62 175.38 1uj3 s PHE 740 N -0.07 2.50 0.12 4.92 0.08 -1.26 -2.01 117.98 122.27 1uj3 s PHE 740 Ca 0.34 0.67 -0.30 0.00 0.12 0.00 0.00 56.93 57.76 1uj3 s PHE 740 Cb -0.19 -3.68 -0.06 0.00 -0.57 0.00 0.00 43.02 38.52 1uj3 s PHE 740 CO 0.19 -2.60 0.95 -0.51 -0.10 0.00 0.00 175.22 173.15 1uj3 s LEU 741 N 3.64 4.52 0.77 -0.37 1.43 0.38 -4.75 118.68 124.29 1uj3 s LEU 741 Ca 0.63 1.80 -0.11 0.00 -1.03 0.00 0.00 54.13 55.41 1uj3 s LEU 741 Cb -0.27 -3.58 0.05 0.00 0.03 0.00 0.00 46.19 42.43 1uj3 s LEU 741 CO 0.21 -0.03 1.10 -0.94 0.23 0.00 0.00 176.35 176.92 1uj3 s SER 742 N -0.16 4.79 0.45 2.29 1.04 -1.26 -0.34 113.70 120.51 1uj3 s SER 742 Ca 0.46 1.24 0.11 0.00 0.48 0.00 0.00 55.95 58.24 1uj3 s SER 742 Cb -0.24 -1.99 1.02 0.00 0.10 0.00 0.00 66.02 64.91 1uj3 s SER 742 CO 0.30 -1.77 2.06 0.25 0.98 0.00 0.00 173.24 175.06 1uj3 h LEU 743 N -0.95 0.32 -0.44 2.42 5.85 -1.41 -1.87 115.31 119.24 1uj3 h LEU 743 Ca -0.46 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.19 1uj3 h LEU 743 Cb 1.26 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 1uj3 h LEU 743 CO 0.61 0.22 0.03 -0.09 -0.34 0.00 0.00 178.44 178.87 1uj3 h ARG 744 N 0.37 0.75 -0.74 1.25 9.65 -1.92 -2.20 114.38 121.55 1uj3 h ARG 744 Ca 0.14 -0.22 0.06 0.00 -1.10 0.00 0.00 59.98 58.86 1uj3 h ARG 744 Cb 0.12 -0.08 -0.06 0.00 -1.39 0.00 0.00 29.97 28.56 1uj3 h ARG 744 CO -0.03 0.80 0.43 -0.44 2.80 0.00 0.00 179.97 183.53 1uj3 h ASP 745 N 0.60 0.66 0.12 -3.80 3.32 -1.71 0.80 116.42 116.41 1uj3 h ASP 745 Ca 0.13 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1uj3 h ASP 745 Cb 0.44 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1uj3 h ASP 745 CO 0.02 0.42 -0.06 0.58 -1.72 0.00 0.00 179.24 178.48 1uj3 h VAL 746 N 0.79 1.03 0.00 -1.35 2.07 -1.23 -3.33 116.25 114.24 1uj3 h VAL 746 Ca 0.32 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 1uj3 h VAL 746 Cb 0.18 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1uj3 h VAL 746 CO -0.18 0.16 -0.92 -0.26 0.02 0.00 0.00 177.57 176.39 1uj3 h PHE 747 N -0.48 0.00 0.00 1.57 0.04 -1.27 -3.50 116.94 113.30 1uj3 h PHE 747 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1uj3 h PHE 747 Cb 0.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.53 1uj3 h PHE 747 CO 0.03 0.27 0.00 0.41 -0.60 0.00 0.00 178.31 178.42 1uj3 n GLY 748 N 1.25 2.91 0.01 -1.45 0.00 0.28 -2.06 105.19 106.12 1uj3 n GLY 748 Ca -0.02 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 45.81 1uj3 n GLY 748 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uj3 n LYS 749 N 13.75 1.01 0.00 1.61 5.02 -1.26 -3.33 118.16 134.96 1uj3 n LYS 749 Ca 0.00 -0.02 0.02 0.00 -2.02 0.00 0.00 58.31 56.30 1uj3 n LYS 749 Cb 0.00 -1.41 0.14 0.00 -0.02 0.00 0.00 35.03 33.74 1uj3 n LYS 749 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1uj3 n ASP 750 N -0.89 0.00 -4.06 4.39 9.92 -0.88 -4.67 116.55 120.36 1uj3 n ASP 750 Ca 0.20 -1.80 -0.28 0.00 -0.53 0.00 0.00 54.79 52.38 1uj3 n ASP 750 Cb 0.10 0.00 -0.17 0.00 -0.64 0.00 0.00 41.12 40.41 1uj3 n ASP 750 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1uj3 s LEU 751 N -1.15 1.73 -0.04 0.64 2.96 -1.21 -3.46 118.68 118.16 1uj3 s LEU 751 Ca 0.07 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 53.63 1uj3 s LEU 751 Cb 0.03 -1.07 -0.02 0.00 0.50 0.00 0.00 46.19 45.64 1uj3 s LEU 751 CO 0.06 0.03 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.26 1uj3 s ILE 752 N 0.88 2.37 -0.14 6.68 1.01 0.82 -4.55 121.20 128.27 1uj3 s ILE 752 Ca -0.09 -0.98 -0.05 0.00 0.00 0.00 0.00 60.65 59.53 1uj3 s ILE 752 Cb -0.15 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 1uj3 s ILE 752 CO 0.00 0.58 0.03 -0.31 0.00 0.00 0.00 174.94 175.24 1uj3 s TYR 753 N -0.57 3.20 -0.17 3.97 2.02 -0.10 -0.78 117.35 124.92 1uj3 s TYR 753 Ca 0.08 0.08 -0.01 0.00 -0.37 0.00 0.00 57.07 56.85 1uj3 s TYR 753 Cb -0.11 -1.95 -0.00 0.00 -0.40 0.00 0.00 41.96 39.51 1uj3 s TYR 753 CO 0.00 0.27 -0.13 0.99 -1.57 0.00 0.00 175.55 175.11 1uj3 s THR 754 N -0.17 2.81 -0.05 -0.71 2.01 0.10 -1.63 115.64 118.01 1uj3 s THR 754 Ca 0.06 -0.71 -0.09 0.00 0.31 0.00 0.00 61.69 61.27 1uj3 s THR 754 Cb -0.12 -2.22 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 1uj3 s THR 754 CO 0.02 0.50 0.25 -0.22 -0.69 0.00 0.00 174.62 174.47 1uj3 s LEU 755 N 1.01 4.40 -0.08 4.42 2.96 0.35 -0.34 118.68 131.39 1uj3 s LEU 755 Ca -0.01 0.61 0.04 0.00 -0.22 0.00 0.00 54.13 54.55 1uj3 s LEU 755 Cb -0.15 -2.40 0.00 0.00 0.50 0.00 0.00 46.19 44.14 1uj3 s LEU 755 CO -0.02 0.33 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.82 1uj3 s TYR 756 N -1.14 2.24 -0.02 5.38 2.02 0.86 -1.75 117.35 124.94 1uj3 s TYR 756 Ca 0.21 -0.84 -0.07 0.00 -0.37 0.00 0.00 57.07 56.00 1uj3 s TYR 756 Cb -0.13 -1.51 0.01 0.00 -0.40 0.00 0.00 41.96 39.92 1uj3 s TYR 756 CO 0.10 -0.33 0.16 1.52 -1.57 0.00 0.00 175.55 175.43 1uj3 s TYR 757 N 0.29 -0.05 0.06 2.71 1.13 -0.32 -1.29 117.35 119.89 1uj3 s TYR 757 Ca -0.14 0.10 -0.22 0.00 -1.41 0.00 0.00 57.07 55.40 1uj3 s TYR 757 Cb -0.16 -0.00 0.05 0.00 -1.10 0.00 0.00 41.96 40.75 1uj3 s TYR 757 CO 0.06 -0.22 0.52 1.67 -2.51 0.00 0.00 175.55 175.07 1uj3 s TRP 758 N -0.86 -0.41 0.19 -3.49 -2.14 -0.40 -0.91 118.94 110.91 1uj3 s TRP 758 Ca -0.09 0.41 -0.30 0.00 2.66 0.00 0.00 56.10 58.77 1uj3 s TRP 758 Cb -0.05 0.35 -0.08 0.00 -3.10 0.00 0.00 33.47 30.59 1uj3 s TRP 758 CO 0.01 -0.67 1.20 0.15 -2.66 0.00 0.00 176.95 174.98 1uj3 s LYS 759 N -2.69 4.49 0.36 3.25 1.02 -1.26 0.54 119.74 125.45 1uj3 s LYS 759 Ca -0.04 1.88 0.07 0.00 0.02 0.00 0.00 55.97 57.91 1uj3 s LYS 759 Cb -0.00 -3.24 0.68 0.00 -0.52 0.00 0.00 37.83 34.75 1uj3 s LYS 759 CO -0.04 -0.08 1.87 0.66 -0.92 0.00 0.00 175.35 176.84 1uj3 h SER 760 N 5.18 0.32 -0.19 2.83 4.64 -1.60 0.55 113.55 125.27 1uj3 h SER 760 Ca -0.45 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 60.79 1uj3 h SER 760 Cb 1.21 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 1uj3 h SER 760 CO 0.74 0.48 0.07 0.77 -0.87 0.00 0.00 176.83 178.01 1uj3 h SER 761 N 0.32 0.28 0.42 4.97 4.64 -1.91 -3.31 113.55 118.95 1uj3 h SER 761 Ca 0.06 -0.19 -0.07 0.00 -0.47 0.00 0.00 61.79 61.12 1uj3 h SER 761 Cb 0.42 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1uj3 h SER 761 CO 0.02 0.40 -1.65 -1.54 -0.87 0.00 0.00 176.83 173.19 1uj3 n SER 762 N -4.81 0.41 -1.20 4.97 3.41 -1.17 -4.96 113.62 110.26 1uj3 n SER 762 Ca -0.04 0.17 -0.16 0.00 -0.26 0.00 0.00 58.87 58.58 1uj3 n SER 762 Cb 0.14 1.09 -0.07 0.00 -0.26 0.00 0.00 64.21 65.11 1uj3 n SER 762 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1uj3 n SER 763 N -2.56 -5.51 -4.64 4.04 7.64 0.17 -4.94 113.62 107.83 1uj3 n SER 763 Ca -0.07 0.39 -0.43 0.00 1.01 0.00 0.00 58.87 59.77 1uj3 n SER 763 Cb 0.68 -4.40 -0.02 0.00 -1.01 0.00 0.00 64.21 59.46 1uj3 n SER 763 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1uj3 s GLY 764 N -2.62 1.45 0.15 0.23 0.00 -1.26 -4.93 107.32 100.33 1uj3 s GLY 764 Ca 0.00 0.34 -0.21 0.00 0.00 0.00 0.00 44.72 44.85 1uj3 s GLY 764 CO 0.00 2.67 0.68 0.54 0.00 0.00 0.00 173.10 176.99 1uj3 s LYS 765 N 4.04 4.34 0.15 2.90 -0.14 -1.26 -4.24 119.74 125.53 1uj3 s LYS 765 Ca 0.60 0.91 0.07 0.00 -1.36 0.00 0.00 55.97 56.19 1uj3 s LYS 765 Cb -0.21 -3.14 -0.04 0.00 -1.68 0.00 0.00 37.83 32.76 1uj3 s LYS 765 CO 0.22 0.55 -0.16 0.15 -0.76 0.00 0.00 175.35 175.34 1uj3 s LYS 766 N -1.39 1.19 0.06 1.68 1.02 -0.09 -4.98 119.74 117.23 1uj3 s LYS 766 Ca 0.35 -1.36 0.03 0.00 0.02 0.00 0.00 55.97 55.01 1uj3 s LYS 766 Cb -0.20 -1.15 -0.03 0.00 -0.52 0.00 0.00 37.83 35.93 1uj3 s LYS 766 CO 0.22 0.23 -0.09 -0.08 -0.92 0.00 0.00 175.35 174.71 1uj3 s THR 767 N -2.18 0.70 0.06 2.17 -1.32 -1.26 -1.17 115.64 112.64 1uj3 s THR 767 Ca 0.14 -1.31 -0.07 0.00 -1.21 0.00 0.00 61.69 59.24 1uj3 s THR 767 Cb -0.05 -0.93 -0.01 0.00 -1.51 0.00 0.00 72.50 70.01 1uj3 s THR 767 CO 0.05 -0.45 0.15 0.00 -2.21 0.00 0.00 174.62 172.16 1uj3 s ALA 768 N -1.82 -0.15 0.10 11.08 0.00 -0.72 -4.98 121.76 125.27 1uj3 s ALA 768 Ca -0.04 -0.58 0.05 0.00 0.00 0.00 0.00 51.96 51.40 1uj3 s ALA 768 Cb -0.07 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 1uj3 s ALA 768 CO -0.00 -0.42 -0.14 0.15 0.00 0.00 0.00 175.76 175.35 1uj3 s LYS 769 N -3.28 0.94 -0.05 0.00 1.02 -1.26 -0.50 119.74 116.61 1uj3 s LYS 769 Ca 0.01 -1.14 -0.16 0.00 0.02 0.00 0.00 55.97 54.69 1uj3 s LYS 769 Cb 0.02 -0.84 0.03 0.00 -0.52 0.00 0.00 37.83 36.52 1uj3 s LYS 769 CO -0.08 0.17 0.37 -0.08 -0.92 0.00 0.00 175.35 174.81 1uj3 s THR 770 N -1.89 0.04 -0.31 2.17 -1.32 -0.65 -4.99 115.64 108.69 1uj3 s THR 770 Ca 0.05 -0.30 0.16 0.00 -1.21 0.00 0.00 61.69 60.39 1uj3 s THR 770 Cb -0.06 -0.64 0.51 0.00 -1.51 0.00 0.00 72.50 70.80 1uj3 s THR 770 CO 0.02 -0.17 1.41 -0.46 -2.21 0.00 0.00 174.62 173.22 1uj3 n ASN 771 N 1.63 3.83 0.00 8.08 0.23 -1.26 -0.92 115.26 126.85 1uj3 n ASN 771 Ca -0.19 -2.86 0.00 0.00 -0.53 0.00 0.00 54.58 51.00 1uj3 n ASN 771 Cb 0.56 -0.50 0.00 0.00 -2.08 0.00 0.00 39.78 37.76 1uj3 n ASN 771 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1uj3 n THR 772 N -0.29 0.00 -0.37 5.53 -2.24 -1.26 -4.79 114.28 110.86 1uj3 n THR 772 Ca 0.20 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 62.04 1uj3 n THR 772 Cb 0.84 -0.05 0.15 0.00 -2.10 0.00 0.00 70.33 69.16 1uj3 n THR 772 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1uj3 n ASN 773 N 0.00 2.92 -4.37 3.42 6.94 -1.26 -4.71 115.26 118.21 1uj3 n ASN 773 Ca 0.00 -2.27 -0.32 0.00 -0.02 0.00 0.00 54.58 51.97 1uj3 n ASN 773 Cb 0.00 -0.27 -0.15 0.00 -2.36 0.00 0.00 39.78 37.00 1uj3 n ASN 773 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1uj3 s GLU 774 N -1.49 2.33 0.03 -3.83 0.41 -1.26 -0.41 118.70 114.48 1uj3 s GLU 774 Ca 0.23 -0.84 0.08 0.00 -0.41 0.00 0.00 54.97 54.03 1uj3 s GLU 774 Cb 0.15 -2.19 -0.02 0.00 -1.78 0.00 0.00 34.13 30.29 1uj3 s GLU 774 CO 0.11 0.56 -0.22 -0.06 -0.49 0.00 0.00 175.26 175.15 1uj3 s PHE 775 N -0.59 1.94 -0.24 1.61 0.40 -0.38 -4.78 117.98 115.94 1uj3 s PHE 775 Ca 0.09 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 56.03 1uj3 s PHE 775 Cb -0.11 -1.17 0.07 0.00 0.51 0.00 0.00 43.02 42.32 1uj3 s PHE 775 CO 0.00 0.08 0.01 -0.51 0.70 0.00 0.00 175.22 175.50 1uj3 s LEU 776 N -1.08 2.16 0.24 -0.37 2.01 -1.26 -0.82 118.68 119.56 1uj3 s LEU 776 Ca 0.08 -1.19 0.06 0.00 0.01 0.00 0.00 54.13 53.10 1uj3 s LEU 776 Cb -0.09 -0.95 -0.05 0.00 0.01 0.00 0.00 46.19 45.11 1uj3 s LEU 776 CO 0.01 -0.30 -0.07 0.27 1.01 0.00 0.00 176.35 177.28 1uj3 s ILE 777 N 1.56 1.49 -0.03 -0.59 -4.36 -0.63 -4.90 121.20 113.74 1uj3 s ILE 777 Ca -0.01 -2.12 -0.11 0.00 -0.26 0.00 0.00 60.65 58.16 1uj3 s ILE 777 Cb -0.18 -2.30 -0.05 0.00 1.25 0.00 0.00 42.46 41.18 1uj3 s ILE 777 CO -0.10 -0.40 0.31 -1.81 0.24 0.00 0.00 174.94 173.18 1uj3 s ASP 778 N -3.37 6.63 0.02 4.36 1.01 -1.26 -0.29 116.67 123.77 1uj3 s ASP 778 Ca 0.27 0.75 0.00 0.00 0.71 0.00 0.00 52.55 54.28 1uj3 s ASP 778 Cb 0.03 -2.17 -0.01 0.00 1.01 0.00 0.00 42.92 41.78 1uj3 s ASP 778 CO 0.09 0.33 -0.03 0.68 0.21 0.00 0.00 175.17 176.45 1uj3 s VAL 779 N -1.12 0.16 0.28 -1.27 -7.23 -1.26 -4.97 120.40 104.99 1uj3 s VAL 779 Ca 0.22 -0.66 -0.29 0.00 -1.81 0.00 0.00 61.98 59.44 1uj3 s VAL 779 Cb -0.15 -0.25 -0.10 0.00 0.56 0.00 0.00 36.38 36.45 1uj3 s VAL 779 CO 0.11 -0.32 1.17 -1.81 -0.31 0.00 0.00 175.10 173.94 1uj3 s ASP 780 N -1.03 7.11 0.40 4.85 1.01 -1.26 -4.97 116.67 122.78 1uj3 s ASP 780 Ca -0.10 2.38 -0.26 0.00 0.71 0.00 0.00 52.55 55.28 1uj3 s ASP 780 Cb -0.07 -2.63 -0.09 0.00 1.01 0.00 0.00 42.92 41.14 1uj3 s ASP 780 CO -0.01 -0.28 1.26 -0.54 0.21 0.00 0.00 175.17 175.82 1uj3 s LYS 781 N -1.38 4.03 -1.36 8.23 -0.14 -1.26 -3.50 119.74 124.36 1uj3 s LYS 781 Ca 0.47 2.06 0.00 0.00 -1.36 0.00 0.00 55.97 57.13 1uj3 s LYS 781 Cb -0.34 -2.76 0.00 0.00 -1.68 0.00 0.00 37.83 33.04 1uj3 s LYS 781 CO 0.44 -0.41 0.00 0.41 -0.76 0.00 0.00 175.35 175.03 1uj3 n GLY 782 N 0.69 1.16 3.38 -3.33 0.00 -1.26 -5.01 105.19 100.82 1uj3 n GLY 782 Ca 0.04 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.36 1uj3 n GLY 782 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uj3 s GLU 783 N -3.35 1.74 -0.18 1.61 0.41 -1.23 -5.09 118.70 112.60 1uj3 s GLU 783 Ca 0.00 -1.16 -0.28 0.00 -0.41 0.00 0.00 54.97 53.13 1uj3 s GLU 783 Cb 0.00 -2.00 -0.00 0.00 -1.78 0.00 0.00 34.13 30.35 1uj3 s GLU 783 CO 0.00 0.50 0.96 -0.80 -0.49 0.00 0.00 175.26 175.43 1uj3 s ASN 784 N -1.54 7.08 0.19 -0.19 0.02 -1.26 -4.97 114.94 114.27 1uj3 s ASN 784 Ca 0.13 1.33 0.08 0.00 -1.02 0.00 0.00 52.86 53.39 1uj3 s ASN 784 Cb -0.10 -2.51 -0.04 0.00 0.02 0.00 0.00 41.25 38.61 1uj3 s ASN 784 CO 0.04 -0.53 -0.04 -0.31 0.02 0.00 0.00 177.10 176.28 1uj3 s TYR 785 N 2.61 2.74 0.09 2.20 1.51 -1.26 -1.54 117.35 123.70 1uj3 s TYR 785 Ca 0.43 -0.18 0.10 0.00 -1.01 0.00 0.00 57.07 56.41 1uj3 s TYR 785 Cb -0.16 -1.31 -0.03 0.00 -0.11 0.00 0.00 41.96 40.34 1uj3 s TYR 785 CO 0.11 0.53 -0.27 0.00 -1.11 0.00 0.00 175.55 174.81 1uj3 s PHE 787 N -0.94 0.50 -0.12 0.00 0.08 0.65 -1.27 117.98 116.89 1uj3 s PHE 787 Ca 0.13 -0.37 -0.11 0.00 0.12 0.00 0.00 56.93 56.70 1uj3 s PHE 787 Cb -0.10 -0.31 0.03 0.00 -0.57 0.00 0.00 43.02 42.07 1uj3 s PHE 787 CO 0.04 -0.08 0.31 0.45 -0.10 0.00 0.00 175.22 175.84 1uj3 s SER 788 N -1.11 -0.33 0.05 1.36 0.15 -0.41 -0.47 113.70 112.95 1uj3 s SER 788 Ca -0.08 0.63 0.07 0.00 0.70 0.00 0.00 55.95 57.28 1uj3 s SER 788 Cb -0.07 0.63 -0.03 0.00 -1.71 0.00 0.00 66.02 64.84 1uj3 s SER 788 CO -0.00 -0.11 -0.21 0.54 1.20 0.00 0.00 173.24 174.66 1uj3 s VAL 789 N 0.23 1.68 0.03 4.45 0.11 -1.26 -0.10 120.40 125.54 1uj3 s VAL 789 Ca -0.01 -1.24 0.04 0.00 -2.93 0.00 0.00 61.98 57.85 1uj3 s VAL 789 Cb -0.03 -1.46 -0.02 0.00 -1.53 0.00 0.00 36.38 33.34 1uj3 s VAL 789 CO -0.00 0.18 -0.13 -1.58 -3.33 0.00 0.00 175.10 170.24 1uj3 s GLN 790 N -1.25 0.91 -0.03 1.54 0.74 0.54 -0.54 119.66 121.56 1uj3 s GLN 790 Ca 0.07 -0.66 -0.02 0.00 0.05 0.00 0.00 55.36 54.80 1uj3 s GLN 790 Cb -0.09 -0.89 -0.04 0.00 1.10 0.00 0.00 33.01 33.09 1uj3 s GLN 790 CO 0.02 0.23 0.11 0.00 -0.55 0.00 0.00 175.29 175.10 1uj3 s ALA 791 N -0.71 3.71 -0.06 1.58 0.00 -1.26 0.00 121.76 125.02 1uj3 s ALA 791 Ca 0.02 -0.80 -0.07 0.00 0.00 0.00 0.00 51.96 51.11 1uj3 s ALA 791 Cb -0.07 -1.72 0.02 0.00 0.00 0.00 0.00 23.12 21.35 1uj3 s ALA 791 CO 0.01 0.69 0.19 0.54 0.00 0.00 0.00 175.76 177.18 1uj3 s VAL 792 N -1.18 0.02 -0.47 0.00 0.11 0.04 -0.90 120.40 118.03 1uj3 s VAL 792 Ca 0.22 -0.15 -0.07 0.00 -2.93 0.00 0.00 61.98 59.04 1uj3 s VAL 792 Cb -0.12 -0.32 0.12 0.00 -1.53 0.00 0.00 36.38 34.53 1uj3 s VAL 792 CO 0.13 -0.08 0.33 -0.63 -3.33 0.00 0.00 175.10 171.51 1uj3 s ILE 793 N -0.24 3.97 0.41 7.04 -1.09 -0.17 -0.13 121.20 130.99 1uj3 s ILE 793 Ca -0.03 -1.95 0.16 0.00 -2.23 0.00 0.00 60.65 56.59 1uj3 s ILE 793 Cb -0.03 -3.63 0.36 0.00 -1.58 0.00 0.00 42.46 37.58 1uj3 s ILE 793 CO 0.01 -0.77 1.88 1.55 -1.23 0.00 0.00 174.94 176.38 1uj3 h PRO 794 N 8.24 0.43 0.00 2.79 0.13 -1.86 -1.74 132.00 139.99 1uj3 h PRO 794 Ca -0.17 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1uj3 h PRO 794 Cb 1.06 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1uj3 h PRO 794 CO 0.81 0.28 0.00 0.66 -0.23 0.00 0.00 178.00 179.52 1uj3 h SER 795 N 0.44 0.00 -4.22 1.44 4.64 -1.94 -3.44 113.55 110.46 1uj3 h SER 795 Ca 0.43 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 61.26 1uj3 h SER 795 Cb 1.01 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.16 1uj3 h SER 795 CO -0.16 0.00 0.38 -0.13 -0.87 0.00 0.00 176.83 176.05 1uj3 s ARG 796 N -3.65 3.25 -0.00 4.77 0.52 -0.66 -4.97 118.95 118.21 1uj3 s ARG 796 Ca 0.01 1.15 0.09 0.00 -0.52 0.00 0.00 55.73 56.47 1uj3 s ARG 796 Cb 0.09 -2.03 -0.11 0.00 0.52 0.00 0.00 34.95 33.43 1uj3 s ARG 796 CO 0.51 -0.86 0.34 0.25 0.02 0.00 0.00 175.30 175.56 1uj3 n THR 797 N -2.24 0.00 -3.81 0.02 -2.24 -1.26 -4.87 114.28 99.88 1uj3 n THR 797 Ca 0.08 -0.27 -0.12 0.00 -2.27 0.00 0.00 64.05 61.47 1uj3 n THR 797 Cb 0.53 0.83 -0.10 0.00 -2.10 0.00 0.00 70.33 69.49 1uj3 n THR 797 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1uj3 s VAL 798 N -2.05 0.05 -1.44 2.28 -7.23 -1.26 -4.89 120.40 105.87 1uj3 s VAL 798 Ca 0.02 -0.43 -0.08 0.00 -1.81 0.00 0.00 61.98 59.67 1uj3 s VAL 798 Cb 0.07 -0.48 0.05 0.00 0.56 0.00 0.00 36.38 36.58 1uj3 s VAL 798 CO 0.38 -0.24 0.87 -3.20 -0.31 0.00 0.00 175.10 172.60 1uj3 n ASN 799 N 1.78 -3.39 -0.07 4.85 5.15 -1.26 -4.86 115.26 117.46 1uj3 n ASN 799 Ca -0.20 -0.79 0.12 0.00 -0.60 0.00 0.00 54.58 53.11 1uj3 n ASN 799 Cb 0.56 -3.97 0.16 0.00 -0.53 0.00 0.00 39.78 36.01 1uj3 n ASN 799 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1uj3 n ARG 800 N -4.54 0.20 -5.26 1.20 1.85 -1.26 -4.81 116.66 104.04 1uj3 n ARG 800 Ca -0.10 -0.13 -0.31 0.00 -1.00 0.00 0.00 57.85 56.31 1uj3 n ARG 800 Cb 0.59 -1.50 -0.16 0.00 -1.05 0.00 0.00 32.46 30.34 1uj3 n ARG 800 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 1uj3 s LYS 801 N -2.89 2.14 0.83 2.89 2.20 -1.26 -1.00 119.74 122.63 1uj3 s LYS 801 Ca 0.13 -0.90 -0.09 0.00 -0.36 0.00 0.00 55.97 54.75 1uj3 s LYS 801 Cb 0.17 -2.01 0.15 0.00 -1.51 0.00 0.00 37.83 34.63 1uj3 s LYS 801 CO 0.71 0.51 1.15 -1.54 -0.36 0.00 0.00 175.35 175.82 1uj3 s SER 802 N -0.50 3.89 0.57 1.43 1.04 -0.07 -4.80 113.70 115.26 1uj3 s SER 802 Ca 0.07 0.10 -0.08 0.00 0.48 0.00 0.00 55.95 56.52 1uj3 s SER 802 Cb -0.10 -0.38 -0.02 0.00 0.10 0.00 0.00 66.02 65.61 1uj3 s SER 802 CO -0.00 -2.20 0.92 0.42 0.98 0.00 0.00 173.24 173.36 1uj3 s THR 803 N -3.50 4.42 0.37 2.02 -4.23 -1.26 -4.67 115.64 108.79 1uj3 s THR 803 Ca 0.68 0.40 -0.25 0.00 -1.18 0.00 0.00 61.69 61.34 1uj3 s THR 803 Cb -0.06 -3.74 -0.09 0.00 1.34 0.00 0.00 72.50 69.96 1uj3 s THR 803 CO 0.48 -0.84 1.05 -1.81 -0.54 0.00 0.00 174.62 172.97 1uj3 s ASP 804 N -4.20 6.88 0.87 3.99 1.01 -1.26 -4.31 116.67 119.65 1uj3 s ASP 804 Ca 0.52 2.07 -0.10 0.00 0.71 0.00 0.00 52.55 55.75 1uj3 s ASP 804 Cb -0.11 -2.59 0.12 0.00 1.01 0.00 0.00 42.92 41.35 1uj3 s ASP 804 CO 0.49 -0.41 1.12 -0.94 0.21 0.00 0.00 175.17 175.64 1uj3 s SER 805 N -1.43 3.41 0.41 0.27 1.04 0.30 -4.87 113.70 112.83 1uj3 s SER 805 Ca 0.55 2.03 -0.27 0.00 0.48 0.00 0.00 55.95 58.74 1uj3 s SER 805 Cb -0.24 -2.53 -0.09 0.00 0.10 0.00 0.00 66.02 63.26 1uj3 s SER 805 CO 0.30 -2.77 1.39 -2.84 0.98 0.00 0.00 173.24 170.31 1uj3 s PRO 806 N -4.74 3.94 0.05 4.02 0.02 -1.26 -4.50 135.00 132.52 1uj3 s PRO 806 Ca 0.65 2.36 -0.30 0.00 0.02 0.00 0.00 61.00 63.72 1uj3 s PRO 806 Cb -0.21 -2.80 -0.09 0.00 0.02 0.00 0.00 34.50 31.42 1uj3 s PRO 806 CO 0.57 -0.59 1.80 0.08 -0.33 0.00 0.00 177.00 178.54 1uj3 s VAL 807 N -1.19 3.00 -0.36 3.83 1.01 -1.26 -4.75 120.40 120.68 1uj3 s VAL 807 Ca 0.57 0.26 -0.06 0.00 0.00 0.00 0.00 61.98 62.74 1uj3 s VAL 807 Cb -0.42 -3.17 0.05 0.00 0.00 0.00 0.00 36.38 32.84 1uj3 s VAL 807 CO 0.55 -0.01 0.14 -1.61 0.00 0.00 0.00 175.10 174.17 1uj3 s GLU 808 N 3.50 2.56 -0.65 2.72 0.41 0.38 -4.91 118.70 122.71 1uj3 s GLU 808 Ca 0.80 -1.29 -0.15 0.00 -0.41 0.00 0.00 54.97 53.92 1uj3 s GLU 808 Cb -0.41 -3.52 0.16 0.00 -1.78 0.00 0.00 34.13 28.58 1uj3 s GLU 808 CO 0.36 -0.75 0.60 0.00 -0.49 0.00 0.00 175.26 174.98