#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zy5 s LEU 593 N 0.00 2.78 0.21 1.04 1.43 -1.26 -4.98 118.68 117.90 1zy5 s LEU 593 Ca 0.00 -1.31 -0.15 0.00 -1.03 0.00 0.00 54.13 51.64 1zy5 s LEU 593 Cb 0.00 -1.13 0.24 0.00 0.03 0.00 0.00 46.19 45.33 1zy5 s LEU 593 CO 0.00 -0.73 1.60 -0.09 0.23 0.00 0.00 176.35 177.36 1zy5 h ARG 594 N 1.31 -0.05 0.12 1.70 2.43 -2.00 -1.53 114.38 116.37 1zy5 h ARG 594 Ca -0.42 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.75 1zy5 h ARG 594 Cb 1.28 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1zy5 h ARG 594 CO 0.70 -0.03 -0.06 -0.92 -1.51 0.00 0.00 179.97 178.15 1zy5 h TYR 595 N -0.05 -0.15 -0.31 2.20 3.20 -1.97 -0.37 116.97 119.51 1zy5 h TYR 595 Ca 0.31 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.14 1zy5 h TYR 595 Cb 0.53 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 1zy5 h TYR 595 CO -0.60 -0.03 0.04 0.00 -1.64 0.00 0.00 178.16 175.94 1zy5 h ALA 596 N 0.64 1.49 0.03 1.82 0.00 -1.80 -1.37 119.26 120.07 1zy5 h ALA 596 Ca -0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1zy5 h ALA 596 Cb 0.19 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1zy5 h ALA 596 CO 0.03 0.37 -0.30 0.77 0.00 0.00 0.00 179.25 180.12 1zy5 h SER 597 N 0.45 0.21 0.41 0.00 0.02 -1.06 -3.38 113.55 110.21 1zy5 h SER 597 Ca 0.10 -0.87 0.00 0.00 -0.84 0.00 0.00 61.79 60.19 1zy5 h SER 597 Cb 0.23 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1zy5 h SER 597 CO 0.00 1.06 -0.74 0.47 -1.14 0.00 0.00 176.83 176.48 1zy5 n ASP 598 N -4.46 0.64 -4.32 3.07 8.00 -0.17 -4.88 116.55 114.44 1zy5 n ASP 598 Ca -0.11 -0.36 -0.26 0.00 0.71 0.00 0.00 54.79 54.77 1zy5 n ASP 598 Cb 0.56 0.53 -0.13 0.00 -0.02 0.00 0.00 41.12 42.06 1zy5 n ASP 598 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1zy5 s PHE 599 N -3.06 1.99 -0.42 1.24 0.40 -0.52 0.13 117.98 117.74 1zy5 s PHE 599 Ca 0.08 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 56.04 1zy5 s PHE 599 Cb 0.16 -1.10 0.12 0.00 0.51 0.00 0.00 43.02 42.71 1zy5 s PHE 599 CO 0.76 0.23 0.17 -2.00 0.70 0.00 0.00 175.22 175.08 1zy5 s GLU 600 N -1.83 1.47 0.20 0.44 2.12 -0.78 -4.69 118.70 115.62 1zy5 s GLU 600 Ca 0.09 -2.02 -0.30 0.00 0.36 0.00 0.00 54.97 53.10 1zy5 s GLU 600 Cb -0.10 -2.82 -0.09 0.00 0.26 0.00 0.00 34.13 31.39 1zy5 s GLU 600 CO 0.04 -1.06 1.26 -1.83 -0.54 0.00 0.00 175.26 173.14 1zy5 s GLU 601 N 0.49 4.43 -0.03 4.30 -1.05 -1.26 -1.84 118.70 123.73 1zy5 s GLU 601 Ca 0.14 1.99 -0.02 0.00 -0.15 0.00 0.00 54.97 56.93 1zy5 s GLU 601 Cb -0.22 -3.21 -0.01 0.00 -0.44 0.00 0.00 34.13 30.25 1zy5 s GLU 601 CO -0.06 -0.18 -0.05 -0.89 0.95 0.00 0.00 175.26 175.03 1zy5 n ILE 602 N 2.49 0.29 -4.11 1.83 2.08 0.24 -4.95 119.36 117.23 1zy5 n ILE 602 Ca 0.05 0.44 -0.13 0.00 0.56 0.00 0.00 62.75 63.67 1zy5 n ILE 602 Cb 0.43 -1.68 -0.11 0.00 -0.75 0.00 0.00 39.64 37.54 1zy5 n ILE 602 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1zy5 s ALA 603 N -2.96 0.79 -0.93 -1.39 0.00 -1.16 -4.96 121.76 111.16 1zy5 s ALA 603 Ca -0.04 -0.96 -0.20 0.00 0.00 0.00 0.00 51.96 50.76 1zy5 s ALA 603 Cb 0.01 0.05 0.10 0.00 0.00 0.00 0.00 23.12 23.28 1zy5 s ALA 603 CO 0.06 -0.04 1.20 0.08 0.00 0.00 0.00 175.76 177.06 1zy5 s VAL 604 N -1.94 4.46 0.29 0.00 1.01 -1.26 -0.28 120.40 122.68 1zy5 s VAL 604 Ca -0.03 -1.22 0.02 0.00 0.00 0.00 0.00 61.98 60.76 1zy5 s VAL 604 Cb -0.06 -4.85 0.29 0.00 0.00 0.00 0.00 36.38 31.76 1zy5 s VAL 604 CO -0.00 -1.63 1.83 -0.07 0.00 0.00 0.00 175.10 175.23 1zy5 h LEU 605 N 11.18 0.89 -8.07 3.92 3.38 -1.36 -3.45 115.31 121.80 1zy5 h LEU 605 Ca 0.12 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1zy5 h LEU 605 Cb 1.02 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.58 1zy5 h LEU 605 CO 1.20 0.45 0.06 -0.83 0.09 0.00 0.00 178.44 179.42 1zy5 s GLY 606 N -3.54 0.17 0.03 0.83 0.00 -0.82 -5.01 107.32 98.98 1zy5 s GLY 606 Ca -0.12 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1zy5 s GLY 606 CO 0.81 -0.33 -0.04 1.20 0.00 0.00 0.00 173.10 174.73 1zy5 s GLN 607 N -3.96 0.41 0.30 2.90 -1.52 -1.26 -2.51 119.66 114.03 1zy5 s GLN 607 Ca 0.16 -0.73 0.01 0.00 -1.95 0.00 0.00 55.36 52.84 1zy5 s GLN 607 Cb -0.03 0.02 -0.02 0.00 -0.22 0.00 0.00 33.01 32.76 1zy5 s GLN 607 CO 0.07 -0.03 0.34 0.20 -0.25 0.00 0.00 175.29 175.61 1zy5 s GLY 608 N -1.69 1.74 0.22 3.09 0.00 -0.40 -4.96 107.32 105.31 1zy5 s GLY 608 Ca -0.11 -1.72 0.20 0.00 0.00 0.00 0.00 44.72 43.09 1zy5 s GLY 608 CO -0.02 -1.23 1.15 0.00 0.00 0.00 0.00 173.10 173.00 1zy5 h ALA 609 N 2.23 0.65 -0.01 3.20 0.00 -2.01 -3.32 119.26 119.98 1zy5 h ALA 609 Ca -0.28 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1zy5 h ALA 609 Cb 1.24 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1zy5 h ALA 609 CO 0.40 0.28 -0.47 1.97 0.00 0.00 0.00 179.25 181.43 1zy5 n PHE 610 N -2.87 0.00 -1.47 0.00 1.16 -1.26 -5.05 117.46 107.97 1zy5 n PHE 610 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.57 1zy5 n PHE 610 Cb 0.63 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.50 1zy5 n PHE 610 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1zy5 n GLY 611 N 1.33 -0.63 3.83 4.97 0.00 -1.25 -2.08 105.19 111.36 1zy5 n GLY 611 Ca 0.08 -0.58 -0.07 0.00 0.00 0.00 0.00 46.02 45.44 1zy5 n GLY 611 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1zy5 s GLN 612 N -0.69 1.91 -0.04 1.61 -2.07 -0.15 -1.27 119.66 118.95 1zy5 s GLN 612 Ca 0.00 -1.21 0.00 0.00 -1.82 0.00 0.00 55.36 52.34 1zy5 s GLN 612 Cb 0.00 0.55 0.03 0.00 -1.09 0.00 0.00 33.01 32.49 1zy5 s GLN 612 CO 0.00 -0.89 -0.01 0.08 -1.32 0.00 0.00 175.29 173.15 1zy5 s VAL 613 N -2.47 0.33 0.26 3.63 1.01 -1.04 -0.27 120.40 121.84 1zy5 s VAL 613 Ca 0.17 0.03 0.07 0.00 0.00 0.00 0.00 61.98 62.25 1zy5 s VAL 613 Cb -0.04 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 1zy5 s VAL 613 CO 0.09 0.19 -0.08 0.68 0.00 0.00 0.00 175.10 175.98 1zy5 s VAL 614 N 1.20 1.68 -0.19 2.92 -7.23 0.84 -0.96 120.40 118.65 1zy5 s VAL 614 Ca -0.07 -2.15 -0.08 0.00 -1.81 0.00 0.00 61.98 57.86 1zy5 s VAL 614 Cb -0.14 -2.33 -0.04 0.00 0.56 0.00 0.00 36.38 34.43 1zy5 s VAL 614 CO -0.02 -0.38 0.08 -0.75 -0.31 0.00 0.00 175.10 173.72 1zy5 s LYS 615 N -3.70 4.04 0.01 4.82 2.20 0.61 -0.44 119.74 127.28 1zy5 s LYS 615 Ca 0.28 -0.31 -0.00 0.00 -0.36 0.00 0.00 55.97 55.58 1zy5 s LYS 615 Cb 0.02 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 33.05 1zy5 s LYS 615 CO 0.11 0.28 -0.01 0.00 -0.36 0.00 0.00 175.35 175.36 1zy5 s ALA 616 N 0.38 0.06 -0.24 3.13 0.00 0.08 0.81 121.76 125.98 1zy5 s ALA 616 Ca 0.05 -0.38 -0.13 0.00 0.00 0.00 0.00 51.96 51.49 1zy5 s ALA 616 Cb -0.12 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1zy5 s ALA 616 CO -0.00 -0.11 0.28 0.50 0.00 0.00 0.00 175.76 176.42 1zy5 s ARG 617 N -1.00 4.07 -0.00 0.00 3.52 -0.77 -0.60 118.95 124.17 1zy5 s ARG 617 Ca -0.11 -0.08 -0.30 0.00 -0.13 0.00 0.00 55.73 55.11 1zy5 s ARG 617 Cb -0.07 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.70 1zy5 s ARG 617 CO -0.01 -0.08 1.13 1.21 -0.81 0.00 0.00 175.30 176.75 1zy5 s ASN 618 N 1.28 7.15 0.24 -2.12 2.47 0.53 -1.87 114.94 122.63 1zy5 s ASN 618 Ca 0.12 1.84 -0.07 0.00 0.42 0.00 0.00 52.86 55.17 1zy5 s ASN 618 Cb -0.15 -2.57 0.24 0.00 -1.45 0.00 0.00 41.25 37.32 1zy5 s ASN 618 CO 0.08 -0.45 1.91 0.00 -3.72 0.00 0.00 177.10 174.91 1zy5 h ALA 619 N 7.02 1.21 -0.06 1.71 0.00 0.72 0.55 119.26 130.41 1zy5 h ALA 619 Ca -0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1zy5 h ALA 619 Cb 1.19 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1zy5 h ALA 619 CO 0.82 0.63 0.01 -0.07 0.00 0.00 0.00 179.25 180.64 1zy5 h LEU 620 N 1.30 0.09 -2.50 0.00 3.38 -1.92 -3.33 115.31 112.33 1zy5 h LEU 620 Ca 0.35 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1zy5 h LEU 620 Cb -0.12 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1zy5 h LEU 620 CO -0.07 0.31 0.00 -0.90 0.09 0.00 0.00 178.44 177.87 1zy5 n ASP 621 N -4.91 2.55 0.00 -0.43 3.85 -1.21 -4.98 116.55 111.42 1zy5 n ASP 621 Ca -0.07 -1.84 0.00 0.00 -0.71 0.00 0.00 54.79 52.17 1zy5 n ASP 621 Cb 0.15 -0.15 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 1zy5 n ASP 621 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1zy5 n SER 622 N 0.43 -2.94 -4.88 -1.12 7.64 0.19 -4.93 113.62 108.01 1zy5 n SER 622 Ca 0.09 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.67 1zy5 n SER 622 Cb 0.36 -2.54 0.02 0.00 -1.01 0.00 0.00 64.21 61.04 1zy5 n SER 622 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1zy5 s ARG 623 N -1.28 3.40 0.17 1.43 0.52 -1.25 -4.65 118.95 117.28 1zy5 s ARG 623 Ca 0.00 0.51 -0.02 0.00 -0.52 0.00 0.00 55.73 55.70 1zy5 s ARG 623 Cb 0.00 -2.15 -0.05 0.00 0.52 0.00 0.00 34.95 33.27 1zy5 s ARG 623 CO 0.00 -0.58 0.37 0.71 0.02 0.00 0.00 175.30 175.82 1zy5 s TYR 624 N -3.10 3.48 0.09 -0.53 1.51 -1.26 -0.35 117.35 117.19 1zy5 s TYR 624 Ca 0.54 0.42 -0.12 0.00 -1.01 0.00 0.00 57.07 56.90 1zy5 s TYR 624 Cb -0.11 -1.91 0.01 0.00 -0.11 0.00 0.00 41.96 39.85 1zy5 s TYR 624 CO 0.51 0.41 0.27 0.71 -1.11 0.00 0.00 175.55 176.35 1zy5 s TYR 625 N -1.76 -0.01 -0.28 2.71 1.51 0.23 -4.27 117.35 115.48 1zy5 s TYR 625 Ca 0.39 -0.31 -0.11 0.00 -1.01 0.00 0.00 57.07 56.03 1zy5 s TYR 625 Cb -0.12 0.07 -0.05 0.00 -0.11 0.00 0.00 41.96 41.75 1zy5 s TYR 625 CO 0.27 -0.57 0.19 0.00 -1.11 0.00 0.00 175.55 174.33 1zy5 s ALA 626 N -3.48 3.53 -0.17 3.71 0.00 -0.60 -0.74 121.76 124.01 1zy5 s ALA 626 Ca 0.02 -1.08 -0.04 0.00 0.00 0.00 0.00 51.96 50.86 1zy5 s ALA 626 Cb 0.02 -2.46 -0.02 0.00 0.00 0.00 0.00 23.12 20.66 1zy5 s ALA 626 CO -0.09 -0.53 -0.03 0.42 0.00 0.00 0.00 175.76 175.53 1zy5 s ILE 627 N 1.72 3.84 -0.15 0.00 -1.09 0.41 -0.44 121.20 125.50 1zy5 s ILE 627 Ca 0.07 -0.37 -0.05 0.00 -2.23 0.00 0.00 60.65 58.07 1zy5 s ILE 627 Cb -0.16 -2.70 -0.03 0.00 -1.58 0.00 0.00 42.46 37.99 1zy5 s ILE 627 CO 0.10 0.47 0.02 -0.75 -1.23 0.00 0.00 174.94 173.55 1zy5 s LYS 628 N 0.60 3.60 -0.08 2.79 2.20 -0.53 -0.11 119.74 128.21 1zy5 s LYS 628 Ca -0.02 -0.41 0.04 0.00 -0.36 0.00 0.00 55.97 55.22 1zy5 s LYS 628 Cb -0.14 -3.01 -0.01 0.00 -1.51 0.00 0.00 37.83 33.16 1zy5 s LYS 628 CO 0.02 0.39 -0.21 0.15 -0.36 0.00 0.00 175.35 175.35 1zy5 s LYS 629 N -0.01 2.87 -0.24 4.03 1.02 0.62 -1.14 119.74 126.90 1zy5 s LYS 629 Ca 0.04 -0.82 -0.01 0.00 0.02 0.00 0.00 55.97 55.19 1zy5 s LYS 629 Cb -0.13 -2.33 0.07 0.00 -0.52 0.00 0.00 37.83 34.92 1zy5 s LYS 629 CO 0.02 0.32 0.01 0.42 -0.92 0.00 0.00 175.35 175.20 1zy5 s ILE 630 N 0.02 1.02 -0.16 2.17 1.01 -0.33 -0.97 121.20 123.96 1zy5 s ILE 630 Ca -0.08 -1.02 -0.08 0.00 0.00 0.00 0.00 60.65 59.47 1zy5 s ILE 630 Cb -0.15 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 1zy5 s ILE 630 CO 0.05 -0.27 0.11 -0.60 0.00 0.00 0.00 174.94 174.23 1zy5 s ARG 631 N 1.61 3.78 0.00 2.79 3.52 -0.88 -1.50 118.95 128.26 1zy5 s ARG 631 Ca -0.00 -0.22 0.00 0.00 -0.13 0.00 0.00 55.73 55.37 1zy5 s ARG 631 Cb -0.18 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.96 1zy5 s ARG 631 CO -0.11 0.51 0.00 1.58 -0.81 0.00 0.00 175.30 176.47 1zy5 n HIS 632 N 2.84 0.00 -2.59 5.12 -0.00 -0.91 -4.78 115.22 114.89 1zy5 n HIS 632 Ca -0.18 0.00 -0.36 0.00 0.46 0.00 0.00 57.72 57.64 1zy5 n HIS 632 Cb 0.53 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.36 1zy5 n HIS 632 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1zy5 s THR 633 N -2.75 3.84 0.57 3.57 -4.23 -1.26 -0.94 115.64 114.44 1zy5 s THR 633 Ca 0.00 1.36 0.27 0.00 -1.18 0.00 0.00 61.69 62.14 1zy5 s THR 633 Cb 0.00 -3.68 0.37 0.00 1.34 0.00 0.00 72.50 70.53 1zy5 s THR 633 CO 0.00 -0.04 2.05 -0.33 -0.54 0.00 0.00 174.62 175.75 1zy5 h GLU 634 N 2.38 0.00 -0.31 3.99 5.08 -1.91 0.06 114.58 123.87 1zy5 h GLU 634 Ca -0.48 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.71 1zy5 h GLU 634 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1zy5 h GLU 634 CO 0.62 0.00 -0.46 1.49 -1.00 0.00 0.00 179.01 179.66 1zy5 h GLU 635 N 0.00 0.83 0.00 2.33 4.81 -1.93 -0.63 114.58 119.99 1zy5 h GLU 635 Ca 0.14 -0.47 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1zy5 h GLU 635 Cb 0.68 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1zy5 h GLU 635 CO -0.00 1.11 -0.19 0.87 -0.73 0.00 0.00 179.01 180.07 1zy5 h LYS 636 N 0.66 0.00 0.00 1.92 1.57 -1.43 -3.18 116.57 116.10 1zy5 h LYS 636 Ca 0.04 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.62 1zy5 h LYS 636 Cb 1.04 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.32 1zy5 h LYS 636 CO 0.10 0.00 -1.17 -0.07 -0.57 0.00 0.00 179.45 177.75 1zy5 h LEU 637 N 0.00 0.00 -0.88 2.94 3.38 -0.98 -3.24 115.31 116.53 1zy5 h LEU 637 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1zy5 h LEU 637 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1zy5 h LEU 637 CO 0.00 0.77 0.00 0.77 0.09 0.00 0.00 178.44 180.07 1zy5 h SER 638 N 0.00 0.00 1.44 -0.43 4.64 -1.09 -2.47 113.55 115.64 1zy5 h SER 638 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1zy5 h SER 638 Cb 1.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.78 1zy5 h SER 638 CO 0.08 0.00 0.00 0.71 -0.87 0.00 0.00 176.83 176.75 1zy5 h THR 639 N 0.00 0.00 -0.01 2.95 1.35 -1.63 -3.27 112.91 112.30 1zy5 h THR 639 Ca 0.00 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 1zy5 h THR 639 Cb 0.33 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 1zy5 h THR 639 CO 0.00 0.00 -0.06 2.30 -0.25 0.00 0.00 175.52 177.51 1zy5 n ILE 640 N -2.45 0.00 -0.18 6.82 -5.35 -0.94 -4.70 119.36 112.55 1zy5 n ILE 640 Ca 0.05 -0.47 -0.05 0.00 -0.27 0.00 0.00 62.75 62.00 1zy5 n ILE 640 Cb 0.41 1.09 0.05 0.00 -1.74 0.00 0.00 39.64 39.45 1zy5 n ILE 640 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 1zy5 h LEU 641 N 0.86 0.52 -0.62 7.28 3.38 -1.58 -0.96 115.31 124.20 1zy5 h LEU 641 Ca 0.00 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1zy5 h LEU 641 Cb 0.21 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1zy5 h LEU 641 CO 0.00 0.36 0.33 -1.28 0.09 0.00 0.00 178.44 177.94 1zy5 h SER 642 N 0.64 0.48 -0.41 -0.43 0.87 -1.84 -0.27 113.55 112.60 1zy5 h SER 642 Ca 0.22 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.70 1zy5 h SER 642 Cb 0.04 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 1zy5 h SER 642 CO -0.11 0.32 -0.18 -0.08 -0.53 0.00 0.00 176.83 176.26 1zy5 h GLU 643 N 0.62 0.89 -0.81 2.24 4.81 -1.72 -1.84 114.58 118.77 1zy5 h GLU 643 Ca 0.28 -0.35 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1zy5 h GLU 643 Cb 0.18 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 1zy5 h GLU 643 CO -0.18 1.00 0.37 0.28 -0.73 0.00 0.00 179.01 179.75 1zy5 h VAL 644 N 0.78 1.26 -0.25 0.32 2.07 -0.58 -0.83 116.25 119.02 1zy5 h VAL 644 Ca 0.11 -0.75 -0.09 0.00 0.82 0.00 0.00 66.70 66.80 1zy5 h VAL 644 Cb 0.71 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1zy5 h VAL 644 CO 0.05 0.32 -0.21 0.24 0.02 0.00 0.00 177.57 177.99 1zy5 h MET 645 N 1.17 0.46 -0.29 1.57 2.86 -0.76 -1.62 114.93 118.31 1zy5 h MET 645 Ca 0.28 -0.16 -0.18 0.00 -2.06 0.00 0.00 59.70 57.58 1zy5 h MET 645 Cb 0.15 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1zy5 h MET 645 CO -0.03 0.65 -0.54 -0.07 1.06 0.00 0.00 176.91 177.98 1zy5 h LEU 646 N 0.41 0.98 -0.97 1.22 3.38 -0.94 -3.03 115.31 116.36 1zy5 h LEU 646 Ca 0.07 -0.53 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 1zy5 h LEU 646 Cb 0.61 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1zy5 h LEU 646 CO 0.04 1.33 0.42 -0.07 0.09 0.00 0.00 178.44 180.25 1zy5 h LEU 647 N 0.67 1.03 0.00 1.67 3.38 -0.85 -1.34 115.31 119.87 1zy5 h LEU 647 Ca 0.02 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1zy5 h LEU 647 Cb 1.15 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1zy5 h LEU 647 CO 0.12 0.85 0.00 0.00 0.09 0.00 0.00 178.44 179.50 1zy5 n ALA 648 N -2.42 1.77 0.24 1.53 0.00 -0.64 -2.39 120.51 118.60 1zy5 n ALA 648 Ca 0.08 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.58 1zy5 n ALA 648 Cb 0.12 -1.23 0.06 0.00 0.00 0.00 0.00 19.45 18.40 1zy5 n ALA 648 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1zy5 h SER 649 N 0.00 0.00 -3.98 0.00 4.64 -1.16 -3.46 113.55 109.59 1zy5 h SER 649 Ca 0.00 -0.06 -0.48 0.00 -0.47 0.00 0.00 61.79 60.78 1zy5 h SER 649 Cb 0.17 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.27 1zy5 h SER 649 CO 0.00 0.03 0.40 -0.76 -0.87 0.00 0.00 176.83 175.63 1zy5 s LEU 650 N -5.15 4.10 -0.44 5.97 1.43 -1.00 -5.01 118.68 118.58 1zy5 s LEU 650 Ca 0.02 2.00 0.06 0.00 -1.03 0.00 0.00 54.13 55.18 1zy5 s LEU 650 Cb 0.10 -4.24 0.22 0.00 0.03 0.00 0.00 46.19 42.30 1zy5 s LEU 650 CO 0.76 -0.50 0.61 -3.20 0.23 0.00 0.00 176.35 174.25 1zy5 n ASN 651 N -0.18 -1.38 -4.46 2.29 4.05 -1.26 -4.73 115.26 109.59 1zy5 n ASN 651 Ca 0.05 -2.81 -0.33 0.00 0.45 0.00 0.00 54.58 51.94 1zy5 n ASN 651 Cb 0.50 0.41 -0.13 0.00 1.23 0.00 0.00 39.78 41.79 1zy5 n ASN 651 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 177.26 171.93 1zy5 s HIS 652 N -0.07 2.79 0.59 1.20 2.46 -1.26 -5.01 115.29 115.98 1zy5 s HIS 652 Ca 0.33 -0.28 0.29 0.00 0.47 0.00 0.00 55.06 55.86 1zy5 s HIS 652 Cb 0.13 -1.72 1.50 0.00 -0.13 0.00 0.00 32.58 32.36 1zy5 s HIS 652 CO -0.16 0.08 1.92 -0.56 -2.47 0.00 0.00 174.74 173.56 1zy5 h GLN 653 N 5.81 0.00 -0.32 2.88 3.07 -2.00 -1.18 115.11 123.38 1zy5 h GLN 653 Ca -0.40 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.27 1zy5 h GLN 653 Cb 1.18 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.69 1zy5 h GLN 653 CO 0.53 0.00 0.00 0.66 0.09 0.00 0.00 178.83 180.11 1zy5 n TYR 654 N -3.70 1.07 -4.27 0.06 0.53 -1.26 -4.79 117.16 104.80 1zy5 n TYR 654 Ca 0.07 -1.14 -0.20 0.00 -1.02 0.00 0.00 57.90 55.61 1zy5 n TYR 654 Cb 0.61 -0.40 -0.16 0.00 -1.03 0.00 0.00 39.34 38.37 1zy5 n TYR 654 CO 0.00 0.00 0.00 0.08 -1.02 0.00 0.00 176.86 175.92 1zy5 s VAL 655 N -2.98 0.64 0.19 -0.72 1.01 -0.45 -0.91 120.40 117.18 1zy5 s VAL 655 Ca 0.44 -0.24 -0.32 0.00 0.00 0.00 0.00 61.98 61.86 1zy5 s VAL 655 Cb 0.37 -0.61 -0.11 0.00 0.00 0.00 0.00 36.38 36.03 1zy5 s VAL 655 CO 0.06 0.23 1.61 -0.69 0.00 0.00 0.00 175.10 176.31 1zy5 s VAL 656 N 0.53 2.42 0.25 2.92 1.01 -0.02 -4.52 120.40 122.98 1zy5 s VAL 656 Ca -0.08 0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 1zy5 s VAL 656 Cb -0.11 -3.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.98 1zy5 s VAL 656 CO 0.01 0.03 1.09 -0.13 0.00 0.00 0.00 175.10 176.09 1zy5 s ARG 657 N 1.04 4.64 -0.46 2.72 0.52 -1.26 -4.88 118.95 121.28 1zy5 s ARG 657 Ca 0.71 1.76 -0.10 0.00 -0.52 0.00 0.00 55.73 57.59 1zy5 s ARG 657 Cb -0.46 -3.22 0.11 0.00 0.52 0.00 0.00 34.95 31.90 1zy5 s ARG 657 CO 0.32 0.20 0.33 0.71 0.02 0.00 0.00 175.30 176.88 1zy5 s TYR 658 N -0.93 3.38 -0.03 -0.53 1.51 -1.26 -0.89 117.35 118.59 1zy5 s TYR 658 Ca 0.45 -1.70 -0.23 0.00 -1.01 0.00 0.00 57.07 54.59 1zy5 s TYR 658 Cb -0.31 -3.33 -0.24 0.00 -0.11 0.00 0.00 41.96 37.97 1zy5 s TYR 658 CO 0.39 -0.94 1.04 1.88 -1.11 0.00 0.00 175.55 176.81 1zy5 h TYR 659 N 8.47 0.39 -2.90 2.71 -1.99 -1.13 -3.38 116.97 119.14 1zy5 h TYR 659 Ca -0.22 -0.21 -0.04 0.00 2.00 0.00 0.00 58.73 60.26 1zy5 h TYR 659 Cb 1.08 -0.04 -0.14 0.00 2.00 0.00 0.00 36.73 39.63 1zy5 h TYR 659 CO 0.63 1.03 0.14 0.00 -0.00 0.00 0.00 178.16 179.97 1zy5 s ALA 660 N -3.11 -1.49 -0.01 3.88 0.00 -1.16 -5.01 121.76 114.87 1zy5 s ALA 660 Ca -0.15 0.53 -0.05 0.00 0.00 0.00 0.00 51.96 52.29 1zy5 s ALA 660 Cb 0.02 0.68 -0.00 0.00 0.00 0.00 0.00 23.12 23.82 1zy5 s ALA 660 CO 0.77 -0.67 0.10 0.00 0.00 0.00 0.00 175.76 175.97 1zy5 s ALA 661 N -3.26 -0.23 0.16 0.00 0.00 -1.26 0.38 121.76 117.54 1zy5 s ALA 661 Ca -0.01 -0.11 -0.17 0.00 0.00 0.00 0.00 51.96 51.67 1zy5 s ALA 661 Cb -0.00 0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.19 1zy5 s ALA 661 CO -0.08 -0.16 0.46 1.67 0.00 0.00 0.00 175.76 177.65 1zy5 s TRP 662 N -1.05 -0.18 -0.21 0.00 -2.14 -0.52 -4.99 118.94 109.84 1zy5 s TRP 662 Ca -0.11 -0.13 -0.01 0.00 2.66 0.00 0.00 56.10 58.50 1zy5 s TRP 662 Cb -0.06 0.33 0.01 0.00 -3.10 0.00 0.00 33.47 30.65 1zy5 s TRP 662 CO 0.01 -0.80 -0.11 -1.17 -2.66 0.00 0.00 176.95 172.22 1zy5 s LEU 663 N -2.83 2.70 -0.17 -4.66 2.96 -1.26 -0.60 118.68 114.82 1zy5 s LEU 663 Ca 0.06 -0.64 -0.07 0.00 -0.22 0.00 0.00 54.13 53.26 1zy5 s LEU 663 Cb 0.01 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 1zy5 s LEU 663 CO -0.08 -0.04 0.05 -1.61 -1.32 0.00 0.00 176.35 173.35 1zy5 s GLU 664 N 1.36 3.82 0.29 1.98 2.02 0.46 -4.95 118.70 123.67 1zy5 s GLU 664 Ca 0.04 -0.35 0.06 0.00 0.02 0.00 0.00 54.97 54.74 1zy5 s GLU 664 Cb -0.15 -3.15 -0.02 0.00 0.10 0.00 0.00 34.13 30.92 1zy5 s GLU 664 CO -0.07 0.35 0.39 1.03 0.02 0.00 0.00 175.26 176.99 1zy5 s ARG 768 N 0.13 3.20 -0.56 1.61 0.52 -1.26 -1.60 118.95 121.00 1zy5 s ARG 768 Ca 0.04 -0.94 0.04 0.00 -0.52 0.00 0.00 55.73 54.36 1zy5 s ARG 768 Cb -0.12 -2.80 0.16 0.00 0.52 0.00 0.00 34.95 32.71 1zy5 s ARG 768 CO 0.01 0.23 0.39 1.03 0.02 0.00 0.00 175.30 176.99 1zy5 s ARG 769 N -4.06 1.72 0.29 3.54 1.81 -1.26 -4.98 118.95 116.00 1zy5 s ARG 769 Ca 0.39 -2.68 0.14 0.00 -1.72 0.00 0.00 55.73 51.86 1zy5 s ARG 769 Cb -0.09 -2.54 0.77 0.00 -0.45 0.00 0.00 34.95 32.65 1zy5 s ARG 769 CO 0.29 -1.30 1.36 0.27 -0.68 0.00 0.00 175.30 175.25 1zy5 n ASN 770 N 2.55 0.37 -1.17 0.23 6.94 -1.26 -2.04 115.26 120.88 1zy5 n ASN 770 Ca 0.21 0.60 0.09 0.00 -0.02 0.00 0.00 54.58 55.46 1zy5 n ASN 770 Cb 0.39 -0.59 0.28 0.00 -2.36 0.00 0.00 39.78 37.50 1zy5 n ASN 770 CO 0.00 0.00 0.00 2.22 -1.03 0.00 0.00 177.26 178.45 1zy5 n PHE 771 N -2.04 1.02 0.00 -2.53 1.16 -1.26 -5.29 117.46 108.52 1zy5 n PHE 771 Ca -0.01 -0.60 0.00 0.00 -1.87 0.00 0.00 57.45 54.98 1zy5 n PHE 771 Cb 0.21 -0.15 0.00 0.00 -1.61 0.00 0.00 39.48 37.93 1zy5 n PHE 771 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1zy5 n VAL 772 N 0.82 0.00 -3.81 1.97 0.31 -0.87 -5.32 118.33 111.44 1zy5 n VAL 772 Ca 0.21 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.35 1zy5 n VAL 772 Cb 0.71 0.00 -0.17 0.00 -0.91 0.00 0.00 33.84 33.47 1zy5 n VAL 772 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1zy5 s LYS 780 N 1.92 0.25 -0.03 5.55 -0.14 -1.26 -5.04 119.74 120.99 1zy5 s LYS 780 Ca 0.00 0.18 0.04 0.00 -1.36 0.00 0.00 55.97 54.83 1zy5 s LYS 780 Cb 0.00 -0.60 -0.00 0.00 -1.68 0.00 0.00 37.83 35.55 1zy5 s LYS 780 CO 0.00 -0.24 -0.13 0.15 -0.76 0.00 0.00 175.35 174.37 1zy5 s LYS 781 N 1.60 1.26 0.50 1.68 1.02 -1.26 -4.27 119.74 120.26 1zy5 s LYS 781 Ca -0.02 -0.46 0.05 0.00 0.02 0.00 0.00 55.97 55.56 1zy5 s LYS 781 Cb -0.13 -1.15 0.00 0.00 -0.52 0.00 0.00 37.83 36.03 1zy5 s LYS 781 CO -0.03 0.21 0.24 -1.12 -0.92 0.00 0.00 175.35 173.73 1zy5 s SER 782 N -0.02 4.45 -0.10 2.83 0.01 -0.11 -4.71 113.70 116.04 1zy5 s SER 782 Ca -0.00 -1.31 0.02 0.00 1.31 0.00 0.00 55.95 55.97 1zy5 s SER 782 Cb -0.08 0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.37 1zy5 s SER 782 CO 0.01 -0.89 -0.16 -0.89 0.41 0.00 0.00 173.24 171.72 1zy5 s THR 783 N -2.75 1.53 -0.26 1.44 2.01 -0.63 -2.14 115.64 114.84 1zy5 s THR 783 Ca 0.28 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.49 1zy5 s THR 783 Cb 0.00 -1.39 -0.05 0.00 0.01 0.00 0.00 72.50 71.08 1zy5 s THR 783 CO 0.17 0.45 0.25 -0.22 -0.69 0.00 0.00 174.62 174.57 1zy5 s LEU 784 N 0.87 4.06 -0.06 4.42 2.96 -0.56 -0.40 118.68 129.96 1zy5 s LEU 784 Ca -0.09 0.14 -0.03 0.00 -0.22 0.00 0.00 54.13 53.93 1zy5 s LEU 784 Cb -0.15 -2.23 -0.04 0.00 0.50 0.00 0.00 46.19 44.27 1zy5 s LEU 784 CO 0.00 -0.06 0.08 -0.36 -1.32 0.00 0.00 176.35 174.69 1zy5 s PHE 785 N 1.64 3.36 -0.14 5.38 0.40 0.23 -1.19 117.98 127.66 1zy5 s PHE 785 Ca 0.10 0.31 -0.02 0.00 -0.60 0.00 0.00 56.93 56.72 1zy5 s PHE 785 Cb -0.15 -1.82 0.05 0.00 0.51 0.00 0.00 43.02 41.60 1zy5 s PHE 785 CO 0.09 0.59 0.02 0.42 0.70 0.00 0.00 175.22 177.04 1zy5 s ILE 786 N -1.06 0.49 -0.35 0.64 1.01 -0.29 -1.44 121.20 120.20 1zy5 s ILE 786 Ca 0.18 -0.29 -0.21 0.00 0.00 0.00 0.00 60.65 60.33 1zy5 s ILE 786 Cb -0.12 -0.84 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1zy5 s ILE 786 CO 0.08 -0.00 0.68 -1.58 0.00 0.00 0.00 174.94 174.11 1zy5 s GLN 787 N 1.90 3.74 0.20 2.79 0.74 0.16 -1.45 119.66 127.73 1zy5 s GLN 787 Ca 0.02 0.17 0.10 0.00 0.05 0.00 0.00 55.36 55.70 1zy5 s GLN 787 Cb -0.15 -3.79 -0.04 0.00 1.10 0.00 0.00 33.01 30.12 1zy5 s GLN 787 CO -0.07 -0.74 -0.12 -1.64 -0.55 0.00 0.00 175.29 172.18 1zy5 s MET 788 N 2.79 1.97 0.28 1.67 -1.94 0.42 -0.51 119.30 123.99 1zy5 s MET 788 Ca 0.26 -1.38 -0.30 0.00 -1.71 0.00 0.00 55.69 52.57 1zy5 s MET 788 Cb -0.14 -2.07 -0.11 0.00 2.01 0.00 0.00 34.83 34.51 1zy5 s MET 788 CO 0.15 0.41 1.60 -2.00 -0.01 0.00 0.00 175.02 175.17 1zy5 s GLU 789 N -2.98 4.13 -0.14 2.03 2.12 -0.07 -1.56 118.70 122.22 1zy5 s GLU 789 Ca 0.26 2.57 -0.21 0.00 0.36 0.00 0.00 54.97 57.95 1zy5 s GLU 789 Cb -0.08 -3.03 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 1zy5 s GLU 789 CO 0.15 -0.64 0.61 -0.47 -0.54 0.00 0.00 175.26 174.37 1zy5 s TYR 790 N 0.14 3.47 -0.67 5.30 5.04 -1.26 -4.52 117.35 124.86 1zy5 s TYR 790 Ca 0.64 1.01 -0.00 0.00 -2.44 0.00 0.00 57.07 56.28 1zy5 s TYR 790 Cb -0.48 -2.73 0.17 0.00 0.35 0.00 0.00 41.96 39.27 1zy5 s TYR 790 CO 0.46 -0.00 0.48 0.00 -1.34 0.00 0.00 175.55 175.14 1zy5 h GLU 792 N 6.53 0.00 -7.31 0.00 4.11 -1.96 -3.44 114.58 112.51 1zy5 h GLU 792 Ca 0.03 0.00 -0.41 0.00 0.07 0.00 0.00 59.36 59.05 1zy5 h GLU 792 Cb 0.89 0.00 0.20 0.00 0.50 0.00 0.00 28.75 30.34 1zy5 h GLU 792 CO 0.73 0.00 0.08 -0.80 0.07 0.00 0.00 179.01 179.09 1zy5 s ASN 793 N -5.23 0.55 0.29 3.06 0.02 -1.26 -5.04 114.94 107.33 1zy5 s ASN 793 Ca 0.05 0.72 0.00 0.00 -1.02 0.00 0.00 52.86 52.61 1zy5 s ASN 793 Cb 0.09 -1.01 0.00 0.00 0.02 0.00 0.00 41.25 40.35 1zy5 s ASN 793 CO 0.55 -4.36 0.00 0.61 0.02 0.00 0.00 177.10 173.92 1zy5 n GLY 794 N -0.43 -0.65 2.13 0.66 0.00 -1.26 -4.86 105.19 100.78 1zy5 n GLY 794 Ca 0.12 -1.68 -0.18 0.00 0.00 0.00 0.00 46.02 44.29 1zy5 n GLY 794 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1zy5 n THR 795 N -0.60 0.00 0.23 2.61 -2.24 -1.26 -2.15 114.28 110.88 1zy5 n THR 795 Ca 0.00 -1.44 0.07 0.00 -2.27 0.00 0.00 64.05 60.41 1zy5 n THR 795 Cb 0.00 0.37 0.56 0.00 -2.10 0.00 0.00 70.33 69.17 1zy5 n THR 795 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1zy5 h LEU 796 N 0.00 0.00 -0.08 3.22 5.85 -0.60 -1.12 115.31 122.58 1zy5 h LEU 796 Ca -0.23 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 1zy5 h LEU 796 Cb 0.76 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 1zy5 h LEU 796 CO 0.38 0.17 0.04 0.22 -0.34 0.00 0.00 178.44 178.91 1zy5 h TYR 797 N 0.00 0.12 -0.29 1.25 5.03 -1.74 0.14 116.97 121.48 1zy5 h TYR 797 Ca -0.00 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 1zy5 h TYR 797 Cb 0.32 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.55 1zy5 h TYR 797 CO 0.00 0.16 0.15 -0.44 -1.32 0.00 0.00 178.16 176.71 1zy5 h ASP 798 N 0.04 0.36 -0.36 -2.11 3.32 -1.65 -1.81 116.42 114.21 1zy5 h ASP 798 Ca 0.03 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.02 1zy5 h ASP 798 Cb 0.09 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.50 1zy5 h ASP 798 CO -0.00 0.36 0.12 0.25 -1.72 0.00 0.00 179.24 178.25 1zy5 h LEU 799 N 0.34 0.11 -0.14 1.55 5.85 -0.95 0.74 115.31 122.81 1zy5 h LEU 799 Ca 0.10 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.88 1zy5 h LEU 799 Cb 0.09 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1zy5 h LEU 799 CO -0.01 0.10 0.04 0.40 -0.34 0.00 0.00 178.44 178.62 1zy5 h ILE 800 N 0.26 0.95 -0.21 4.05 2.04 -0.52 -2.37 117.51 121.72 1zy5 h ILE 800 Ca 0.17 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1zy5 h ILE 800 Cb 0.15 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1zy5 h ILE 800 CO -0.18 0.02 0.00 1.41 0.00 0.00 0.00 178.15 179.40 1zy5 n HIS 801 N -5.07 0.27 0.07 1.37 8.25 -0.70 -3.68 115.22 115.73 1zy5 n HIS 801 Ca -0.04 -0.14 0.01 0.00 -0.26 0.00 0.00 57.72 57.29 1zy5 n HIS 801 Cb 0.06 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.18 1zy5 n HIS 801 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1zy5 n SER 802 N 0.25 0.83 -3.71 0.41 3.41 0.23 -5.04 113.62 109.99 1zy5 n SER 802 Ca 0.13 -0.91 -0.12 0.00 -0.26 0.00 0.00 58.87 57.72 1zy5 n SER 802 Cb 0.28 0.29 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 1zy5 n SER 802 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1zy5 s GLU 803 N -0.42 1.65 -1.04 4.33 2.02 -0.91 -5.03 118.70 119.31 1zy5 s GLU 803 Ca 0.01 -1.50 -0.02 0.00 0.02 0.00 0.00 54.97 53.48 1zy5 s GLU 803 Cb 0.01 0.44 0.31 0.00 0.10 0.00 0.00 34.13 34.99 1zy5 s GLU 803 CO 0.03 -0.67 1.56 0.09 0.02 0.00 0.00 175.26 176.29 1zy5 n ASN 804 N -0.78 6.60 0.02 -0.19 3.02 -1.26 -4.76 115.26 117.91 1zy5 n ASN 804 Ca -0.00 -3.51 -0.11 0.00 -0.03 0.00 0.00 54.58 50.92 1zy5 n ASN 804 Cb 0.62 -1.20 -0.06 0.00 -0.61 0.00 0.00 39.78 38.53 1zy5 n ASN 804 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1zy5 h LEU 805 N 4.94 0.07 -1.52 3.41 5.85 -1.83 -0.77 115.31 125.46 1zy5 h LEU 805 Ca 0.31 -0.00 0.40 0.00 0.84 0.00 0.00 57.88 59.42 1zy5 h LEU 805 Cb 0.52 -0.02 -0.11 0.00 0.37 0.00 0.00 40.66 41.42 1zy5 h LEU 805 CO 1.26 0.05 0.86 -0.55 -0.34 0.00 0.00 178.44 179.72 1zy5 h ASN 806 N 0.08 0.24 -0.03 1.25 7.08 -1.60 -3.33 115.58 119.27 1zy5 h ASN 806 Ca 0.02 0.10 -0.41 0.00 -3.08 0.00 0.00 56.30 52.92 1zy5 h ASN 806 Cb -0.01 0.07 0.10 0.00 -2.08 0.00 0.00 38.32 36.40 1zy5 h ASN 806 CO -0.00 -0.08 1.00 0.00 -2.08 0.00 0.00 177.43 176.27 1zy5 n GLN 807 N -4.55 0.13 -3.77 4.14 6.02 -0.30 -4.45 117.38 114.61 1zy5 n GLN 807 Ca 0.34 -1.28 -0.28 0.00 -0.01 0.00 0.00 57.00 55.77 1zy5 n GLN 807 Cb 1.33 -2.98 0.05 0.00 1.02 0.00 0.00 30.24 29.66 1zy5 n GLN 807 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1zy5 n GLN 808 N 8.00 -6.50 -4.02 -1.09 6.02 -1.25 -5.00 117.38 113.55 1zy5 n GLN 808 Ca 0.45 0.69 -0.27 0.00 -0.01 0.00 0.00 57.00 57.86 1zy5 n GLN 808 Cb 0.44 -5.65 -0.05 0.00 1.02 0.00 0.00 30.24 25.99 1zy5 n GLN 808 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1zy5 s ARG 809 N -6.49 3.12 0.10 -1.09 3.00 -1.25 -4.82 118.95 111.52 1zy5 s ARG 809 Ca 0.63 -0.71 0.27 0.00 0.00 0.00 0.00 55.73 55.92 1zy5 s ARG 809 Cb -0.30 -2.80 0.98 0.00 0.00 0.00 0.00 34.95 32.83 1zy5 s ARG 809 CO 0.78 0.52 1.82 -0.25 0.00 0.00 0.00 175.30 178.17 1zy5 n ASP 810 N -0.22 0.41 -0.03 0.23 8.00 -1.26 -2.95 116.55 120.73 1zy5 n ASP 810 Ca -0.08 0.49 -0.13 0.00 0.71 0.00 0.00 54.79 55.78 1zy5 n ASP 810 Cb 0.54 -0.58 -0.11 0.00 -0.02 0.00 0.00 41.12 40.95 1zy5 n ASP 810 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1zy5 h GLU 811 N 0.00 -0.01 0.00 -1.24 4.39 -1.95 0.17 114.58 115.94 1zy5 h GLU 811 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1zy5 h GLU 811 Cb 0.62 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1zy5 h GLU 811 CO 0.00 0.65 -0.01 0.10 -1.16 0.00 0.00 179.01 178.59 1zy5 h TYR 812 N -0.68 0.00 0.16 4.33 -0.00 -1.83 0.39 116.97 119.35 1zy5 h TYR 812 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 58.73 58.42 1zy5 h TYR 812 Cb 0.66 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.40 1zy5 h TYR 812 CO 0.16 0.01 -1.42 -1.49 -0.00 0.00 0.00 178.16 175.42 1zy5 h TRP 813 N 0.00 0.62 -0.21 0.10 -0.00 -1.56 -1.98 115.95 112.91 1zy5 h TRP 813 Ca -0.00 -0.45 -0.01 0.00 -0.00 0.00 0.00 58.89 58.42 1zy5 h TRP 813 Cb 0.64 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 29.76 1zy5 h TRP 813 CO 0.00 1.41 0.09 -0.09 -0.00 0.00 0.00 178.44 179.85 1zy5 h ARG 814 N 0.09 0.32 -0.48 0.49 2.43 -0.19 0.75 114.38 117.80 1zy5 h ARG 814 Ca -0.21 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 58.80 1zy5 h ARG 814 Cb 2.04 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 31.53 1zy5 h ARG 814 CO 0.21 0.36 -0.10 -0.07 -1.51 0.00 0.00 179.97 178.87 1zy5 h LEU 815 N 0.20 0.92 -1.37 3.80 3.38 -1.02 -2.12 115.31 119.10 1zy5 h LEU 815 Ca 0.07 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 1zy5 h LEU 815 Cb 0.16 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1zy5 h LEU 815 CO -0.01 1.06 0.09 0.15 0.09 0.00 0.00 178.44 179.81 1zy5 h PHE 816 N 0.76 0.51 0.01 1.13 3.57 -1.17 -2.06 116.94 119.70 1zy5 h PHE 816 Ca 0.12 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 1zy5 h PHE 816 Cb 0.64 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.23 1zy5 h PHE 816 CO 0.05 0.45 -0.01 -0.09 -2.23 0.00 0.00 178.31 176.48 1zy5 h ARG 817 N 0.50 -0.02 -0.76 1.11 2.43 -0.55 -2.56 114.38 114.53 1zy5 h ARG 817 Ca 0.12 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.39 1zy5 h ARG 817 Cb 0.19 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.67 1zy5 h ARG 817 CO -0.00 0.42 0.41 1.96 -1.51 0.00 0.00 179.97 181.24 1zy5 h GLN 818 N -0.46 0.66 -0.89 0.20 4.20 -1.16 -0.82 115.11 116.85 1zy5 h GLN 818 Ca -0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1zy5 h GLN 818 Cb 0.44 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 1zy5 h GLN 818 CO 0.00 0.44 0.51 0.82 -0.67 0.00 0.00 178.83 179.92 1zy5 h ILE 819 N 0.68 1.25 -0.38 2.54 2.04 -1.34 -0.55 117.51 121.74 1zy5 h ILE 819 Ca 0.38 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1zy5 h ILE 819 Cb 0.38 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 1zy5 h ILE 819 CO -0.27 0.28 0.18 -0.07 0.00 0.00 0.00 178.15 178.27 1zy5 h LEU 820 N 1.23 0.51 -0.59 1.44 3.38 -0.79 0.70 115.31 121.19 1zy5 h LEU 820 Ca 0.31 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1zy5 h LEU 820 Cb -0.00 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1zy5 h LEU 820 CO -0.05 0.50 0.26 -0.33 0.09 0.00 0.00 178.44 178.91 1zy5 h GLU 821 N 0.48 0.87 -0.15 1.13 4.39 -0.87 0.52 114.58 120.95 1zy5 h GLU 821 Ca 0.13 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.70 1zy5 h GLU 821 Cb 0.14 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1zy5 h GLU 821 CO -0.01 0.72 0.08 0.00 -1.16 0.00 0.00 179.01 178.63 1zy5 h ALA 822 N 1.10 0.18 -0.38 3.43 0.00 -0.84 -0.34 119.26 122.42 1zy5 h ALA 822 Ca 0.20 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1zy5 h ALA 822 Cb 0.16 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1zy5 h ALA 822 CO -0.02 -0.35 0.04 -0.07 0.00 0.00 0.00 179.25 178.84 1zy5 h LEU 823 N 0.17 0.54 -0.44 0.00 3.38 -0.33 -1.39 115.31 117.23 1zy5 h LEU 823 Ca 0.06 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1zy5 h LEU 823 Cb 0.01 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1zy5 h LEU 823 CO -0.04 0.58 0.15 -1.28 0.09 0.00 0.00 178.44 177.94 1zy5 h SER 824 N 0.56 0.64 -0.12 -0.43 0.87 0.81 -0.47 113.55 115.40 1zy5 h SER 824 Ca 0.12 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1zy5 h SER 824 Cb 0.30 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 1zy5 h SER 824 CO 0.01 0.66 0.04 0.22 -0.53 0.00 0.00 176.83 177.22 1zy5 h TYR 825 N 0.58 0.20 -0.01 2.24 3.20 -0.74 -2.49 116.97 119.94 1zy5 h TYR 825 Ca 0.15 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.01 1zy5 h TYR 825 Cb 0.24 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1zy5 h TYR 825 CO 0.01 0.33 -0.05 0.82 -1.64 0.00 0.00 178.16 177.63 1zy5 h ILE 826 N 0.01 0.85 -0.46 1.81 2.04 -1.12 -2.96 117.51 117.68 1zy5 h ILE 826 Ca 0.04 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 1zy5 h ILE 826 Cb 0.23 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1zy5 h ILE 826 CO -0.00 0.00 0.14 0.45 0.00 0.00 0.00 178.15 178.74 1zy5 h HIS 827 N -0.09 0.69 0.00 1.37 3.86 -1.10 -1.84 115.15 118.03 1zy5 h HIS 827 Ca 0.03 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1zy5 h HIS 827 Cb 0.13 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1zy5 h HIS 827 CO -0.13 0.57 0.00 0.66 0.86 0.00 0.00 177.93 179.89 1zy5 h SER 828 N 0.67 0.00 -0.23 2.45 4.64 -1.28 -0.24 113.55 119.56 1zy5 h SER 828 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1zy5 h SER 828 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1zy5 h SER 828 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 1zy5 n GLN 829 N -2.86 2.15 -2.24 4.77 1.13 -0.72 -4.96 117.38 114.66 1zy5 n GLN 829 Ca -0.00 -1.73 -0.05 0.00 -1.94 0.00 0.00 57.00 53.28 1zy5 n GLN 829 Cb 0.20 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 29.09 1zy5 n GLN 829 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1zy5 n GLY 830 N 1.33 0.28 3.37 1.08 0.00 -0.10 -5.05 105.19 106.10 1zy5 n GLY 830 Ca 0.17 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1zy5 n GLY 830 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zy5 s ILE 831 N -2.43 2.20 -0.04 -0.61 1.01 -1.07 -5.03 121.20 115.23 1zy5 s ILE 831 Ca 0.03 -1.67 0.04 0.00 0.00 0.00 0.00 60.65 59.05 1zy5 s ILE 831 Cb -0.01 -1.94 -0.00 0.00 0.01 0.00 0.00 42.46 40.51 1zy5 s ILE 831 CO 0.04 0.14 -0.16 -0.63 0.00 0.00 0.00 174.94 174.32 1zy5 s ILE 832 N -1.01 1.36 -0.02 2.92 1.01 -1.26 -3.81 121.20 120.39 1zy5 s ILE 832 Ca 0.13 -0.68 -0.25 0.00 0.00 0.00 0.00 60.65 59.86 1zy5 s ILE 832 Cb -0.10 -1.17 -0.19 0.00 0.01 0.00 0.00 42.46 41.01 1zy5 s ILE 832 CO 0.05 0.39 1.22 -0.74 0.00 0.00 0.00 174.94 175.87 1zy5 h HIS 833 N 6.28 -0.11 0.00 3.97 -0.00 -1.94 -3.44 115.15 119.92 1zy5 h HIS 833 Ca -0.33 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.04 1zy5 h HIS 833 Cb 1.17 0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.62 1zy5 h HIS 833 CO 0.44 0.32 0.00 0.54 -0.00 0.00 0.00 177.93 179.23 1zy5 n ARG 834 N -4.93 0.00 -2.74 5.26 1.74 -1.26 -0.16 116.66 114.56 1zy5 n ARG 834 Ca -0.09 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.96 1zy5 n ARG 834 Cb 0.25 -2.88 0.08 0.00 -1.02 0.00 0.00 32.46 28.89 1zy5 n ARG 834 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1zy5 n ASP 835 N 0.00 0.22 -4.67 0.55 4.64 -1.26 -4.83 116.55 111.20 1zy5 n ASP 835 Ca 0.00 -2.26 -0.43 0.00 -1.38 0.00 0.00 54.79 50.73 1zy5 n ASP 835 Cb 0.00 0.04 -0.02 0.00 -1.04 0.00 0.00 41.12 40.10 1zy5 n ASP 835 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 1zy5 s LEU 836 N -3.70 4.25 0.18 -2.67 2.96 -1.26 -4.84 118.68 113.60 1zy5 s LEU 836 Ca 0.21 1.83 -0.21 0.00 -0.22 0.00 0.00 54.13 55.74 1zy5 s LEU 836 Cb 0.39 -3.55 0.05 0.00 0.50 0.00 0.00 46.19 43.59 1zy5 s LEU 836 CO -0.06 -0.70 0.59 -1.59 -1.32 0.00 0.00 176.35 173.27 1zy5 s LYS 837 N 2.88 1.35 0.44 1.98 -2.85 -1.26 -4.83 119.74 117.45 1zy5 s LYS 837 Ca 0.57 -0.63 0.22 0.00 -1.00 0.00 0.00 55.97 55.13 1zy5 s LYS 837 Cb -0.25 0.57 1.20 0.00 -2.06 0.00 0.00 37.83 37.30 1zy5 s LYS 837 CO 0.20 -0.59 1.80 -1.35 0.10 0.00 0.00 175.35 175.51 1zy5 h PRO 838 N 2.07 0.29 0.00 1.78 0.11 -1.94 0.16 132.00 134.47 1zy5 h PRO 838 Ca -0.31 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1zy5 h PRO 838 Cb 1.29 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1zy5 h PRO 838 CO 0.36 0.19 0.00 -1.33 -0.21 0.00 0.00 178.00 177.02 1zy5 n MET 839 N -4.50 0.22 0.00 1.05 2.81 -1.26 -2.45 117.12 112.98 1zy5 n MET 839 Ca 0.24 0.26 0.11 0.00 -1.81 0.00 0.00 57.70 56.50 1zy5 n MET 839 Cb 0.91 -1.80 0.05 0.00 -0.71 0.00 0.00 33.22 31.67 1zy5 n MET 839 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1zy5 n ASN 840 N -2.19 2.43 -4.15 7.83 5.03 0.53 -4.72 115.26 120.02 1zy5 n ASN 840 Ca 0.05 -1.71 -0.39 0.00 0.87 0.00 0.00 54.58 53.39 1zy5 n ASN 840 Cb 0.36 0.27 -0.08 0.00 -1.02 0.00 0.00 39.78 39.32 1zy5 n ASN 840 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1zy5 s ILE 841 N -2.28 4.17 0.82 2.41 1.01 -1.04 -0.85 121.20 125.44 1zy5 s ILE 841 Ca 0.23 -2.79 -0.11 0.00 0.00 0.00 0.00 60.65 57.98 1zy5 s ILE 841 Cb 0.19 -3.68 0.08 0.00 0.01 0.00 0.00 42.46 39.06 1zy5 s ILE 841 CO 0.46 -0.91 1.09 -0.36 0.00 0.00 0.00 174.94 175.22 1zy5 s PHE 842 N 0.06 2.49 -0.10 3.97 0.40 -0.54 -0.63 117.98 123.64 1zy5 s PHE 842 Ca 0.17 1.44 -0.01 0.00 -0.60 0.00 0.00 56.93 57.93 1zy5 s PHE 842 Cb -0.18 -3.09 0.03 0.00 0.51 0.00 0.00 43.02 40.28 1zy5 s PHE 842 CO -0.05 -2.01 -0.05 0.42 0.70 0.00 0.00 175.22 174.23 1zy5 s ILE 843 N -2.92 0.81 0.92 0.64 -1.09 -0.91 -1.06 121.20 117.59 1zy5 s ILE 843 Ca 0.62 -0.16 -0.14 0.00 -2.23 0.00 0.00 60.65 58.74 1zy5 s ILE 843 Cb -0.17 -0.86 0.16 0.00 -1.58 0.00 0.00 42.46 40.00 1zy5 s ILE 843 CO 0.56 0.33 1.23 1.51 -1.23 0.00 0.00 174.94 177.34 1zy5 s ASP 844 N 1.72 3.45 0.61 3.58 1.47 0.13 -4.37 116.67 123.25 1zy5 s ASP 844 Ca 0.04 0.59 0.34 0.00 1.18 0.00 0.00 52.55 54.70 1zy5 s ASP 844 Cb -0.13 -0.89 2.01 0.00 -0.34 0.00 0.00 42.92 43.58 1zy5 s ASP 844 CO -0.06 -2.55 2.29 1.05 0.68 0.00 0.00 175.17 176.57 1zy5 h GLU 845 N -1.51 0.00 -0.12 2.11 4.11 -1.99 0.32 114.58 117.49 1zy5 h GLU 845 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1zy5 h GLU 845 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1zy5 h GLU 845 CO 0.51 0.00 0.00 0.43 0.07 0.00 0.00 179.01 180.02 1zy5 n SER 846 N -3.60 1.01 -2.53 3.06 7.64 -1.26 -4.89 113.62 113.05 1zy5 n SER 846 Ca -0.03 -1.68 -0.16 0.00 1.01 0.00 0.00 58.87 58.01 1zy5 n SER 846 Cb 0.08 -0.08 0.05 0.00 -1.01 0.00 0.00 64.21 63.25 1zy5 n SER 846 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1zy5 n ARG 847 N -0.08 -5.16 -4.43 1.43 1.74 0.11 -5.04 116.66 105.24 1zy5 n ARG 847 Ca 0.13 0.56 -0.32 0.00 -0.77 0.00 0.00 57.85 57.46 1zy5 n ARG 847 Cb 0.21 -4.78 -0.10 0.00 -1.02 0.00 0.00 32.46 26.77 1zy5 n ARG 847 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1zy5 s ASN 848 N -3.17 4.64 0.55 0.55 0.01 -1.25 -4.85 114.94 111.41 1zy5 s ASN 848 Ca 0.38 -0.15 -0.14 0.00 -0.71 0.00 0.00 52.86 52.23 1zy5 s ASN 848 Cb -0.17 -1.08 -0.06 0.00 0.41 0.00 0.00 41.25 40.35 1zy5 s ASN 848 CO 0.47 0.27 0.99 0.68 -1.51 0.00 0.00 177.10 178.00 1zy5 s VAL 849 N -1.02 4.60 -0.28 1.60 -7.23 -1.26 -0.69 120.40 116.11 1zy5 s VAL 849 Ca 0.18 1.08 -0.02 0.00 -1.81 0.00 0.00 61.98 61.40 1zy5 s VAL 849 Cb -0.11 -3.77 0.12 0.00 0.56 0.00 0.00 36.38 33.17 1zy5 s VAL 849 CO 0.08 -0.84 0.23 -0.54 -0.31 0.00 0.00 175.10 173.71 1zy5 s LYS 850 N -4.45 0.26 0.10 4.82 1.02 -0.22 -4.25 119.74 117.02 1zy5 s LYS 850 Ca 0.57 -0.27 -0.31 0.00 0.02 0.00 0.00 55.97 55.98 1zy5 s LYS 850 Cb -0.10 -0.89 -0.08 0.00 -0.52 0.00 0.00 37.83 36.24 1zy5 s LYS 850 CO 0.39 -1.00 1.47 0.42 -0.92 0.00 0.00 175.35 175.71 1zy5 s ILE 851 N 2.26 3.19 0.00 2.17 1.01 -0.09 -1.46 121.20 128.27 1zy5 s ILE 851 Ca 0.09 0.78 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1zy5 s ILE 851 Cb -0.15 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1zy5 s ILE 851 CO -0.33 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.26 1zy5 n GLY 852 N 3.66 4.37 4.02 6.18 0.00 -0.03 -0.84 105.19 122.55 1zy5 n GLY 852 Ca 0.13 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 1zy5 n GLY 852 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zy5 n ASP 853 N -2.05 -1.99 -4.48 1.61 -0.08 -1.26 -4.83 116.55 103.47 1zy5 n ASP 853 Ca 0.00 -1.07 -0.38 0.00 -1.51 0.00 0.00 54.79 51.83 1zy5 n ASP 853 Cb 0.00 -1.29 0.04 0.00 2.34 0.00 0.00 41.12 42.20 1zy5 n ASP 853 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1zy5 n PHE 854 N -4.22 -0.49 -3.08 -0.67 3.01 -1.26 -4.89 117.46 105.85 1zy5 n PHE 854 Ca -0.15 0.45 -0.41 0.00 1.01 0.00 0.00 57.45 58.36 1zy5 n PHE 854 Cb 0.50 -1.98 -0.06 0.00 -0.01 0.00 0.00 39.48 37.93 1zy5 n PHE 854 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1zy5 s GLY 855 N -1.16 1.86 0.00 1.37 0.00 0.77 -4.98 107.32 105.18 1zy5 s GLY 855 Ca 0.69 -0.36 0.07 0.00 0.00 0.00 0.00 44.72 45.12 1zy5 s GLY 855 CO 0.54 1.46 0.81 1.04 0.00 0.00 0.00 173.10 176.96 1zy5 n LEU 856 N 5.60 1.78 0.00 0.66 4.77 -1.26 -4.69 117.00 123.86 1zy5 n LEU 856 Ca 0.00 -1.24 0.00 0.00 -0.03 0.00 0.00 56.01 54.74 1zy5 n LEU 856 Cb 0.49 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1zy5 n LEU 856 CO 0.44 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1zy5 n GLY 886 N 0.31 0.00 0.12 -0.72 0.00 -1.26 -5.03 105.19 98.60 1zy5 n GLY 886 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1zy5 n GLY 886 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zy5 h THR 887 N 0.00 1.36 -0.97 2.61 1.03 -2.02 -3.36 112.91 111.56 1zy5 h THR 887 Ca 0.00 -1.29 0.40 0.00 -0.01 0.00 0.00 66.41 65.51 1zy5 h THR 887 Cb 0.00 1.97 -0.17 0.00 -1.07 0.00 0.00 68.15 68.88 1zy5 h THR 887 CO 0.00 0.37 0.53 0.00 -0.01 0.00 0.00 175.52 176.41 1zy5 n ALA 888 N -2.41 0.99 0.28 0.00 0.00 -1.26 -1.47 120.51 116.64 1zy5 n ALA 888 Ca -0.07 0.96 0.13 0.00 0.00 0.00 0.00 53.44 54.46 1zy5 n ALA 888 Cb 0.34 -0.97 0.79 0.00 0.00 0.00 0.00 19.45 19.61 1zy5 n ALA 888 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1zy5 h MET 889 N 0.00 0.00 -0.02 0.00 1.85 -2.03 -2.87 114.93 111.86 1zy5 h MET 889 Ca 0.81 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.90 1zy5 h MET 889 Cb 2.16 0.00 0.00 0.00 0.43 0.00 0.00 31.60 34.19 1zy5 h MET 889 CO -0.72 0.05 -0.02 0.66 -0.40 0.00 0.00 176.91 176.48 1zy5 n TYR 890 N -3.93 0.00 -2.48 1.39 4.02 -0.54 -4.99 117.16 110.63 1zy5 n TYR 890 Ca -0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.46 1zy5 n TYR 890 Cb 0.14 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.42 1zy5 n TYR 890 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1zy5 s VAL 891 N -1.65 3.71 0.62 -0.72 1.01 -1.09 -3.92 120.40 118.35 1zy5 s VAL 891 Ca 0.22 1.54 -0.19 0.00 0.00 0.00 0.00 61.98 63.55 1zy5 s VAL 891 Cb 0.16 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1zy5 s VAL 891 CO 0.26 0.29 1.26 0.00 0.00 0.00 0.00 175.10 176.91 1zy5 s ALA 892 N -0.50 2.48 -0.51 5.51 0.00 -1.26 -4.89 121.76 122.60 1zy5 s ALA 892 Ca 0.48 1.12 0.17 0.00 0.00 0.00 0.00 51.96 53.74 1zy5 s ALA 892 Cb -0.31 -3.50 0.85 0.00 0.00 0.00 0.00 23.12 20.16 1zy5 s ALA 892 CO 0.37 -1.37 1.53 0.25 0.00 0.00 0.00 175.76 176.54 1zy5 n THR 893 N -1.70 1.15 1.01 0.00 -2.24 -1.26 -2.71 114.28 108.53 1zy5 n THR 893 Ca 0.15 0.50 0.12 0.00 -2.27 0.00 0.00 64.05 62.55 1zy5 n THR 893 Cb 0.49 -1.46 0.12 0.00 -2.10 0.00 0.00 70.33 67.37 1zy5 n THR 893 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1zy5 n GLU 894 N -2.04 2.31 0.02 -0.78 0.00 -1.26 -4.49 120.64 114.40 1zy5 n GLU 894 Ca 0.00 -1.90 -0.17 0.00 0.00 0.00 0.00 57.16 55.10 1zy5 n GLU 894 Cb 0.10 -1.46 -0.14 0.00 0.00 0.00 0.00 31.44 29.93 1zy5 n GLU 894 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1zy5 h VAL 895 N 4.62 0.84 -0.08 3.84 2.07 -1.89 -3.46 116.25 122.20 1zy5 h VAL 895 Ca 0.00 -2.57 -0.05 0.00 0.82 0.00 0.00 66.70 64.90 1zy5 h VAL 895 Cb 0.98 2.57 -0.02 0.00 -1.52 0.00 0.00 31.29 33.30 1zy5 h VAL 895 CO 0.00 0.77 0.06 0.18 0.02 0.00 0.00 177.57 178.61 1zy5 n LEU 896 N -3.37 5.08 -3.28 2.57 4.77 -1.26 -5.12 117.00 116.39 1zy5 n LEU 896 Ca -0.23 -2.37 -0.25 0.00 -0.03 0.00 0.00 56.01 53.12 1zy5 n LEU 896 Cb 1.05 -1.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 1zy5 n LEU 896 CO 0.46 0.94 -0.10 1.41 -1.33 0.00 0.00 177.39 178.78 1zy5 n HIS 901 N 1.12 -0.68 -2.39 -1.77 8.25 -1.26 -5.16 115.22 113.33 1zy5 n HIS 901 Ca 0.05 0.40 -0.35 0.00 -0.26 0.00 0.00 57.72 57.56 1zy5 n HIS 901 Cb 0.53 -1.10 -0.02 0.00 1.12 0.00 0.00 29.99 30.53 1zy5 n HIS 901 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1zy5 s TYR 902 N -2.35 2.83 0.53 4.41 -0.85 -1.26 -5.08 117.35 115.59 1zy5 s TYR 902 Ca 0.47 1.56 0.02 0.00 -0.52 0.00 0.00 57.07 58.60 1zy5 s TYR 902 Cb -0.28 -3.19 0.02 0.00 0.38 0.00 0.00 41.96 38.89 1zy5 s TYR 902 CO 0.60 -1.23 0.14 0.27 -1.52 0.00 0.00 175.55 173.82 1zy5 n ASN 903 N -1.10 3.22 0.13 -0.18 2.04 -1.26 -5.00 115.26 113.11 1zy5 n ASN 903 Ca 0.10 -3.16 0.06 0.00 -0.44 0.00 0.00 54.58 51.14 1zy5 n ASN 903 Cb 0.51 0.23 0.31 0.00 -2.53 0.00 0.00 39.78 38.30 1zy5 n ASN 903 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 1zy5 n GLU 904 N -1.47 0.08 0.29 -3.83 0.00 -1.26 -2.51 120.64 111.93 1zy5 n GLU 904 Ca -0.15 0.53 0.16 0.00 0.00 0.00 0.00 57.16 57.70 1zy5 n GLU 904 Cb 0.65 -2.01 0.91 0.00 0.00 0.00 0.00 31.44 30.99 1zy5 n GLU 904 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1zy5 h LYS 905 N 0.00 0.00 0.00 3.44 1.79 -1.94 -2.69 116.57 117.17 1zy5 h LYS 905 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 1zy5 h LYS 905 Cb 0.52 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.16 1zy5 h LYS 905 CO 0.00 0.04 -0.14 -0.84 -1.08 0.00 0.00 179.45 177.43 1zy5 h ILE 906 N 0.00 0.94 -0.44 1.86 3.07 -1.89 -1.54 117.51 119.51 1zy5 h ILE 906 Ca -0.00 -0.50 -0.12 0.00 1.55 0.00 0.00 64.86 65.79 1zy5 h ILE 906 Cb 0.16 1.28 -0.01 0.00 -0.27 0.00 0.00 36.82 37.98 1zy5 h ILE 906 CO 0.01 0.14 -0.20 0.44 -1.05 0.00 0.00 178.15 177.48 1zy5 h ASP 907 N 0.00 0.88 -0.36 2.16 3.45 -1.75 -2.15 116.42 118.65 1zy5 h ASP 907 Ca -0.00 -0.31 -0.03 0.00 0.43 0.00 0.00 57.03 57.11 1zy5 h ASP 907 Cb 0.27 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 1zy5 h ASP 907 CO 0.02 1.05 0.13 0.24 -1.57 0.00 0.00 179.24 179.11 1zy5 h MET 908 N 0.76 0.62 0.38 3.56 2.86 -1.43 -0.72 114.93 120.97 1zy5 h MET 908 Ca 0.11 -0.10 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1zy5 h MET 908 Cb 0.73 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.29 1zy5 h MET 908 CO 0.06 0.55 -0.18 -0.92 1.06 0.00 0.00 176.91 177.47 1zy5 h TYR 909 N 0.61 -0.48 -0.92 -0.22 3.20 -1.13 -0.54 116.97 117.49 1zy5 h TYR 909 Ca 0.14 -0.01 0.20 0.00 3.14 0.00 0.00 58.73 62.20 1zy5 h TYR 909 Cb 0.19 0.16 -0.11 0.00 1.54 0.00 0.00 36.73 38.51 1zy5 h TYR 909 CO 0.01 -0.17 0.48 0.77 -1.64 0.00 0.00 178.16 177.61 1zy5 h SER 910 N -0.77 0.52 -0.22 -2.11 0.02 -1.12 1.17 113.55 111.04 1zy5 h SER 910 Ca -0.05 0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 1zy5 h SER 910 Cb 0.52 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 1zy5 h SER 910 CO 0.09 0.13 0.02 0.25 -1.14 0.00 0.00 176.83 176.17 1zy5 h LEU 911 N 0.56 0.46 0.50 5.07 5.85 -0.92 -0.64 115.31 126.20 1zy5 h LEU 911 Ca 0.55 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 59.18 1zy5 h LEU 911 Cb 0.94 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1zy5 h LEU 911 CO -0.45 0.52 -0.38 1.23 -0.34 0.00 0.00 178.44 179.03 1zy5 h GLY 912 N 0.79 -0.95 0.74 3.75 0.00 0.30 0.48 103.07 108.18 1zy5 h GLY 912 Ca 0.11 0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.89 1zy5 h GLY 912 CO 0.01 -0.34 -0.04 -2.22 0.00 0.00 0.00 176.54 173.95 1zy5 h ILE 913 N -0.86 0.86 -0.52 2.60 1.08 -1.12 -2.78 117.51 116.77 1zy5 h ILE 913 Ca -0.05 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.51 1zy5 h ILE 913 Cb 0.73 0.86 -0.07 0.00 -3.07 0.00 0.00 36.82 35.27 1zy5 h ILE 913 CO 0.01 0.00 0.11 0.40 -0.69 0.00 0.00 178.15 177.99 1zy5 h ILE 914 N -0.01 0.71 -0.19 -0.67 2.04 -0.93 -1.57 117.51 116.88 1zy5 h ILE 914 Ca 0.06 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1zy5 h ILE 914 Cb 0.10 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1zy5 h ILE 914 CO -0.13 0.05 0.03 0.15 0.00 0.00 0.00 178.15 178.25 1zy5 h PHE 915 N 0.25 0.26 -0.22 1.37 3.57 -0.65 -2.14 116.94 119.39 1zy5 h PHE 915 Ca 0.26 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 1zy5 h PHE 915 Cb 0.36 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1zy5 h PHE 915 CO -0.23 0.25 0.04 0.35 -2.23 0.00 0.00 178.31 176.49 1zy5 h PHE 916 N 0.26 0.38 0.00 0.41 3.57 -1.04 -2.49 116.94 118.03 1zy5 h PHE 916 Ca 0.06 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1zy5 h PHE 916 Cb 0.13 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1zy5 h PHE 916 CO 0.00 0.49 -0.03 0.93 -2.23 0.00 0.00 178.31 177.48 1zy5 h GLU 917 N 0.16 0.00 0.00 1.11 5.08 -0.94 0.76 114.58 120.76 1zy5 h GLU 917 Ca 0.07 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 1zy5 h GLU 917 Cb 0.31 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1zy5 h GLU 917 CO 0.00 0.03 -0.54 0.52 -1.00 0.00 0.00 179.01 178.02 1zy5 h MET 918 N 0.00 0.00 0.00 2.33 2.86 -0.99 -3.35 114.93 115.79 1zy5 h MET 918 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1zy5 h MET 918 Cb 0.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1zy5 h MET 918 CO 0.00 0.48 -0.46 0.44 1.06 0.00 0.00 176.91 178.43 1zy5 n ILE 919 N -3.21 0.00 -3.89 -1.22 -5.35 -0.31 -1.72 119.36 103.66 1zy5 n ILE 919 Ca 0.02 -0.29 -0.30 0.00 -0.27 0.00 0.00 62.75 61.90 1zy5 n ILE 919 Cb 0.74 0.96 -0.15 0.00 -1.74 0.00 0.00 39.64 39.45 1zy5 n ILE 919 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1zy5 s TYR 920 N -1.86 2.85 0.64 4.28 5.04 0.25 -4.66 117.35 123.89 1zy5 s TYR 920 Ca 0.03 -2.55 -0.16 0.00 -2.44 0.00 0.00 57.07 51.95 1zy5 s TYR 920 Cb 0.06 -2.41 -0.01 0.00 0.35 0.00 0.00 41.96 39.95 1zy5 s TYR 920 CO 0.35 -0.89 1.11 -1.25 -1.34 0.00 0.00 175.55 173.54 1zy5 s PRO 921 N 0.96 2.91 0.11 4.97 0.04 -1.26 -4.62 135.00 138.11 1zy5 s PRO 921 Ca 0.12 1.43 0.09 0.00 0.04 0.00 0.00 61.00 62.68 1zy5 s PRO 921 Cb -0.20 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 1zy5 s PRO 921 CO -0.12 -1.17 -0.22 -0.06 0.04 0.00 0.00 177.00 175.47 1zy5 s PHE 922 N -2.23 1.86 -0.12 0.56 0.40 -1.26 -5.06 117.98 112.12 1zy5 s PHE 922 Ca 0.68 -0.41 0.06 0.00 -0.60 0.00 0.00 56.93 56.65 1zy5 s PHE 922 Cb -0.21 -1.01 -0.24 0.00 0.51 0.00 0.00 43.02 42.07 1zy5 s PHE 922 CO 0.39 0.22 0.34 0.43 0.70 0.00 0.00 175.22 177.30 1zy5 n SER 923 N 1.05 1.29 -4.11 1.36 7.64 -1.26 -5.01 113.62 114.58 1zy5 n SER 923 Ca -0.19 0.20 -0.08 0.00 1.01 0.00 0.00 58.87 59.81 1zy5 n SER 923 Cb 0.53 -0.19 -0.10 0.00 -1.01 0.00 0.00 64.21 63.44 1zy5 n SER 923 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1zy5 s THR 924 N -2.56 0.17 0.11 0.44 -4.23 -1.26 -5.07 115.64 103.25 1zy5 s THR 924 Ca -0.15 -1.84 -0.20 0.00 -1.18 0.00 0.00 61.69 58.31 1zy5 s THR 924 Cb 0.07 -1.72 -0.08 0.00 1.34 0.00 0.00 72.50 72.10 1zy5 s THR 924 CO 0.78 -0.78 1.74 1.23 -0.54 0.00 0.00 174.62 177.05 1zy5 h GLY 925 N 3.03 0.24 0.87 3.99 0.00 -2.00 -2.15 103.07 107.06 1zy5 h GLY 925 Ca -0.34 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 46.92 1zy5 h GLY 925 CO 0.63 0.10 0.42 1.98 0.00 0.00 0.00 176.54 179.67 1zy5 h MET 926 N 0.21 0.81 -0.87 4.80 1.85 -1.99 -0.14 114.93 119.59 1zy5 h MET 926 Ca 0.06 -0.05 0.05 0.00 -0.61 0.00 0.00 59.70 59.15 1zy5 h MET 926 Cb 0.01 -0.18 -0.06 0.00 0.43 0.00 0.00 31.60 31.80 1zy5 h MET 926 CO -0.01 0.53 0.55 1.49 -0.40 0.00 0.00 176.91 179.07 1zy5 h GLU 927 N 0.83 1.00 -0.11 0.39 4.81 -1.93 -0.70 114.58 118.86 1zy5 h GLU 927 Ca 0.27 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1zy5 h GLU 927 Cb 0.02 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.17 1zy5 h GLU 927 CO -0.11 0.66 -0.02 -0.09 -0.73 0.00 0.00 179.01 178.73 1zy5 h ARG 928 N 1.03 0.20 0.19 1.92 2.43 -0.64 -2.52 114.38 116.98 1zy5 h ARG 928 Ca 0.37 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.46 1zy5 h ARG 928 Cb 0.11 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1zy5 h ARG 928 CO -0.15 0.49 -0.11 0.28 -1.51 0.00 0.00 179.97 178.97 1zy5 h VAL 929 N -0.11 0.77 -0.35 0.20 2.07 -0.72 -0.68 116.25 117.43 1zy5 h VAL 929 Ca 0.03 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.59 1zy5 h VAL 929 Cb 0.41 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 1zy5 h VAL 929 CO 0.01 0.00 0.12 0.78 0.02 0.00 0.00 177.57 178.50 1zy5 h ASN 930 N -0.28 0.13 0.11 0.57 2.35 -1.20 0.53 115.58 117.77 1zy5 h ASN 930 Ca -0.02 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1zy5 h ASN 930 Cb 0.23 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1zy5 h ASN 930 CO 0.03 0.11 -0.05 0.40 -1.65 0.00 0.00 177.43 176.27 1zy5 h ILE 931 N 0.27 0.92 -0.74 2.81 2.04 -1.32 -2.42 117.51 119.07 1zy5 h ILE 931 Ca 0.16 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 1zy5 h ILE 931 Cb 0.14 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 1zy5 h ILE 931 CO -0.17 0.02 0.31 -0.07 0.00 0.00 0.00 178.15 178.25 1zy5 h LEU 932 N -0.19 1.01 -2.03 1.44 3.38 -0.96 -2.01 115.31 115.95 1zy5 h LEU 932 Ca -0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1zy5 h LEU 932 Cb 0.15 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1zy5 h LEU 932 CO 0.02 0.89 -0.01 0.11 0.09 0.00 0.00 178.44 179.55 1zy5 h LYS 933 N 1.06 0.00 0.03 1.13 1.57 -0.79 -0.98 116.57 118.58 1zy5 h LYS 933 Ca 0.25 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.80 1zy5 h LYS 933 Cb 0.19 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 1zy5 h LYS 933 CO -0.02 0.01 -0.98 0.87 -0.57 0.00 0.00 179.45 178.76 1zy5 h LYS 934 N 0.00 0.32 -0.06 3.15 1.79 -0.87 -2.88 116.57 118.01 1zy5 h LYS 934 Ca -0.00 -0.38 -0.08 0.00 -2.18 0.00 0.00 60.65 58.01 1zy5 h LYS 934 Cb 0.02 0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 1zy5 h LYS 934 CO 0.00 1.08 -0.34 -0.07 -1.08 0.00 0.00 179.45 179.04 1zy5 h LEU 935 N 0.16 0.12 -0.09 2.94 3.38 -0.60 -2.56 115.31 118.67 1zy5 h LEU 935 Ca -0.08 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1zy5 h LEU 935 Cb 1.63 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.35 1zy5 h LEU 935 CO 0.16 0.46 0.00 0.03 0.09 0.00 0.00 178.44 179.19 1zy5 h ARG 936 N 0.11 0.00 -7.28 1.13 3.08 -1.23 -3.39 114.38 106.80 1zy5 h ARG 936 Ca 0.01 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.55 1zy5 h ARG 936 Cb 0.66 0.00 0.12 0.00 0.08 0.00 0.00 29.97 30.83 1zy5 h ARG 936 CO 0.05 0.00 0.34 -1.54 -1.07 0.00 0.00 179.97 177.74 1zy5 s SER 937 N -5.03 4.71 0.56 7.04 1.04 -0.97 -4.87 113.70 116.17 1zy5 s SER 937 Ca 0.09 1.86 0.35 0.00 0.48 0.00 0.00 55.95 58.73 1zy5 s SER 937 Cb 0.10 -2.53 1.50 0.00 0.10 0.00 0.00 66.02 65.19 1zy5 s SER 937 CO 0.60 -1.90 1.78 0.58 0.98 0.00 0.00 173.24 175.29 1zy5 h VAL 938 N -0.79 0.37 -0.02 5.02 2.07 -1.90 0.34 116.25 121.34 1zy5 h VAL 938 Ca -0.44 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 66.93 1zy5 h VAL 938 Cb 1.23 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1zy5 h VAL 938 CO 0.52 0.00 -0.66 0.28 0.02 0.00 0.00 177.57 177.74 1zy5 h SER 939 N 0.00 0.09 -5.32 0.57 0.02 -1.90 -3.48 113.55 103.53 1zy5 h SER 939 Ca 0.50 -0.06 -0.18 0.00 -0.84 0.00 0.00 61.79 61.22 1zy5 h SER 939 Cb 2.15 -0.03 0.14 0.00 0.14 0.00 0.00 62.40 64.80 1zy5 h SER 939 CO -0.01 0.72 -0.62 -0.38 -1.14 0.00 0.00 176.83 175.41 1zy5 n ILE 940 N -3.78 -9.08 -3.54 3.27 5.41 0.12 -4.96 119.36 106.78 1zy5 n ILE 940 Ca -0.02 -1.03 -0.36 0.00 1.00 0.00 0.00 62.75 62.34 1zy5 n ILE 940 Cb 0.65 -6.49 -0.07 0.00 -0.71 0.00 0.00 39.64 33.02 1zy5 n ILE 940 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1zy5 s GLU 941 N -4.00 4.23 0.02 0.38 2.12 -1.17 -4.97 118.70 115.31 1zy5 s GLU 941 Ca 0.33 0.06 -0.05 0.00 0.36 0.00 0.00 54.97 55.67 1zy5 s GLU 941 Cb -0.04 -3.45 -0.05 0.00 0.26 0.00 0.00 34.13 30.86 1zy5 s GLU 941 CO 0.71 0.20 0.25 -0.06 -0.54 0.00 0.00 175.26 175.82 1zy5 s PHE 942 N 0.59 3.55 0.35 5.30 0.08 -1.26 -3.45 117.98 123.14 1zy5 s PHE 942 Ca 0.15 0.49 -0.29 0.00 0.12 0.00 0.00 56.93 57.41 1zy5 s PHE 942 Cb -0.13 -1.93 -0.12 0.00 -0.57 0.00 0.00 43.02 40.27 1zy5 s PHE 942 CO 0.04 0.60 1.44 -0.35 -0.10 0.00 0.00 175.22 176.85 1zy5 n PRO 943 N 0.89 2.48 -0.32 0.24 -0.04 -1.26 -4.89 135.00 132.09 1zy5 n PRO 943 Ca -0.10 0.87 0.20 0.00 -0.04 0.00 0.00 63.50 64.43 1zy5 n PRO 943 Cb 0.52 -2.56 0.46 0.00 -0.04 0.00 0.00 33.50 31.88 1zy5 n PRO 943 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1zy5 h PRO 944 N 3.19 0.48 -0.03 0.54 0.13 -2.04 -1.08 132.00 133.19 1zy5 h PRO 944 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1zy5 h PRO 944 Cb 1.25 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1zy5 h PRO 944 CO 0.67 0.32 0.00 -0.40 -0.23 0.00 0.00 178.00 178.35 1zy5 n ASP 945 N -4.67 0.69 -4.64 1.44 3.85 -1.26 -4.82 116.55 107.13 1zy5 n ASP 945 Ca 0.24 -1.36 -0.43 0.00 -0.71 0.00 0.00 54.79 52.54 1zy5 n ASP 945 Cb 0.78 -0.02 -0.03 0.00 -1.35 0.00 0.00 41.12 40.50 1zy5 n ASP 945 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 1zy5 s PHE 946 N -1.96 2.07 -0.78 2.11 5.36 -0.41 -4.85 117.98 119.51 1zy5 s PHE 946 Ca 0.38 0.46 -0.24 0.00 -0.96 0.00 0.00 56.93 56.57 1zy5 s PHE 946 Cb 0.19 -3.94 -0.17 0.00 -0.34 0.00 0.00 43.02 38.76 1zy5 s PHE 946 CO 0.31 -3.20 2.43 -3.47 -1.46 0.00 0.00 175.22 169.82 1zy5 n ASP 947 N 8.05 1.00 0.16 6.13 -0.08 -1.26 -4.75 116.55 125.80 1zy5 n ASP 947 Ca 0.18 -0.66 0.13 0.00 -1.51 0.00 0.00 54.79 52.93 1zy5 n ASP 947 Cb 0.44 -1.26 0.57 0.00 2.34 0.00 0.00 41.12 43.21 1zy5 n ASP 947 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1zy5 h ASP 948 N 14.37 0.00 0.00 1.67 3.32 -1.89 -2.71 116.42 131.19 1zy5 h ASP 948 Ca -0.08 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.80 1zy5 h ASP 948 Cb 1.17 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.69 1zy5 h ASP 948 CO 1.25 0.00 -1.66 0.59 -1.72 0.00 0.00 179.24 177.71 1zy5 n ASN 949 N -2.36 3.04 0.10 6.45 3.02 -1.26 -3.98 115.26 120.27 1zy5 n ASN 949 Ca 0.01 -0.05 -0.05 0.00 -0.03 0.00 0.00 54.58 54.46 1zy5 n ASN 949 Cb 0.17 -0.05 0.07 0.00 -0.61 0.00 0.00 39.78 39.36 1zy5 n ASN 949 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1zy5 h LYS 950 N 0.00 0.09 -2.12 3.52 3.64 -1.97 -3.25 116.57 116.48 1zy5 h LYS 950 Ca -0.26 -0.08 -0.58 0.00 -1.27 0.00 0.00 60.65 58.46 1zy5 h LYS 950 Cb 1.43 0.02 -0.42 0.00 -0.41 0.00 0.00 32.23 32.85 1zy5 h LYS 950 CO -0.03 0.79 -0.69 -1.33 -2.27 0.00 0.00 179.45 175.92 1zy5 n MET 951 N -3.70 3.15 -0.00 1.90 2.81 -1.02 -4.87 117.12 115.38 1zy5 n MET 951 Ca -0.02 -4.72 -0.17 0.00 -1.81 0.00 0.00 57.70 50.99 1zy5 n MET 951 Cb 0.72 -2.21 -0.12 0.00 -0.71 0.00 0.00 33.22 30.90 1zy5 n MET 951 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1zy5 h LYS 952 N 2.91 0.26 -0.08 0.03 3.64 -1.69 -3.29 116.57 118.35 1zy5 h LYS 952 Ca 0.16 -0.32 -0.13 0.00 -1.27 0.00 0.00 60.65 59.09 1zy5 h LYS 952 Cb 0.61 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1zy5 h LYS 952 CO 0.81 1.06 -0.52 -0.24 -2.27 0.00 0.00 179.45 178.29 1zy5 h VAL 953 N -0.40 1.36 0.00 2.00 3.04 -1.89 -3.05 116.25 117.31 1zy5 h VAL 953 Ca -0.07 -1.78 -0.08 0.00 -1.01 0.00 0.00 66.70 63.76 1zy5 h VAL 953 Cb 1.25 1.87 -0.01 0.00 -2.01 0.00 0.00 31.29 32.38 1zy5 h VAL 953 CO 0.09 0.53 -0.40 1.05 -1.01 0.00 0.00 177.57 177.82 1zy5 h GLU 954 N 0.18 0.00 -0.15 4.17 9.09 -1.97 -2.78 114.58 123.12 1zy5 h GLU 954 Ca 0.00 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.30 1zy5 h GLU 954 Cb 0.98 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.06 1zy5 h GLU 954 CO 0.08 0.40 -0.39 -0.22 0.05 0.00 0.00 179.01 178.93 1zy5 h LYS 955 N 0.00 0.33 -0.04 1.06 3.64 -1.60 0.33 116.57 120.28 1zy5 h LYS 955 Ca -0.00 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 1zy5 h LYS 955 Cb 0.90 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1zy5 h LYS 955 CO 0.05 0.67 -0.02 -0.22 -2.27 0.00 0.00 179.45 177.66 1zy5 h LYS 956 N 0.28 0.09 0.26 1.90 3.64 -1.50 -1.27 116.57 119.96 1zy5 h LYS 956 Ca 0.03 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1zy5 h LYS 956 Cb 0.81 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1zy5 h LYS 956 CO 0.06 0.49 -0.12 0.82 -2.27 0.00 0.00 179.45 178.43 1zy5 h ILE 957 N -0.30 0.77 -0.25 2.00 2.04 -1.37 -1.72 117.51 118.68 1zy5 h ILE 957 Ca 0.01 -0.14 0.05 0.00 1.00 0.00 0.00 64.86 65.79 1zy5 h ILE 957 Cb 0.46 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 37.33 1zy5 h ILE 957 CO 0.01 0.03 -0.10 0.40 0.00 0.00 0.00 178.15 178.48 1zy5 h ILE 958 N -0.41 0.66 -0.94 -0.67 2.04 -0.97 0.35 117.51 117.57 1zy5 h ILE 958 Ca -0.04 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.93 1zy5 h ILE 958 Cb 0.31 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 36.98 1zy5 h ILE 958 CO 0.06 0.00 0.60 -0.09 0.00 0.00 0.00 178.15 178.72 1zy5 h ARG 959 N -0.07 0.92 -0.31 2.37 9.65 -1.16 0.32 114.38 126.09 1zy5 h ARG 959 Ca 0.13 -0.06 -0.08 0.00 -1.10 0.00 0.00 59.98 58.88 1zy5 h ARG 959 Cb 0.26 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1zy5 h ARG 959 CO -0.29 0.61 -0.10 -0.07 2.80 0.00 0.00 179.97 182.91 1zy5 h LEU 960 N 0.94 0.63 -0.97 3.80 3.38 -0.18 -2.72 115.31 120.19 1zy5 h LEU 960 Ca 0.44 -0.38 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1zy5 h LEU 960 Cb 0.41 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1zy5 h LEU 960 CO -0.20 0.87 -0.30 -0.07 0.09 0.00 0.00 178.44 178.83 1zy5 h LEU 961 N 0.39 0.39 -3.75 1.67 3.38 0.11 -3.07 115.31 114.42 1zy5 h LEU 961 Ca 0.08 -0.14 -0.35 0.00 0.09 0.00 0.00 57.88 57.56 1zy5 h LEU 961 Cb 0.61 -0.11 -0.21 0.00 0.09 0.00 0.00 40.66 41.04 1zy5 h LEU 961 CO 0.04 0.68 0.36 2.30 0.09 0.00 0.00 178.44 181.90 1zy5 n ILE 962 N -4.10 2.95 -2.32 1.22 -5.35 0.98 -3.55 119.36 109.19 1zy5 n ILE 962 Ca -0.01 -2.10 -0.39 0.00 -0.27 0.00 0.00 62.75 59.99 1zy5 n ILE 962 Cb 0.42 -0.40 -0.02 0.00 -1.74 0.00 0.00 39.64 37.90 1zy5 n ILE 962 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1zy5 s ASP 963 N -1.62 6.68 0.35 7.28 -1.08 -1.03 -4.90 116.67 122.34 1zy5 s ASP 963 Ca 0.53 2.35 0.27 0.00 -0.52 0.00 0.00 52.55 55.17 1zy5 s ASP 963 Cb 0.45 -2.62 1.11 0.00 -1.46 0.00 0.00 42.92 40.40 1zy5 s ASP 963 CO 0.08 -0.57 1.79 0.45 0.52 0.00 0.00 175.17 177.45 1zy5 h HIS 964 N 2.88 0.00 -3.58 -5.34 3.86 -1.92 -3.40 115.15 107.65 1zy5 h HIS 964 Ca -0.48 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.05 1zy5 h HIS 964 Cb 1.23 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 29.52 1zy5 h HIS 964 CO 0.56 0.00 -0.16 0.34 0.86 0.00 0.00 177.93 179.53 1zy5 s ASP 965 N -4.65 6.22 0.50 2.45 -1.08 -1.26 -4.86 116.67 114.00 1zy5 s ASP 965 Ca 0.03 -0.46 0.17 0.00 -0.52 0.00 0.00 52.55 51.77 1zy5 s ASP 965 Cb 0.09 -2.24 1.23 0.00 -1.46 0.00 0.00 42.92 40.54 1zy5 s ASP 965 CO 0.43 -0.55 2.10 1.55 0.52 0.00 0.00 175.17 179.22 1zy5 h PRO 966 N 8.66 0.09 0.00 4.34 0.13 -1.96 -1.81 132.00 141.45 1zy5 h PRO 966 Ca -0.27 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.80 1zy5 h PRO 966 Cb 1.12 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1zy5 h PRO 966 CO 0.78 0.06 -0.26 -0.91 -0.23 0.00 0.00 178.00 177.44 1zy5 h ASN 967 N 0.09 0.00 0.21 1.44 2.35 -1.95 -2.69 115.58 115.03 1zy5 h ASN 967 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1zy5 h ASN 967 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1zy5 h ASN 967 CO -0.01 0.26 -0.10 0.29 -1.65 0.00 0.00 177.43 176.22 1zy5 n LYS 968 N -3.25 0.97 -3.02 0.81 5.02 -0.70 -4.79 118.16 113.20 1zy5 n LYS 968 Ca 0.02 -0.42 -0.40 0.00 -2.02 0.00 0.00 58.31 55.49 1zy5 n LYS 968 Cb 0.55 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.02 1zy5 n LYS 968 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1zy5 s ARG 969 N -2.32 4.35 0.39 1.97 0.52 -1.02 -4.89 118.95 117.95 1zy5 s ARG 969 Ca 0.32 0.86 -0.25 0.00 -0.52 0.00 0.00 55.73 56.14 1zy5 s ARG 969 Cb 0.20 -3.51 -0.09 0.00 0.52 0.00 0.00 34.95 32.07 1zy5 s ARG 969 CO 0.44 -0.12 1.10 -1.25 0.02 0.00 0.00 175.30 175.50 1zy5 s PRO 970 N 1.44 4.17 0.86 3.54 0.04 -1.26 -5.01 135.00 138.77 1zy5 s PRO 970 Ca 0.36 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.96 1zy5 s PRO 970 Cb -0.17 -2.67 0.11 0.00 0.04 0.00 0.00 34.50 31.81 1zy5 s PRO 970 CO 0.15 -0.18 1.10 0.20 0.04 0.00 0.00 177.00 178.31 1zy5 s GLY 971 N -1.31 1.61 0.23 0.56 0.00 -1.26 -4.89 107.32 102.26 1zy5 s GLY 971 Ca 0.56 -0.21 -0.02 0.00 0.00 0.00 0.00 44.72 45.05 1zy5 s GLY 971 CO 0.34 0.27 1.63 0.00 0.00 0.00 0.00 173.10 175.33 1zy5 h ALA 972 N -1.35 0.90 0.02 3.20 0.00 -1.93 -2.34 119.26 117.77 1zy5 h ALA 972 Ca -0.49 -0.40 -0.19 0.00 0.00 0.00 0.00 54.91 53.83 1zy5 h ALA 972 Cb 1.29 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.97 1zy5 h ALA 972 CO 0.58 0.62 -0.76 -0.09 0.00 0.00 0.00 179.25 179.60 1zy5 h ARG 973 N 0.53 0.47 -0.68 0.00 9.65 -1.92 -3.02 114.38 119.41 1zy5 h ARG 973 Ca 0.06 -0.54 0.07 0.00 -1.10 0.00 0.00 59.98 58.46 1zy5 h ARG 973 Cb 0.81 0.16 -0.06 0.00 -1.39 0.00 0.00 29.97 29.49 1zy5 h ARG 973 CO 0.07 1.19 0.37 1.15 2.80 0.00 0.00 179.97 185.54 1zy5 h THR 974 N -0.00 0.94 -0.30 0.20 2.02 -1.90 0.33 112.91 114.20 1zy5 h THR 974 Ca -0.10 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 1zy5 h THR 974 Cb 1.47 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1zy5 h THR 974 CO 0.15 0.12 -0.04 -0.07 0.37 0.00 0.00 175.52 176.05 1zy5 h LEU 975 N 0.67 0.45 -0.43 2.58 3.38 -1.49 -1.76 115.31 118.71 1zy5 h LEU 975 Ca 0.31 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 1zy5 h LEU 975 Cb 0.23 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1zy5 h LEU 975 CO -0.20 0.55 -0.56 -0.07 0.09 0.00 0.00 178.44 178.24 1zy5 h LEU 976 N 0.45 0.00 -4.17 1.67 3.38 -1.01 -3.29 115.31 112.34 1zy5 h LEU 976 Ca 0.10 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.43 1zy5 h LEU 976 Cb 0.36 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 40.75 1zy5 h LEU 976 CO 0.02 0.56 0.05 0.59 0.09 0.00 0.00 178.44 179.75 1zy5 n ASN 977 N -3.42 6.21 -0.01 -0.43 5.03 0.10 -4.41 115.26 118.33 1zy5 n ASN 977 Ca 0.00 -3.77 -0.01 0.00 0.87 0.00 0.00 54.58 51.67 1zy5 n ASN 977 Cb 0.68 -0.69 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 1zy5 n ASN 977 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1zy5 n SER 978 N -0.71 4.36 0.00 6.41 3.41 -0.83 -4.90 113.62 121.36 1zy5 n SER 978 Ca 0.51 -0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.12 1zy5 n SER 978 Cb 0.69 0.47 0.00 0.00 -0.26 0.00 0.00 64.21 65.12 1zy5 n SER 978 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zy5 n GLY 979 N 2.93 1.82 0.27 5.00 0.00 -1.26 -4.93 105.19 109.01 1zy5 n GLY 979 Ca -0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.05 1zy5 n GLY 979 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1zy5 h TRP 980 N 0.00 0.12 -3.33 1.61 6.55 -1.93 -3.42 115.95 115.55 1zy5 h TRP 980 Ca 0.00 0.00 -0.53 0.00 0.95 0.00 0.00 58.89 59.31 1zy5 h TRP 980 Cb 0.00 -0.04 -0.01 0.00 -0.86 0.00 0.00 29.16 28.26 1zy5 h TRP 980 CO 0.00 0.10 0.48 -0.51 -1.05 0.00 0.00 178.44 177.46 1zy5 s LEU 981 N -9.11 4.39 0.19 -4.49 1.02 -1.26 -4.97 118.68 104.45 1zy5 s LEU 981 Ca -0.06 1.90 -0.32 0.00 0.02 0.00 0.00 54.13 55.68 1zy5 s LEU 981 Cb 0.17 -3.58 -0.16 0.00 0.02 0.00 0.00 46.19 42.64 1zy5 s LEU 981 CO 0.69 -0.35 1.10 -2.65 0.02 0.00 0.00 176.35 175.16 1zy5 n PRO 982 N 3.65 1.11 0.00 1.29 -0.02 -1.26 -5.10 135.00 134.66 1zy5 n PRO 982 Ca 0.07 0.39 0.04 0.00 -2.02 0.00 0.00 63.50 61.98 1zy5 n PRO 982 Cb 0.48 -1.85 0.03 0.00 -0.02 0.00 0.00 33.50 32.15 1zy5 n PRO 982 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03