#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvb s ALA 579 N 0.00 -1.11 -0.56 -1.84 0.00 -1.26 -5.11 121.76 111.89 2kvb s ALA 579 Ca 0.00 1.53 -0.24 0.00 0.00 0.00 0.00 51.96 53.25 2kvb s ALA 579 Cb 0.00 -1.11 0.04 0.00 0.00 0.00 0.00 23.12 22.05 2kvb s ALA 579 CO 0.00 -0.48 0.96 -1.83 0.00 0.00 0.00 175.76 174.41 2kvb s GLU 580 N 1.92 3.33 -0.61 0.00 -1.05 -1.26 -4.98 118.70 116.05 2kvb s GLU 580 Ca -0.06 -0.27 -0.28 0.00 -0.15 0.00 0.00 54.97 54.22 2kvb s GLU 580 Cb -0.10 -4.06 0.02 0.00 -0.44 0.00 0.00 34.13 29.55 2kvb s GLU 580 CO -0.13 -1.51 1.41 0.00 0.95 0.00 0.00 175.26 175.98 2kvb s ALA 581 N 4.01 2.74 -0.05 -0.84 0.00 -1.26 -4.80 121.76 121.56 2kvb s ALA 581 Ca 0.31 -0.85 0.13 0.00 0.00 0.00 0.00 51.96 51.55 2kvb s ALA 581 Cb -0.12 -4.16 -0.17 0.00 0.00 0.00 0.00 23.12 18.67 2kvb s ALA 581 CO 0.19 -3.10 0.89 0.93 0.00 0.00 0.00 175.76 174.68 2kvb h GLU 582 N 11.10 0.00 -5.67 0.00 5.08 -2.05 -3.45 114.58 119.60 2kvb h GLU 582 Ca -0.27 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.43 2kvb h GLU 582 Cb 1.09 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.20 2kvb h GLU 582 CO 1.21 0.51 -0.58 -0.06 -1.00 0.00 0.00 179.01 179.08 2kvb s PHE 583 N -2.76 3.27 -1.33 4.33 0.08 -1.26 -5.01 117.98 115.30 2kvb s PHE 583 Ca -0.02 0.20 -0.12 0.00 0.12 0.00 0.00 56.93 57.11 2kvb s PHE 583 Cb 0.08 -1.91 0.12 0.00 -0.57 0.00 0.00 43.02 40.75 2kvb s PHE 583 CO 0.81 0.41 1.91 1.28 -0.10 0.00 0.00 175.22 179.53 2kvb n LEU 584 N 2.57 6.39 -0.51 -0.37 7.99 -1.26 -4.20 117.00 127.61 2kvb n LEU 584 Ca -0.18 -4.41 0.06 0.00 -0.01 0.00 0.00 56.01 51.47 2kvb n LEU 584 Cb 0.53 -1.57 0.10 0.00 -0.11 0.00 0.00 43.42 42.38 2kvb n LEU 584 CO 0.31 1.11 0.37 -1.54 -1.51 0.00 0.00 177.39 176.13 2kvb n SER 585 N 5.14 1.43 -4.30 -1.43 3.41 -1.26 -5.01 113.62 111.60 2kvb n SER 585 Ca 0.44 -2.86 -0.32 0.00 -0.26 0.00 0.00 58.87 55.88 2kvb n SER 585 Cb 0.39 -0.38 -0.16 0.00 -0.26 0.00 0.00 64.21 63.80 2kvb n SER 585 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2kvb s ARG 586 N -1.84 2.59 0.00 4.33 3.52 -1.24 -1.50 118.95 124.81 2kvb s ARG 586 Ca 0.26 -0.87 0.02 0.00 -0.13 0.00 0.00 55.73 55.01 2kvb s ARG 586 Cb 0.25 -2.21 -0.01 0.00 -1.56 0.00 0.00 34.95 31.42 2kvb s ARG 586 CO -0.03 0.40 -0.06 -0.08 -0.81 0.00 0.00 175.30 174.72 2kvb s THR 587 N -0.21 0.45 -0.15 4.11 -1.32 -0.45 -4.94 115.64 113.13 2kvb s THR 587 Ca -0.02 -0.39 0.02 0.00 -1.21 0.00 0.00 61.69 60.09 2kvb s THR 587 Cb -0.13 -0.41 0.01 0.00 -1.51 0.00 0.00 72.50 70.46 2kvb s THR 587 CO 0.03 0.03 -0.21 -0.70 -2.21 0.00 0.00 174.62 171.56 2kvb s GLU 588 N -0.40 2.95 0.00 7.08 2.12 -1.26 -0.35 118.70 128.83 2kvb s GLU 588 Ca -0.00 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.50 2kvb s GLU 588 Cb -0.04 -2.43 0.00 0.00 0.26 0.00 0.00 34.13 31.92 2kvb s GLU 588 CO -0.00 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.05 2kvb n GLY 589 N 4.24 0.68 0.00 -1.50 0.00 0.63 -4.98 105.19 104.26 2kvb n GLY 589 Ca -0.20 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 43.97 2kvb n GLY 589 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kvb n ASP 590 N -0.11 1.92 -2.20 1.61 2.03 -1.26 -4.37 116.55 114.17 2kvb n ASP 590 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 2kvb n ASP 590 Cb 0.00 0.08 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 2kvb n ASP 590 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2kvb n ASN 591 N -1.68 0.34 -0.49 1.67 3.02 -1.25 -4.17 115.26 112.69 2kvb n ASN 591 Ca 0.00 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 2kvb n ASN 591 Cb 0.22 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 2kvb n ASN 591 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kvb s THR 593 N -1.01 1.12 -0.00 0.00 -4.23 -1.26 -1.37 115.64 108.89 2kvb s THR 593 Ca 0.00 -1.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.56 2kvb s THR 593 Cb 0.00 -1.02 -0.01 0.00 1.34 0.00 0.00 72.50 72.81 2kvb s THR 593 CO 0.00 0.01 -0.14 0.54 -0.54 0.00 0.00 174.62 174.50 2kvb s VAL 594 N -0.84 1.08 -0.07 2.29 0.11 -0.18 -4.34 120.40 118.44 2kvb s VAL 594 Ca 0.02 -0.65 0.01 0.00 -2.93 0.00 0.00 61.98 58.43 2kvb s VAL 594 Cb -0.08 -0.91 0.02 0.00 -1.53 0.00 0.00 36.38 33.88 2kvb s VAL 594 CO 0.01 0.26 -0.08 0.12 -3.33 0.00 0.00 175.10 172.08 2kvb s PHE 595 N -0.40 1.20 -0.11 1.54 5.36 -1.26 0.08 117.98 124.38 2kvb s PHE 595 Ca 0.05 -0.46 -0.02 0.00 -0.96 0.00 0.00 56.93 55.54 2kvb s PHE 595 Cb -0.06 -0.97 -0.03 0.00 -0.34 0.00 0.00 43.02 41.63 2kvb s PHE 595 CO -0.00 -0.31 -0.03 0.16 -1.46 0.00 0.00 175.22 173.58 2kvb s ASP 596 N 1.06 4.92 0.33 6.13 -4.77 -1.16 -4.83 116.67 118.35 2kvb s ASP 596 Ca -0.08 -0.00 0.13 0.00 -3.30 0.00 0.00 52.55 49.30 2kvb s ASP 596 Cb -0.14 -1.52 0.58 0.00 -1.09 0.00 0.00 42.92 40.75 2kvb s ASP 596 CO -0.01 0.29 1.73 0.77 0.70 0.00 0.00 175.17 178.65 2kvb h SER 597 N 5.79 0.00 0.19 2.11 4.64 -1.95 -1.81 113.55 122.53 2kvb h SER 597 Ca -0.43 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.63 2kvb h SER 597 Cb 1.19 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.30 2kvb h SER 597 CO 0.57 0.47 -1.18 0.06 -0.87 0.00 0.00 176.83 175.88 2kvb h GLN 598 N 0.00 0.40 0.00 4.77 -0.00 -1.94 -3.28 115.11 115.05 2kvb h GLN 598 Ca -0.00 -0.68 -0.05 0.00 -0.00 0.00 0.00 58.65 57.92 2kvb h GLN 598 Cb 0.88 0.25 -0.01 0.00 -0.00 0.00 0.00 27.48 28.60 2kvb h GLN 598 CO 0.06 1.32 -0.79 0.00 -0.00 0.00 0.00 178.83 179.43 2kvb h ALA 599 N 0.10 0.67 -4.00 0.06 0.00 -1.99 -3.47 119.26 110.63 2kvb h ALA 599 Ca -0.21 -0.23 -0.27 0.00 0.00 0.00 0.00 54.91 54.19 2kvb h ALA 599 Cb 1.89 0.05 0.08 0.00 0.00 0.00 0.00 17.79 19.80 2kvb h ALA 599 CO 0.19 0.27 -0.44 0.41 0.00 0.00 0.00 179.25 179.68 2kvb n GLY 600 N 1.21 -0.06 3.06 0.00 0.00 -0.68 -5.01 105.19 103.71 2kvb n GLY 600 Ca -0.01 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 2kvb n GLY 600 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kvb s PHE 601 N -3.16 1.42 -0.13 1.61 0.08 -1.22 -4.99 117.98 111.60 2kvb s PHE 601 Ca 0.35 -0.43 -0.15 0.00 0.12 0.00 0.00 56.93 56.82 2kvb s PHE 601 Cb -0.16 -0.99 -0.05 0.00 -0.57 0.00 0.00 43.02 41.26 2kvb s PHE 601 CO 0.44 -0.18 0.37 -1.54 -0.10 0.00 0.00 175.22 174.21 2kvb s SER 602 N 0.26 6.57 -0.11 1.36 1.04 -1.26 -3.01 113.70 118.54 2kvb s SER 602 Ca -0.07 0.67 0.03 0.00 0.48 0.00 0.00 55.95 57.07 2kvb s SER 602 Cb -0.12 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.78 2kvb s SER 602 CO 0.02 0.09 -0.22 -0.36 0.98 0.00 0.00 173.24 173.75 2kvb s PHE 603 N 0.33 2.61 -0.35 5.02 0.08 0.11 -5.00 117.98 120.79 2kvb s PHE 603 Ca 0.21 -1.08 -0.13 0.00 0.12 0.00 0.00 56.93 56.05 2kvb s PHE 603 Cb -0.14 -1.75 -0.01 0.00 -0.57 0.00 0.00 43.02 40.55 2kvb s PHE 603 CO 0.07 -0.45 0.26 -0.51 -0.10 0.00 0.00 175.22 174.50 2kvb s ASP 604 N 0.46 6.08 -0.04 1.36 1.01 -1.26 -1.01 116.67 123.27 2kvb s ASP 604 Ca -0.15 -0.45 0.17 0.00 0.71 0.00 0.00 52.55 52.83 2kvb s ASP 604 Cb -0.17 -2.15 0.53 0.00 1.01 0.00 0.00 42.92 42.14 2kvb s ASP 604 CO 0.06 -0.27 1.44 0.18 0.21 0.00 0.00 175.17 176.80 2kvb n LEU 605 N 5.15 3.75 0.07 1.23 7.99 -0.47 -4.56 117.00 130.16 2kvb n LEU 605 Ca -0.12 -2.19 -0.13 0.00 -0.01 0.00 0.00 56.01 53.57 2kvb n LEU 605 Cb 0.49 -0.42 -0.07 0.00 -0.11 0.00 0.00 43.42 43.31 2kvb n LEU 605 CO 0.38 0.83 0.84 0.74 -1.51 0.00 0.00 177.39 178.66 2kvb h THR 606 N 3.18 0.94 0.00 -5.08 2.02 -1.81 -2.57 112.91 109.59 2kvb h THR 606 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2kvb h THR 606 Cb 1.03 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 2kvb h THR 606 CO 0.07 0.01 0.00 1.55 0.37 0.00 0.00 175.52 177.52 2kvb h PRO 607 N -0.10 0.00 0.00 6.66 0.13 -1.92 -1.43 132.00 135.34 2kvb h PRO 607 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2kvb h PRO 607 Cb 0.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.21 2kvb h PRO 607 CO 0.02 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.07 2kvb n LEU 608 N -2.92 0.57 -4.72 1.56 7.99 -0.97 -4.76 117.00 113.75 2kvb n LEU 608 Ca -0.03 0.60 -0.42 0.00 -0.01 0.00 0.00 56.01 56.15 2kvb n LEU 608 Cb 0.07 -0.47 -0.03 0.00 -0.11 0.00 0.00 43.42 42.88 2kvb n LEU 608 CO 0.18 -0.33 0.79 -0.89 -1.51 0.00 0.00 177.39 175.64 2kvb s THR 609 N -3.17 4.27 0.00 -5.08 2.01 -0.54 -4.30 115.64 108.84 2kvb s THR 609 Ca 0.08 1.70 0.03 0.00 0.31 0.00 0.00 61.69 63.81 2kvb s THR 609 Cb 0.11 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.53 2kvb s THR 609 CO 0.47 0.17 -0.09 -0.54 -0.69 0.00 0.00 174.62 173.94 2kvb s LYS 610 N 0.70 0.71 0.08 4.92 1.02 -1.26 -5.01 119.74 120.90 2kvb s LYS 610 Ca 0.54 -0.41 -0.15 0.00 0.02 0.00 0.00 55.97 55.97 2kvb s LYS 610 Cb -0.27 -0.67 -0.14 0.00 -0.52 0.00 0.00 37.83 36.23 2kvb s LYS 610 CO 0.30 0.18 1.31 -0.22 -0.92 0.00 0.00 175.35 176.00 2kvb h LYS 611 N 5.66 0.66 0.00 1.68 3.64 -1.95 -2.63 116.57 123.62 2kvb h LYS 611 Ca -0.32 -0.47 -0.01 0.00 -1.27 0.00 0.00 60.65 58.58 2kvb h LYS 611 Cb 1.18 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2kvb h LYS 611 CO 0.48 1.09 -0.06 -0.44 -2.27 0.00 0.00 179.45 178.25 2kvb h ASP 612 N 0.34 0.00 -3.46 4.20 3.32 -1.96 -3.13 116.42 115.73 2kvb h ASP 612 Ca -0.01 0.00 0.31 0.00 0.02 0.00 0.00 57.03 57.35 2kvb h ASP 612 Cb 1.13 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.59 2kvb h ASP 612 CO 0.11 0.06 -0.50 0.00 -1.72 0.00 0.00 179.24 177.20 2kvb n ALA 613 N -2.33 -2.99 -2.79 3.45 0.00 -0.99 -4.85 120.51 110.01 2kvb n ALA 613 Ca -0.02 0.41 -0.34 0.00 0.00 0.00 0.00 53.44 53.48 2kvb n ALA 613 Cb 0.16 -1.06 -0.10 0.00 0.00 0.00 0.00 19.45 18.44 2kvb n ALA 613 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2kvb s TYR 614 N -2.24 3.12 -0.15 0.00 1.51 0.19 -4.96 117.35 114.83 2kvb s TYR 614 Ca 0.00 0.01 0.01 0.00 -1.01 0.00 0.00 57.07 56.08 2kvb s TYR 614 Cb 0.00 -1.88 -0.00 0.00 -0.11 0.00 0.00 41.96 39.96 2kvb s TYR 614 CO 0.00 0.26 -0.16 0.21 -1.11 0.00 0.00 175.55 174.75 2kvb s LYS 615 N -0.29 3.23 -0.12 -0.62 2.20 -1.26 -0.53 119.74 122.35 2kvb s LYS 615 Ca 0.06 -0.75 -0.04 0.00 -0.36 0.00 0.00 55.97 54.88 2kvb s LYS 615 Cb -0.12 -2.59 -0.04 0.00 -1.51 0.00 0.00 37.83 33.57 2kvb s LYS 615 CO 0.02 0.06 0.04 0.08 -0.36 0.00 0.00 175.35 175.20 2kvb s VAL 616 N 0.70 4.66 -0.02 4.02 1.01 0.73 -4.93 120.40 126.56 2kvb s VAL 616 Ca -0.07 -0.10 0.07 0.00 0.00 0.00 0.00 61.98 61.87 2kvb s VAL 616 Cb -0.16 -3.01 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 2kvb s VAL 616 CO 0.02 0.58 -0.24 -1.61 0.00 0.00 0.00 175.10 173.85 2kvb s GLU 617 N -0.62 2.18 0.00 2.72 2.02 -1.26 0.11 118.70 123.85 2kvb s GLU 617 Ca 0.11 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.21 2kvb s GLU 617 Cb -0.12 -2.10 0.00 0.00 0.10 0.00 0.00 34.13 32.01 2kvb s GLU 617 CO 0.02 0.57 0.00 0.25 0.02 0.00 0.00 175.26 176.12 2kvb n THR 618 N 2.41 0.00 0.08 3.63 -2.24 0.10 -4.98 114.28 113.28 2kvb n THR 618 Ca -0.16 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2kvb n THR 618 Cb 0.51 0.00 0.29 0.00 -2.10 0.00 0.00 70.33 69.03 2kvb n THR 618 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2kvb h ASP 619 N 0.00 0.29 0.00 3.42 3.32 -2.04 -3.37 116.42 118.05 2kvb h ASP 619 Ca 0.00 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2kvb h ASP 619 Cb 0.00 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.47 2kvb h ASP 619 CO 0.00 0.54 0.00 0.29 -1.72 0.00 0.00 179.24 178.35 2kvb n LYS 620 N -4.16 0.79 -4.27 3.56 5.02 -1.26 -4.94 118.16 112.90 2kvb n LYS 620 Ca -0.01 -0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.10 2kvb n LYS 620 Cb 0.36 -0.26 -0.10 0.00 -0.02 0.00 0.00 35.03 35.01 2kvb n LYS 620 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2kvb s TYR 621 N -0.12 1.33 0.06 2.13 1.51 -1.26 -0.94 117.35 120.06 2kvb s TYR 621 Ca 0.00 -0.88 0.04 0.00 -1.01 0.00 0.00 57.07 55.22 2kvb s TYR 621 Cb 0.00 -0.73 -0.03 0.00 -0.11 0.00 0.00 41.96 41.09 2kvb s TYR 621 CO 0.00 -0.04 -0.12 -1.83 -1.11 0.00 0.00 175.55 172.44 2kvb s GLU 622 N -3.83 0.76 -0.17 -0.62 -1.05 -0.81 0.01 118.70 112.99 2kvb s GLU 622 Ca 0.22 -0.86 0.01 0.00 -0.15 0.00 0.00 54.97 54.19 2kvb s GLU 622 Cb 0.05 -0.71 0.01 0.00 -0.44 0.00 0.00 34.13 33.04 2kvb s GLU 622 CO 0.04 0.16 -0.18 -0.06 0.95 0.00 0.00 175.26 176.17 2kvb s PHE 623 N -1.20 2.77 -0.22 4.83 0.08 0.12 -2.36 117.98 121.99 2kvb s PHE 623 Ca -0.03 -1.36 -0.05 0.00 0.12 0.00 0.00 56.93 55.60 2kvb s PHE 623 Cb -0.09 -1.90 -0.02 0.00 -0.57 0.00 0.00 43.02 40.43 2kvb s PHE 623 CO 0.02 -0.66 0.01 -1.58 -0.10 0.00 0.00 175.22 172.91 2kvb s HIS 624 N 1.08 3.03 0.04 0.36 2.46 -0.20 -0.19 115.29 121.87 2kvb s HIS 624 Ca -0.00 -0.54 -0.00 0.00 0.47 0.00 0.00 55.06 54.98 2kvb s HIS 624 Cb -0.14 -2.13 -0.03 0.00 -0.13 0.00 0.00 32.58 30.15 2kvb s HIS 624 CO -0.06 -0.33 -0.03 0.96 -2.47 0.00 0.00 174.74 172.80 2kvb s ILE 625 N 1.25 0.21 0.05 0.89 -4.36 0.31 -0.74 121.20 118.81 2kvb s ILE 625 Ca 0.04 -1.49 0.03 0.00 -0.26 0.00 0.00 60.65 58.97 2kvb s ILE 625 Cb -0.15 -1.07 -0.02 0.00 1.25 0.00 0.00 42.46 42.47 2kvb s ILE 625 CO 0.01 -0.81 -0.09 0.21 0.24 0.00 0.00 174.94 174.51 2kvb s ASN 626 N -2.39 1.02 -0.49 4.36 2.47 -0.86 -0.63 114.94 118.42 2kvb s ASN 626 Ca -0.01 -0.55 -0.28 0.00 0.42 0.00 0.00 52.86 52.44 2kvb s ASN 626 Cb 0.01 0.01 0.03 0.00 -1.45 0.00 0.00 41.25 39.86 2kvb s ASN 626 CO -0.06 -0.17 1.08 -0.69 -3.72 0.00 0.00 177.10 173.54 2kvb s VAL 627 N -1.31 4.26 0.18 -5.21 1.01 -1.26 -4.79 120.40 113.28 2kvb s VAL 627 Ca -0.08 1.04 0.00 0.00 0.00 0.00 0.00 61.98 62.94 2kvb s VAL 627 Cb -0.10 -4.57 0.00 0.00 0.00 0.00 0.00 36.38 31.71 2kvb s VAL 627 CO 0.01 -1.01 0.00 0.00 0.00 0.00 0.00 175.10 174.10 2kvb n GLY 629 N -1.45 0.34 4.01 0.00 0.00 0.14 -4.84 105.19 103.38 2kvb n GLY 629 Ca 0.00 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 44.93 2kvb n GLY 629 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kvb s PRO 630 N 0.00 2.66 -0.13 1.61 0.04 -1.26 -2.90 135.00 135.01 2kvb s PRO 630 Ca 0.00 -1.22 -0.01 0.00 0.04 0.00 0.00 61.00 59.81 2kvb s PRO 630 Cb 0.00 -2.68 -0.02 0.00 0.04 0.00 0.00 34.50 31.84 2kvb s PRO 630 CO 0.00 -0.48 -0.11 0.54 0.04 0.00 0.00 177.00 176.99 2kvb s VAL 631 N -2.50 3.26 -1.06 -0.36 0.11 0.18 -4.76 120.40 115.27 2kvb s VAL 631 Ca 0.57 -0.59 -0.12 0.00 -2.93 0.00 0.00 61.98 58.91 2kvb s VAL 631 Cb -0.09 -2.38 0.22 0.00 -1.53 0.00 0.00 36.38 32.60 2kvb s VAL 631 CO 0.35 0.52 1.12 -0.44 -3.33 0.00 0.00 175.10 173.32 2kvb s SER 632 N 0.29 7.07 -0.15 3.54 0.01 -1.18 -4.62 113.70 118.66 2kvb s SER 632 Ca -0.08 -3.09 -0.03 0.00 1.31 0.00 0.00 55.95 54.05 2kvb s SER 632 Cb -0.15 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 2kvb s SER 632 CO 0.05 -0.54 -0.05 -0.69 0.41 0.00 0.00 173.24 172.42 2kvb s VAL 633 N 0.15 3.80 0.00 3.43 1.01 -1.26 -4.64 120.40 122.89 2kvb s VAL 633 Ca 0.31 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 2kvb s VAL 633 Cb -0.08 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 2kvb s VAL 633 CO -0.06 0.50 2.06 0.61 0.00 0.00 0.00 175.10 178.20 2kvb n GLY 634 N 3.54 2.36 0.00 4.51 0.00 -1.26 -2.23 105.19 112.11 2kvb n GLY 634 Ca -0.17 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2kvb n GLY 634 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvb n ALA 635 N 1.77 0.00 -2.47 4.61 0.00 -1.26 -5.12 120.51 118.04 2kvb n ALA 635 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.39 2kvb n ALA 635 Cb 0.51 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.86 2kvb n ALA 635 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kvb n PRO 637 N 0.60 2.13 0.05 0.00 -0.02 -1.26 -4.55 135.00 131.94 2kvb n PRO 637 Ca -0.17 0.76 0.06 0.00 -2.02 0.00 0.00 63.50 62.13 2kvb n PRO 637 Cb 0.58 -2.63 0.27 0.00 -0.02 0.00 0.00 33.50 31.70 2kvb n PRO 637 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kvb n PRO 638 N -0.41 0.05 0.00 0.52 -0.02 -1.26 -1.69 135.00 132.19 2kvb n PRO 638 Ca 0.06 0.46 0.15 0.00 -2.02 0.00 0.00 63.50 62.15 2kvb n PRO 638 Cb 0.42 -1.65 0.82 0.00 -0.02 0.00 0.00 33.50 33.08 2kvb n PRO 638 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2kvb n ASP 639 N -1.76 0.00 -4.89 2.55 8.00 -1.26 -4.48 116.55 114.71 2kvb n ASP 639 Ca 0.01 -0.50 -0.34 0.00 0.71 0.00 0.00 54.79 54.67 2kvb n ASP 639 Cb 0.08 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.12 40.97 2kvb n ASP 639 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2kvb s SER 640 N -2.33 6.34 -0.01 -2.24 0.15 -0.68 -0.04 113.70 114.89 2kvb s SER 640 Ca 0.36 0.37 0.16 0.00 0.70 0.00 0.00 55.95 57.54 2kvb s SER 640 Cb 0.21 -2.00 -0.20 0.00 -1.71 0.00 0.00 66.02 62.31 2kvb s SER 640 CO 0.41 0.31 0.56 0.61 1.20 0.00 0.00 173.24 176.33 2kvb n GLY 641 N 1.26 -0.57 3.39 9.45 0.00 0.05 0.48 105.19 119.24 2kvb n GLY 641 Ca -0.14 -0.43 -0.07 0.00 0.00 0.00 0.00 46.02 45.39 2kvb n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvb s ALA 642 N -2.71 -1.40 -0.02 4.61 0.00 -1.16 -2.04 121.76 119.04 2kvb s ALA 642 Ca 0.02 1.80 -0.01 0.00 0.00 0.00 0.00 51.96 53.77 2kvb s ALA 642 Cb 0.11 -1.34 0.01 0.00 0.00 0.00 0.00 23.12 21.91 2kvb s ALA 642 CO 0.66 -0.64 0.04 0.00 0.00 0.00 0.00 175.76 175.82 2kvb s GLN 644 N 0.46 2.83 -0.03 0.00 -2.07 -0.72 -1.03 119.66 119.09 2kvb s GLN 644 Ca -0.04 -0.59 0.01 0.00 -1.82 0.00 0.00 55.36 52.93 2kvb s GLN 644 Cb -0.05 -2.70 0.01 0.00 -1.09 0.00 0.00 33.01 29.18 2kvb s GLN 644 CO -0.01 0.63 -0.04 0.54 -1.32 0.00 0.00 175.29 175.08 2kvb s VAL 645 N -1.09 0.44 -0.27 3.63 0.11 -1.00 -0.50 120.40 121.73 2kvb s VAL 645 Ca 0.20 -0.13 -0.29 0.00 -2.93 0.00 0.00 61.98 58.82 2kvb s VAL 645 Cb -0.12 -0.45 0.01 0.00 -1.53 0.00 0.00 36.38 34.30 2kvb s VAL 645 CO 0.10 0.18 1.14 -0.55 -3.33 0.00 0.00 175.10 172.64 2kvb s SER 646 N 0.54 6.92 0.54 3.54 0.15 0.18 -1.92 113.70 123.66 2kvb s SER 646 Ca -0.07 1.26 0.32 0.00 0.70 0.00 0.00 55.95 58.17 2kvb s SER 646 Cb -0.10 -2.54 1.26 0.00 -1.71 0.00 0.00 66.02 62.93 2kvb s SER 646 CO -0.00 -0.85 1.95 0.08 1.20 0.00 0.00 173.24 175.61 2kvb h ARG 647 N 8.18 0.00 0.04 5.44 0.11 -1.36 0.25 114.38 127.06 2kvb h ARG 647 Ca -0.22 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.77 2kvb h ARG 647 Cb 1.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.16 2kvb h ARG 647 CO 1.01 0.01 -0.45 1.03 0.10 0.00 0.00 179.97 181.67 2kvb h SER 648 N 0.00 0.15 0.00 0.08 0.87 -1.84 -3.40 113.55 109.40 2kvb h SER 648 Ca -0.00 -0.93 0.00 0.00 -1.23 0.00 0.00 61.79 59.63 2kvb h SER 648 Cb 0.57 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2kvb h SER 648 CO 0.00 1.20 -1.75 0.47 -0.53 0.00 0.00 176.83 176.22 2kvb n ASP 649 N -4.42 0.93 -0.54 6.23 8.00 -1.19 -4.97 116.55 120.59 2kvb n ASP 649 Ca -0.14 -0.06 -0.07 0.00 0.71 0.00 0.00 54.79 55.22 2kvb n ASP 649 Cb 0.62 1.76 -0.03 0.00 -0.02 0.00 0.00 41.12 43.45 2kvb n ASP 649 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2kvb n ARG 650 N -2.07 -0.68 -3.19 -1.24 5.12 0.88 -5.00 116.66 110.48 2kvb n ARG 650 Ca -0.03 0.69 -0.38 0.00 -1.93 0.00 0.00 57.85 56.20 2kvb n ARG 650 Cb 0.45 -4.52 -0.06 0.00 -1.16 0.00 0.00 32.46 27.17 2kvb n ARG 650 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2kvb s LYS 651 N -2.35 4.25 0.09 5.56 -0.14 -1.25 -4.80 119.74 121.11 2kvb s LYS 651 Ca 0.00 0.81 0.07 0.00 -1.36 0.00 0.00 55.97 55.50 2kvb s LYS 651 Cb 0.00 -3.11 -0.03 0.00 -1.68 0.00 0.00 37.83 33.01 2kvb s LYS 651 CO 0.00 0.54 -0.19 -1.54 -0.76 0.00 0.00 175.35 173.40 2kvb s SER 652 N -1.34 2.32 0.06 2.83 1.04 -1.26 0.48 113.70 117.83 2kvb s SER 652 Ca 0.35 -0.66 0.04 0.00 0.48 0.00 0.00 55.95 56.16 2kvb s SER 652 Cb -0.19 -0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.78 2kvb s SER 652 CO 0.21 0.03 -0.12 0.26 0.98 0.00 0.00 173.24 174.60 2kvb s TRP 653 N -1.16 1.04 -0.23 5.02 0.51 0.34 -4.98 118.94 119.48 2kvb s TRP 653 Ca 0.04 -0.48 -0.16 0.00 -2.12 0.00 0.00 56.10 53.39 2kvb s TRP 653 Cb -0.10 -0.59 -0.04 0.00 -0.81 0.00 0.00 33.47 31.93 2kvb s TRP 653 CO 0.04 0.01 0.40 1.21 -0.51 0.00 0.00 176.95 178.10 2kvb s ASN 654 N -1.70 6.37 -0.05 2.95 2.47 -1.26 -1.76 114.94 121.96 2kvb s ASN 654 Ca -0.04 0.44 0.17 0.00 0.42 0.00 0.00 52.86 53.85 2kvb s ASN 654 Cb -0.10 -2.23 0.57 0.00 -1.45 0.00 0.00 41.25 38.04 2kvb s ASN 654 CO 0.02 -0.14 1.48 0.18 -3.72 0.00 0.00 177.10 174.91 2kvb n LEU 655 N 4.91 3.92 0.00 3.21 4.77 -0.12 -1.16 117.00 132.52 2kvb n LEU 655 Ca -0.08 -2.22 0.00 0.00 -0.03 0.00 0.00 56.01 53.68 2kvb n LEU 655 Cb 0.51 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2kvb n LEU 655 CO 0.39 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 177.90 2kvb n GLY 656 N 0.99 4.32 3.74 -0.72 0.00 -1.19 -1.22 105.19 111.11 2kvb n GLY 656 Ca 0.21 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 2kvb n GLY 656 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kvb s ARG 657 N -3.79 0.85 -0.04 1.61 0.52 -1.26 -0.77 118.95 116.07 2kvb s ARG 657 Ca 0.00 0.39 -0.33 0.00 -0.52 0.00 0.00 55.73 55.26 2kvb s ARG 657 Cb 0.00 -1.80 -0.11 0.00 0.52 0.00 0.00 34.95 33.56 2kvb s ARG 657 CO 0.00 -2.42 1.88 0.43 0.02 0.00 0.00 175.30 175.21 2kvb n SER 658 N -3.94 3.59 -3.84 0.23 7.64 0.94 -3.94 113.62 114.30 2kvb n SER 658 Ca 0.06 0.97 -0.09 0.00 1.01 0.00 0.00 58.87 60.81 2kvb n SER 658 Cb 0.58 -1.41 -0.05 0.00 -1.01 0.00 0.00 64.21 62.32 2kvb n SER 658 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2kvb s ASN 659 N 3.85 -0.16 0.00 6.43 2.47 -1.14 -4.90 114.94 121.49 2kvb s ASN 659 Ca 0.91 -0.65 0.12 0.00 0.42 0.00 0.00 52.86 53.65 2kvb s ASN 659 Cb -0.63 0.55 0.19 0.00 -1.45 0.00 0.00 41.25 39.91 2kvb s ASN 659 CO 0.48 -1.04 1.03 0.00 -3.72 0.00 0.00 177.10 173.85 2kvb n ALA 660 N -0.32 2.36 -2.38 1.71 0.00 -1.26 -0.68 120.51 119.93 2kvb n ALA 660 Ca -0.08 -1.48 -0.39 0.00 0.00 0.00 0.00 53.44 51.49 2kvb n ALA 660 Cb 0.62 -0.54 -0.03 0.00 0.00 0.00 0.00 19.45 19.50 2kvb n ALA 660 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2kvb s LYS 661 N 0.00 3.06 0.03 0.00 -0.14 -1.26 -3.82 119.74 117.61 2kvb s LYS 661 Ca 0.15 -0.17 -0.21 0.00 -1.36 0.00 0.00 55.97 54.39 2kvb s LYS 661 Cb 0.17 -4.48 -0.06 0.00 -1.68 0.00 0.00 37.83 31.78 2kvb s LYS 661 CO -0.08 -2.40 0.61 -0.51 -0.76 0.00 0.00 175.35 172.21 2kvb s LEU 662 N 6.80 4.46 -0.03 3.17 1.43 -1.26 -1.78 118.68 131.47 2kvb s LEU 662 Ca 0.48 1.23 0.06 0.00 -1.03 0.00 0.00 54.13 54.86 2kvb s LEU 662 Cb -0.08 -2.95 -0.01 0.00 0.03 0.00 0.00 46.19 43.18 2kvb s LEU 662 CO 0.11 0.15 -0.20 -0.44 0.23 0.00 0.00 176.35 176.21 2kvb s SER 663 N -0.50 2.37 -0.12 2.29 0.01 0.19 -0.27 113.70 117.67 2kvb s SER 663 Ca 0.31 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.20 2kvb s SER 663 Cb -0.19 -0.43 -0.02 0.00 0.21 0.00 0.00 66.02 65.59 2kvb s SER 663 CO 0.19 0.22 -0.13 -0.47 0.41 0.00 0.00 173.24 173.46 2kvb s TYR 664 N -0.28 2.81 -0.07 2.43 6.14 0.52 0.39 117.35 129.29 2kvb s TYR 664 Ca 0.03 -0.52 0.04 0.00 0.64 0.00 0.00 57.07 57.25 2kvb s TYR 664 Cb -0.10 -1.81 0.00 0.00 0.42 0.00 0.00 41.96 40.48 2kvb s TYR 664 CO 0.01 -0.12 -0.18 -0.47 0.64 0.00 0.00 175.55 175.43 2kvb s TYR 665 N 0.14 1.88 -0.50 4.97 5.04 -0.88 -1.34 117.35 126.66 2kvb s TYR 665 Ca -0.06 -0.67 -0.46 0.00 -2.44 0.00 0.00 57.07 53.44 2kvb s TYR 665 Cb -0.15 -1.29 -0.20 0.00 0.35 0.00 0.00 41.96 40.67 2kvb s TYR 665 CO 0.05 -0.28 1.74 -3.47 -1.34 0.00 0.00 175.55 172.25 2kvb n ASP 666 N 3.49 1.11 0.00 4.32 -0.08 -0.56 -0.44 116.55 124.39 2kvb n ASP 666 Ca -0.20 1.06 0.00 0.00 -1.51 0.00 0.00 54.79 54.14 2kvb n ASP 666 Cb 0.52 -0.89 0.00 0.00 2.34 0.00 0.00 41.12 43.10 2kvb n ASP 666 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2kvb n GLY 667 N 4.90 3.20 2.93 0.27 0.00 -1.26 -5.06 105.19 110.17 2kvb n GLY 667 Ca 0.37 -0.98 -0.18 0.00 0.00 0.00 0.00 46.02 45.23 2kvb n GLY 667 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kvb n MET 668 N 0.00 0.38 -4.98 1.61 2.81 0.42 -4.83 117.12 112.53 2kvb n MET 668 Ca 0.00 -3.04 -0.27 0.00 -1.81 0.00 0.00 57.70 52.58 2kvb n MET 668 Cb 0.00 2.50 -0.16 0.00 -0.71 0.00 0.00 33.22 34.86 2kvb n MET 668 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2kvb s ILE 669 N -3.23 1.60 0.03 2.02 1.01 -1.16 -2.07 121.20 119.40 2kvb s ILE 669 Ca 0.36 -0.85 0.05 0.00 0.00 0.00 0.00 60.65 60.21 2kvb s ILE 669 Cb 0.02 -1.34 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 2kvb s ILE 669 CO 0.26 0.45 -0.15 -1.10 0.00 0.00 0.00 174.94 174.40 2kvb s GLN 670 N -0.35 1.05 -0.13 2.79 -0.21 0.16 0.10 119.66 123.07 2kvb s GLN 670 Ca 0.05 -0.73 0.02 0.00 0.02 0.00 0.00 55.36 54.73 2kvb s GLN 670 Cb -0.09 -1.06 0.00 0.00 1.00 0.00 0.00 33.01 32.86 2kvb s GLN 670 CO 0.00 0.27 -0.21 -1.17 -2.12 0.00 0.00 175.29 172.06 2kvb s LEU 671 N -0.96 2.22 -0.14 2.90 0.20 0.53 0.54 118.68 123.97 2kvb s LEU 671 Ca 0.03 -0.54 -0.03 0.00 0.69 0.00 0.00 54.13 54.29 2kvb s LEU 671 Cb -0.07 -1.47 -0.03 0.00 -0.43 0.00 0.00 46.19 44.19 2kvb s LEU 671 CO 0.01 0.12 -0.05 -0.89 -0.29 0.00 0.00 176.35 175.25 2kvb s THR 672 N 0.58 3.79 0.54 3.68 2.01 -0.73 -1.05 115.64 124.45 2kvb s THR 672 Ca -0.12 -0.40 0.08 0.00 0.31 0.00 0.00 61.69 61.56 2kvb s THR 672 Cb -0.17 -2.64 0.06 0.00 0.01 0.00 0.00 72.50 69.77 2kvb s THR 672 CO 0.04 0.51 0.66 -0.31 -0.69 0.00 0.00 174.62 174.83 2kvb s TYR 673 N 0.21 1.68 0.91 4.92 2.02 -0.44 -4.17 117.35 122.47 2kvb s TYR 673 Ca -0.03 -0.70 -0.13 0.00 -0.37 0.00 0.00 57.07 55.84 2kvb s TYR 673 Cb -0.14 -2.16 0.18 0.00 -0.40 0.00 0.00 41.96 39.44 2kvb s TYR 673 CO 0.03 -0.87 1.25 1.03 -1.57 0.00 0.00 175.55 175.42 2kvb s ARG 674 N -4.52 0.89 0.38 -0.62 1.81 -1.26 -4.65 118.95 110.98 2kvb s ARG 674 Ca 0.54 -0.55 0.14 0.00 -1.72 0.00 0.00 55.73 54.14 2kvb s ARG 674 Cb -0.05 -1.95 0.96 0.00 -0.45 0.00 0.00 34.95 33.46 2kvb s ARG 674 CO 0.34 -2.19 1.84 0.38 -0.68 0.00 0.00 175.30 174.99 2kvb h ASP 675 N -1.39 0.53 0.00 0.23 2.03 -1.91 -3.33 116.42 112.58 2kvb h ASP 675 Ca -0.43 0.05 0.00 0.00 -0.73 0.00 0.00 57.03 55.92 2kvb h ASP 675 Cb 1.24 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 2kvb h ASP 675 CO 0.39 0.22 0.00 0.61 -1.03 0.00 0.00 179.24 179.43 2kvb n GLY 676 N -1.47 0.96 2.73 7.15 0.00 -1.26 -1.84 105.19 111.47 2kvb n GLY 676 Ca 0.20 0.39 -0.25 0.00 0.00 0.00 0.00 46.02 46.35 2kvb n GLY 676 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kvb s THR 677 N 0.00 0.38 0.64 2.61 2.01 -0.31 -4.86 115.64 116.10 2kvb s THR 677 Ca 0.00 -0.22 -0.15 0.00 0.31 0.00 0.00 61.69 61.63 2kvb s THR 677 Cb 0.00 -0.76 -0.01 0.00 0.01 0.00 0.00 72.50 71.74 2kvb s THR 677 CO 0.00 -0.02 1.09 -2.16 -0.69 0.00 0.00 174.62 172.84 2kvb s PRO 678 N 1.94 2.97 1.17 4.92 0.04 -1.26 -3.32 135.00 141.47 2kvb s PRO 678 Ca 0.02 1.30 -0.17 0.00 0.04 0.00 0.00 61.00 62.18 2kvb s PRO 678 Cb -0.15 -1.98 0.21 0.00 0.04 0.00 0.00 34.50 32.62 2kvb s PRO 678 CO -0.07 -1.10 0.40 0.66 0.04 0.00 0.00 177.00 176.93 2kvb n TYR 679 N -2.35 -2.16 -0.60 0.56 4.02 -0.18 -4.85 117.16 111.61 2kvb n TYR 679 Ca 0.10 -0.14 0.01 0.00 -0.01 0.00 0.00 57.90 57.86 2kvb n TYR 679 Cb 0.52 -1.48 0.30 0.00 -0.02 0.00 0.00 39.34 38.66 2kvb n TYR 679 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2kvb n ASN 680 N -2.80 4.64 -4.91 7.72 3.02 -1.26 -4.49 115.26 117.18 2kvb n ASN 680 Ca 0.05 -2.87 -0.28 0.00 -0.03 0.00 0.00 54.58 51.45 2kvb n ASN 680 Cb 0.53 -0.68 0.08 0.00 -0.61 0.00 0.00 39.78 39.09 2kvb n ASN 680 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2kvb s ASN 681 N -0.68 4.74 0.27 6.41 4.22 -1.26 -4.93 114.94 123.71 2kvb s ASN 681 Ca 0.45 0.69 -0.02 0.00 -2.14 0.00 0.00 52.86 51.83 2kvb s ASN 681 Cb 0.35 -1.28 0.40 0.00 1.28 0.00 0.00 41.25 42.00 2kvb s ASN 681 CO 0.12 -1.71 1.88 -0.33 -2.04 0.00 0.00 177.10 175.02 2kvb h GLU 682 N -0.82 1.16 0.00 3.55 5.08 -2.03 -2.18 114.58 119.34 2kvb h GLU 682 Ca -0.45 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 57.70 2kvb h GLU 682 Cb 1.32 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2kvb h GLU 682 CO 0.64 0.77 -0.65 -0.22 -1.00 0.00 0.00 179.01 178.54 2kvb h LYS 683 N 1.19 0.00 -5.23 2.33 3.64 -1.95 -3.48 116.57 113.07 2kvb h LYS 683 Ca 0.43 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.80 2kvb h LYS 683 Cb 0.15 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2kvb h LYS 683 CO -0.17 0.65 -0.04 0.54 -2.27 0.00 0.00 179.45 178.16 2kvb n ARG 684 N -3.45 -1.29 -2.99 1.90 3.00 -0.82 -4.97 116.66 108.04 2kvb n ARG 684 Ca 0.00 1.41 -0.41 0.00 -0.01 0.00 0.00 57.85 58.84 2kvb n ARG 684 Cb 0.72 -5.52 -0.05 0.00 0.00 0.00 0.00 32.46 27.62 2kvb n ARG 684 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2kvb s THR 685 N -3.02 4.96 0.23 0.55 2.01 -1.26 -4.80 115.64 114.31 2kvb s THR 685 Ca 0.02 1.47 -0.32 0.00 0.31 0.00 0.00 61.69 63.17 2kvb s THR 685 Cb -0.00 -4.06 -0.12 0.00 0.01 0.00 0.00 72.50 68.32 2kvb s THR 685 CO 0.70 0.10 1.65 -0.81 -0.69 0.00 0.00 174.62 175.58 2kvb n PRO 686 N 4.83 2.63 -3.51 4.92 -0.04 -1.26 -1.00 135.00 141.56 2kvb n PRO 686 Ca 0.02 0.94 -0.42 0.00 -0.04 0.00 0.00 63.50 64.00 2kvb n PRO 686 Cb 0.50 -2.75 -0.10 0.00 -0.04 0.00 0.00 33.50 31.10 2kvb n PRO 686 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2kvb s ARG 687 N 0.54 3.12 0.29 0.54 3.52 -0.77 -4.77 118.95 121.42 2kvb s ARG 687 Ca 0.72 -0.91 0.04 0.00 -0.13 0.00 0.00 55.73 55.46 2kvb s ARG 687 Cb -0.53 -3.87 -0.06 0.00 -1.56 0.00 0.00 34.95 28.93 2kvb s ARG 687 CO 0.39 -0.64 0.02 0.00 -0.81 0.00 0.00 175.30 174.26 2kvb s ALA 688 N 1.67 2.21 -0.09 6.12 0.00 -1.21 -3.94 121.76 126.51 2kvb s ALA 688 Ca 0.05 -1.95 0.02 0.00 0.00 0.00 0.00 51.96 50.08 2kvb s ALA 688 Cb -0.18 0.52 -0.02 0.00 0.00 0.00 0.00 23.12 23.43 2kvb s ALA 688 CO 0.09 -0.24 -0.13 0.99 0.00 0.00 0.00 175.76 176.47 2kvb s THR 689 N -3.27 3.11 -0.18 0.00 2.01 -0.36 0.24 115.64 117.19 2kvb s THR 689 Ca 0.33 -0.67 0.00 0.00 0.31 0.00 0.00 61.69 61.66 2kvb s THR 689 Cb 0.07 -2.26 0.04 0.00 0.01 0.00 0.00 72.50 70.35 2kvb s THR 689 CO 0.13 0.56 -0.08 -0.22 -0.69 0.00 0.00 174.62 174.31 2kvb s LEU 690 N -0.21 1.92 -0.20 4.42 1.98 0.20 -1.33 118.68 125.46 2kvb s LEU 690 Ca 0.01 -0.74 -0.09 0.00 -2.89 0.00 0.00 54.13 50.42 2kvb s LEU 690 Cb -0.13 -1.08 -0.05 0.00 0.66 0.00 0.00 46.19 45.59 2kvb s LEU 690 CO 0.03 -0.15 0.10 -0.63 -1.89 0.00 0.00 176.35 173.81 2kvb s ILE 691 N 1.51 5.12 -0.22 6.68 1.01 -0.22 -1.43 121.20 133.65 2kvb s ILE 691 Ca 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 60.65 60.72 2kvb s ILE 691 Cb -0.15 -3.33 0.01 0.00 0.01 0.00 0.00 42.46 38.99 2kvb s ILE 691 CO -0.08 0.44 -0.08 -0.89 0.00 0.00 0.00 174.94 174.33 2kvb s THR 692 N 0.47 3.00 -0.14 2.92 2.01 0.13 -0.35 115.64 123.68 2kvb s THR 692 Ca 0.06 -0.71 -0.13 0.00 0.31 0.00 0.00 61.69 61.22 2kvb s THR 692 Cb -0.12 -2.39 -0.05 0.00 0.01 0.00 0.00 72.50 69.95 2kvb s THR 692 CO -0.00 0.39 0.27 -0.36 -0.69 0.00 0.00 174.62 174.23 2kvb s PHE 693 N 1.41 3.50 0.29 4.92 0.40 0.11 -0.35 117.98 128.26 2kvb s PHE 693 Ca 0.04 0.60 0.09 0.00 -0.60 0.00 0.00 56.93 57.07 2kvb s PHE 693 Cb -0.15 -2.28 -0.06 0.00 0.51 0.00 0.00 43.02 41.05 2kvb s PHE 693 CO -0.05 0.34 -0.13 -0.51 0.70 0.00 0.00 175.22 175.56 2kvb s LEU 694 N 0.15 2.61 -0.95 -0.37 1.43 0.11 -2.99 118.68 118.66 2kvb s LEU 694 Ca 0.16 -1.12 -0.09 0.00 -1.03 0.00 0.00 54.13 52.06 2kvb s LEU 694 Cb -0.13 -0.90 0.24 0.00 0.03 0.00 0.00 46.19 45.43 2kvb s LEU 694 CO 0.04 -0.15 0.90 0.00 0.23 0.00 0.00 176.35 177.37 2kvb s ASP 696 N 1.29 -0.47 0.00 0.00 2.15 -1.26 -5.06 116.67 113.32 2kvb s ASP 696 Ca 0.25 0.63 0.00 0.00 0.43 0.00 0.00 52.55 53.86 2kvb s ASP 696 Cb -0.10 0.54 0.00 0.00 -0.30 0.00 0.00 42.92 43.05 2kvb s ASP 696 CO -0.09 -0.36 0.00 -1.14 -0.17 0.00 0.00 175.17 173.42 2kvb n ARG 697 N 1.18 0.00 -3.69 4.34 0.63 -1.26 -4.41 116.66 113.45 2kvb n ARG 697 Ca -0.13 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.43 2kvb n ARG 697 Cb 0.57 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 33.37 2kvb n ARG 697 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2kvb s ASP 698 N -3.90 5.86 -1.04 6.15 1.01 -1.26 -5.00 116.67 118.48 2kvb s ASP 698 Ca 0.00 0.01 -0.09 0.00 0.71 0.00 0.00 52.55 53.18 2kvb s ASP 698 Cb 0.00 -2.06 0.26 0.00 1.01 0.00 0.00 42.92 42.13 2kvb s ASP 698 CO 0.00 0.02 1.02 0.00 0.21 0.00 0.00 175.17 176.41 2kvb s ALA 699 N 1.35 4.58 0.00 5.23 0.00 -1.26 -3.64 121.76 128.01 2kvb s ALA 699 Ca 0.07 -3.77 0.00 0.00 0.00 0.00 0.00 51.96 48.26 2kvb s ALA 699 Cb -0.15 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2kvb s ALA 699 CO 0.06 -2.20 0.00 0.41 0.00 0.00 0.00 175.76 174.03 2kvb n GLY 700 N 2.83 1.79 0.22 0.00 0.00 -1.26 -4.82 105.19 103.95 2kvb n GLY 700 Ca 0.22 -0.29 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 2kvb n GLY 700 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2kvb h VAL 701 N 0.00 1.16 0.00 1.61 3.04 -1.90 -1.67 116.25 118.49 2kvb h VAL 701 Ca 0.00 -0.35 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 2kvb h VAL 701 Cb 0.00 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 29.74 2kvb h VAL 701 CO 0.00 0.16 0.00 0.61 -1.01 0.00 0.00 177.57 177.33 2kvb n GLY 702 N -1.12 -2.88 3.52 3.17 0.00 -1.24 -4.53 105.19 102.11 2kvb n GLY 702 Ca 0.02 -1.22 -0.33 0.00 0.00 0.00 0.00 46.02 44.49 2kvb n GLY 702 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kvb s PHE 703 N -2.70 2.83 0.39 1.61 0.08 -1.26 -4.90 117.98 114.02 2kvb s PHE 703 Ca 0.00 -0.10 -0.25 0.00 0.12 0.00 0.00 56.93 56.70 2kvb s PHE 703 Cb 0.00 -1.69 -0.09 0.00 -0.57 0.00 0.00 43.02 40.67 2kvb s PHE 703 CO 0.00 0.23 1.08 -1.25 -0.10 0.00 0.00 175.22 175.18 2kvb s PRO 704 N -0.68 4.16 -0.07 0.24 0.04 -1.26 -4.08 135.00 133.34 2kvb s PRO 704 Ca 0.10 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2kvb s PRO 704 Cb -0.11 -2.62 -0.03 0.00 0.04 0.00 0.00 34.50 31.78 2kvb s PRO 704 CO 0.01 -0.16 -0.06 -1.21 0.04 0.00 0.00 177.00 175.62 2kvb s GLU 705 N -2.37 2.81 -0.37 4.56 0.41 0.17 -4.84 118.70 119.07 2kvb s GLU 705 Ca 0.57 -0.53 -0.28 0.00 -0.41 0.00 0.00 54.97 54.32 2kvb s GLU 705 Cb -0.25 -2.63 0.02 0.00 -1.78 0.00 0.00 34.13 29.49 2kvb s GLU 705 CO 0.31 0.66 1.04 -0.47 -0.49 0.00 0.00 175.26 176.31 2kvb s TYR 706 N -0.78 3.06 0.00 1.61 5.04 -1.26 0.31 117.35 125.32 2kvb s TYR 706 Ca 0.12 0.97 0.00 0.00 -2.44 0.00 0.00 57.07 55.72 2kvb s TYR 706 Cb -0.11 -3.84 0.00 0.00 0.35 0.00 0.00 41.96 38.36 2kvb s TYR 706 CO 0.02 -0.89 0.18 0.94 -1.34 0.00 0.00 175.55 174.45 2kvb n GLN 707 N 7.05 0.00 0.00 4.97 -0.06 -0.21 -4.87 117.38 124.26 2kvb n GLN 707 Ca 0.11 0.26 0.00 0.00 -2.00 0.00 0.00 57.00 55.36 2kvb n GLN 707 Cb 0.48 -0.87 0.00 0.00 -4.06 0.00 0.00 30.24 25.79 2kvb n GLN 707 CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01 2kvb n GLU 708 N -1.27 0.00 -2.97 3.69 0.28 -1.20 -5.04 120.64 114.13 2kvb n GLU 708 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.59 2kvb n GLU 708 Cb 0.00 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 32.82 2kvb n GLU 708 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 2kvb s GLU 709 N 0.00 4.34 0.00 3.44 -6.30 -1.26 -3.79 118.70 115.13 2kvb s GLU 709 Ca 0.00 0.92 0.00 0.00 -2.50 0.00 0.00 54.97 53.39 2kvb s GLU 709 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 34.13 30.60 2kvb s GLU 709 CO 0.00 -0.17 0.00 -3.47 0.02 0.00 0.00 175.26 171.64 2kvb n ASP 710 N 4.66 0.00 -1.47 -1.70 2.03 -1.26 -4.87 116.55 113.94 2kvb n ASP 710 Ca 0.02 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.37 2kvb n ASP 710 Cb 0.50 0.00 0.28 0.00 -0.72 0.00 0.00 41.12 41.18 2kvb n ASP 710 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2kvb n ASN 711 N -0.92 4.29 0.00 1.67 0.23 -1.26 -4.85 115.26 114.42 2kvb n ASN 711 Ca 0.00 -2.64 0.00 0.00 -0.53 0.00 0.00 54.58 51.41 2kvb n ASN 711 Cb 0.00 -0.63 0.00 0.00 -2.08 0.00 0.00 39.78 37.07 2kvb n ASN 711 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2kvb n SER 712 N 0.44 0.00 -4.14 0.53 7.64 -1.26 -4.67 113.62 112.16 2kvb n SER 712 Ca 0.19 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.81 2kvb n SER 712 Cb 0.91 -0.40 -0.16 0.00 -1.01 0.00 0.00 64.21 63.54 2kvb n SER 712 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2kvb s THR 713 N -3.40 1.50 -0.23 0.44 2.01 -1.26 -3.33 115.64 111.38 2kvb s THR 713 Ca 0.00 -0.75 -0.29 0.00 0.31 0.00 0.00 61.69 60.96 2kvb s THR 713 Cb 0.00 -1.29 0.01 0.00 0.01 0.00 0.00 72.50 71.23 2kvb s THR 713 CO 0.00 0.43 1.05 -0.31 -0.69 0.00 0.00 174.62 175.10 2kvb s TYR 714 N 0.08 3.32 -0.14 4.92 1.51 0.14 -4.11 117.35 123.06 2kvb s TYR 714 Ca -0.05 1.45 -0.08 0.00 -1.01 0.00 0.00 57.07 57.38 2kvb s TYR 714 Cb -0.12 -3.28 -0.04 0.00 -0.11 0.00 0.00 41.96 38.41 2kvb s TYR 714 CO 0.03 -0.53 0.14 -0.80 -1.11 0.00 0.00 175.55 173.28 2kvb s ASN 715 N 1.23 6.33 0.03 2.29 -0.87 -1.25 0.62 114.94 123.32 2kvb s ASN 715 Ca 0.44 0.40 0.09 0.00 -1.57 0.00 0.00 52.86 52.22 2kvb s ASN 715 Cb -0.15 -2.07 -0.03 0.00 -0.02 0.00 0.00 41.25 38.98 2kvb s ASN 715 CO 0.06 0.34 -0.25 -0.36 -2.57 0.00 0.00 177.10 174.32 2kvb s PHE 716 N -0.61 2.24 -0.29 2.20 0.40 -0.52 -1.05 117.98 120.36 2kvb s PHE 716 Ca 0.13 -0.41 -0.09 0.00 -0.60 0.00 0.00 56.93 55.96 2kvb s PHE 716 Cb -0.12 -1.36 -0.02 0.00 0.51 0.00 0.00 43.02 42.03 2kvb s PHE 716 CO 0.02 0.08 0.13 0.50 0.70 0.00 0.00 175.22 176.66 2kvb s ARG 717 N -1.08 3.48 -0.16 0.44 3.52 0.15 0.18 118.95 125.47 2kvb s ARG 717 Ca 0.11 -0.62 0.00 0.00 -0.13 0.00 0.00 55.73 55.09 2kvb s ARG 717 Cb -0.10 -3.50 0.00 0.00 -1.56 0.00 0.00 34.95 29.79 2kvb s ARG 717 CO 0.01 -0.33 -0.16 -0.46 -0.81 0.00 0.00 175.30 173.56 2kvb s TRP 718 N 1.62 2.79 -0.50 5.12 -0.11 0.53 0.46 118.94 128.85 2kvb s TRP 718 Ca 0.05 -1.13 -0.17 0.00 1.22 0.00 0.00 56.10 56.07 2kvb s TRP 718 Cb -0.16 -1.90 0.08 0.00 -1.50 0.00 0.00 33.47 29.98 2kvb s TRP 718 CO 0.06 -0.53 0.49 0.71 -4.62 0.00 0.00 176.95 173.06 2kvb s TYR 719 N 0.93 3.17 0.00 5.86 2.02 -1.26 0.09 117.35 128.16 2kvb s TYR 719 Ca -0.03 -0.86 -0.01 0.00 -0.37 0.00 0.00 57.07 55.80 2kvb s TYR 719 Cb -0.15 -3.40 -0.00 0.00 -0.40 0.00 0.00 41.96 38.00 2kvb s TYR 719 CO -0.02 -0.92 0.01 -0.08 -1.57 0.00 0.00 175.55 172.96 2kvb s THR 720 N 1.99 0.03 0.19 -0.71 -1.32 -1.09 -3.68 115.64 111.06 2kvb s THR 720 Ca 0.08 -0.29 0.24 0.00 -1.21 0.00 0.00 61.69 60.50 2kvb s THR 720 Cb -0.23 -0.11 0.23 0.00 -1.51 0.00 0.00 72.50 70.87 2kvb s THR 720 CO 0.08 -0.16 1.86 0.77 -2.21 0.00 0.00 174.62 174.95 2kvb h SER 721 N 5.63 0.00 0.73 8.08 4.64 -1.37 -3.18 113.55 128.09 2kvb h SER 721 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2kvb h SER 721 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2kvb h SER 721 CO 0.47 0.23 0.00 -1.22 -0.87 0.00 0.00 176.83 175.44 2kvb n TYR 722 N -3.46 0.28 0.48 4.77 4.01 -1.26 -1.45 117.16 120.52 2kvb n TYR 722 Ca -0.00 0.10 0.12 0.00 -0.16 0.00 0.00 57.90 57.95 2kvb n TYR 722 Cb 0.41 -0.66 0.25 0.00 -0.31 0.00 0.00 39.34 39.02 2kvb n TYR 722 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2kvb n ALA 723 N -1.59 2.44 -3.52 -0.72 0.00 -1.20 -4.54 120.51 111.38 2kvb n ALA 723 Ca 0.04 -0.91 -0.26 0.00 0.00 0.00 0.00 53.44 52.31 2kvb n ALA 723 Cb 0.24 -0.92 -0.17 0.00 0.00 0.00 0.00 19.45 18.60 2kvb n ALA 723 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50