#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkt s GLU 581 N 0.00 1.28 -0.09 1.96 2.02 0.16 -4.96 118.70 119.07 2qkt s GLU 581 Ca 0.00 -0.69 0.03 0.00 0.02 0.00 0.00 54.97 54.33 2qkt s GLU 581 Cb 0.00 -1.28 0.01 0.00 0.10 0.00 0.00 34.13 32.96 2qkt s GLU 581 CO 0.00 0.34 -0.17 0.15 0.02 0.00 0.00 175.26 175.60 2qkt s LYS 582 N -0.67 2.25 0.27 1.61 1.02 -1.26 0.76 119.74 123.73 2qkt s LYS 582 Ca 0.06 -0.59 -0.08 0.00 0.02 0.00 0.00 55.97 55.37 2qkt s LYS 582 Cb -0.07 -1.82 -0.01 0.00 -0.52 0.00 0.00 37.83 35.41 2qkt s LYS 582 CO 0.00 0.04 0.44 -0.59 -0.92 0.00 0.00 175.35 174.32 2qkt s PHE 583 N 0.69 0.67 0.16 3.18 -0.12 -0.36 -5.01 117.98 117.19 2qkt s PHE 583 Ca -0.13 -0.98 0.10 0.00 -0.05 0.00 0.00 56.93 55.87 2qkt s PHE 583 Cb -0.16 0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.21 2qkt s PHE 583 CO 0.03 -1.00 -0.21 -0.80 -0.05 0.00 0.00 175.22 173.19 2qkt s ASN 584 N -3.10 3.64 -0.07 1.98 0.01 -1.26 -0.43 114.94 115.71 2qkt s ASN 584 Ca 0.27 -0.72 0.01 0.00 -0.71 0.00 0.00 52.86 51.71 2qkt s ASN 584 Cb 0.00 -0.39 0.02 0.00 0.41 0.00 0.00 41.25 41.30 2qkt s ASN 584 CO 0.13 0.15 -0.07 -0.69 -1.51 0.00 0.00 177.10 175.11 2qkt s VAL 585 N -1.40 0.79 -0.05 1.60 1.01 -0.14 -4.98 120.40 117.25 2qkt s VAL 585 Ca 0.19 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.96 2qkt s VAL 585 Cb -0.09 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.50 2qkt s VAL 585 CO 0.10 0.30 -0.10 -1.81 0.00 0.00 0.00 175.10 173.59 2qkt s ASP 586 N 1.15 1.44 0.15 3.32 1.01 -1.26 -0.24 116.67 122.24 2qkt s ASP 586 Ca -0.07 -0.23 -0.14 0.00 0.71 0.00 0.00 52.55 52.82 2qkt s ASP 586 Cb -0.14 -0.56 0.02 0.00 1.01 0.00 0.00 42.92 43.25 2qkt s ASP 586 CO -0.01 0.04 0.38 -1.48 0.21 0.00 0.00 175.17 174.31 2qkt s LEU 587 N 0.50 0.57 -0.25 1.23 0.05 -0.51 -4.95 118.68 115.32 2qkt s LEU 587 Ca -0.09 -0.53 -0.06 0.00 0.05 0.00 0.00 54.13 53.50 2qkt s LEU 587 Cb -0.13 1.68 -0.01 0.00 -2.05 0.00 0.00 46.19 45.68 2qkt s LEU 587 CO 0.02 -0.90 0.03 -0.32 -0.55 0.00 0.00 176.35 174.63 2qkt s MET 588 N -3.87 3.45 0.34 1.48 -2.45 -1.26 0.14 119.30 117.14 2qkt s MET 588 Ca 0.08 -0.60 -0.27 0.00 -1.25 0.00 0.00 55.69 53.65 2qkt s MET 588 Cb 0.02 -3.23 -0.09 0.00 1.25 0.00 0.00 34.83 32.78 2qkt s MET 588 CO -0.07 -0.24 1.15 0.21 1.05 0.00 0.00 175.02 177.12 2qkt s LYS 589 N 1.55 4.34 -0.09 4.11 2.20 0.08 -4.97 119.74 126.95 2qkt s LYS 589 Ca 0.05 1.84 -0.03 0.00 -0.36 0.00 0.00 55.97 57.47 2qkt s LYS 589 Cb -0.15 -2.91 -0.03 0.00 -1.51 0.00 0.00 37.83 33.22 2qkt s LYS 589 CO 0.01 -0.07 0.03 0.15 -0.36 0.00 0.00 175.35 175.11 2qkt s LYS 590 N -1.93 3.07 0.20 4.03 1.02 -1.26 -4.30 119.74 120.56 2qkt s LYS 590 Ca 0.51 -0.36 -0.33 0.00 0.02 0.00 0.00 55.97 55.82 2qkt s LYS 590 Cb -0.31 -2.87 -0.14 0.00 -0.52 0.00 0.00 37.83 33.99 2qkt s LYS 590 CO 0.40 0.72 1.44 0.00 -0.92 0.00 0.00 175.35 176.99 2qkt n ALA 591 N 2.08 0.87 -0.95 5.17 0.00 -1.26 -1.35 120.51 125.07 2qkt n ALA 591 Ca -0.19 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2qkt n ALA 591 Cb 0.54 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2qkt n ALA 591 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkt n GLY 592 N 2.59 0.57 3.03 0.00 0.00 -1.26 -4.98 105.19 105.15 2qkt n GLY 592 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 2qkt n GLY 592 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qkt s LYS 593 N -0.34 1.74 0.65 1.61 2.20 -0.46 -5.10 119.74 120.05 2qkt s LYS 593 Ca 0.00 -2.04 -0.16 0.00 -0.36 0.00 0.00 55.97 53.41 2qkt s LYS 593 Cb 0.00 -3.34 -0.00 0.00 -1.51 0.00 0.00 37.83 32.98 2qkt s LYS 593 CO 0.00 -1.01 1.15 -1.21 -0.36 0.00 0.00 175.35 173.92 2qkt s GLU 594 N 0.68 2.73 0.27 4.03 8.01 -1.26 -4.45 118.70 128.72 2qkt s GLU 594 Ca 0.12 1.58 -0.02 0.00 0.01 0.00 0.00 54.97 56.66 2qkt s GLU 594 Cb -0.21 -1.92 0.36 0.00 -4.31 0.00 0.00 34.13 28.05 2qkt s GLU 594 CO -0.06 -1.34 1.84 -0.07 0.01 0.00 0.00 175.26 175.65 2qkt h LEU 595 N 0.25 0.86 0.00 1.80 3.38 -1.97 -3.47 115.31 116.16 2qkt h LEU 595 Ca -0.48 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.36 2qkt h LEU 595 Cb 1.27 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2qkt h LEU 595 CO 0.53 0.79 0.00 0.61 0.09 0.00 0.00 178.44 180.46 2qkt n GLY 596 N -0.94 0.50 3.90 0.83 0.00 -1.26 -4.71 105.19 103.51 2qkt n GLY 596 Ca 0.05 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 2qkt n GLY 596 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qkt s LEU 597 N 0.00 4.37 -0.12 0.99 1.43 -1.26 -0.68 118.68 123.41 2qkt s LEU 597 Ca 0.00 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2qkt s LEU 597 Cb 0.00 -2.59 0.01 0.00 0.03 0.00 0.00 46.19 43.65 2qkt s LEU 597 CO 0.00 0.27 -0.18 -0.55 0.23 0.00 0.00 176.35 176.12 2qkt s SER 598 N -1.87 2.72 0.30 2.29 0.15 -0.36 -4.97 113.70 111.95 2qkt s SER 598 Ca 0.27 -0.50 0.08 0.00 0.70 0.00 0.00 55.95 56.50 2qkt s SER 598 Cb -0.13 -1.23 -0.04 0.00 -1.71 0.00 0.00 66.02 62.91 2qkt s SER 598 CO 0.18 0.03 0.11 -0.76 1.20 0.00 0.00 173.24 174.00 2qkt s LEU 599 N 0.98 3.37 0.03 3.45 1.43 -1.26 -0.53 118.68 126.16 2qkt s LEU 599 Ca -0.05 -0.60 -0.04 0.00 -1.03 0.00 0.00 54.13 52.40 2qkt s LEU 599 Cb -0.15 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 2qkt s LEU 599 CO -0.03 -0.14 0.06 -0.94 0.23 0.00 0.00 176.35 175.53 2qkt s SER 600 N -3.80 0.20 0.44 2.29 1.04 -0.38 -4.81 113.70 108.67 2qkt s SER 600 Ca 0.35 -0.52 -0.26 0.00 0.48 0.00 0.00 55.95 56.00 2qkt s SER 600 Cb -0.05 0.19 -0.09 0.00 0.10 0.00 0.00 66.02 66.17 2qkt s SER 600 CO 0.22 -0.45 1.46 -2.84 0.98 0.00 0.00 173.24 172.61 2qkt s PRO 601 N -2.30 3.76 0.03 4.02 0.02 -1.26 -0.26 135.00 139.00 2qkt s PRO 601 Ca -0.08 2.49 0.01 0.00 0.02 0.00 0.00 61.00 63.44 2qkt s PRO 601 Cb -0.03 -2.72 -0.02 0.00 0.02 0.00 0.00 34.50 31.75 2qkt s PRO 601 CO -0.03 -0.79 -0.04 1.21 -0.33 0.00 0.00 177.00 177.02 2qkt s ASN 602 N -0.39 0.41 0.30 2.53 3.84 -0.13 -4.64 114.94 116.86 2qkt s ASN 602 Ca 0.59 -0.53 0.05 0.00 0.21 0.00 0.00 52.86 53.19 2qkt s ASN 602 Cb -0.45 0.09 0.76 0.00 -0.55 0.00 0.00 41.25 41.10 2qkt s ASN 602 CO 0.59 -0.28 1.71 -0.08 -2.79 0.00 0.00 177.10 176.25 2qkt h GLU 603 N 4.56 0.47 -0.30 0.43 4.81 -2.02 -1.94 114.58 120.58 2qkt h GLU 603 Ca -0.33 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 2qkt h GLU 603 Cb 1.21 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.48 2qkt h GLU 603 CO 0.42 0.31 0.00 0.44 -0.73 0.00 0.00 179.01 179.45 2qkt n ILE 604 N -4.98 2.20 0.00 2.32 -5.35 -1.26 -4.73 119.36 107.56 2qkt n ILE 604 Ca 0.23 -1.74 0.00 0.00 -0.27 0.00 0.00 62.75 60.97 2qkt n ILE 604 Cb 0.67 -0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.39 2qkt n ILE 604 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qkt n GLY 605 N -0.28 -0.40 3.04 3.28 0.00 -0.73 -4.25 105.19 105.85 2qkt n GLY 605 Ca 0.21 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 2qkt n GLY 605 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkt s THR 607 N 1.33 3.64 -0.60 0.00 2.01 0.64 -0.87 115.64 121.78 2qkt s THR 607 Ca -0.01 1.32 -0.21 0.00 0.31 0.00 0.00 61.69 63.10 2qkt s THR 607 Cb -0.16 -3.72 0.07 0.00 0.01 0.00 0.00 72.50 68.70 2qkt s THR 607 CO -0.09 0.08 0.84 -0.63 -0.69 0.00 0.00 174.62 174.13 2qkt s ILE 608 N -1.55 4.55 0.09 1.82 1.01 0.20 -1.25 121.20 126.07 2qkt s ILE 608 Ca 0.55 -0.45 -0.06 0.00 0.00 0.00 0.00 60.65 60.69 2qkt s ILE 608 Cb -0.24 -4.55 -0.24 0.00 0.01 0.00 0.00 42.46 37.43 2qkt s ILE 608 CO 0.31 -1.22 1.20 0.00 0.00 0.00 0.00 174.94 175.23 2qkt h ALA 609 N 9.34 0.19 -2.79 9.38 0.00 -1.12 -0.04 119.26 134.22 2qkt h ALA 609 Ca -0.28 -0.79 -0.06 0.00 0.00 0.00 0.00 54.91 53.78 2qkt h ALA 609 Cb 1.08 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.78 2qkt h ALA 609 CO 1.11 0.85 -0.14 0.34 0.00 0.00 0.00 179.25 181.42 2qkt s ASP 610 N -7.18 -0.10 0.06 0.00 -1.08 -0.98 -4.83 116.67 102.56 2qkt s ASP 610 Ca -0.06 -0.78 -0.26 0.00 -0.52 0.00 0.00 52.55 50.93 2qkt s ASP 610 Cb 0.07 0.54 0.07 0.00 -1.46 0.00 0.00 42.92 42.14 2qkt s ASP 610 CO 0.89 -1.04 0.61 -1.48 0.52 0.00 0.00 175.17 174.67 2qkt s LEU 611 N -2.96 -0.50 -0.32 -1.34 0.05 -1.26 -1.22 118.68 111.13 2qkt s LEU 611 Ca 0.17 0.29 -0.11 0.00 0.05 0.00 0.00 54.13 54.53 2qkt s LEU 611 Cb 0.00 2.48 -0.01 0.00 -2.05 0.00 0.00 46.19 46.61 2qkt s LEU 611 CO 0.03 -0.79 0.19 -0.63 -0.55 0.00 0.00 176.35 174.60 2qkt s ILE 612 N -2.56 4.92 0.21 1.48 1.01 0.15 -5.00 121.20 121.41 2qkt s ILE 612 Ca -0.05 -0.30 -0.30 0.00 0.00 0.00 0.00 60.65 60.00 2qkt s ILE 612 Cb -0.01 -3.50 -0.08 0.00 0.01 0.00 0.00 42.46 38.88 2qkt s ILE 612 CO -0.02 0.05 1.17 -1.58 0.00 0.00 0.00 174.94 174.55 2qkt s GLN 613 N 1.67 4.53 0.00 2.79 0.74 -1.26 -3.69 119.66 124.43 2qkt s GLN 613 Ca 0.05 1.86 0.00 0.00 0.05 0.00 0.00 55.36 57.32 2qkt s GLN 613 Cb -0.17 -3.22 0.00 0.00 1.10 0.00 0.00 33.01 30.72 2qkt s GLN 613 CO 0.08 -0.00 0.00 0.41 -0.55 0.00 0.00 175.29 175.23 2qkt n GLY 614 N 1.86 0.43 0.11 2.59 0.00 -1.26 -4.99 105.19 103.92 2qkt n GLY 614 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 2qkt n GLY 614 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qkt h GLN 615 N 4.85 -0.14 -4.26 1.61 1.08 -1.87 -3.47 115.11 112.91 2qkt h GLN 615 Ca 0.00 0.01 -0.39 0.00 -1.45 0.00 0.00 58.65 56.82 2qkt h GLN 615 Cb 0.00 0.03 -0.32 0.00 -0.05 0.00 0.00 27.48 27.15 2qkt h GLN 615 CO 0.00 0.14 -0.77 0.71 -0.95 0.00 0.00 178.83 177.96 2qkt s TYR 616 N -2.39 0.72 0.29 2.96 1.51 -1.26 -5.03 117.35 114.15 2qkt s TYR 616 Ca -0.07 -0.18 0.01 0.00 -1.01 0.00 0.00 57.07 55.82 2qkt s TYR 616 Cb -0.00 -0.57 0.55 0.00 -0.11 0.00 0.00 41.96 41.83 2qkt s TYR 616 CO 0.26 -0.11 1.87 -1.35 -1.11 0.00 0.00 175.55 175.10 2qkt h PRO 617 N 6.65 0.98 -0.78 -1.71 0.11 -1.98 0.09 132.00 135.36 2qkt h PRO 617 Ca -0.35 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 2qkt h PRO 617 Cb 1.17 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 32.02 2qkt h PRO 617 CO 0.49 0.65 0.48 0.93 -0.21 0.00 0.00 178.00 180.33 2qkt h GLU 618 N 1.01 1.04 -0.02 1.05 3.07 -1.96 0.88 114.58 119.66 2qkt h GLU 618 Ca 0.46 -0.08 -0.03 0.00 -0.50 0.00 0.00 59.36 59.20 2qkt h GLU 618 Cb 0.38 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2qkt h GLU 618 CO -0.21 0.72 -0.10 0.82 -1.40 0.00 0.00 179.01 178.84 2qkt h ILE 619 N 1.07 1.52 0.00 3.13 2.04 -1.62 -2.31 117.51 121.34 2qkt h ILE 619 Ca 0.28 -1.68 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 2qkt h ILE 619 Cb -0.06 2.60 -0.00 0.00 -0.74 0.00 0.00 36.82 38.61 2qkt h ILE 619 CO -0.05 0.45 -0.00 0.44 0.00 0.00 0.00 178.15 178.98 2qkt h ASP 620 N -0.55 0.00 0.67 1.72 3.32 -0.73 -1.74 116.42 119.12 2qkt h ASP 620 Ca -0.01 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.79 2qkt h ASP 620 Cb 0.79 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.30 2qkt h ASP 620 CO 0.02 0.00 -1.46 0.28 -1.72 0.00 0.00 179.24 176.36 2qkt h SER 621 N 0.00 0.00 0.00 6.45 0.02 -0.81 -3.43 113.55 115.78 2qkt h SER 621 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qkt h SER 621 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2qkt h SER 621 CO 0.00 0.94 -0.18 0.29 -1.14 0.00 0.00 176.83 176.74 2qkt n LYS 622 N -3.11 3.58 -4.19 3.45 5.02 -0.87 -5.08 118.16 116.96 2qkt n LYS 622 Ca -0.11 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.85 2qkt n LYS 622 Cb 0.99 -0.45 -0.08 0.00 -0.02 0.00 0.00 35.03 35.47 2qkt n LYS 622 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qkt s LEU 623 N -1.35 3.68 0.05 -0.35 1.43 -0.67 -5.07 118.68 116.40 2qkt s LEU 623 Ca 0.00 0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.12 2qkt s LEU 623 Cb 0.00 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 2qkt s LEU 623 CO 0.00 0.27 0.00 -1.10 0.23 0.00 0.00 176.35 175.75 2qkt s GLN 624 N -1.70 0.60 0.35 1.70 -0.21 -1.26 -4.80 119.66 114.35 2qkt s GLN 624 Ca 0.22 -1.09 -0.29 0.00 0.02 0.00 0.00 55.36 54.22 2qkt s GLN 624 Cb -0.12 0.22 -0.11 0.00 1.00 0.00 0.00 33.01 34.00 2qkt s GLN 624 CO 0.13 -0.12 1.51 0.54 -2.12 0.00 0.00 175.29 175.22 2qkt n ARG 625 N 0.30 2.66 0.00 2.91 1.74 -1.26 -1.88 116.66 121.13 2qkt n ARG 625 Ca -0.16 0.94 0.00 0.00 -0.77 0.00 0.00 57.85 57.86 2qkt n ARG 625 Cb 0.60 -2.68 0.00 0.00 -1.02 0.00 0.00 32.46 29.37 2qkt n ARG 625 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qkt n GLY 626 N 0.93 3.29 3.76 -0.13 0.00 -0.03 -5.00 105.19 108.02 2qkt n GLY 626 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 2qkt n GLY 626 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qkt s ASP 627 N -0.81 5.53 -0.19 1.61 1.01 -0.79 -4.66 116.67 118.37 2qkt s ASP 627 Ca 0.00 2.40 -0.01 0.00 0.71 0.00 0.00 52.55 55.65 2qkt s ASP 627 Cb 0.00 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.33 2qkt s ASP 627 CO 0.00 -1.36 -0.13 -0.63 0.21 0.00 0.00 175.17 173.26 2qkt s ILE 628 N -1.56 2.73 -0.33 0.77 1.01 0.10 -0.62 121.20 123.31 2qkt s ILE 628 Ca 0.72 -0.72 -0.27 0.00 0.00 0.00 0.00 60.65 60.38 2qkt s ILE 628 Cb -0.31 -2.19 0.01 0.00 0.01 0.00 0.00 42.46 39.98 2qkt s ILE 628 CO 0.35 0.49 0.96 -0.63 0.00 0.00 0.00 174.94 176.10 2qkt s ILE 629 N 1.20 4.61 -0.13 2.92 1.01 -0.05 -0.81 121.20 129.95 2qkt s ILE 629 Ca 0.02 1.44 0.22 0.00 0.00 0.00 0.00 60.65 62.33 2qkt s ILE 629 Cb -0.14 -4.32 -0.27 0.00 0.01 0.00 0.00 42.46 37.74 2qkt s ILE 629 CO -0.05 -0.43 0.61 0.35 0.00 0.00 0.00 174.94 175.42 2qkt n THR 630 N 5.80 0.10 -3.75 2.92 -2.24 0.38 -1.48 114.28 116.01 2qkt n THR 630 Ca 0.08 -0.47 -0.13 0.00 -2.27 0.00 0.00 64.05 61.26 2qkt n THR 630 Cb 0.48 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.60 2qkt n THR 630 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qkt s LYS 631 N -3.46 0.39 -0.08 -0.78 2.20 -1.20 -0.73 119.74 116.10 2qkt s LYS 631 Ca -0.06 0.51 0.00 0.00 -0.36 0.00 0.00 55.97 56.07 2qkt s LYS 631 Cb 0.13 0.16 0.02 0.00 -1.51 0.00 0.00 37.83 36.64 2qkt s LYS 631 CO 0.89 -0.06 -0.06 0.12 -0.36 0.00 0.00 175.35 175.87 2qkt s PHE 632 N 0.35 1.08 -1.58 4.03 5.36 -0.29 -1.57 117.98 125.36 2qkt s PHE 632 Ca -0.01 -0.42 -0.04 0.00 -0.96 0.00 0.00 56.93 55.49 2qkt s PHE 632 Cb -0.03 -0.94 0.04 0.00 -0.34 0.00 0.00 43.02 41.75 2qkt s PHE 632 CO -0.01 -0.34 0.20 0.09 -1.46 0.00 0.00 175.22 173.71 2qkt n ASN 633 N 4.53 0.10 0.00 6.13 3.02 -0.29 -0.58 115.26 128.17 2qkt n ASN 633 Ca -0.17 -1.21 0.00 0.00 -0.03 0.00 0.00 54.58 53.17 2qkt n ASN 633 Cb 0.51 -1.92 0.00 0.00 -0.61 0.00 0.00 39.78 37.75 2qkt n ASN 633 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qkt n GLY 634 N -2.20 1.95 3.57 7.41 0.00 -1.26 -5.02 105.19 109.64 2qkt n GLY 634 Ca -0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 2qkt n GLY 634 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qkt s ASP 635 N -3.11 6.02 0.25 1.61 1.01 0.26 -5.05 116.67 117.66 2qkt s ASP 635 Ca 0.00 -0.13 -0.30 0.00 0.71 0.00 0.00 52.55 52.84 2qkt s ASP 635 Cb 0.00 -2.12 -0.10 0.00 1.01 0.00 0.00 42.92 41.71 2qkt s ASP 635 CO 0.00 -0.10 1.35 0.00 0.21 0.00 0.00 175.17 176.63 2qkt s ALA 636 N 1.75 3.55 -0.16 5.23 0.00 -1.26 -1.14 121.76 129.73 2qkt s ALA 636 Ca 0.07 1.21 0.22 0.00 0.00 0.00 0.00 51.96 53.46 2qkt s ALA 636 Cb -0.16 -3.50 -0.13 0.00 0.00 0.00 0.00 23.12 19.33 2qkt s ALA 636 CO 0.11 -0.62 0.82 1.28 0.00 0.00 0.00 175.76 177.35 2qkt n LEU 637 N 2.02 0.54 -4.70 0.00 4.77 0.09 -4.78 117.00 114.94 2qkt n LEU 637 Ca 0.05 0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.82 2qkt n LEU 637 Cb 0.42 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 2qkt n LEU 637 CO 0.59 -0.10 1.10 -0.70 -1.33 0.00 0.00 177.39 176.95 2qkt s GLU 638 N -3.39 4.30 0.00 3.23 2.12 -1.26 -2.52 118.70 121.18 2qkt s GLU 638 Ca -0.03 2.03 0.00 0.00 0.36 0.00 0.00 54.97 57.32 2qkt s GLU 638 Cb 0.11 -3.43 0.00 0.00 0.26 0.00 0.00 34.13 31.07 2qkt s GLU 638 CO 0.83 -0.51 0.00 0.41 -0.54 0.00 0.00 175.26 175.45 2qkt n GLY 639 N 3.58 2.66 3.85 -1.50 0.00 -1.26 -5.05 105.19 107.47 2qkt n GLY 639 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2qkt n GLY 639 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qkt s LEU 640 N 0.00 3.34 0.37 0.99 1.43 -1.05 -4.98 118.68 118.79 2qkt s LEU 640 Ca 0.00 1.50 -0.27 0.00 -1.03 0.00 0.00 54.13 54.34 2qkt s LEU 640 Cb 0.00 -4.49 -0.11 0.00 0.03 0.00 0.00 46.19 41.62 2qkt s LEU 640 CO 0.00 -0.88 1.20 -2.65 0.23 0.00 0.00 176.35 174.26 2qkt n PRO 641 N -2.44 1.84 0.02 1.29 -0.02 -1.26 -4.82 135.00 129.61 2qkt n PRO 641 Ca 0.06 0.65 0.17 0.00 -2.02 0.00 0.00 63.50 62.37 2qkt n PRO 641 Cb 0.54 -2.24 0.65 0.00 -0.02 0.00 0.00 33.50 32.43 2qkt n PRO 641 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2qkt h PHE 642 N 2.16 0.07 0.00 6.00 -5.15 -1.95 -1.99 116.94 116.08 2qkt h PHE 642 Ca -0.46 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.32 2qkt h PHE 642 Cb 1.30 -0.02 0.00 0.00 0.22 0.00 0.00 35.95 37.45 2qkt h PHE 642 CO 0.48 0.03 0.00 0.00 -2.00 0.00 0.00 178.31 176.82 2qkt n GLN 643 N -4.41 0.07 0.28 6.09 0.00 -1.26 -2.57 117.38 115.57 2qkt n GLN 643 Ca 0.08 0.26 0.14 0.00 0.00 0.00 0.00 57.00 57.48 2qkt n GLN 643 Cb 0.51 -1.50 0.82 0.00 0.00 0.00 0.00 30.24 30.07 2qkt n GLN 643 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 2qkt h VAL 644 N 0.00 0.56 0.00 -0.39 3.04 -1.70 -1.18 116.25 116.58 2qkt h VAL 644 Ca 0.00 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 2qkt h VAL 644 Cb 0.15 1.17 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 2qkt h VAL 644 CO 0.00 0.06 0.00 0.00 -1.01 0.00 0.00 177.57 176.62 2qkt n TYR 646 N -1.54 0.00 -2.24 0.00 0.53 -0.44 -4.31 117.16 109.15 2qkt n TYR 646 Ca 0.04 0.00 -0.04 0.00 -1.02 0.00 0.00 57.90 56.87 2qkt n TYR 646 Cb 0.18 -0.03 -0.01 0.00 -1.03 0.00 0.00 39.34 38.46 2qkt n TYR 646 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2qkt n ALA 647 N 0.26 3.37 -0.10 -0.72 0.00 -1.16 -4.97 120.51 117.19 2qkt n ALA 647 Ca 0.15 -1.02 0.13 0.00 0.00 0.00 0.00 53.44 52.69 2qkt n ALA 647 Cb 0.43 -0.51 0.50 0.00 0.00 0.00 0.00 19.45 19.87 2qkt n ALA 647 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2qkt h LEU 648 N 0.45 0.38 -1.56 0.00 5.85 -1.66 -2.61 115.31 116.16 2qkt h LEU 648 Ca -0.49 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2qkt h LEU 648 Cb 1.43 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.39 2qkt h LEU 648 CO -0.21 0.22 0.00 0.49 -0.34 0.00 0.00 178.44 178.60 2qkt n PHE 649 N -4.47 0.14 -2.24 1.25 0.99 -1.26 -4.89 117.46 106.97 2qkt n PHE 649 Ca 0.11 -0.07 -0.42 0.00 -0.00 0.00 0.00 57.45 57.07 2qkt n PHE 649 Cb 0.41 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.86 2qkt n PHE 649 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 2qkt s LYS 650 N -1.86 4.39 0.00 -1.08 2.20 -0.99 -2.32 119.74 120.08 2qkt s LYS 650 Ca 0.34 2.01 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 2qkt s LYS 650 Cb 0.20 -3.23 0.00 0.00 -1.51 0.00 0.00 37.83 33.30 2qkt s LYS 650 CO 0.31 -0.27 0.00 0.41 -0.36 0.00 0.00 175.35 175.43 2qkt n GLY 651 N 2.67 1.28 3.57 5.54 0.00 -1.26 -4.99 105.19 112.01 2qkt n GLY 651 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2qkt n GLY 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkt s ALA 652 N -3.66 3.16 0.12 4.61 0.00 -0.98 -5.00 121.76 120.01 2qkt s ALA 652 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.24 2qkt s ALA 652 Cb 0.00 -3.80 -0.04 0.00 0.00 0.00 0.00 23.12 19.29 2qkt s ALA 652 CO 0.00 -2.27 -0.15 -0.80 0.00 0.00 0.00 175.76 172.54 2qkt s ASN 653 N 2.53 2.06 0.00 0.00 0.01 -1.26 -4.93 114.94 113.35 2qkt s ASN 653 Ca 0.40 -0.78 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 2qkt s ASN 653 Cb -0.09 -0.08 0.00 0.00 0.41 0.00 0.00 41.25 41.49 2qkt s ASN 653 CO 0.27 -0.11 0.00 0.61 -1.51 0.00 0.00 177.10 176.36 2qkt n GLY 654 N 0.65 -0.24 3.70 0.66 0.00 -1.26 -4.84 105.19 103.86 2qkt n GLY 654 Ca -0.16 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 2qkt n GLY 654 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qkt s LYS 655 N 0.00 4.43 -0.22 1.61 2.20 -1.26 -0.75 119.74 125.75 2qkt s LYS 655 Ca 0.00 1.59 -0.09 0.00 -0.36 0.00 0.00 55.97 57.11 2qkt s LYS 655 Cb 0.00 -3.48 -0.05 0.00 -1.51 0.00 0.00 37.83 32.79 2qkt s LYS 655 CO 0.00 -0.29 0.12 0.08 -0.36 0.00 0.00 175.35 174.90 2qkt s VAL 656 N 1.65 5.13 -0.17 4.02 1.01 0.37 -4.94 120.40 127.46 2qkt s VAL 656 Ca 0.54 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.63 2qkt s VAL 656 Cb -0.24 -3.37 0.02 0.00 0.00 0.00 0.00 36.38 32.79 2qkt s VAL 656 CO 0.24 0.39 -0.20 -0.55 0.00 0.00 0.00 175.10 174.98 2qkt s SER 657 N 0.84 3.18 0.04 3.32 0.15 -1.26 -1.43 113.70 118.54 2qkt s SER 657 Ca 0.06 -0.63 0.06 0.00 0.70 0.00 0.00 55.95 56.15 2qkt s SER 657 Cb -0.13 -1.48 -0.02 0.00 -1.71 0.00 0.00 66.02 62.67 2qkt s SER 657 CO 0.02 0.02 -0.18 -0.04 1.20 0.00 0.00 173.24 174.26 2qkt s MET 658 N 1.17 1.22 -0.15 5.44 -1.94 0.67 -1.14 119.30 124.57 2qkt s MET 658 Ca 0.02 -0.87 -0.03 0.00 -1.71 0.00 0.00 55.69 53.10 2qkt s MET 658 Cb -0.14 -1.30 -0.02 0.00 2.01 0.00 0.00 34.83 35.38 2qkt s MET 658 CO -0.10 0.33 -0.05 -1.21 -0.01 0.00 0.00 175.02 173.98 2qkt s GLU 659 N -1.15 3.62 0.04 2.03 2.02 -0.61 -0.96 118.70 123.69 2qkt s GLU 659 Ca 0.05 -0.55 0.06 0.00 0.02 0.00 0.00 54.97 54.55 2qkt s GLU 659 Cb -0.08 -2.87 -0.02 0.00 0.10 0.00 0.00 34.13 31.25 2qkt s GLU 659 CO 0.02 0.23 -0.17 0.08 0.02 0.00 0.00 175.26 175.43 2qkt s VAL 660 N 0.38 1.35 -0.08 2.63 1.01 0.43 -0.47 120.40 125.66 2qkt s VAL 660 Ca -0.05 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 60.90 2qkt s VAL 660 Cb -0.14 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 2qkt s VAL 660 CO 0.03 0.10 -0.24 -0.89 0.00 0.00 0.00 175.10 174.11 2qkt s THR 661 N -0.81 2.16 -0.23 3.92 2.01 0.01 -1.23 115.64 121.47 2qkt s THR 661 Ca 0.04 -1.01 0.02 0.00 0.31 0.00 0.00 61.69 61.05 2qkt s THR 661 Cb -0.08 -1.80 0.05 0.00 0.01 0.00 0.00 72.50 70.67 2qkt s THR 661 CO 0.01 0.56 -0.14 -0.60 -0.69 0.00 0.00 174.62 173.77 2qkt s ARG 662 N 0.03 2.46 1.09 4.92 3.52 0.23 -0.72 118.95 130.48 2qkt s ARG 662 Ca -0.09 -1.17 -0.13 0.00 -0.13 0.00 0.00 55.73 54.21 2qkt s ARG 662 Cb -0.15 -2.77 0.24 0.00 -1.56 0.00 0.00 34.95 30.71 2qkt s ARG 662 CO 0.06 -0.46 1.06 -2.14 -0.81 0.00 0.00 175.30 173.01 2qkt s PRO 663 N 1.17 -0.35 0.00 5.12 0.02 -1.26 -0.66 135.00 139.03 2qkt s PRO 663 Ca -0.04 0.73 0.12 0.00 0.02 0.00 0.00 61.00 61.83 2qkt s PRO 663 Cb -0.18 -1.63 0.10 0.00 0.02 0.00 0.00 34.50 32.81 2qkt s PRO 663 CO -0.08 -3.31 0.89 0.36 -0.33 0.00 0.00 177.00 174.53