#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kvb n ALA 579 N 0.00 0.68 0.00 0.62 0.00 -1.26 -4.97 120.51 115.58 2kvb n ALA 579 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2kvb n ALA 579 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.47 2kvb n ALA 579 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2kvb n GLU 580 N -4.06 0.00 0.08 0.00 -0.58 -1.26 -4.58 120.64 110.24 2kvb n GLU 580 Ca -0.11 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.59 2kvb n GLU 580 Cb 0.40 -0.16 -0.02 0.00 -0.57 0.00 0.00 31.44 31.09 2kvb n GLU 580 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2kvb h ALA 581 N 0.00 -0.38 -2.09 0.62 0.00 -2.06 -3.49 119.26 111.86 2kvb h ALA 581 Ca 0.00 -0.06 0.23 0.00 0.00 0.00 0.00 54.91 55.08 2kvb h ALA 581 Cb 0.00 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.80 2kvb h ALA 581 CO 0.00 -0.36 0.62 -1.83 0.00 0.00 0.00 179.25 177.68 2kvb s GLU 582 N -2.40 0.94 -0.28 0.00 -1.05 -1.26 -5.13 118.70 109.53 2kvb s GLU 582 Ca -0.04 -0.54 0.00 0.00 -0.15 0.00 0.00 54.97 54.25 2kvb s GLU 582 Cb 0.00 0.31 0.05 0.00 -0.44 0.00 0.00 34.13 34.05 2kvb s GLU 582 CO 0.11 -0.43 -0.06 -0.06 0.95 0.00 0.00 175.26 175.77 2kvb s PHE 583 N -2.81 3.24 -0.07 4.83 0.08 -1.26 -4.92 117.98 117.07 2kvb s PHE 583 Ca 0.15 -2.05 0.01 0.00 0.12 0.00 0.00 56.93 55.16 2kvb s PHE 583 Cb 0.00 -2.02 0.02 0.00 -0.57 0.00 0.00 43.02 40.46 2kvb s PHE 583 CO 0.01 -0.83 -0.07 -0.48 -0.10 0.00 0.00 175.22 173.74 2kvb s LEU 584 N 1.19 1.34 0.00 -0.37 2.34 -1.26 -4.05 118.68 117.88 2kvb s LEU 584 Ca -0.06 -0.22 0.00 0.00 0.06 0.00 0.00 54.13 53.91 2kvb s LEU 584 Cb -0.19 -0.66 0.00 0.00 -0.56 0.00 0.00 46.19 44.77 2kvb s LEU 584 CO -0.03 -0.05 0.00 -1.54 -1.06 0.00 0.00 176.35 173.67 2kvb n SER 585 N 4.25 0.00 -4.11 1.48 3.41 -1.26 -4.54 113.62 112.85 2kvb n SER 585 Ca -0.20 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.08 2kvb n SER 585 Cb 0.51 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.31 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 0.00 2.32 -0.10 4.33 3.00 -1.26 -1.12 118.95 126.12 2kvb s ARG 586 Ca 0.00 -1.31 -0.05 0.00 -1.00 0.00 0.00 55.73 53.37 2kvb s ARG 586 Cb 0.00 -2.99 -0.04 0.00 0.00 0.00 0.00 34.95 31.92 2kvb s ARG 586 CO 0.00 -0.58 0.09 0.99 0.00 0.00 0.00 175.30 175.80 2kvb s THR 587 N 1.16 5.03 0.00 4.11 2.01 0.15 -4.94 115.64 123.16 2kvb s THR 587 Ca -0.07 0.02 0.07 0.00 0.31 0.00 0.00 61.69 62.02 2kvb s THR 587 Cb -0.20 -3.17 -0.02 0.00 0.01 0.00 0.00 72.50 69.13 2kvb s THR 587 CO -0.04 0.61 -0.21 -0.70 -0.69 0.00 0.00 174.62 173.59 2kvb s GLU 588 N -0.99 1.64 0.00 4.92 2.12 -1.26 0.53 118.70 125.66 2kvb s GLU 588 Ca 0.14 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.65 2kvb s GLU 588 Cb -0.12 -1.63 0.00 0.00 0.26 0.00 0.00 34.13 32.64 2kvb s GLU 588 CO 0.04 0.44 0.00 0.41 -0.54 0.00 0.00 175.26 175.61 2kvb n GLY 589 N 2.34 3.16 0.00 -1.50 0.00 0.14 -4.85 105.19 104.48 2kvb n GLY 589 Ca -0.16 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.70 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 -1.88 2.81 -4.97 1.61 2.03 -1.26 -4.30 116.55 110.58 2kvb n ASP 590 Ca 0.00 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.09 2kvb n ASP 590 Cb 0.00 0.05 0.03 0.00 -0.72 0.00 0.00 41.12 40.47 2kvb n ASP 590 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2kvb s ASN 591 N -3.50 4.91 0.00 1.67 0.02 -1.24 -3.64 114.94 113.15 2kvb s ASN 591 Ca 0.00 -1.01 0.00 0.00 -1.02 0.00 0.00 52.86 50.83 2kvb s ASN 591 Cb 0.00 0.31 0.00 0.00 0.02 0.00 0.00 41.25 41.58 2kvb s ASN 591 CO 0.00 -1.21 1.64 0.00 0.02 0.00 0.00 177.10 177.55 2kvb s THR 593 N 0.25 1.13 -0.10 0.00 -4.23 -1.26 -1.59 115.64 109.84 2kvb s THR 593 Ca 0.00 -0.84 -0.00 0.00 -1.18 0.00 0.00 61.69 59.67 2kvb s THR 593 Cb 0.00 -0.99 0.02 0.00 1.34 0.00 0.00 72.50 72.88 2kvb s THR 593 CO 0.00 0.14 -0.06 0.54 -0.54 0.00 0.00 174.62 174.70 2kvb s VAL 594 N -0.63 0.87 -0.18 2.29 0.11 0.72 -4.51 120.40 119.06 2kvb s VAL 594 Ca 0.03 -0.21 -0.01 0.00 -2.93 0.00 0.00 61.98 58.86 2kvb s VAL 594 Cb -0.07 -0.91 0.00 0.00 -1.53 0.00 0.00 36.38 33.88 2kvb s VAL 594 CO 0.01 0.34 -0.13 0.12 -3.33 0.00 0.00 175.10 172.10 2kvb s PHE 595 N 1.60 2.84 -0.22 1.54 5.36 -1.26 -0.03 117.98 127.81 2kvb s PHE 595 Ca 0.02 -1.15 -0.04 0.00 -0.96 0.00 0.00 56.93 54.80 2kvb s PHE 595 Cb -0.13 -1.97 -0.01 0.00 -0.34 0.00 0.00 43.02 40.57 2kvb s PHE 595 CO -0.06 -0.58 -0.03 0.34 -1.46 0.00 0.00 175.22 173.43 2kvb s ASP 596 N 1.15 4.39 0.30 6.13 2.15 -1.03 -4.96 116.67 124.80 2kvb s ASP 596 Ca 0.01 -0.36 0.09 0.00 0.43 0.00 0.00 52.55 52.72 2kvb s ASP 596 Cb -0.14 -1.75 0.47 0.00 -0.30 0.00 0.00 42.92 41.19 2kvb s ASP 596 CO -0.05 -0.01 1.69 0.77 -0.17 0.00 0.00 175.17 177.40 2kvb h SER 597 N 8.03 0.12 0.71 -0.34 4.64 -1.87 0.81 113.55 125.65 2kvb h SER 597 Ca -0.40 -0.06 -0.23 0.00 -0.47 0.00 0.00 61.79 60.64 2kvb h SER 597 Cb 1.16 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2kvb h SER 597 CO 0.60 0.59 -1.03 0.06 -0.87 0.00 0.00 176.83 176.18 2kvb h GLN 598 N 0.09 0.17 0.00 4.77 3.07 -1.95 -3.19 115.11 118.07 2kvb h GLN 598 Ca 0.00 -0.24 -0.05 0.00 0.09 0.00 0.00 58.65 58.45 2kvb h GLN 598 Cb 0.89 0.08 -0.01 0.00 0.08 0.00 0.00 27.48 28.53 2kvb h GLN 598 CO 0.07 1.05 -0.66 0.00 0.09 0.00 0.00 178.83 179.38 2kvb h ALA 599 N 0.85 0.72 -0.21 0.06 0.00 -1.89 -3.47 119.26 115.32 2kvb h ALA 599 Ca -0.06 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 2kvb h ALA 599 Cb 1.73 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.51 2kvb h ALA 599 CO 0.16 0.29 -0.08 0.41 0.00 0.00 0.00 179.25 180.03 2kvb n GLY 600 N 1.20 0.70 3.01 0.00 0.00 0.27 -5.00 105.19 105.37 2kvb n GLY 600 Ca -0.00 -0.48 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.05 0.54 -0.11 1.61 0.08 -1.17 -5.01 117.98 111.87 2kvb s PHE 601 Ca 0.00 -0.36 -0.02 0.00 0.12 0.00 0.00 56.93 56.67 2kvb s PHE 601 Cb 0.00 -0.33 -0.03 0.00 -0.57 0.00 0.00 43.02 42.09 2kvb s PHE 601 CO 0.00 -0.07 -0.03 -1.54 -0.10 0.00 0.00 175.22 173.48 2kvb s SER 602 N -1.08 4.90 -0.11 1.36 1.04 -1.26 -2.45 113.70 116.11 2kvb s SER 602 Ca -0.07 -0.01 -0.00 0.00 0.48 0.00 0.00 55.95 56.34 2kvb s SER 602 Cb -0.07 -1.52 0.02 0.00 0.10 0.00 0.00 66.02 64.55 2kvb s SER 602 CO 0.00 0.28 -0.07 -0.36 0.98 0.00 0.00 173.24 174.07 2kvb s PHE 603 N -0.33 1.41 -0.34 5.02 0.40 0.95 -4.98 117.98 120.11 2kvb s PHE 603 Ca 0.06 -0.68 -0.18 0.00 -0.60 0.00 0.00 56.93 55.52 2kvb s PHE 603 Cb -0.12 -1.19 -0.01 0.00 0.51 0.00 0.00 43.02 42.21 2kvb s PHE 603 CO 0.02 -0.49 0.53 -0.51 0.70 0.00 0.00 175.22 175.48 2kvb s ASP 604 N 1.67 6.35 -0.15 1.36 1.11 -1.26 -0.20 116.67 125.55 2kvb s ASP 604 Ca 0.04 0.07 0.16 0.00 0.18 0.00 0.00 52.55 52.99 2kvb s ASP 604 Cb -0.13 -2.28 0.63 0.00 1.07 0.00 0.00 42.92 42.22 2kvb s ASP 604 CO -0.07 -0.47 1.55 0.18 1.18 0.00 0.00 175.17 177.53 2kvb n LEU 605 N 5.76 4.49 -0.24 1.23 4.77 -0.62 -4.43 117.00 127.96 2kvb n LEU 605 Ca -0.04 -2.68 -0.06 0.00 -0.03 0.00 0.00 56.01 53.19 2kvb n LEU 605 Cb 0.49 -0.55 0.04 0.00 -2.33 0.00 0.00 43.42 41.08 2kvb n LEU 605 CO 0.45 0.72 1.05 0.74 -1.33 0.00 0.00 177.39 179.02 2kvb h THR 606 N 3.09 1.23 0.00 -5.08 2.02 -1.85 -2.10 112.91 110.21 2kvb h THR 606 Ca 0.00 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.55 2kvb h THR 606 Cb 1.48 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2kvb h THR 606 CO 0.26 0.26 0.01 1.55 0.37 0.00 0.00 175.52 177.97 2kvb h PRO 607 N 0.94 0.00 0.00 6.66 0.13 -1.92 -1.12 132.00 136.68 2kvb h PRO 607 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.36 2kvb h PRO 607 Cb 0.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.25 2kvb h PRO 607 CO -0.03 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.02 2kvb n LEU 608 N -3.05 0.75 -4.69 1.56 4.32 -0.79 -4.77 117.00 110.32 2kvb n LEU 608 Ca -0.03 0.57 -0.42 0.00 -0.02 0.00 0.00 56.01 56.11 2kvb n LEU 608 Cb 0.07 -0.34 -0.03 0.00 -1.62 0.00 0.00 43.42 41.50 2kvb n LEU 608 CO 0.20 -0.19 0.87 -0.89 -1.22 0.00 0.00 177.39 176.16 2kvb s THR 609 N -3.10 4.41 0.01 -5.08 2.01 -0.42 -4.38 115.64 109.08 2kvb s THR 609 Ca 0.11 1.72 0.03 0.00 0.31 0.00 0.00 61.69 63.86 2kvb s THR 609 Cb 0.13 -4.11 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2kvb s THR 609 CO 0.58 0.04 -0.10 -0.54 -0.69 0.00 0.00 174.62 173.91 2kvb s LYS 610 N 1.85 0.70 0.10 4.92 1.02 -1.26 -5.02 119.74 122.05 2kvb s LYS 610 Ca 0.54 -0.50 -0.16 0.00 0.02 0.00 0.00 55.97 55.88 2kvb s LYS 610 Cb -0.24 -0.65 -0.06 0.00 -0.52 0.00 0.00 37.83 36.37 2kvb s LYS 610 CO 0.23 0.16 1.49 -0.22 -0.92 0.00 0.00 175.35 176.09 2kvb h LYS 611 N 5.41 0.63 0.00 1.68 3.64 -1.94 -2.27 116.57 123.72 2kvb h LYS 611 Ca -0.33 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 2kvb h LYS 611 Cb 1.19 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2kvb h LYS 611 CO 0.47 0.83 0.00 -0.44 -2.27 0.00 0.00 179.45 178.04 2kvb h ASP 612 N 0.40 0.00 -0.91 4.20 5.19 -1.96 -2.58 116.42 120.76 2kvb h ASP 612 Ca 0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 2kvb h ASP 612 Cb 0.61 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.12 2kvb h ASP 612 CO 0.04 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.16 2kvb n ALA 613 N -1.81 0.00 -2.47 3.45 0.00 -0.86 -4.83 120.51 113.99 2kvb n ALA 613 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.16 2kvb n ALA 613 Cb 0.32 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.64 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 0.00 2.63 -0.07 0.00 1.51 0.44 -4.92 117.35 116.93 2kvb s TYR 614 Ca 0.00 -0.21 0.03 0.00 -1.01 0.00 0.00 57.07 55.88 2kvb s TYR 614 Cb 0.00 -1.53 0.01 0.00 -0.11 0.00 0.00 41.96 40.33 2kvb s TYR 614 CO 0.00 0.23 -0.15 0.21 -1.11 0.00 0.00 175.55 174.74 2kvb s LYS 615 N -1.18 1.99 -0.16 -0.62 2.20 -1.26 -0.38 119.74 120.33 2kvb s LYS 615 Ca 0.14 -0.51 -0.07 0.00 -0.36 0.00 0.00 55.97 55.17 2kvb s LYS 615 Cb -0.11 -1.61 -0.04 0.00 -1.51 0.00 0.00 37.83 34.57 2kvb s LYS 615 CO 0.04 0.05 0.07 0.08 -0.36 0.00 0.00 175.35 175.23 2kvb s VAL 616 N 0.63 4.92 -0.14 4.02 1.01 0.14 -4.92 120.40 126.05 2kvb s VAL 616 Ca -0.15 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 2kvb s VAL 616 Cb -0.16 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 2kvb s VAL 616 CO 0.04 0.50 -0.12 -1.61 0.00 0.00 0.00 175.10 173.91 2kvb s GLU 617 N 0.00 3.38 0.00 2.72 2.02 -1.26 0.11 118.70 125.67 2kvb s GLU 617 Ca 0.07 -0.68 0.00 0.00 0.02 0.00 0.00 54.97 54.38 2kvb s GLU 617 Cb -0.12 -2.69 0.00 0.00 0.10 0.00 0.00 34.13 31.42 2kvb s GLU 617 CO 0.01 0.15 0.00 0.25 0.02 0.00 0.00 175.26 175.68 2kvb n THR 618 N 3.73 0.00 -0.15 3.63 -2.24 0.51 -5.00 114.28 114.76 2kvb n THR 618 Ca -0.18 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.52 2kvb n THR 618 Cb 0.52 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.76 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 0.53 0.00 3.42 3.32 -2.03 -3.35 116.42 118.30 2kvb h ASP 619 Ca 0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2kvb h ASP 619 Cb 0.00 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.42 2kvb h ASP 619 CO 0.00 0.41 -0.46 0.29 -1.72 0.00 0.00 179.24 177.77 2kvb n LYS 620 N -4.75 2.97 -4.62 3.56 5.02 -1.26 -4.94 118.16 114.14 2kvb n LYS 620 Ca 0.01 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.05 2kvb n LYS 620 Cb 0.04 -0.68 -0.14 0.00 -0.02 0.00 0.00 35.03 34.23 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 -1.21 1.76 -0.01 2.13 2.02 -1.26 -0.60 117.35 120.19 2kvb s TYR 621 Ca 0.00 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.36 2kvb s TYR 621 Cb 0.00 -1.05 -0.03 0.00 -0.40 0.00 0.00 41.96 40.48 2kvb s TYR 621 CO 0.00 0.08 -0.08 -1.83 -1.57 0.00 0.00 175.55 172.16 2kvb s GLU 622 N -1.16 2.55 -0.19 -0.62 -1.05 -0.77 -0.36 118.70 117.10 2kvb s GLU 622 Ca 0.07 -0.71 -0.02 0.00 -0.15 0.00 0.00 54.97 54.16 2kvb s GLU 622 Cb -0.09 -2.49 -0.00 0.00 -0.44 0.00 0.00 34.13 31.11 2kvb s GLU 622 CO 0.02 0.61 -0.11 -0.06 0.95 0.00 0.00 175.26 176.67 2kvb s PHE 623 N -0.95 2.88 -0.20 4.83 0.40 0.12 -2.27 117.98 122.79 2kvb s PHE 623 Ca 0.16 -1.10 -0.03 0.00 -0.60 0.00 0.00 56.93 55.36 2kvb s PHE 623 Cb -0.11 -2.00 -0.01 0.00 0.51 0.00 0.00 43.02 41.40 2kvb s PHE 623 CO 0.06 -0.57 -0.06 -1.58 0.70 0.00 0.00 175.22 173.77 2kvb s HIS 624 N 1.23 2.94 0.04 0.36 2.46 0.15 0.27 115.29 122.74 2kvb s HIS 624 Ca 0.03 -0.82 -0.04 0.00 0.47 0.00 0.00 55.06 54.69 2kvb s HIS 624 Cb -0.14 -2.04 -0.02 0.00 -0.13 0.00 0.00 32.58 30.25 2kvb s HIS 624 CO -0.05 -0.44 0.05 0.96 -2.47 0.00 0.00 174.74 172.80 2kvb s ILE 625 N 1.15 0.15 0.02 0.89 -4.36 0.49 -0.05 121.20 119.49 2kvb s ILE 625 Ca 0.02 -1.22 0.03 0.00 -0.26 0.00 0.00 60.65 59.22 2kvb s ILE 625 Cb -0.14 -0.93 -0.01 0.00 1.25 0.00 0.00 42.46 42.62 2kvb s ILE 625 CO -0.01 -0.67 -0.09 0.21 0.24 0.00 0.00 174.94 174.62 2kvb s ASN 626 N -2.20 1.04 -0.26 4.36 2.47 -0.88 -0.42 114.94 119.04 2kvb s ASN 626 Ca -0.04 -0.30 -0.28 0.00 0.42 0.00 0.00 52.86 52.66 2kvb s ASN 626 Cb -0.01 -0.07 0.01 0.00 -1.45 0.00 0.00 41.25 39.74 2kvb s ASN 626 CO -0.05 0.01 1.00 -0.69 -3.72 0.00 0.00 177.10 173.64 2kvb s VAL 627 N -0.61 4.66 0.08 -5.21 1.01 -1.26 -4.79 120.40 114.28 2kvb s VAL 627 Ca -0.00 1.81 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2kvb s VAL 627 Cb -0.06 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.02 2kvb s VAL 627 CO 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 175.10 174.85 2kvb n GLY 629 N -1.26 0.56 3.22 0.00 0.00 0.05 -4.82 105.19 102.93 2kvb n GLY 629 Ca 0.00 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 45.04 2kvb n GLY 629 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kvb n PRO 630 N 0.00 0.15 -4.65 1.61 -0.04 -1.26 -2.56 135.00 128.25 2kvb n PRO 630 Ca 0.00 -2.32 -0.33 0.00 -0.04 0.00 0.00 63.50 60.81 2kvb n PRO 630 Cb 0.00 -0.48 -0.14 0.00 -0.04 0.00 0.00 33.50 32.85 2kvb n PRO 630 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2kvb s VAL 631 N -2.41 3.33 -1.07 0.52 0.11 0.13 -4.72 120.40 116.29 2kvb s VAL 631 Ca 0.54 -0.56 -0.11 0.00 -2.93 0.00 0.00 61.98 58.91 2kvb s VAL 631 Cb -0.03 -2.42 0.24 0.00 -1.53 0.00 0.00 36.38 32.64 2kvb s VAL 631 CO 0.35 0.51 1.12 -0.55 -3.33 0.00 0.00 175.10 173.21 2kvb s SER 632 N 0.36 7.15 0.04 3.54 0.15 -0.97 -4.63 113.70 119.32 2kvb s SER 632 Ca -0.09 -3.25 0.03 0.00 0.70 0.00 0.00 55.95 53.35 2kvb s SER 632 Cb -0.15 -2.26 -0.02 0.00 -1.71 0.00 0.00 66.02 61.88 2kvb s SER 632 CO 0.05 -0.47 -0.09 0.54 1.20 0.00 0.00 173.24 174.47 2kvb s VAL 633 N -0.26 0.71 -2.00 4.45 0.11 -1.26 -4.51 120.40 117.64 2kvb s VAL 633 Ca 0.31 -0.94 0.18 0.00 -2.93 0.00 0.00 61.98 58.60 2kvb s VAL 633 Cb -0.08 -0.71 0.50 0.00 -1.53 0.00 0.00 36.38 34.57 2kvb s VAL 633 CO -0.07 -0.19 1.51 0.61 -3.33 0.00 0.00 175.10 173.63 2kvb n GLY 634 N 1.80 -0.72 0.11 6.54 0.00 -1.26 -2.81 105.19 108.84 2kvb n GLY 634 Ca -0.20 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.53 2kvb n GLY 634 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kvb h ALA 635 N 3.21 -0.04 -3.45 4.61 0.00 -1.97 -3.47 119.26 118.16 2kvb h ALA 635 Ca 0.00 -0.62 -0.40 0.00 0.00 0.00 0.00 54.91 53.89 2kvb h ALA 635 Cb 0.00 0.06 -0.22 0.00 0.00 0.00 0.00 17.79 17.63 2kvb h ALA 635 CO 0.00 0.27 -0.78 0.00 0.00 0.00 0.00 179.25 178.74 2kvb n PRO 637 N 1.42 0.27 0.05 0.00 -0.02 -1.26 -4.45 135.00 131.01 2kvb n PRO 637 Ca -0.21 0.13 0.03 0.00 -2.02 0.00 0.00 63.50 61.43 2kvb n PRO 637 Cb 0.54 -1.77 0.14 0.00 -0.02 0.00 0.00 33.50 32.40 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 -0.55 0.04 0.00 0.52 -0.02 -1.26 -0.74 135.00 132.98 2kvb n PRO 638 Ca 0.10 0.45 0.14 0.00 -2.02 0.00 0.00 63.50 62.16 2kvb n PRO 638 Cb 0.50 -1.75 0.60 0.00 -0.02 0.00 0.00 33.50 32.83 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 -1.62 0.20 -4.87 2.55 8.00 -1.26 -4.63 116.55 114.92 2kvb n ASP 639 Ca -0.00 -0.06 -0.37 0.00 0.71 0.00 0.00 54.79 55.07 2kvb n ASP 639 Cb 0.15 -0.23 -0.06 0.00 -0.02 0.00 0.00 41.12 40.96 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 -2.75 6.54 -0.02 -2.24 0.15 0.08 -0.13 113.70 115.32 2kvb s SER 640 Ca 0.21 0.64 0.14 0.00 0.70 0.00 0.00 55.95 57.64 2kvb s SER 640 Cb 0.19 -2.13 -0.22 0.00 -1.71 0.00 0.00 66.02 62.16 2kvb s SER 640 CO 0.52 0.35 0.30 0.61 1.20 0.00 0.00 173.24 176.23 2kvb n GLY 641 N 1.76 -0.66 2.85 9.45 0.00 0.06 0.22 105.19 118.88 2kvb n GLY 641 Ca -0.16 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.97 -0.16 -0.01 4.61 0.00 -0.96 -2.07 121.76 120.20 2kvb s ALA 642 Ca -0.05 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 52.47 2kvb s ALA 642 Cb 0.09 -0.64 0.02 0.00 0.00 0.00 0.00 23.12 22.59 2kvb s ALA 642 CO 0.60 -0.38 0.02 0.00 0.00 0.00 0.00 175.76 175.99 2kvb s GLN 644 N 0.54 2.29 -0.01 0.00 -2.07 -0.80 0.34 119.66 119.94 2kvb s GLN 644 Ca -0.04 -0.86 0.02 0.00 -1.82 0.00 0.00 55.36 52.65 2kvb s GLN 644 Cb -0.06 -2.33 0.00 0.00 -1.09 0.00 0.00 33.01 29.53 2kvb s GLN 644 CO -0.02 0.57 -0.05 0.54 -1.32 0.00 0.00 175.29 175.01 2kvb s VAL 645 N -0.95 0.46 -0.19 3.63 0.11 -0.96 -0.03 120.40 122.46 2kvb s VAL 645 Ca 0.16 -0.21 -0.26 0.00 -2.93 0.00 0.00 61.98 58.74 2kvb s VAL 645 Cb -0.11 -0.42 -0.01 0.00 -1.53 0.00 0.00 36.38 34.31 2kvb s VAL 645 CO 0.06 0.15 0.86 -0.94 -3.33 0.00 0.00 175.10 171.91 2kvb s SER 646 N 0.14 6.95 0.44 3.54 1.04 0.12 -1.84 113.70 124.08 2kvb s SER 646 Ca -0.01 1.17 0.30 0.00 0.48 0.00 0.00 55.95 57.89 2kvb s SER 646 Cb -0.05 -2.46 1.19 0.00 0.10 0.00 0.00 66.02 64.80 2kvb s SER 646 CO -0.00 -0.47 1.88 0.08 0.98 0.00 0.00 173.24 175.71 2kvb h ARG 647 N 7.44 0.00 0.00 4.02 0.11 -1.18 0.20 114.38 124.96 2kvb h ARG 647 Ca -0.26 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.81 2kvb h ARG 647 Cb 1.11 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.19 2kvb h ARG 647 CO 0.86 0.00 -0.06 0.77 0.10 0.00 0.00 179.97 181.65 2kvb h SER 648 N 0.00 0.00 0.00 0.08 0.02 -1.90 -3.40 113.55 108.35 2kvb h SER 648 Ca 0.00 -0.89 0.00 0.00 -0.84 0.00 0.00 61.79 60.06 2kvb h SER 648 Cb 0.48 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2kvb h SER 648 CO 0.00 0.98 -1.37 -0.67 -1.14 0.00 0.00 176.83 174.63 2kvb n ASP 649 N -4.62 1.37 -0.61 3.07 -0.08 -1.20 -4.98 116.55 109.50 2kvb n ASP 649 Ca -0.10 -0.25 -0.07 0.00 -1.51 0.00 0.00 54.79 52.85 2kvb n ASP 649 Cb 0.45 1.47 -0.03 0.00 2.34 0.00 0.00 41.12 45.34 2kvb n ASP 649 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2kvb n ARG 650 N -1.81 -0.53 -3.01 -0.67 3.00 0.70 -5.02 116.66 109.33 2kvb n ARG 650 Ca -0.01 0.71 -0.39 0.00 -0.01 0.00 0.00 57.85 58.14 2kvb n ARG 650 Cb 0.33 -4.54 -0.06 0.00 0.00 0.00 0.00 32.46 28.20 2kvb n ARG 650 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2kvb s LYS 651 N -2.88 4.51 0.04 5.56 -0.14 -1.25 -4.78 119.74 120.80 2kvb s LYS 651 Ca 0.00 1.09 0.07 0.00 -1.36 0.00 0.00 55.97 55.77 2kvb s LYS 651 Cb 0.00 -3.30 -0.02 0.00 -1.68 0.00 0.00 37.83 32.83 2kvb s LYS 651 CO 0.00 0.47 -0.21 -1.54 -0.76 0.00 0.00 175.35 173.31 2kvb s SER 652 N -0.74 2.55 0.08 2.83 1.04 -1.26 0.13 113.70 118.33 2kvb s SER 652 Ca 0.36 -0.52 0.08 0.00 0.48 0.00 0.00 55.95 56.36 2kvb s SER 652 Cb -0.22 -0.22 -0.03 0.00 0.10 0.00 0.00 66.02 65.65 2kvb s SER 652 CO 0.24 0.18 -0.22 0.26 0.98 0.00 0.00 173.24 174.69 2kvb s TRP 653 N -0.77 1.89 -0.32 5.02 0.51 0.95 -4.98 118.94 121.24 2kvb s TRP 653 Ca 0.08 -0.40 -0.17 0.00 -2.12 0.00 0.00 56.10 53.50 2kvb s TRP 653 Cb -0.09 -1.07 -0.01 0.00 -0.81 0.00 0.00 33.47 31.49 2kvb s TRP 653 CO 0.02 0.18 0.44 1.21 -0.51 0.00 0.00 176.95 178.28 2kvb s ASN 654 N -1.65 6.27 -0.04 2.95 2.47 -1.26 -1.91 114.94 121.77 2kvb s ASN 654 Ca 0.08 0.01 0.21 0.00 0.42 0.00 0.00 52.86 53.58 2kvb s ASN 654 Cb -0.10 -2.24 0.66 0.00 -1.45 0.00 0.00 41.25 38.13 2kvb s ASN 654 CO 0.04 -0.36 1.56 0.18 -3.72 0.00 0.00 177.10 174.79 2kvb n LEU 655 N 5.53 4.19 0.00 3.21 4.77 0.23 -1.35 117.00 133.60 2kvb n LEU 655 Ca -0.07 -2.15 0.00 0.00 -0.03 0.00 0.00 56.01 53.76 2kvb n LEU 655 Cb 0.49 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2kvb n LEU 655 CO 0.42 0.92 0.00 0.61 -1.33 0.00 0.00 177.39 178.01 2kvb n GLY 656 N 1.43 4.04 3.72 -0.72 0.00 -1.19 -1.08 105.19 111.39 2kvb n GLY 656 Ca 0.25 -0.50 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.89 0.79 0.27 1.61 0.52 -1.25 -0.76 118.95 117.24 2kvb s ARG 657 Ca 0.00 0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 55.36 2kvb s ARG 657 Cb 0.00 -1.78 -0.13 0.00 0.52 0.00 0.00 34.95 33.56 2kvb s ARG 657 CO 0.00 -2.47 1.45 -1.13 0.02 0.00 0.00 175.30 173.17 2kvb n SER 658 N -3.98 3.10 -3.45 0.23 3.41 0.81 -3.57 113.62 110.17 2kvb n SER 658 Ca 0.06 1.15 -0.11 0.00 -0.26 0.00 0.00 58.87 59.71 2kvb n SER 658 Cb 0.58 -1.49 -0.02 0.00 -0.26 0.00 0.00 64.21 63.02 2kvb n SER 658 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2kvb s ASN 659 N 0.27 -0.50 -0.01 4.04 2.47 -1.06 -4.81 114.94 115.34 2kvb s ASN 659 Ca 0.65 0.00 0.01 0.00 0.42 0.00 0.00 52.86 53.94 2kvb s ASN 659 Cb -0.59 0.53 0.02 0.00 -1.45 0.00 0.00 41.25 39.76 2kvb s ASN 659 CO 0.51 -0.86 0.72 0.00 -3.72 0.00 0.00 177.10 173.76 2kvb n ALA 660 N -0.33 1.44 -2.54 1.71 0.00 -1.26 -0.77 120.51 118.76 2kvb n ALA 660 Ca -0.14 -0.81 -0.41 0.00 0.00 0.00 0.00 53.44 52.07 2kvb n ALA 660 Cb 0.64 -0.11 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 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 -0.36 3.31 0.33 0.00 -0.14 -1.24 -2.89 119.74 118.76 2kvb s LYS 661 Ca 0.02 0.02 -0.17 0.00 -1.36 0.00 0.00 55.97 54.48 2kvb s LYS 661 Cb 0.02 -4.12 -0.09 0.00 -1.68 0.00 0.00 37.83 31.96 2kvb s LYS 661 CO 0.00 -1.97 0.77 -0.51 -0.76 0.00 0.00 175.35 172.89 2kvb s LEU 662 N 5.54 4.08 -0.03 3.17 1.43 -1.26 -3.59 118.68 128.02 2kvb s LEU 662 Ca 0.40 1.37 0.04 0.00 -1.03 0.00 0.00 54.13 54.91 2kvb s LEU 662 Cb -0.08 -4.10 -0.00 0.00 0.03 0.00 0.00 46.19 42.03 2kvb s LEU 662 CO 0.20 -0.20 -0.14 -0.44 0.23 0.00 0.00 176.35 176.00 2kvb s SER 663 N -2.18 1.71 -0.22 2.29 0.01 0.12 0.25 113.70 115.68 2kvb s SER 663 Ca 0.54 -0.27 -0.03 0.00 1.31 0.00 0.00 55.95 57.50 2kvb s SER 663 Cb -0.11 -0.36 0.00 0.00 0.21 0.00 0.00 66.02 65.76 2kvb s SER 663 CO 0.17 0.14 -0.07 -0.47 0.41 0.00 0.00 173.24 173.42 2kvb s TYR 664 N -0.06 2.94 -0.07 2.43 6.14 0.19 0.38 117.35 129.30 2kvb s TYR 664 Ca -0.00 -1.16 0.00 0.00 0.64 0.00 0.00 57.07 56.55 2kvb s TYR 664 Cb -0.08 -2.07 -0.03 0.00 0.42 0.00 0.00 41.96 40.20 2kvb s TYR 664 CO 0.01 -0.62 -0.04 -0.47 0.64 0.00 0.00 175.55 175.06 2kvb s TYR 665 N 1.42 3.03 -0.16 4.97 5.04 0.21 0.33 117.35 132.19 2kvb s TYR 665 Ca 0.05 0.09 -0.34 0.00 -2.44 0.00 0.00 57.07 54.42 2kvb s TYR 665 Cb -0.14 -1.73 -0.12 0.00 0.35 0.00 0.00 41.96 40.32 2kvb s TYR 665 CO -0.05 0.40 1.94 -3.47 -1.34 0.00 0.00 175.55 173.03 2kvb n ASP 666 N 2.09 3.14 0.00 4.32 -0.08 -0.27 -0.44 116.55 125.30 2kvb n ASP 666 Ca -0.18 0.84 0.00 0.00 -1.51 0.00 0.00 54.79 53.94 2kvb n ASP 666 Cb 0.53 -1.35 0.00 0.00 2.34 0.00 0.00 41.12 42.65 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 4.82 2.94 3.44 0.27 0.00 -1.26 -5.05 105.19 110.35 2kvb n GLY 667 Ca 0.26 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 45.19 2kvb n GLY 667 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2kvb s MET 668 N 0.00 0.93 0.04 1.61 0.23 0.42 -4.86 119.30 117.67 2kvb s MET 668 Ca 0.00 0.15 -0.18 0.00 -1.03 0.00 0.00 55.69 54.63 2kvb s MET 668 Cb 0.00 0.43 -0.06 0.00 -1.53 0.00 0.00 34.83 33.67 2kvb s MET 668 CO 0.00 -0.28 0.52 0.42 -2.03 0.00 0.00 175.02 173.65 2kvb s ILE 669 N -1.18 4.86 -0.00 3.16 1.09 -1.19 -0.62 121.20 127.31 2kvb s ILE 669 Ca -0.11 1.09 0.03 0.00 -1.10 0.00 0.00 60.65 60.55 2kvb s ILE 669 Cb -0.02 -3.84 -0.01 0.00 -1.06 0.00 0.00 42.46 37.54 2kvb s ILE 669 CO 0.08 0.55 -0.08 -1.10 -0.10 0.00 0.00 174.94 174.28 2kvb s GLN 670 N -0.98 0.66 -0.14 2.79 -0.21 0.16 0.41 119.66 122.35 2kvb s GLN 670 Ca 0.27 -0.34 0.02 0.00 0.02 0.00 0.00 55.36 55.34 2kvb s GLN 670 Cb -0.18 -0.63 0.01 0.00 1.00 0.00 0.00 33.01 33.21 2kvb s GLN 670 CO 0.17 0.17 -0.21 -1.17 -2.12 0.00 0.00 175.29 172.12 2kvb s LEU 671 N -0.31 2.16 -0.19 2.90 0.20 0.46 0.12 118.68 124.01 2kvb s LEU 671 Ca 0.02 -0.58 -0.07 0.00 0.69 0.00 0.00 54.13 54.19 2kvb s LEU 671 Cb -0.04 -1.46 -0.04 0.00 -0.43 0.00 0.00 46.19 44.23 2kvb s LEU 671 CO -0.00 0.09 0.07 -0.89 -0.29 0.00 0.00 176.35 175.33 2kvb s THR 672 N 0.75 4.74 0.48 3.68 2.01 -1.24 -0.61 115.64 125.45 2kvb s THR 672 Ca -0.08 -0.05 0.04 0.00 0.31 0.00 0.00 61.69 61.90 2kvb s THR 672 Cb -0.16 -3.15 0.02 0.00 0.01 0.00 0.00 72.50 69.22 2kvb s THR 672 CO -0.00 0.44 0.67 -0.31 -0.69 0.00 0.00 174.62 174.73 2kvb s TYR 673 N 0.55 2.91 1.16 4.92 2.02 0.42 -4.64 117.35 124.68 2kvb s TYR 673 Ca 0.03 -0.13 -0.18 0.00 -0.37 0.00 0.00 57.07 56.43 2kvb s TYR 673 Cb -0.13 -2.52 0.27 0.00 -0.40 0.00 0.00 41.96 39.18 2kvb s TYR 673 CO 0.01 -0.59 1.11 1.03 -1.57 0.00 0.00 175.55 175.54 2kvb s ARG 674 N -4.55 -0.87 0.31 -0.62 1.81 -1.23 -4.46 118.95 109.34 2kvb s ARG 674 Ca 0.54 0.03 0.04 0.00 -1.72 0.00 0.00 55.73 54.63 2kvb s ARG 674 Cb -0.10 -1.63 0.66 0.00 -0.45 0.00 0.00 34.95 33.43 2kvb s ARG 674 CO 0.36 -3.50 1.85 0.38 -0.68 0.00 0.00 175.30 173.72 2kvb h ASP 675 N -2.43 0.82 0.00 0.23 2.03 -1.92 -3.35 116.42 111.80 2kvb h ASP 675 Ca -0.47 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 55.87 2kvb h ASP 675 Cb 1.30 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 2kvb h ASP 675 CO 0.39 0.43 0.00 0.61 -1.03 0.00 0.00 179.24 179.64 2kvb n GLY 676 N -1.38 3.88 3.13 7.15 0.00 -1.26 -2.99 105.19 113.72 2kvb n GLY 676 Ca 0.18 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 1.90 0.58 2.61 2.01 -0.45 -4.92 115.64 117.37 2kvb s THR 677 Ca 0.00 -0.87 -0.15 0.00 0.31 0.00 0.00 61.69 60.98 2kvb s THR 677 Cb 0.00 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 2kvb s THR 677 CO 0.00 0.52 1.04 -2.16 -0.69 0.00 0.00 174.62 173.32 2kvb s PRO 678 N 0.95 3.46 1.27 4.92 0.04 -1.26 -1.90 135.00 142.48 2kvb s PRO 678 Ca -0.05 1.09 -0.19 0.00 0.04 0.00 0.00 61.00 61.89 2kvb s PRO 678 Cb -0.15 -2.06 0.29 0.00 0.04 0.00 0.00 34.50 32.62 2kvb s PRO 678 CO -0.04 -0.69 0.66 0.66 0.04 0.00 0.00 177.00 177.64 2kvb n TYR 679 N -2.07 -2.83 -0.99 0.56 4.02 0.33 -4.82 117.16 111.35 2kvb n TYR 679 Ca 0.08 -0.41 -0.17 0.00 -0.01 0.00 0.00 57.90 57.39 2kvb n TYR 679 Cb 0.53 -1.42 0.20 0.00 -0.02 0.00 0.00 39.34 38.63 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 -3.99 3.98 -4.94 7.72 3.02 -1.26 -4.53 115.26 115.26 2kvb n ASN 680 Ca 0.09 -3.37 -0.25 0.00 -0.03 0.00 0.00 54.58 51.02 2kvb n ASN 680 Cb 0.52 -0.79 0.02 0.00 -0.61 0.00 0.00 39.78 38.92 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 -1.04 5.78 0.60 6.41 4.22 -1.26 -4.96 114.94 124.69 2kvb s ASN 681 Ca 0.52 0.49 0.36 0.00 -2.14 0.00 0.00 52.86 52.09 2kvb s ASN 681 Cb 0.43 -1.65 1.95 0.00 1.28 0.00 0.00 41.25 43.26 2kvb s ASN 681 CO 0.11 -0.82 2.24 -0.33 -2.04 0.00 0.00 177.10 176.25 2kvb h GLU 682 N 0.18 0.00 0.00 3.55 5.08 -2.03 -1.69 114.58 119.66 2kvb h GLU 682 Ca -0.46 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.70 2kvb h GLU 682 Cb 1.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2kvb h GLU 682 CO 0.59 0.03 -1.08 0.87 -1.00 0.00 0.00 179.01 178.41 2kvb h LYS 683 N 0.00 0.00 -5.22 2.33 1.57 -1.96 -3.49 116.57 109.81 2kvb h LYS 683 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2kvb h LYS 683 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2kvb h LYS 683 CO 0.00 0.69 -0.03 0.54 -0.57 0.00 0.00 179.45 180.09 2kvb n ARG 684 N -3.20 -1.30 -3.57 3.15 3.00 -0.64 -5.00 116.66 109.11 2kvb n ARG 684 Ca -0.04 1.47 -0.38 0.00 -0.01 0.00 0.00 57.85 58.89 2kvb n ARG 684 Cb 0.90 -5.51 -0.11 0.00 0.00 0.00 0.00 32.46 27.75 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 -2.97 5.29 -0.00 0.55 2.01 -1.26 -4.88 115.64 114.38 2kvb s THR 685 Ca 0.01 0.22 -0.30 0.00 0.31 0.00 0.00 61.69 61.94 2kvb s THR 685 Cb -0.00 -3.55 -0.07 0.00 0.01 0.00 0.00 72.50 68.88 2kvb s THR 685 CO 0.71 0.24 1.77 -2.16 -0.69 0.00 0.00 174.62 174.49 2kvb s PRO 686 N 1.76 4.17 -0.11 4.92 0.04 -1.26 -0.52 135.00 144.01 2kvb s PRO 686 Ca 0.08 2.37 -0.30 0.00 0.04 0.00 0.00 61.00 63.19 2kvb s PRO 686 Cb -0.16 -3.99 -0.02 0.00 0.04 0.00 0.00 34.50 30.37 2kvb s PRO 686 CO 0.11 -0.87 1.23 1.03 0.04 0.00 0.00 177.00 178.53 2kvb s ARG 687 N 3.99 4.30 0.28 4.56 0.52 -0.80 -4.84 118.95 126.95 2kvb s ARG 687 Ca 0.79 1.66 0.05 0.00 -0.52 0.00 0.00 55.73 57.71 2kvb s ARG 687 Cb -0.38 -3.65 -0.06 0.00 0.52 0.00 0.00 34.95 31.38 2kvb s ARG 687 CO 0.34 -0.57 -0.01 0.00 0.02 0.00 0.00 175.30 175.08 2kvb s ALA 688 N 2.82 2.19 -0.08 2.13 0.00 -1.25 -3.72 121.76 123.85 2kvb s ALA 688 Ca 0.55 -1.90 0.04 0.00 0.00 0.00 0.00 51.96 50.64 2kvb s ALA 688 Cb -0.23 0.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 2kvb s ALA 688 CO 0.18 -0.19 -0.18 0.99 0.00 0.00 0.00 175.76 176.56 2kvb s THR 689 N -3.21 2.66 -0.19 0.00 2.01 -0.24 0.50 115.64 117.17 2kvb s THR 689 Ca 0.31 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.47 2kvb s THR 689 Cb 0.06 -2.04 0.04 0.00 0.01 0.00 0.00 72.50 70.57 2kvb s THR 689 CO 0.12 0.56 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.29 2kvb s LEU 690 N -0.19 2.15 -0.25 4.42 1.98 0.18 -0.44 118.68 126.52 2kvb s LEU 690 Ca -0.01 -0.81 -0.10 0.00 -2.89 0.00 0.00 54.13 50.32 2kvb s LEU 690 Cb -0.13 -1.21 -0.04 0.00 0.66 0.00 0.00 46.19 45.46 2kvb s LEU 690 CO 0.03 -0.13 0.14 -0.63 -1.89 0.00 0.00 176.35 173.87 2kvb s ILE 691 N 1.42 5.03 -0.22 6.68 1.01 0.22 -1.39 121.20 133.96 2kvb s ILE 691 Ca -0.00 0.07 -0.07 0.00 0.00 0.00 0.00 60.65 60.64 2kvb s ILE 691 Cb -0.16 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 2kvb s ILE 691 CO -0.09 0.31 0.07 -0.89 0.00 0.00 0.00 174.94 174.35 2kvb s THR 692 N 1.44 4.56 -0.23 2.92 2.01 0.92 -0.40 115.64 126.87 2kvb s THR 692 Ca 0.07 -0.10 -0.09 0.00 0.31 0.00 0.00 61.69 61.87 2kvb s THR 692 Cb -0.15 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 2kvb s THR 692 CO 0.07 0.39 0.12 -0.36 -0.69 0.00 0.00 174.62 174.16 2kvb s PHE 693 N 1.00 3.26 0.11 4.92 0.40 0.17 0.68 117.98 128.51 2kvb s PHE 693 Ca 0.04 0.08 0.08 0.00 -0.60 0.00 0.00 56.93 56.53 2kvb s PHE 693 Cb -0.14 -2.23 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 2kvb s PHE 693 CO 0.03 0.01 -0.14 -0.51 0.70 0.00 0.00 175.22 175.31 2kvb s LEU 694 N 1.02 2.88 -0.57 -0.37 2.01 0.10 -3.18 118.68 120.57 2kvb s LEU 694 Ca 0.06 -0.47 -0.25 0.00 0.01 0.00 0.00 54.13 53.48 2kvb s LEU 694 Cb -0.14 -1.69 0.04 0.00 0.01 0.00 0.00 46.19 44.41 2kvb s LEU 694 CO 0.04 0.18 0.99 0.00 1.01 0.00 0.00 176.35 178.56 2kvb s ASP 696 N 2.99 1.47 0.00 0.00 -1.08 -1.21 -4.97 116.67 113.87 2kvb s ASP 696 Ca 0.31 -0.23 0.31 0.00 -0.52 0.00 0.00 52.55 52.41 2kvb s ASP 696 Cb -0.12 -0.52 1.64 0.00 -1.46 0.00 0.00 42.92 42.46 2kvb s ASP 696 CO 0.19 0.05 2.11 0.54 0.52 0.00 0.00 175.17 178.58 2kvb n ARG 697 N 3.50 0.65 -3.95 4.34 1.74 -1.26 -3.41 116.66 118.28 2kvb n ARG 697 Ca -0.20 -0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.55 2kvb n ARG 697 Cb 0.53 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 30.31 2kvb n ARG 697 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2kvb s ASP 698 N -2.36 3.91 0.00 0.55 1.01 -1.26 -4.83 116.67 113.69 2kvb s ASP 698 Ca 0.35 -1.21 0.00 0.00 0.71 0.00 0.00 52.55 52.41 2kvb s ASP 698 Cb 0.21 -1.21 0.00 0.00 1.01 0.00 0.00 42.92 42.92 2kvb s ASP 698 CO 0.43 -0.23 0.00 0.00 0.21 0.00 0.00 175.17 175.58 2kvb n ALA 699 N 4.65 0.00 0.00 5.23 0.00 -1.26 -4.93 120.51 124.20 2kvb n ALA 699 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2kvb n ALA 699 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2kvb n ALA 699 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kvb n GLY 700 N 0.00 0.85 0.22 0.00 0.00 -1.26 -4.08 105.19 100.92 2kvb n GLY 700 Ca 0.00 -1.09 0.01 0.00 0.00 0.00 0.00 46.02 44.95 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 1.22 0.00 1.61 3.04 -1.97 -2.57 116.25 117.58 2kvb h VAL 701 Ca 0.00 -1.01 0.00 0.00 -1.01 0.00 0.00 66.70 64.68 2kvb h VAL 701 Cb 0.00 1.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.66 2kvb h VAL 701 CO 0.00 0.31 0.00 0.61 -1.01 0.00 0.00 177.57 177.48 2kvb n GLY 702 N -0.67 2.80 3.08 3.17 0.00 -1.26 -4.66 105.19 107.65 2kvb n GLY 702 Ca -0.01 -1.71 -0.27 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.83 1.78 0.26 1.61 0.40 -0.93 -4.95 117.98 114.32 2kvb s PHE 703 Ca 0.00 -0.69 -0.25 0.00 -0.60 0.00 0.00 56.93 55.39 2kvb s PHE 703 Cb 0.00 -1.26 -0.09 0.00 0.51 0.00 0.00 43.02 42.18 2kvb s PHE 703 CO 0.00 -0.33 0.86 -1.25 0.70 0.00 0.00 175.22 175.20 2kvb s PRO 704 N 0.59 4.52 -0.06 0.24 0.04 -1.26 -2.03 135.00 137.04 2kvb s PRO 704 Ca -0.15 1.19 0.04 0.00 0.04 0.00 0.00 61.00 62.11 2kvb s PRO 704 Cb -0.16 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 31.44 2kvb s PRO 704 CO 0.05 0.38 -0.17 -2.00 0.04 0.00 0.00 177.00 175.30 2kvb s GLU 705 N -1.81 1.96 -0.22 4.56 2.56 0.18 -4.84 118.70 121.09 2kvb s GLU 705 Ca 0.45 -0.60 -0.27 0.00 0.00 0.00 0.00 54.97 54.55 2kvb s GLU 705 Cb -0.19 -1.63 0.00 0.00 2.00 0.00 0.00 34.13 34.31 2kvb s GLU 705 CO 0.24 0.18 0.95 -0.47 -0.56 0.00 0.00 175.26 175.60 2kvb s TYR 706 N 0.25 3.34 0.00 5.30 5.04 -1.26 0.29 117.35 130.32 2kvb s TYR 706 Ca -0.09 1.35 0.00 0.00 -2.44 0.00 0.00 57.07 55.89 2kvb s TYR 706 Cb -0.14 -3.17 0.00 0.00 0.35 0.00 0.00 41.96 39.00 2kvb s TYR 706 CO 0.04 -0.43 0.00 1.04 -1.34 0.00 0.00 175.55 174.86 2kvb n GLN 707 N 6.08 0.00 -3.64 4.97 1.13 -0.95 -4.95 117.38 120.03 2kvb n GLN 707 Ca 0.09 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.08 2kvb n GLN 707 Cb 0.47 -0.14 -0.07 0.00 0.11 0.00 0.00 30.24 30.61 2kvb n GLN 707 CO 0.00 0.00 0.00 -1.83 -1.44 0.00 0.00 177.06 173.79 2kvb s GLU 708 N 0.00 0.62 -0.11 -1.09 -1.05 -1.25 -5.07 118.70 110.75 2kvb s GLU 708 Ca 0.00 0.94 -0.25 0.00 -0.15 0.00 0.00 54.97 55.52 2kvb s GLU 708 Cb 0.00 0.19 -0.03 0.00 -0.44 0.00 0.00 34.13 33.85 2kvb s GLU 708 CO 0.00 -0.11 0.77 -2.00 0.95 0.00 0.00 175.26 174.87 2kvb s GLU 709 N 1.11 4.37 0.00 -4.83 -6.30 -1.26 -4.07 118.70 107.72 2kvb s GLU 709 Ca -0.06 0.96 0.00 0.00 -2.50 0.00 0.00 54.97 53.38 2kvb s GLU 709 Cb -0.05 -3.51 0.00 0.00 0.00 0.00 0.00 34.13 30.57 2kvb s GLU 709 CO -0.13 -0.13 0.00 -3.47 0.02 0.00 0.00 175.26 171.56 2kvb n ASP 710 N 4.47 0.00 -1.06 -1.70 2.03 -1.26 -4.88 116.55 114.16 2kvb n ASP 710 Ca 0.02 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.33 2kvb n ASP 710 Cb 0.50 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 41.01 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 -1.20 2.70 0.00 1.67 6.94 -1.26 -4.83 115.26 119.29 2kvb n ASN 711 Ca 0.00 -2.35 0.00 0.00 -0.02 0.00 0.00 54.58 52.21 2kvb n ASN 711 Cb 0.00 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 36.85 2kvb n ASN 711 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2kvb n SER 712 N 0.15 -0.34 -3.96 0.53 7.64 -1.26 -4.93 113.62 111.44 2kvb n SER 712 Ca 0.11 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.82 2kvb n SER 712 Cb 0.63 -1.00 -0.15 0.00 -1.01 0.00 0.00 64.21 62.69 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 -2.77 0.51 -0.27 0.44 2.01 -1.26 -3.75 115.64 110.55 2kvb s THR 713 Ca 0.00 -0.24 -0.28 0.00 0.31 0.00 0.00 61.69 61.48 2kvb s THR 713 Cb 0.00 -0.45 0.01 0.00 0.01 0.00 0.00 72.50 72.07 2kvb s THR 713 CO 0.00 0.16 1.01 -0.31 -0.69 0.00 0.00 174.62 174.79 2kvb s TYR 714 N 0.07 3.26 -0.22 4.92 1.51 0.18 -4.16 117.35 122.90 2kvb s TYR 714 Ca -0.00 1.28 -0.09 0.00 -1.01 0.00 0.00 57.07 57.24 2kvb s TYR 714 Cb -0.05 -3.40 -0.05 0.00 -0.11 0.00 0.00 41.96 38.36 2kvb s TYR 714 CO -0.00 -0.58 0.12 -0.80 -1.11 0.00 0.00 175.55 173.18 2kvb s ASN 715 N 1.41 5.93 -0.00 2.29 -0.87 -1.25 0.48 114.94 122.92 2kvb s ASN 715 Ca 0.43 0.09 0.05 0.00 -1.57 0.00 0.00 52.86 51.86 2kvb s ASN 715 Cb -0.14 -2.05 -0.03 0.00 -0.02 0.00 0.00 41.25 39.01 2kvb s ASN 715 CO 0.10 0.10 -0.15 -0.36 -2.57 0.00 0.00 177.10 174.22 2kvb s PHE 716 N 0.83 2.65 -0.29 2.20 0.40 -0.49 -2.24 117.98 121.05 2kvb s PHE 716 Ca 0.06 -0.19 -0.09 0.00 -0.60 0.00 0.00 56.93 56.11 2kvb s PHE 716 Cb -0.13 -1.55 -0.02 0.00 0.51 0.00 0.00 43.02 41.83 2kvb s PHE 716 CO 0.02 0.23 0.14 0.50 0.70 0.00 0.00 175.22 176.81 2kvb s ARG 717 N -1.14 3.51 -0.29 0.44 3.52 0.15 -0.05 118.95 125.09 2kvb s ARG 717 Ca 0.14 -0.60 -0.07 0.00 -0.13 0.00 0.00 55.73 55.07 2kvb s ARG 717 Cb -0.11 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 29.77 2kvb s ARG 717 CO 0.04 -0.32 0.08 -0.46 -0.81 0.00 0.00 175.30 173.83 2kvb s TRP 718 N 1.64 3.14 -0.39 5.12 -0.11 0.21 0.50 118.94 129.05 2kvb s TRP 718 Ca 0.05 -0.87 -0.20 0.00 1.22 0.00 0.00 56.10 56.30 2kvb s TRP 718 Cb -0.16 -2.26 0.01 0.00 -1.50 0.00 0.00 33.47 29.56 2kvb s TRP 718 CO 0.06 -0.54 0.62 0.71 -4.62 0.00 0.00 176.95 173.18 2kvb s TYR 719 N 1.52 3.12 0.00 5.86 2.02 -0.86 0.01 117.35 129.03 2kvb s TYR 719 Ca 0.03 0.16 0.01 0.00 -0.37 0.00 0.00 57.07 56.91 2kvb s TYR 719 Cb -0.17 -3.19 -0.01 0.00 -0.40 0.00 0.00 41.96 38.20 2kvb s TYR 719 CO 0.03 -0.71 -0.04 -0.08 -1.57 0.00 0.00 175.55 173.18 2kvb s THR 720 N 2.70 0.32 0.16 -0.71 -1.32 -0.72 -2.20 115.64 113.87 2kvb s THR 720 Ca 0.23 -0.28 0.27 0.00 -1.21 0.00 0.00 61.69 60.70 2kvb s THR 720 Cb -0.14 -0.29 0.28 0.00 -1.51 0.00 0.00 72.50 70.83 2kvb s THR 720 CO 0.16 0.02 1.89 0.28 -2.21 0.00 0.00 174.62 174.77 2kvb h SER 721 N 5.86 0.00 0.74 8.08 0.02 -1.47 -2.73 113.55 124.06 2kvb h SER 721 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2kvb h SER 721 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2kvb h SER 721 CO 0.49 0.16 0.00 -1.22 -1.14 0.00 0.00 176.83 175.12 2kvb n TYR 722 N -3.35 0.58 1.46 3.45 4.01 -1.26 -1.86 117.16 120.19 2kvb n TYR 722 Ca -0.00 0.22 0.11 0.00 -0.16 0.00 0.00 57.90 58.07 2kvb n TYR 722 Cb 0.38 -0.86 0.46 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 -1.69 2.55 -3.02 -0.72 0.00 -1.03 -4.77 120.51 111.82 2kvb n ALA 723 Ca 0.03 -0.41 -0.35 0.00 0.00 0.00 0.00 53.44 52.71 2kvb n ALA 723 Cb 0.24 -1.16 -0.12 0.00 0.00 0.00 0.00 19.45 18.40 2kvb n ALA 723 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50