#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qku s GLU 581 N 0.00 3.29 -0.06 3.23 2.02 -1.11 -4.78 118.70 121.29 2qku s GLU 581 Ca 0.00 1.56 0.01 0.00 0.02 0.00 0.00 54.97 56.56 2qku s GLU 581 Cb 0.00 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.25 2qku s GLU 581 CO 0.00 -0.89 -0.07 0.15 0.02 0.00 0.00 175.26 174.47 2qku s LYS 582 N -3.43 1.18 0.24 1.61 1.02 -1.26 -1.04 119.74 118.06 2qku s LYS 582 Ca 0.71 -0.22 -0.10 0.00 0.02 0.00 0.00 55.97 56.38 2qku s LYS 582 Cb -0.23 -1.08 -0.01 0.00 -0.52 0.00 0.00 37.83 35.99 2qku s LYS 582 CO 0.29 -0.05 0.40 -0.59 -0.92 0.00 0.00 175.35 174.48 2qku s PHE 583 N 0.88 0.54 0.19 3.18 -0.12 -0.23 -4.99 117.98 117.43 2qku s PHE 583 Ca -0.11 -0.87 0.10 0.00 -0.05 0.00 0.00 56.93 55.99 2qku s PHE 583 Cb -0.15 0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.23 2qku s PHE 583 CO 0.01 -0.92 -0.15 -0.80 -0.05 0.00 0.00 175.22 173.31 2qku s ASN 584 N -3.05 3.96 -0.12 1.98 -0.87 -1.26 0.18 114.94 115.76 2qku s ASN 584 Ca 0.26 -0.70 -0.01 0.00 -1.57 0.00 0.00 52.86 50.84 2qku s ASN 584 Cb 0.01 -0.55 0.03 0.00 -0.02 0.00 0.00 41.25 40.73 2qku s ASN 584 CO 0.10 0.10 -0.02 -0.69 -2.57 0.00 0.00 177.10 174.02 2qku s VAL 585 N -1.74 0.69 -0.04 1.60 1.01 -1.26 -4.96 120.40 115.70 2qku s VAL 585 Ca 0.24 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.05 2qku s VAL 585 Cb -0.08 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 2qku s VAL 585 CO 0.13 0.19 -0.20 -1.81 0.00 0.00 0.00 175.10 173.42 2qku s ASP 586 N 1.83 2.42 0.00 3.32 1.01 -1.26 -4.20 116.67 119.78 2qku s ASP 586 Ca 0.03 -0.39 0.00 0.00 0.71 0.00 0.00 52.55 52.90 2qku s ASP 586 Cb -0.14 -0.60 0.00 0.00 1.01 0.00 0.00 42.92 43.20 2qku s ASP 586 CO -0.07 0.19 0.00 0.00 0.21 0.00 0.00 175.17 175.50 2qku n LEU 587 N 3.00 0.00 -3.93 1.23 -0.00 -0.27 -4.92 117.00 112.11 2qku n LEU 587 Ca -0.17 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.62 2qku n LEU 587 Cb 0.53 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.78 2qku n LEU 587 CO 0.25 0.00 -0.43 -0.75 -0.00 0.00 0.00 177.39 176.46 2qku s LYS 589 N 3.65 1.12 -0.09 1.47 2.47 -0.02 -0.85 119.74 127.49 2qku s LYS 589 Ca 0.00 -0.20 -0.04 0.00 -1.56 0.00 0.00 55.97 54.17 2qku s LYS 589 Cb 0.00 -1.06 -0.04 0.00 -1.46 0.00 0.00 37.83 35.28 2qku s LYS 589 CO 0.00 -0.07 0.07 0.15 0.16 0.00 0.00 175.35 175.67 2qku s LYS 590 N 0.93 3.20 0.28 4.03 1.02 -1.26 -4.43 119.74 123.51 2qku s LYS 590 Ca -0.11 -0.29 -0.30 0.00 0.02 0.00 0.00 55.97 55.29 2qku s LYS 590 Cb -0.15 -2.98 -0.13 0.00 -0.52 0.00 0.00 37.83 34.06 2qku s LYS 590 CO 0.00 0.73 1.42 0.00 -0.92 0.00 0.00 175.35 176.58 2qku n ALA 591 N 1.93 1.49 -0.88 5.17 0.00 -1.26 -1.78 120.51 125.18 2qku n ALA 591 Ca -0.18 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2qku n ALA 591 Cb 0.54 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2qku n ALA 591 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qku n GLY 592 N 1.73 0.38 3.01 0.00 0.00 -1.26 -4.95 105.19 104.10 2qku n GLY 592 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 2qku n GLY 592 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qku s LYS 593 N -0.74 1.76 0.69 1.61 2.20 -0.73 -5.10 119.74 119.44 2qku s LYS 593 Ca 0.00 -2.17 -0.15 0.00 -0.36 0.00 0.00 55.97 53.29 2qku s LYS 593 Cb 0.00 -3.31 0.02 0.00 -1.51 0.00 0.00 37.83 33.03 2qku s LYS 593 CO 0.00 -1.02 1.15 -1.83 -0.36 0.00 0.00 175.35 173.29 2qku s GLU 594 N 0.45 2.48 0.58 4.03 -1.05 -1.26 -4.48 118.70 119.44 2qku s GLU 594 Ca 0.13 1.56 0.28 0.00 -0.15 0.00 0.00 54.97 56.79 2qku s GLU 594 Cb -0.22 -1.89 1.73 0.00 -0.44 0.00 0.00 34.13 33.31 2qku s GLU 594 CO -0.05 -1.53 2.23 -0.07 0.95 0.00 0.00 175.26 176.79 2qku h LEU 595 N -0.13 0.00 1.10 1.83 3.38 -1.96 -3.47 115.31 116.07 2qku h LEU 595 Ca -0.47 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.31 2qku h LEU 595 Cb 1.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 2qku h LEU 595 CO 0.52 0.01 -0.25 0.61 0.09 0.00 0.00 178.44 179.42 2qku n GLY 596 N -1.33 0.01 3.31 0.83 0.00 -1.26 -4.78 105.19 101.98 2qku n GLY 596 Ca -0.03 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 2qku n GLY 596 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qku s LEU 597 N -2.81 3.43 -0.03 0.99 1.43 -1.26 -0.65 118.68 119.78 2qku s LEU 597 Ca 0.03 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.27 2qku s LEU 597 Cb -0.01 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2qku s LEU 597 CO 0.03 -0.12 0.71 -0.44 0.23 0.00 0.00 176.35 176.76 2qku s SER 598 N 1.47 7.04 0.30 2.29 0.01 0.90 -4.98 113.70 120.73 2qku s SER 598 Ca 0.03 1.25 0.10 0.00 1.31 0.00 0.00 55.95 58.64 2qku s SER 598 Cb -0.16 -2.42 -0.05 0.00 0.21 0.00 0.00 66.02 63.60 2qku s SER 598 CO -0.00 -0.06 -0.04 -0.76 0.41 0.00 0.00 173.24 172.78 2qku s LEU 599 N 0.49 2.95 -0.03 2.44 1.43 -1.26 -0.10 118.68 124.59 2qku s LEU 599 Ca 0.37 -0.90 -0.03 0.00 -1.03 0.00 0.00 54.13 52.53 2qku s LEU 599 Cb -0.18 -1.39 0.01 0.00 0.03 0.00 0.00 46.19 44.65 2qku s LEU 599 CO 0.19 -0.10 0.10 -0.44 0.23 0.00 0.00 176.35 176.33 2qku s SER 600 N -3.65 -0.08 0.46 2.29 0.01 -0.37 -4.73 113.70 107.64 2qku s SER 600 Ca 0.33 0.14 -0.24 0.00 1.31 0.00 0.00 55.95 57.49 2qku s SER 600 Cb -0.03 0.20 -0.08 0.00 0.21 0.00 0.00 66.02 66.31 2qku s SER 600 CO 0.18 -0.07 1.23 -2.65 0.41 0.00 0.00 173.24 172.35 2qku n PRO 601 N 2.87 1.72 -3.86 12.44 -0.02 -1.26 -0.87 135.00 146.02 2qku n PRO 601 Ca -0.13 0.62 -0.10 0.00 -2.02 0.00 0.00 63.50 61.87 2qku n PRO 601 Cb 0.59 -2.36 -0.08 0.00 -0.02 0.00 0.00 33.50 31.62 2qku n PRO 601 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2qku s ASN 602 N -0.70 0.08 0.26 2.55 3.84 -0.54 -4.65 114.94 115.77 2qku s ASN 602 Ca 0.65 -0.49 -0.05 0.00 0.21 0.00 0.00 52.86 53.18 2qku s ASN 602 Cb -0.48 0.30 0.31 0.00 -0.55 0.00 0.00 41.25 40.83 2qku s ASN 602 CO 0.55 -0.62 1.93 -0.08 -2.79 0.00 0.00 177.10 176.09 2qku h GLU 603 N 3.20 1.26 -0.41 0.43 4.81 -2.02 -3.01 114.58 118.85 2qku h GLU 603 Ca -0.33 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 2qku h GLU 603 Cb 1.19 -0.29 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2qku h GLU 603 CO 0.52 0.84 0.00 0.44 -0.73 0.00 0.00 179.01 180.07 2qku n ILE 604 N -4.41 2.30 0.00 2.32 -5.35 -1.26 -4.67 119.36 108.29 2qku n ILE 604 Ca 0.12 -1.59 0.00 0.00 -0.27 0.00 0.00 62.75 61.01 2qku n ILE 604 Cb 0.05 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 37.79 2qku n ILE 604 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qku n GLY 605 N 0.11 0.07 3.19 3.28 0.00 -1.14 -4.20 105.19 106.50 2qku n GLY 605 Ca 0.23 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.88 2qku n GLY 605 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qku s THR 607 N 1.33 3.67 -0.58 0.00 2.01 -0.05 -0.55 115.64 121.48 2qku s THR 607 Ca 0.05 1.48 -0.27 0.00 0.31 0.00 0.00 61.69 63.26 2qku s THR 607 Cb -0.14 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.55 2qku s THR 607 CO -0.09 0.20 1.11 -0.63 -0.69 0.00 0.00 174.62 174.52 2qku s ILE 608 N -1.41 4.13 0.13 1.82 -1.09 -0.15 -1.23 121.20 123.40 2qku s ILE 608 Ca 0.50 0.65 0.09 0.00 -2.23 0.00 0.00 60.65 59.67 2qku s ILE 608 Cb -0.26 -4.67 -0.12 0.00 -1.58 0.00 0.00 42.46 35.82 2qku s ILE 608 CO 0.33 -1.29 1.40 0.00 -1.23 0.00 0.00 174.94 174.15 2qku h ALA 609 N 9.49 0.56 -1.56 9.38 0.00 -0.79 -0.96 119.26 135.39 2qku h ALA 609 Ca -0.26 -0.75 0.28 0.00 0.00 0.00 0.00 54.91 54.18 2qku h ALA 609 Cb 1.06 -0.13 -0.15 0.00 0.00 0.00 0.00 17.79 18.57 2qku h ALA 609 CO 1.16 1.03 0.78 0.34 0.00 0.00 0.00 179.25 182.56 2qku s ASP 610 N -6.70 -0.11 -0.09 0.00 3.68 -1.09 -4.85 116.67 107.50 2qku s ASP 610 Ca 0.01 -0.09 -0.16 0.00 2.13 0.00 0.00 52.55 54.44 2qku s ASP 610 Cb 0.10 0.19 0.04 0.00 -1.45 0.00 0.00 42.92 41.80 2qku s ASP 610 CO 0.79 -0.32 0.40 -1.48 0.13 0.00 0.00 175.17 174.68 2qku s LEU 611 N -2.61 0.49 -0.29 -1.34 2.34 -1.26 -0.07 118.68 115.94 2qku s LEU 611 Ca 0.12 0.54 -0.20 0.00 0.06 0.00 0.00 54.13 54.65 2qku s LEU 611 Cb 0.02 1.46 -0.01 0.00 -0.56 0.00 0.00 46.19 47.09 2qku s LEU 611 CO -0.04 -0.30 0.60 -0.63 -1.06 0.00 0.00 176.35 174.92 2qku s ILE 612 N -0.49 4.97 0.77 1.48 1.01 0.18 -5.02 121.20 124.10 2qku s ILE 612 Ca -0.06 0.87 -0.11 0.00 0.00 0.00 0.00 60.65 61.35 2qku s ILE 612 Cb -0.04 -3.96 0.06 0.00 0.01 0.00 0.00 42.46 38.53 2qku s ILE 612 CO 0.03 -0.09 1.09 -1.10 0.00 0.00 0.00 174.94 174.87 2qku s GLN 613 N 2.53 2.28 0.00 2.79 1.11 -1.26 -3.86 119.66 123.25 2qku s GLN 613 Ca 0.24 1.08 0.00 0.00 0.01 0.00 0.00 55.36 56.69 2qku s GLN 613 Cb -0.15 -1.91 0.00 0.00 -1.01 0.00 0.00 33.01 29.94 2qku s GLN 613 CO 0.11 -1.60 0.00 0.41 0.01 0.00 0.00 175.29 174.22 2qku n GLY 614 N -1.37 0.90 0.07 3.09 0.00 -1.26 -4.90 105.19 101.72 2qku n GLY 614 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 2qku n GLY 614 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2qku h GLN 615 N 2.62 -0.01 -3.22 1.61 5.75 -1.91 -3.45 115.11 116.49 2qku h GLN 615 Ca 0.00 0.00 -0.34 0.00 -0.15 0.00 0.00 58.65 58.16 2qku h GLN 615 Cb 0.00 0.00 -0.38 0.00 1.07 0.00 0.00 27.48 28.18 2qku h GLN 615 CO 0.00 0.74 -0.70 0.71 -2.65 0.00 0.00 178.83 176.93 2qku s TYR 616 N -2.28 -0.04 0.60 3.99 1.51 -1.26 -5.02 117.35 114.86 2qku s TYR 616 Ca -0.15 0.40 0.30 0.00 -1.01 0.00 0.00 57.07 56.61 2qku s TYR 616 Cb -0.02 -0.39 1.67 0.00 -0.11 0.00 0.00 41.96 43.11 2qku s TYR 616 CO 0.55 -0.22 2.06 -1.00 -1.11 0.00 0.00 175.55 175.83 2qku h PRO 617 N 8.40 0.00 -0.00 -1.71 0.13 -1.99 0.36 132.00 137.19 2qku h PRO 617 Ca -0.13 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.88 2qku h PRO 617 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 2qku h PRO 617 CO 0.15 0.00 -0.59 0.93 -0.23 0.00 0.00 178.00 178.26 2qku h GLU 618 N 0.00 0.00 0.00 0.86 3.07 -1.95 -2.00 114.58 114.56 2qku h GLU 618 Ca 0.09 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.94 2qku h GLU 618 Cb 0.60 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.51 2qku h GLU 618 CO -0.00 0.59 -0.05 0.82 -1.40 0.00 0.00 179.01 178.97 2qku h ILE 619 N 0.00 1.56 -0.59 3.13 2.04 -0.73 -3.23 117.51 119.69 2qku h ILE 619 Ca -0.01 -2.18 0.14 0.00 1.00 0.00 0.00 64.86 63.81 2qku h ILE 619 Cb 1.04 2.96 -0.03 0.00 -0.74 0.00 0.00 36.82 40.04 2qku h ILE 619 CO 0.08 0.53 0.41 0.44 0.00 0.00 0.00 178.15 179.60 2qku h ASP 620 N -1.00 0.19 0.89 1.72 3.32 -1.24 -0.96 116.42 119.34 2qku h ASP 620 Ca -0.01 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 2qku h ASP 620 Cb 0.89 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 2qku h ASP 620 CO -0.01 0.10 -0.54 -1.28 -1.72 0.00 0.00 179.24 175.80 2qku h SER 621 N 0.21 0.00 0.00 6.45 0.87 -1.45 -3.42 113.55 116.21 2qku h SER 621 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 2qku h SER 621 Cb 0.84 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 2qku h SER 621 CO -0.05 0.54 -0.74 0.29 -0.53 0.00 0.00 176.83 176.33 2qku n LYS 622 N -3.54 0.00 -2.09 2.24 5.02 -0.78 -5.09 118.16 113.91 2qku n LYS 622 Ca -0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2qku n LYS 622 Cb 0.62 -0.41 0.01 0.00 -0.02 0.00 0.00 35.03 35.24 2qku n LYS 622 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qku s LEU 623 N -5.94 3.88 0.04 -0.35 1.43 -0.43 -5.06 118.68 112.25 2qku s LEU 623 Ca 0.00 2.43 -0.19 0.00 -1.03 0.00 0.00 54.13 55.33 2qku s LEU 623 Cb 0.00 -4.35 0.04 0.00 0.03 0.00 0.00 46.19 41.91 2qku s LEU 623 CO 0.00 -1.24 0.43 0.00 0.23 0.00 0.00 176.35 175.77 2qku s GLN 624 N -2.93 0.93 0.22 1.70 -2.07 -1.26 -4.78 119.66 111.47 2qku s GLN 624 Ca 0.69 -0.31 -0.30 0.00 -1.82 0.00 0.00 55.36 53.62 2qku s GLN 624 Cb -0.31 0.42 -0.15 0.00 -1.09 0.00 0.00 33.01 31.87 2qku s GLN 624 CO 0.37 -0.32 1.00 -2.13 -1.32 0.00 0.00 175.29 172.89 2qku n ARG 625 N 0.56 1.02 0.00 9.60 0.63 -1.26 -1.77 116.66 125.43 2qku n ARG 625 Ca -0.19 0.36 0.00 0.00 -0.92 0.00 0.00 57.85 57.10 2qku n ARG 625 Cb 0.59 -1.73 0.00 0.00 0.45 0.00 0.00 32.46 31.78 2qku n ARG 625 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qku n GLY 626 N 1.68 3.19 3.69 5.14 0.00 -0.36 -4.99 105.19 113.53 2qku n GLY 626 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2qku n GLY 626 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qku s ASP 627 N 0.09 3.31 -0.19 1.61 1.01 -0.73 -4.64 116.67 117.14 2qku s ASP 627 Ca 0.00 2.31 0.01 0.00 0.71 0.00 0.00 52.55 55.57 2qku s ASP 627 Cb 0.00 -2.58 0.03 0.00 1.01 0.00 0.00 42.92 41.38 2qku s ASP 627 CO 0.00 -2.85 -0.13 -0.63 0.21 0.00 0.00 175.17 171.77 2qku s ILE 628 N -2.33 1.73 -0.33 0.77 1.01 0.02 -0.98 121.20 121.08 2qku s ILE 628 Ca 0.71 -0.93 -0.29 0.00 0.00 0.00 0.00 60.65 60.14 2qku s ILE 628 Cb -0.27 -1.71 0.02 0.00 0.01 0.00 0.00 42.46 40.51 2qku s ILE 628 CO 0.53 0.30 1.08 -0.63 0.00 0.00 0.00 174.94 176.23 2qku s ILE 629 N 1.38 4.48 -0.59 2.92 -1.09 0.29 -1.25 121.20 127.35 2qku s ILE 629 Ca 0.01 1.70 0.22 0.00 -2.23 0.00 0.00 60.65 60.35 2qku s ILE 629 Cb -0.15 -4.43 -0.22 0.00 -1.58 0.00 0.00 42.46 36.07 2qku s ILE 629 CO -0.10 -0.53 0.82 0.35 -1.23 0.00 0.00 174.94 174.26 2qku n THR 630 N 5.96 0.06 -3.72 2.92 -2.24 -0.34 -1.14 114.28 115.77 2qku n THR 630 Ca 0.12 -0.23 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 2qku n THR 630 Cb 0.47 0.44 -0.11 0.00 -2.10 0.00 0.00 70.33 69.04 2qku n THR 630 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qku s LYS 631 N -3.22 0.40 -0.19 -0.78 2.20 -1.18 -1.32 119.74 115.65 2qku s LYS 631 Ca 0.02 0.65 0.01 0.00 -0.36 0.00 0.00 55.97 56.29 2qku s LYS 631 Cb 0.15 0.07 0.04 0.00 -1.51 0.00 0.00 37.83 36.58 2qku s LYS 631 CO 0.86 -0.11 -0.10 0.12 -0.36 0.00 0.00 175.35 175.76 2qku s PHE 632 N 0.86 2.25 -1.39 4.03 5.36 -0.67 -1.43 117.98 126.99 2qku s PHE 632 Ca -0.05 -1.46 -0.00 0.00 -0.96 0.00 0.00 56.93 54.46 2qku s PHE 632 Cb -0.06 -1.57 -0.00 0.00 -0.34 0.00 0.00 43.02 41.05 2qku s PHE 632 CO -0.07 -0.71 0.44 0.09 -1.46 0.00 0.00 175.22 173.52 2qku n ASN 633 N 4.73 -0.42 0.00 6.13 3.02 0.12 -1.20 115.26 127.64 2qku n ASN 633 Ca -0.14 -0.99 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 2qku n ASN 633 Cb 0.47 -3.14 0.00 0.00 -0.61 0.00 0.00 39.78 36.50 2qku n ASN 633 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qku n GLY 634 N -1.95 2.94 3.57 7.41 0.00 -1.26 -4.99 105.19 110.91 2qku n GLY 634 Ca -0.31 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 2qku n GLY 634 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qku s ASP 635 N -2.78 6.31 0.17 1.61 1.01 -0.34 -5.02 116.67 117.62 2qku s ASP 635 Ca 0.00 0.10 -0.32 0.00 0.71 0.00 0.00 52.55 53.05 2qku s ASP 635 Cb 0.00 -2.25 -0.11 0.00 1.01 0.00 0.00 42.92 41.56 2qku s ASP 635 CO 0.00 -0.38 1.78 0.00 0.21 0.00 0.00 175.17 176.78 2qku n ALA 636 N 5.60 2.53 0.09 5.23 0.00 -1.26 -1.67 120.51 131.01 2qku n ALA 636 Ca -0.06 0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.70 2qku n ALA 636 Cb 0.49 -2.56 -0.03 0.00 0.00 0.00 0.00 19.45 17.36 2qku n ALA 636 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2qku h LEU 637 N 7.64 0.00 -9.63 0.00 3.38 -1.51 -3.43 115.31 111.76 2qku h LEU 637 Ca -0.45 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.00 2qku h LEU 637 Cb 1.21 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.02 2qku h LEU 637 CO 0.95 0.86 1.03 -0.70 0.09 0.00 0.00 178.44 180.67 2qku s GLU 638 N -2.96 4.13 0.00 1.13 2.12 -1.26 -1.55 118.70 120.31 2qku s GLU 638 Ca 0.01 2.60 0.00 0.00 0.36 0.00 0.00 54.97 57.93 2qku s GLU 638 Cb 0.10 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.33 2qku s GLU 638 CO 0.80 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 175.16 2qku n GLY 639 N 4.01 1.69 3.88 -1.50 0.00 -1.26 -4.99 105.19 107.03 2qku n GLY 639 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2qku n GLY 639 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qku s LEU 640 N 0.00 4.21 0.46 0.99 1.43 -0.60 -5.06 118.68 120.12 2qku s LEU 640 Ca 0.00 0.79 -0.23 0.00 -1.03 0.00 0.00 54.13 53.66 2qku s LEU 640 Cb 0.00 -3.53 -0.07 0.00 0.03 0.00 0.00 46.19 42.62 2qku s LEU 640 CO 0.00 -0.02 1.18 -2.84 0.23 0.00 0.00 176.35 174.90 2qku s PRO 641 N -2.74 3.73 0.25 1.29 0.02 -1.26 -4.89 135.00 131.40 2qku s PRO 641 Ca 0.45 1.83 -0.03 0.00 0.02 0.00 0.00 61.00 63.26 2qku s PRO 641 Cb -0.12 -2.42 0.45 0.00 0.02 0.00 0.00 34.50 32.44 2qku s PRO 641 CO 0.22 -0.59 1.79 0.35 -0.33 0.00 0.00 177.00 178.45 2qku h PHE 642 N 2.05 0.83 -1.01 6.54 3.57 -1.97 -1.86 116.94 125.10 2qku h PHE 642 Ca -0.49 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.14 2qku h PHE 642 Cb 1.25 -0.25 -0.08 0.00 2.79 0.00 0.00 35.95 39.67 2qku h PHE 642 CO 0.53 0.29 0.64 1.96 -2.23 0.00 0.00 178.31 179.50 2qku h GLN 643 N 0.73 1.04 -0.22 1.11 4.20 -1.99 0.68 115.11 120.65 2qku h GLN 643 Ca 0.43 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 59.02 2qku h GLN 643 Cb 0.48 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2qku h GLN 643 CO -0.29 0.68 -0.05 0.28 -0.67 0.00 0.00 178.83 178.78 2qku h VAL 644 N 1.07 1.28 -0.33 -0.54 2.07 -1.72 -0.19 116.25 117.88 2qku h VAL 644 Ca 0.47 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.98 2qku h VAL 644 Cb 0.37 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 2qku h VAL 644 CO -0.23 0.32 0.16 0.00 0.02 0.00 0.00 177.57 177.84 2qku h TYR 646 N 0.33 1.00 -0.56 0.00 3.20 -0.78 -1.71 116.97 118.45 2qku h TYR 646 Ca 0.14 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 2qku h TYR 646 Cb 0.06 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 2qku h TYR 646 CO -0.10 0.54 0.02 0.00 -1.64 0.00 0.00 178.16 176.97 2qku h ALA 647 N 1.39 0.98 -0.51 1.82 0.00 0.07 -1.91 119.26 121.10 2qku h ALA 647 Ca 0.36 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2qku h ALA 647 Cb 0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2qku h ALA 647 CO -0.15 0.63 0.17 -0.07 0.00 0.00 0.00 179.25 179.82 2qku h LEU 648 N 0.88 0.74 -0.59 0.00 4.07 -0.02 0.14 115.31 120.53 2qku h LEU 648 Ca 0.17 -0.20 -0.12 0.00 0.08 0.00 0.00 57.88 57.80 2qku h LEU 648 Cb 0.49 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.02 2qku h LEU 648 CO 0.02 0.74 -0.21 -0.26 -1.08 0.00 0.00 178.44 177.66 2qku h PHE 649 N 0.69 1.03 -0.30 1.13 -1.00 -1.22 -2.67 116.94 114.60 2qku h PHE 649 Ca 0.17 -0.24 -0.09 0.00 2.81 0.00 0.00 57.97 60.61 2qku h PHE 649 Cb 0.26 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 2qku h PHE 649 CO 0.01 1.02 -0.17 -0.22 -1.61 0.00 0.00 178.31 177.35 2qku h LYS 650 N 0.79 0.65 -0.34 1.51 3.64 -1.16 -3.00 116.57 118.66 2qku h LYS 650 Ca 0.11 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 2qku h LYS 650 Cb 0.76 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 2qku h LYS 650 CO 0.06 0.88 0.00 0.41 -2.27 0.00 0.00 179.45 178.54 2qku n GLY 651 N -0.01 0.22 3.61 5.01 0.00 0.02 -4.93 105.19 109.12 2qku n GLY 651 Ca -0.03 -0.17 -0.51 0.00 0.00 0.00 0.00 46.02 45.31 2qku n GLY 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qku n ALA 652 N -0.02 -0.46 -3.05 4.61 0.00 -1.01 -4.99 120.51 115.60 2qku n ALA 652 Ca 0.05 0.50 -0.12 0.00 0.00 0.00 0.00 53.44 53.87 2qku n ALA 652 Cb 0.20 -2.14 -0.11 0.00 0.00 0.00 0.00 19.45 17.40 2qku n ALA 652 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qku s ASN 653 N 0.67 -0.06 1.07 0.00 4.22 -1.26 -4.99 114.94 114.60 2qku s ASN 653 Ca 0.84 0.05 0.00 0.00 -2.14 0.00 0.00 52.86 51.60 2qku s ASN 653 Cb -0.90 0.25 0.00 0.00 1.28 0.00 0.00 41.25 41.88 2qku s ASN 653 CO 0.45 -0.19 0.00 0.61 -2.04 0.00 0.00 177.10 175.94 2qku n GLY 654 N 2.33 2.76 3.71 0.45 0.00 -1.26 -4.68 105.19 108.49 2qku n GLY 654 Ca -0.17 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.04 2qku n GLY 654 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qku s LYS 655 N 0.00 4.22 -0.13 1.61 1.02 -1.26 -0.84 119.74 124.36 2qku s LYS 655 Ca 0.00 2.31 0.02 0.00 0.02 0.00 0.00 55.97 58.33 2qku s LYS 655 Cb 0.00 -3.31 0.01 0.00 -0.52 0.00 0.00 37.83 34.01 2qku s LYS 655 CO 0.00 -0.63 -0.21 0.08 -0.92 0.00 0.00 175.35 173.67 2qku s VAL 656 N 1.61 1.96 0.29 3.17 1.01 -0.03 -4.92 120.40 123.49 2qku s VAL 656 Ca 0.71 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.79 2qku s VAL 656 Cb -0.42 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.17 2qku s VAL 656 CO 0.31 0.53 0.06 -0.55 0.00 0.00 0.00 175.10 175.46 2qku s SER 657 N 0.83 1.95 -0.24 3.32 0.15 -1.26 -1.12 113.70 117.34 2qku s SER 657 Ca -0.07 -1.36 -0.10 0.00 0.70 0.00 0.00 55.95 55.11 2qku s SER 657 Cb -0.15 0.00 0.09 0.00 -1.71 0.00 0.00 66.02 64.25 2qku s SER 657 CO -0.01 -0.63 0.54 -1.61 1.20 0.00 0.00 173.24 172.72 2qku s GLU 659 N -3.93 0.49 -0.00 5.44 2.02 -0.51 0.16 118.70 122.36 2qku s GLU 659 Ca 0.36 1.13 0.06 0.00 0.02 0.00 0.00 54.97 56.55 2qku s GLU 659 Cb 0.08 0.35 -0.03 0.00 0.10 0.00 0.00 34.13 34.63 2qku s GLU 659 CO 0.14 -0.19 -0.19 0.08 0.02 0.00 0.00 175.26 175.12 2qku s VAL 660 N 2.20 2.68 -0.10 2.63 1.01 0.13 -1.20 120.40 127.74 2qku s VAL 660 Ca -0.06 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.91 2qku s VAL 660 Cb -0.10 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.23 2qku s VAL 660 CO -0.16 0.47 -0.19 -0.89 0.00 0.00 0.00 175.10 174.33 2qku s THR 661 N -0.79 1.73 -0.10 3.92 2.01 -0.38 -1.07 115.64 120.97 2qku s THR 661 Ca 0.12 -0.81 0.04 0.00 0.31 0.00 0.00 61.69 61.35 2qku s THR 661 Cb -0.10 -1.53 0.00 0.00 0.01 0.00 0.00 72.50 70.87 2qku s THR 661 CO 0.02 0.49 -0.24 0.00 -0.69 0.00 0.00 174.62 174.20 2qku s ARG 662 N 0.64 3.01 0.00 4.92 1.70 -0.21 -0.80 118.95 128.22 2qku s ARG 662 Ca -0.13 -0.87 0.00 0.00 -0.47 0.00 0.00 55.73 54.26 2qku s ARG 662 Cb -0.16 -2.28 0.00 0.00 -0.57 0.00 0.00 34.95 31.94 2qku s ARG 662 CO 0.04 0.17 0.32 -2.30 -1.08 0.00 0.00 175.30 172.45