#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 0.00 0.00 0.62 0.00 -1.26 -5.06 120.51 114.81 2kvb n ALA 579 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2kvb n ALA 579 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -1.76 0.00 -3.24 0.00 1.02 -1.26 -4.78 120.64 110.62 2kvb n GLU 580 Ca 0.00 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.69 2kvb n GLU 580 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 2kvb n GLU 580 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2kvb s ALA 581 N 0.00 3.52 -0.26 0.62 0.00 -1.26 -4.78 121.76 119.61 2kvb s ALA 581 Ca 0.00 -2.25 -0.02 0.00 0.00 0.00 0.00 51.96 49.69 2kvb s ALA 581 Cb 0.00 -3.33 -0.15 0.00 0.00 0.00 0.00 23.12 19.64 2kvb s ALA 581 CO 0.00 -2.07 -0.25 -0.85 0.00 0.00 0.00 175.76 172.59 2kvb n GLU 582 N 5.72 0.62 -3.34 0.00 0.28 -1.26 -4.70 120.64 117.96 2kvb n GLU 582 Ca -0.11 0.17 -0.26 0.00 -0.16 0.00 0.00 57.16 56.80 2kvb n GLU 582 Cb 0.42 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.78 2kvb n GLU 582 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2kvb s PHE 583 N -2.50 3.50 -1.36 -1.84 0.08 -1.26 -3.97 117.98 110.62 2kvb s PHE 583 Ca -0.35 0.46 -0.07 0.00 0.12 0.00 0.00 56.93 57.09 2kvb s PHE 583 Cb 0.10 -1.98 0.01 0.00 -0.57 0.00 0.00 43.02 40.58 2kvb s PHE 583 CO 0.56 0.13 0.92 1.28 -0.10 0.00 0.00 175.22 178.01 2kvb n LEU 584 N -1.49 -3.07 0.00 -0.37 4.32 -1.26 -4.94 117.00 110.19 2kvb n LEU 584 Ca -0.04 -0.42 -0.05 0.00 -0.02 0.00 0.00 56.01 55.48 2kvb n LEU 584 Cb 0.55 -2.89 0.05 0.00 -1.62 0.00 0.00 43.42 39.51 2kvb n LEU 584 CO 0.49 0.47 0.06 -1.20 -1.22 0.00 0.00 177.39 175.98 2kvb n SER 585 N -2.60 -1.64 -4.48 -1.43 7.64 -1.25 -1.71 113.62 108.15 2kvb n SER 585 Ca -0.04 -0.14 -0.33 0.00 1.01 0.00 0.00 58.87 59.37 2kvb n SER 585 Cb 0.58 -0.31 -0.12 0.00 -1.01 0.00 0.00 64.21 63.35 2kvb n SER 585 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2kvb s ARG 586 N -1.96 3.58 -0.04 1.43 3.52 -1.25 -3.81 118.95 120.42 2kvb s ARG 586 Ca 0.11 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.16 2kvb s ARG 586 Cb -0.02 -2.84 -0.03 0.00 -1.56 0.00 0.00 34.95 30.49 2kvb s ARG 586 CO 0.09 0.26 -0.01 -0.08 -0.81 0.00 0.00 175.30 174.75 2kvb s THR 587 N 0.30 4.17 -0.24 4.11 -1.32 -0.67 -4.91 115.64 117.08 2kvb s THR 587 Ca -0.05 -0.46 -0.08 0.00 -1.21 0.00 0.00 61.69 59.89 2kvb s THR 587 Cb -0.14 -2.80 -0.04 0.00 -1.51 0.00 0.00 72.50 68.01 2kvb s THR 587 CO 0.03 0.48 0.09 -0.70 -2.21 0.00 0.00 174.62 172.32 2kvb s GLU 588 N -1.24 3.79 0.00 7.08 2.12 -1.26 -2.25 118.70 126.93 2kvb s GLU 588 Ca 0.17 -0.42 0.00 0.00 0.36 0.00 0.00 54.97 55.08 2kvb s GLU 588 Cb -0.11 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 30.92 2kvb s GLU 588 CO 0.06 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.12 2kvb n GLY 589 N 4.61 1.50 0.00 -1.50 0.00 0.42 -4.84 105.19 105.39 2kvb n GLY 589 Ca -0.16 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2kvb n GLY 589 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2kvb n ASP 590 N 0.00 1.99 -4.61 1.61 9.92 0.00 -4.70 116.55 120.77 2kvb n ASP 590 Ca 0.00 -0.76 -0.43 0.00 -0.53 0.00 0.00 54.79 53.08 2kvb n ASP 590 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 2kvb n ASP 590 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2kvb s ASN 591 N -0.51 5.62 0.00 -2.24 2.47 -1.26 -2.76 114.94 116.26 2kvb s ASN 591 Ca 0.00 1.86 0.00 0.00 0.42 0.00 0.00 52.86 55.14 2kvb s ASN 591 Cb 0.00 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.29 2kvb s ASN 591 CO 0.00 -1.83 0.00 0.00 -3.72 0.00 0.00 177.10 171.55 2kvb s THR 593 N -1.23 0.45 -0.03 0.00 -4.23 -1.11 -2.29 115.64 107.20 2kvb s THR 593 Ca 0.00 -0.83 0.04 0.00 -1.18 0.00 0.00 61.69 59.73 2kvb s THR 593 Cb 0.00 -0.50 -0.01 0.00 1.34 0.00 0.00 72.50 73.34 2kvb s THR 593 CO 0.00 -0.26 -0.16 0.54 -0.54 0.00 0.00 174.62 174.20 2kvb s VAL 594 N -1.04 1.29 -0.07 2.29 0.11 0.51 -0.82 120.40 122.67 2kvb s VAL 594 Ca -0.07 -0.67 0.01 0.00 -2.93 0.00 0.00 61.98 58.31 2kvb s VAL 594 Cb -0.08 -1.10 0.02 0.00 -1.53 0.00 0.00 36.38 33.70 2kvb s VAL 594 CO 0.00 0.37 -0.06 0.12 -3.33 0.00 0.00 175.10 172.20 2kvb s PHE 595 N -0.15 1.08 -0.19 1.54 5.36 -1.26 -0.01 117.98 124.35 2kvb s PHE 595 Ca 0.01 -0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 55.53 2kvb s PHE 595 Cb -0.09 -0.92 -0.02 0.00 -0.34 0.00 0.00 43.02 41.65 2kvb s PHE 595 CO 0.01 -0.31 -0.02 0.34 -1.46 0.00 0.00 175.22 173.78 2kvb s ASP 596 N 1.23 4.76 0.25 6.13 -1.08 -0.92 -4.60 116.67 122.44 2kvb s ASP 596 Ca -0.05 -0.20 0.04 0.00 -0.52 0.00 0.00 52.55 51.81 2kvb s ASP 596 Cb -0.14 -1.80 0.32 0.00 -1.46 0.00 0.00 42.92 39.84 2kvb s ASP 596 CO -0.02 0.08 1.62 0.77 0.52 0.00 0.00 175.17 178.14 2kvb h SER 597 N 7.34 0.33 0.60 -0.34 4.64 -1.95 0.54 113.55 124.71 2kvb h SER 597 Ca -0.35 -0.16 -0.28 0.00 -0.47 0.00 0.00 61.79 60.53 2kvb h SER 597 Cb 1.18 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2kvb h SER 597 CO 0.61 0.77 -1.29 0.06 -0.87 0.00 0.00 176.83 176.11 2kvb h GLN 598 N 0.24 0.27 0.00 4.77 3.07 -1.96 -3.19 115.11 118.30 2kvb h GLN 598 Ca 0.01 -0.46 -0.04 0.00 0.09 0.00 0.00 58.65 58.25 2kvb h GLN 598 Cb 0.96 0.17 -0.01 0.00 0.08 0.00 0.00 27.48 28.68 2kvb h GLN 598 CO 0.08 1.20 -0.42 0.00 0.09 0.00 0.00 178.83 179.78 2kvb h ALA 599 N 0.57 0.80 -0.29 0.06 0.00 -1.99 -3.47 119.26 114.93 2kvb h ALA 599 Ca -0.15 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 2kvb h ALA 599 Cb 1.98 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.72 2kvb h ALA 599 CO 0.20 0.25 -0.11 0.41 0.00 0.00 0.00 179.25 179.99 2kvb n GLY 600 N 1.17 0.81 3.13 0.00 0.00 0.17 -4.99 105.19 105.48 2kvb n GLY 600 Ca 0.02 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.61 2kvb n GLY 600 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2kvb s PHE 601 N -2.04 0.42 0.16 1.61 -0.12 -1.15 -4.99 117.98 111.87 2kvb s PHE 601 Ca 0.00 -0.93 0.10 0.00 -0.05 0.00 0.00 56.93 56.06 2kvb s PHE 601 Cb 0.00 -0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.06 2kvb s PHE 601 CO 0.00 -0.43 -0.21 -1.54 -0.05 0.00 0.00 175.22 172.99 2kvb s SER 602 N -2.90 3.65 0.04 1.98 1.04 -1.26 -2.17 113.70 114.07 2kvb s SER 602 Ca 0.07 -0.73 0.04 0.00 0.48 0.00 0.00 55.95 55.80 2kvb s SER 602 Cb 0.07 -0.39 -0.02 0.00 0.10 0.00 0.00 66.02 65.78 2kvb s SER 602 CO -0.10 0.14 -0.11 -0.36 0.98 0.00 0.00 173.24 173.79 2kvb s PHE 603 N -1.46 0.98 -0.18 5.02 0.40 0.99 -4.99 117.98 118.74 2kvb s PHE 603 Ca 0.20 -0.36 0.01 0.00 -0.60 0.00 0.00 56.93 56.17 2kvb s PHE 603 Cb -0.09 -0.58 0.03 0.00 0.51 0.00 0.00 43.02 42.89 2kvb s PHE 603 CO 0.10 0.00 -0.14 0.16 0.70 0.00 0.00 175.22 176.05 2kvb s ASP 604 N -1.15 3.14 -0.25 1.36 -4.77 -1.26 -0.37 116.67 113.37 2kvb s ASP 604 Ca -0.02 -0.72 0.13 0.00 -3.30 0.00 0.00 52.55 48.65 2kvb s ASP 604 Cb -0.08 -1.28 0.66 0.00 -1.09 0.00 0.00 42.92 41.13 2kvb s ASP 604 CO 0.01 -0.09 1.62 0.18 0.70 0.00 0.00 175.17 177.59 2kvb n LEU 605 N 4.69 4.98 -0.21 2.11 4.77 -0.97 -4.60 117.00 127.78 2kvb n LEU 605 Ca -0.17 -3.15 -0.03 0.00 -0.03 0.00 0.00 56.01 52.63 2kvb n LEU 605 Cb 0.48 -0.65 0.07 0.00 -2.33 0.00 0.00 43.42 41.00 2kvb n LEU 605 CO 0.22 0.77 1.08 0.74 -1.33 0.00 0.00 177.39 178.87 2kvb h THR 606 N 2.42 1.01 0.00 -5.08 2.02 -1.93 -1.39 112.91 109.96 2kvb h THR 606 Ca 0.11 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.06 2kvb h THR 606 Cb 1.86 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 2kvb h THR 606 CO 0.46 0.12 0.00 -0.65 0.37 0.00 0.00 175.52 175.82 2kvb h PRO 607 N 0.67 0.00 0.00 6.66 0.11 -1.94 -1.88 132.00 135.62 2kvb h PRO 607 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2kvb h PRO 607 Cb 0.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.22 2kvb h PRO 607 CO -0.15 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 177.57 2kvb h LEU 608 N 0.00 0.00 -9.62 2.35 4.07 -1.60 -3.45 115.31 107.07 2kvb h LEU 608 Ca 0.00 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.44 2kvb h LEU 608 Cb 0.13 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.88 2kvb h LEU 608 CO 0.00 0.00 0.54 -0.89 -1.08 0.00 0.00 178.44 177.01 2kvb s THR 609 N -3.19 3.76 0.01 0.22 2.01 -0.71 -4.54 115.64 113.20 2kvb s THR 609 Ca 0.08 1.43 0.03 0.00 0.31 0.00 0.00 61.69 63.54 2kvb s THR 609 Cb 0.09 -3.91 -0.01 0.00 0.01 0.00 0.00 72.50 68.67 2kvb s THR 609 CO 0.62 0.20 -0.09 -0.54 -0.69 0.00 0.00 174.62 174.12 2kvb s LYS 610 N 0.05 0.71 0.13 4.92 1.02 -1.26 -5.00 119.74 120.31 2kvb s LYS 610 Ca 0.53 -0.47 -0.11 0.00 0.02 0.00 0.00 55.97 55.95 2kvb s LYS 610 Cb -0.31 -0.66 -0.07 0.00 -0.52 0.00 0.00 37.83 36.27 2kvb s LYS 610 CO 0.34 0.17 1.43 -0.22 -0.92 0.00 0.00 175.35 176.15 2kvb h LYS 611 N 5.50 0.90 0.00 1.68 3.64 -1.96 -2.83 116.57 123.50 2kvb h LYS 611 Ca -0.33 -0.54 -0.04 0.00 -1.27 0.00 0.00 60.65 58.48 2kvb h LYS 611 Cb 1.18 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 2kvb h LYS 611 CO 0.47 1.18 -0.19 0.22 -2.27 0.00 0.00 179.45 178.86 2kvb h ASP 612 N 0.70 0.00 -3.67 4.20 3.58 -1.96 -3.27 116.42 116.00 2kvb h ASP 612 Ca 0.03 0.00 0.19 0.00 0.42 0.00 0.00 57.03 57.67 2kvb h ASP 612 Cb 1.10 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.09 2kvb h ASP 612 CO 0.11 0.19 -0.33 0.00 -2.88 0.00 0.00 179.24 176.33 2kvb n ALA 613 N -2.27 -1.87 -3.07 -0.78 0.00 -1.07 -4.89 120.51 106.55 2kvb n ALA 613 Ca -0.01 0.27 -0.33 0.00 0.00 0.00 0.00 53.44 53.37 2kvb n ALA 613 Cb 0.33 -0.67 -0.13 0.00 0.00 0.00 0.00 19.45 18.97 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 -1.98 2.92 -0.06 0.00 1.51 0.10 -4.97 117.35 114.87 2kvb s TYR 614 Ca 0.00 -0.53 0.04 0.00 -1.01 0.00 0.00 57.07 55.57 2kvb s TYR 614 Cb 0.00 -1.92 -0.02 0.00 -0.11 0.00 0.00 41.96 39.91 2kvb s TYR 614 CO 0.00 -0.17 -0.19 0.21 -1.11 0.00 0.00 175.55 174.29 2kvb s LYS 615 N 0.47 2.59 0.02 -0.62 2.20 -1.26 -0.23 119.74 122.92 2kvb s LYS 615 Ca -0.06 -0.78 0.09 0.00 -0.36 0.00 0.00 55.97 54.85 2kvb s LYS 615 Cb -0.15 -2.31 -0.02 0.00 -1.51 0.00 0.00 37.83 33.83 2kvb s LYS 615 CO 0.04 0.49 -0.26 0.08 -0.36 0.00 0.00 175.35 175.34 2kvb s VAL 616 N -0.39 2.06 0.15 4.02 1.01 0.65 -4.95 120.40 122.95 2kvb s VAL 616 Ca 0.04 -1.26 0.10 0.00 0.00 0.00 0.00 61.98 60.86 2kvb s VAL 616 Cb -0.12 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 2kvb s VAL 616 CO 0.02 0.44 -0.19 -1.61 0.00 0.00 0.00 175.10 173.75 2kvb s GLU 617 N -0.98 1.70 0.00 2.72 2.02 -1.26 0.49 118.70 123.39 2kvb s GLU 617 Ca 0.11 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.79 2kvb s GLU 617 Cb -0.10 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.11 2kvb s GLU 617 CO 0.01 0.45 0.00 0.25 0.02 0.00 0.00 175.26 175.99 2kvb n THR 618 N 0.56 0.00 -0.03 3.63 -2.24 0.15 -4.96 114.28 111.39 2kvb n THR 618 Ca -0.14 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.54 2kvb n THR 618 Cb 0.54 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 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 0.03 0.00 3.42 5.19 -2.04 -3.36 116.42 119.67 2kvb h ASP 619 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2kvb h ASP 619 Cb 0.00 0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2kvb h ASP 619 CO 0.00 0.05 0.00 0.29 -3.12 0.00 0.00 179.24 176.46 2kvb n LYS 620 N -5.07 0.07 -4.30 3.56 5.02 -1.26 -4.95 118.16 111.23 2kvb n LYS 620 Ca -0.03 -0.47 -0.16 0.00 -2.02 0.00 0.00 58.31 55.63 2kvb n LYS 620 Cb 0.08 -0.76 -0.10 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 -0.14 1.44 0.01 2.13 1.51 -1.26 -0.74 117.35 120.29 2kvb s TYR 621 Ca 0.00 -0.86 -0.02 0.00 -1.01 0.00 0.00 57.07 55.18 2kvb s TYR 621 Cb 0.00 -0.80 -0.01 0.00 -0.11 0.00 0.00 41.96 41.04 2kvb s TYR 621 CO 0.00 0.01 0.02 -1.83 -1.11 0.00 0.00 175.55 172.64 2kvb s GLU 622 N -3.82 0.28 -0.12 -0.62 -1.05 -0.35 0.31 118.70 113.33 2kvb s GLU 622 Ca 0.24 -0.40 0.03 0.00 -0.15 0.00 0.00 54.97 54.68 2kvb s GLU 622 Cb 0.04 0.11 0.01 0.00 -0.44 0.00 0.00 34.13 33.85 2kvb s GLU 622 CO 0.05 -0.05 -0.22 -0.06 0.95 0.00 0.00 175.26 175.93 2kvb s PHE 623 N -1.08 2.58 -0.20 4.83 0.40 0.18 -0.96 117.98 123.73 2kvb s PHE 623 Ca -0.12 -1.20 -0.05 0.00 -0.60 0.00 0.00 56.93 54.96 2kvb s PHE 623 Cb -0.07 -1.75 -0.02 0.00 0.51 0.00 0.00 43.02 41.69 2kvb s PHE 623 CO -0.00 -0.53 0.00 -1.01 0.70 0.00 0.00 175.22 174.39 2kvb s HIS 624 N 0.63 3.04 0.06 0.36 3.76 0.50 -0.25 115.29 123.38 2kvb s HIS 624 Ca -0.12 -0.47 0.01 0.00 -0.15 0.00 0.00 55.06 54.33 2kvb s HIS 624 Cb -0.16 -2.10 -0.03 0.00 1.11 0.00 0.00 32.58 31.40 2kvb s HIS 624 CO 0.03 -0.26 -0.05 0.96 -0.85 0.00 0.00 174.74 174.56 2kvb s ILE 625 N 1.06 0.41 0.07 0.60 -4.36 0.67 -0.68 121.20 118.97 2kvb s ILE 625 Ca 0.02 -1.49 0.03 0.00 -0.26 0.00 0.00 60.65 58.95 2kvb s ILE 625 Cb -0.14 -1.10 -0.03 0.00 1.25 0.00 0.00 42.46 42.44 2kvb s ILE 625 CO 0.02 -0.72 -0.10 0.21 0.24 0.00 0.00 174.94 174.59 2kvb s ASN 626 N -2.34 1.22 -0.38 4.36 2.47 -1.00 -0.72 114.94 118.55 2kvb s ASN 626 Ca -0.00 -0.67 -0.27 0.00 0.42 0.00 0.00 52.86 52.34 2kvb s ASN 626 Cb -0.01 0.01 0.02 0.00 -1.45 0.00 0.00 41.25 39.83 2kvb s ASN 626 CO -0.04 -0.21 1.01 -0.69 -3.72 0.00 0.00 177.10 173.45 2kvb s VAL 627 N -1.80 4.49 0.18 -5.21 1.01 -1.26 -4.80 120.40 113.00 2kvb s VAL 627 Ca -0.03 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.30 2kvb s VAL 627 Cb -0.07 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 31.90 2kvb s VAL 627 CO 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 175.10 174.48 2kvb n GLY 629 N -1.49 0.37 3.95 0.00 0.00 0.60 -4.80 105.19 103.83 2kvb n GLY 629 Ca 0.00 -0.85 -0.25 0.00 0.00 0.00 0.00 46.02 44.92 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 1.80 -0.15 1.61 0.04 -1.26 -3.19 135.00 133.85 2kvb s PRO 630 Ca 0.00 -0.62 -0.03 0.00 0.04 0.00 0.00 61.00 60.39 2kvb s PRO 630 Cb 0.00 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 2kvb s PRO 630 CO 0.00 -1.45 -0.05 0.54 0.04 0.00 0.00 177.00 176.08 2kvb s VAL 631 N -3.27 3.75 -1.16 -0.36 0.11 0.14 -4.76 120.40 114.85 2kvb s VAL 631 Ca 0.64 -0.41 -0.10 0.00 -2.93 0.00 0.00 61.98 59.18 2kvb s VAL 631 Cb -0.08 -2.63 0.23 0.00 -1.53 0.00 0.00 36.38 32.37 2kvb s VAL 631 CO 0.45 0.50 1.32 -0.24 -3.33 0.00 0.00 175.10 173.80 2kvb n SER 632 N 3.53 5.45 -4.46 3.54 2.88 -1.23 -4.73 113.62 118.60 2kvb n SER 632 Ca -0.17 -3.05 -0.33 0.00 -1.33 0.00 0.00 58.87 53.98 2kvb n SER 632 Cb 0.52 -1.45 -0.13 0.00 -0.75 0.00 0.00 64.21 62.40 2kvb n SER 632 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2kvb s VAL 633 N -0.20 3.36 0.00 2.46 1.01 -1.26 -4.62 120.40 121.15 2kvb s VAL 633 Ca 0.36 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.77 2kvb s VAL 633 Cb -0.05 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2kvb s VAL 633 CO -0.03 0.55 1.64 0.61 0.00 0.00 0.00 175.10 177.87 2kvb n GLY 634 N 3.03 2.22 0.00 4.51 0.00 -1.26 -2.21 105.19 111.47 2kvb n GLY 634 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 1.37 0.00 -2.76 4.61 0.00 -1.26 -5.11 120.51 117.35 2kvb n ALA 635 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2kvb n ALA 635 Cb 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.79 2kvb n ALA 635 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kvb s PRO 637 N -2.05 3.83 0.17 0.00 0.02 -1.26 -4.63 135.00 131.07 2kvb s PRO 637 Ca -0.10 2.02 0.10 0.00 0.02 0.00 0.00 61.00 63.04 2kvb s PRO 637 Cb -0.06 -2.60 0.52 0.00 0.02 0.00 0.00 34.50 32.38 2kvb s PRO 637 CO -0.03 -0.56 1.24 -2.30 -0.33 0.00 0.00 177.00 175.01 2kvb n PRO 638 N -0.16 0.06 -0.07 5.54 -0.02 -1.26 -0.74 135.00 138.35 2kvb n PRO 638 Ca 0.05 0.52 0.11 0.00 -2.02 0.00 0.00 63.50 62.17 2kvb n PRO 638 Cb 0.45 -1.80 0.39 0.00 -0.02 0.00 0.00 33.50 32.52 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 -1.82 1.66 -4.69 2.55 9.92 -1.26 -4.64 116.55 118.28 2kvb n ASP 639 Ca -0.01 -1.69 -0.35 0.00 -0.53 0.00 0.00 54.79 52.21 2kvb n ASP 639 Cb 0.11 -0.10 -0.09 0.00 -0.64 0.00 0.00 41.12 40.40 2kvb n ASP 639 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2kvb s SER 640 N -1.61 5.62 -0.07 -2.24 0.01 0.08 -0.15 113.70 115.33 2kvb s SER 640 Ca 0.33 0.17 0.20 0.00 1.31 0.00 0.00 55.95 57.96 2kvb s SER 640 Cb 0.18 -1.82 -0.31 0.00 0.21 0.00 0.00 66.02 64.28 2kvb s SER 640 CO 0.27 0.29 0.36 0.61 0.41 0.00 0.00 173.24 175.17 2kvb n GLY 641 N 2.77 -0.97 2.76 3.44 0.00 -0.07 0.26 105.19 113.39 2kvb n GLY 641 Ca -0.18 -0.46 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.20 0.05 -0.02 4.61 0.00 -1.15 -2.38 121.76 119.68 2kvb s ALA 642 Ca -0.08 0.35 -0.00 0.00 0.00 0.00 0.00 51.96 52.23 2kvb s ALA 642 Cb 0.11 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2kvb s ALA 642 CO 0.86 -0.34 0.03 0.00 0.00 0.00 0.00 175.76 176.32 2kvb s GLN 644 N 0.67 2.60 -0.04 0.00 -2.07 -1.10 -0.37 119.66 119.35 2kvb s GLN 644 Ca -0.06 -0.72 0.02 0.00 -1.82 0.00 0.00 55.36 52.78 2kvb s GLN 644 Cb -0.08 -2.55 0.01 0.00 -1.09 0.00 0.00 33.01 29.30 2kvb s GLN 644 CO -0.02 0.59 -0.08 0.54 -1.32 0.00 0.00 175.29 175.00 2kvb s VAL 645 N -1.09 0.76 -0.25 3.63 0.11 -0.14 -0.97 120.40 122.45 2kvb s VAL 645 Ca 0.19 -0.30 -0.29 0.00 -2.93 0.00 0.00 61.98 58.66 2kvb s VAL 645 Cb -0.11 -0.71 -0.01 0.00 -1.53 0.00 0.00 36.38 34.02 2kvb s VAL 645 CO 0.10 0.26 1.42 -0.55 -3.33 0.00 0.00 175.10 173.00 2kvb s SER 646 N 0.53 6.59 0.47 3.54 0.15 0.17 -1.21 113.70 123.95 2kvb s SER 646 Ca -0.09 1.42 0.30 0.00 0.70 0.00 0.00 55.95 58.29 2kvb s SER 646 Cb -0.12 -2.54 1.17 0.00 -1.71 0.00 0.00 66.02 62.83 2kvb s SER 646 CO 0.01 -1.11 1.89 0.08 1.20 0.00 0.00 173.24 175.31 2kvb h ARG 647 N 9.72 0.00 0.00 5.44 0.11 -1.23 0.25 114.38 128.67 2kvb h ARG 647 Ca -0.29 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.73 2kvb h ARG 647 Cb 1.12 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.19 2kvb h ARG 647 CO 1.01 0.00 -0.34 1.03 0.10 0.00 0.00 179.97 181.78 2kvb h SER 648 N 0.00 0.00 0.00 0.08 0.87 -1.79 -3.42 113.55 109.29 2kvb h SER 648 Ca 0.00 -0.77 0.00 0.00 -1.23 0.00 0.00 61.79 59.79 2kvb h SER 648 Cb 0.54 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2kvb h SER 648 CO 0.00 1.08 -1.10 -0.67 -0.53 0.00 0.00 176.83 175.61 2kvb n ASP 649 N -4.58 1.02 -0.62 6.23 2.03 -1.21 -4.99 116.55 114.43 2kvb n ASP 649 Ca -0.15 -0.51 -0.08 0.00 0.52 0.00 0.00 54.79 54.57 2kvb n ASP 649 Cb 0.49 1.28 -0.03 0.00 -0.72 0.00 0.00 41.12 42.13 2kvb n ASP 649 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2kvb n ARG 650 N -1.62 -0.56 -3.23 -0.67 3.00 0.88 -5.00 116.66 109.46 2kvb n ARG 650 Ca 0.01 0.77 -0.34 0.00 -0.01 0.00 0.00 57.85 58.28 2kvb n ARG 650 Cb 0.30 -4.61 -0.06 0.00 0.00 0.00 0.00 32.46 28.08 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 -2.72 4.03 0.09 5.56 1.02 -1.25 -4.78 119.74 121.68 2kvb s LYS 651 Ca 0.00 0.61 0.06 0.00 0.02 0.00 0.00 55.97 56.66 2kvb s LYS 651 Cb 0.00 -2.69 -0.03 0.00 -0.52 0.00 0.00 37.83 34.58 2kvb s LYS 651 CO 0.00 0.32 -0.15 -1.54 -0.92 0.00 0.00 175.35 173.05 2kvb s SER 652 N -2.01 1.90 0.19 2.83 1.04 -1.26 0.44 113.70 116.84 2kvb s SER 652 Ca 0.47 -0.67 0.05 0.00 0.48 0.00 0.00 55.95 56.27 2kvb s SER 652 Cb -0.13 -0.07 -0.05 0.00 0.10 0.00 0.00 66.02 65.87 2kvb s SER 652 CO 0.19 -0.07 -0.07 0.26 0.98 0.00 0.00 173.24 174.53 2kvb s TRP 653 N -1.46 1.49 -0.24 5.02 0.51 -0.15 -4.99 118.94 119.14 2kvb s TRP 653 Ca 0.02 -0.78 -0.15 0.00 -2.12 0.00 0.00 56.10 53.07 2kvb s TRP 653 Cb -0.09 -0.79 -0.04 0.00 -0.81 0.00 0.00 33.47 31.74 2kvb s TRP 653 CO 0.03 0.10 0.37 1.21 -0.51 0.00 0.00 176.95 178.15 2kvb s ASN 654 N -3.26 6.33 -0.08 2.95 3.84 -1.26 -2.71 114.94 120.74 2kvb s ASN 654 Ca 0.23 0.39 0.14 0.00 0.21 0.00 0.00 52.86 53.82 2kvb s ASN 654 Cb 0.03 -2.21 0.44 0.00 -0.55 0.00 0.00 41.25 38.96 2kvb s ASN 654 CO 0.05 -0.12 1.36 0.18 -2.79 0.00 0.00 177.10 175.79 2kvb n LEU 655 N 4.85 3.51 0.00 3.21 4.77 -0.13 -3.51 117.00 129.71 2kvb n LEU 655 Ca -0.09 -2.44 0.00 0.00 -0.03 0.00 0.00 56.01 53.45 2kvb n LEU 655 Cb 0.51 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2kvb n LEU 655 CO 0.38 0.72 0.00 0.61 -1.33 0.00 0.00 177.39 177.77 2kvb n GLY 656 N 0.19 3.40 3.75 -0.72 0.00 -1.22 -1.47 105.19 109.11 2kvb n GLY 656 Ca 0.17 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.33 1.95 0.11 1.61 0.52 -1.25 -0.89 118.95 118.67 2kvb s ARG 657 Ca 0.00 1.14 -0.34 0.00 -0.52 0.00 0.00 55.73 56.01 2kvb s ARG 657 Cb 0.00 -1.86 -0.13 0.00 0.52 0.00 0.00 34.95 33.48 2kvb s ARG 657 CO 0.00 -1.85 1.67 -1.13 0.02 0.00 0.00 175.30 174.01 2kvb n SER 658 N -3.66 3.31 -3.76 0.23 3.41 0.78 -3.39 113.62 110.56 2kvb n SER 658 Ca 0.09 1.05 -0.13 0.00 -0.26 0.00 0.00 58.87 59.62 2kvb n SER 658 Cb 0.53 -1.44 -0.11 0.00 -0.26 0.00 0.00 64.21 62.94 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 1.69 -0.34 0.00 4.04 2.47 -1.19 -4.89 114.94 116.73 2kvb s ASN 659 Ca 0.81 0.63 0.04 0.00 0.42 0.00 0.00 52.86 54.76 2kvb s ASN 659 Cb -0.65 0.66 0.01 0.00 -1.45 0.00 0.00 41.25 39.81 2kvb s ASN 659 CO 0.40 -0.15 0.45 0.00 -3.72 0.00 0.00 177.10 174.08 2kvb n ALA 660 N 2.75 2.47 -2.28 1.71 0.00 -1.26 -0.29 120.51 123.61 2kvb n ALA 660 Ca -0.14 -0.38 -0.42 0.00 0.00 0.00 0.00 53.44 52.51 2kvb n ALA 660 Cb 0.57 -0.12 -0.02 0.00 0.00 0.00 0.00 19.45 19.88 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 -0.66 3.38 0.40 0.00 -0.14 -1.26 -1.21 119.74 120.26 2kvb s LYS 661 Ca 0.03 0.85 -0.15 0.00 -1.36 0.00 0.00 55.97 55.35 2kvb s LYS 661 Cb 0.03 -4.11 -0.08 0.00 -1.68 0.00 0.00 37.83 31.99 2kvb s LYS 661 CO 0.08 -1.81 0.82 -0.51 -0.76 0.00 0.00 175.35 173.17 2kvb s LEU 662 N 6.13 3.88 -0.02 3.17 1.43 -1.24 -4.42 118.68 127.61 2kvb s LEU 662 Ca 0.62 1.34 0.06 0.00 -1.03 0.00 0.00 54.13 55.12 2kvb s LEU 662 Cb -0.14 -4.20 -0.01 0.00 0.03 0.00 0.00 46.19 41.86 2kvb s LEU 662 CO 0.30 -0.36 -0.21 -0.44 0.23 0.00 0.00 176.35 175.86 2kvb s SER 663 N -2.72 2.55 -0.05 2.29 0.01 -0.40 -0.44 113.70 114.95 2kvb s SER 663 Ca 0.55 -0.40 0.04 0.00 1.31 0.00 0.00 55.95 57.45 2kvb s SER 663 Cb -0.10 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.72 2kvb s SER 663 CO 0.24 0.25 -0.15 -0.47 0.41 0.00 0.00 173.24 173.52 2kvb s TYR 664 N -0.41 2.66 -0.01 2.43 6.14 -0.96 -0.80 117.35 126.42 2kvb s TYR 664 Ca 0.06 -0.19 0.06 0.00 0.64 0.00 0.00 57.07 57.64 2kvb s TYR 664 Cb -0.09 -1.62 -0.02 0.00 0.42 0.00 0.00 41.96 40.65 2kvb s TYR 664 CO -0.00 0.16 -0.19 0.71 0.64 0.00 0.00 175.55 176.87 2kvb s TYR 665 N -0.71 1.71 -0.06 4.97 1.51 -0.68 -1.66 117.35 122.43 2kvb s TYR 665 Ca 0.11 -0.33 -0.32 0.00 -1.01 0.00 0.00 57.07 55.52 2kvb s TYR 665 Cb -0.11 -1.09 -0.10 0.00 -0.11 0.00 0.00 41.96 40.55 2kvb s TYR 665 CO 0.00 -0.02 1.94 -3.47 -1.11 0.00 0.00 175.55 172.90 2kvb n ASP 666 N 2.52 3.66 0.00 2.29 2.03 -0.69 -1.22 116.55 125.13 2kvb n ASP 666 Ca -0.15 0.89 0.00 0.00 0.52 0.00 0.00 54.79 56.05 2kvb n ASP 666 Cb 0.53 -1.43 0.00 0.00 -0.72 0.00 0.00 41.12 39.50 2kvb n ASP 666 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kvb n GLY 667 N 4.60 3.32 3.55 0.27 0.00 -1.26 -5.03 105.19 110.64 2kvb n GLY 667 Ca 0.23 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 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 1.42 -0.06 1.61 0.23 -0.36 -4.98 119.30 117.16 2kvb s MET 668 Ca 0.00 -0.82 -0.11 0.00 -1.03 0.00 0.00 55.69 53.73 2kvb s MET 668 Cb 0.00 0.54 -0.05 0.00 -1.53 0.00 0.00 34.83 33.79 2kvb s MET 668 CO 0.00 -0.61 0.27 0.42 -2.03 0.00 0.00 175.02 173.07 2kvb s ILE 669 N -3.86 5.28 0.03 3.16 1.09 -1.24 -1.69 121.20 123.97 2kvb s ILE 669 Ca 0.08 0.51 0.04 0.00 -1.10 0.00 0.00 60.65 60.19 2kvb s ILE 669 Cb -0.02 -3.55 -0.02 0.00 -1.06 0.00 0.00 42.46 37.81 2kvb s ILE 669 CO -0.03 0.60 -0.12 -1.10 -0.10 0.00 0.00 174.94 174.19 2kvb s GLN 670 N -1.03 0.81 -0.15 2.79 -0.21 0.02 -0.02 119.66 121.87 2kvb s GLN 670 Ca 0.19 -0.66 0.01 0.00 0.02 0.00 0.00 55.36 54.92 2kvb s GLN 670 Cb -0.14 -0.78 0.01 0.00 1.00 0.00 0.00 33.01 33.10 2kvb s GLN 670 CO 0.08 0.19 -0.18 -1.17 -2.12 0.00 0.00 175.29 172.09 2kvb s LEU 671 N -1.01 2.30 -0.18 2.90 0.20 0.74 -1.28 118.68 122.34 2kvb s LEU 671 Ca 0.00 -0.54 -0.03 0.00 0.69 0.00 0.00 54.13 54.25 2kvb s LEU 671 Cb -0.07 -1.51 -0.02 0.00 -0.43 0.00 0.00 46.19 44.16 2kvb s LEU 671 CO 0.01 0.07 -0.06 -0.89 -0.29 0.00 0.00 176.35 175.19 2kvb s THR 672 N 0.89 3.45 0.67 3.68 2.01 -1.26 -0.70 115.64 124.38 2kvb s THR 672 Ca -0.04 -0.49 0.03 0.00 0.31 0.00 0.00 61.69 61.50 2kvb s THR 672 Cb -0.15 -2.53 0.12 0.00 0.01 0.00 0.00 72.50 69.95 2kvb s THR 672 CO -0.02 0.46 0.92 -0.31 -0.69 0.00 0.00 174.62 174.98 2kvb s TYR 673 N 0.94 1.45 0.97 4.92 2.02 -0.20 -4.86 117.35 122.59 2kvb s TYR 673 Ca -0.01 -0.47 -0.16 0.00 -0.37 0.00 0.00 57.07 56.06 2kvb s TYR 673 Cb -0.15 -2.68 0.20 0.00 -0.40 0.00 0.00 41.96 38.93 2kvb s TYR 673 CO 0.01 -1.53 1.30 1.03 -1.57 0.00 0.00 175.55 174.79 2kvb s ARG 674 N -4.97 0.58 0.25 -0.62 1.81 -1.22 -4.58 118.95 110.21 2kvb s ARG 674 Ca 0.65 -0.35 0.00 0.00 -1.72 0.00 0.00 55.73 54.31 2kvb s ARG 674 Cb -0.05 -1.83 0.30 0.00 -0.45 0.00 0.00 34.95 32.91 2kvb s ARG 674 CO 0.42 -2.46 1.65 0.38 -0.68 0.00 0.00 175.30 174.62 2kvb h ASP 675 N -1.68 0.56 0.00 0.23 2.03 -1.91 -3.35 116.42 112.31 2kvb h ASP 675 Ca -0.45 -0.22 0.00 0.00 -0.73 0.00 0.00 57.03 55.64 2kvb h ASP 675 Cb 1.24 -0.15 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 2kvb h ASP 675 CO 0.39 0.84 0.00 0.61 -1.03 0.00 0.00 179.24 180.06 2kvb n GLY 676 N -0.20 3.51 3.72 7.15 0.00 -1.26 -2.39 105.19 115.71 2kvb n GLY 676 Ca -0.01 0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 5.39 0.60 2.61 2.01 -1.23 -4.84 115.64 120.18 2kvb s THR 677 Ca 0.00 0.22 -0.16 0.00 0.31 0.00 0.00 61.69 62.06 2kvb s THR 677 Cb 0.00 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 2kvb s THR 677 CO 0.00 0.42 1.06 -2.16 -0.69 0.00 0.00 174.62 173.25 2kvb s PRO 678 N 0.50 3.27 0.00 4.92 0.04 -1.26 -1.44 135.00 141.04 2kvb s PRO 678 Ca 0.09 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2kvb s PRO 678 Cb -0.12 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2kvb s PRO 678 CO -0.00 -0.85 0.63 0.66 0.04 0.00 0.00 177.00 177.47 2kvb n TYR 679 N -2.07 0.00 0.00 0.56 4.01 0.42 -4.79 117.16 115.28 2kvb n TYR 679 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 2kvb n TYR 679 Cb 0.53 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 2kvb n TYR 679 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2kvb n ASN 680 N -1.39 0.00 -4.93 7.72 0.23 -1.26 -5.06 115.26 110.57 2kvb n ASN 680 Ca 0.00 0.00 -0.26 0.00 -0.53 0.00 0.00 54.58 53.79 2kvb n ASN 680 Cb 0.00 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 37.73 2kvb n ASN 680 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2kvb s ASN 681 N 0.00 5.50 0.31 0.53 4.22 -1.26 -4.93 114.94 119.31 2kvb s ASN 681 Ca 0.00 0.56 0.02 0.00 -2.14 0.00 0.00 52.86 51.31 2kvb s ASN 681 Cb 0.00 -1.54 0.59 0.00 1.28 0.00 0.00 41.25 41.58 2kvb s ASN 681 CO 0.00 -1.09 1.90 -0.08 -2.04 0.00 0.00 177.10 175.79 2kvb h GLU 682 N -0.13 0.92 0.00 3.55 4.81 -2.02 -0.05 114.58 121.67 2kvb h GLU 682 Ca -0.45 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 58.62 2kvb h GLU 682 Cb 1.27 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 2kvb h GLU 682 CO 0.59 0.61 -0.51 -0.22 -0.73 0.00 0.00 179.01 178.76 2kvb h LYS 683 N 0.95 0.00 -4.99 1.92 3.64 -2.06 -3.48 116.57 112.55 2kvb h LYS 683 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 2kvb h LYS 683 Cb 0.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2kvb h LYS 683 CO -0.16 0.51 -0.37 0.54 -2.27 0.00 0.00 179.45 177.69 2kvb n ARG 684 N -3.39 -1.93 -3.21 1.90 5.12 -0.03 -4.99 116.66 110.13 2kvb n ARG 684 Ca 0.01 1.83 -0.40 0.00 -1.93 0.00 0.00 57.85 57.36 2kvb n ARG 684 Cb 0.66 -5.14 -0.07 0.00 -1.16 0.00 0.00 32.46 26.74 2kvb n ARG 684 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2kvb s THR 685 N -2.49 5.06 0.46 0.55 2.01 -1.26 -4.89 115.64 115.09 2kvb s THR 685 Ca 0.18 0.95 -0.25 0.00 0.31 0.00 0.00 61.69 62.88 2kvb s THR 685 Cb -0.05 -3.85 -0.08 0.00 0.01 0.00 0.00 72.50 68.53 2kvb s THR 685 CO 0.66 0.10 1.43 -2.16 -0.69 0.00 0.00 174.62 173.96 2kvb s PRO 686 N 2.14 3.61 -0.20 4.92 0.04 -1.26 -0.44 135.00 143.81 2kvb s PRO 686 Ca 0.23 2.41 -0.16 0.00 0.04 0.00 0.00 61.00 63.52 2kvb s PRO 686 Cb -0.16 -2.61 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 2kvb s PRO 686 CO 0.09 -0.87 0.43 1.03 0.04 0.00 0.00 177.00 177.71 2kvb s ARG 687 N -2.51 4.17 0.26 4.56 0.52 -0.52 -4.75 118.95 120.69 2kvb s ARG 687 Ca 0.62 0.25 0.05 0.00 -0.52 0.00 0.00 55.73 56.14 2kvb s ARG 687 Cb -0.44 -3.54 -0.06 0.00 0.52 0.00 0.00 34.95 31.43 2kvb s ARG 687 CO 0.56 -0.07 -0.04 0.00 0.02 0.00 0.00 175.30 175.77 2kvb s ALA 688 N 1.40 2.13 -0.07 2.13 0.00 -1.16 -3.44 121.76 122.75 2kvb s ALA 688 Ca 0.20 -1.84 0.04 0.00 0.00 0.00 0.00 51.96 50.36 2kvb s ALA 688 Cb -0.15 0.28 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 2kvb s ALA 688 CO 0.08 -0.13 -0.21 0.99 0.00 0.00 0.00 175.76 176.49 2kvb s THR 689 N -3.16 1.77 -0.19 0.00 2.01 -0.55 0.02 115.64 115.54 2kvb s THR 689 Ca 0.29 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2kvb s THR 689 Cb 0.04 -1.52 0.04 0.00 0.01 0.00 0.00 72.50 71.07 2kvb s THR 689 CO 0.10 0.50 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.20 2kvb s LEU 690 N 0.18 2.23 -0.25 4.42 1.98 0.14 -1.03 118.68 126.35 2kvb s LEU 690 Ca -0.10 -0.85 -0.08 0.00 -2.89 0.00 0.00 54.13 50.20 2kvb s LEU 690 Cb -0.15 -1.23 -0.04 0.00 0.66 0.00 0.00 46.19 45.43 2kvb s LEU 690 CO 0.05 -0.14 0.10 -0.63 -1.89 0.00 0.00 176.35 173.85 2kvb s ILE 691 N 1.40 4.68 -0.27 6.68 1.01 0.12 -1.44 121.20 133.39 2kvb s ILE 691 Ca -0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.49 2kvb s ILE 691 Cb -0.16 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 2kvb s ILE 691 CO -0.08 0.33 0.16 -0.89 0.00 0.00 0.00 174.94 174.46 2kvb s THR 692 N 1.46 5.07 -0.25 2.92 2.01 0.94 -0.19 115.64 127.61 2kvb s THR 692 Ca 0.06 0.09 -0.14 0.00 0.31 0.00 0.00 61.69 62.01 2kvb s THR 692 Cb -0.15 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 2kvb s THR 692 CO 0.05 0.28 0.32 -0.36 -0.69 0.00 0.00 174.62 174.22 2kvb s PHE 693 N 1.67 3.29 0.08 4.92 0.40 0.97 0.38 117.98 129.69 2kvb s PHE 693 Ca 0.07 0.40 0.07 0.00 -0.60 0.00 0.00 56.93 56.87 2kvb s PHE 693 Cb -0.16 -2.47 -0.04 0.00 0.51 0.00 0.00 43.02 40.86 2kvb s PHE 693 CO 0.09 -0.10 -0.13 -0.51 0.70 0.00 0.00 175.22 175.27 2kvb s LEU 694 N 1.61 2.88 -0.34 -0.37 2.01 0.16 -3.61 118.68 121.01 2kvb s LEU 694 Ca 0.14 -0.41 -0.21 0.00 0.01 0.00 0.00 54.13 53.65 2kvb s LEU 694 Cb -0.15 -1.69 0.00 0.00 0.01 0.00 0.00 46.19 44.36 2kvb s LEU 694 CO 0.08 0.20 0.69 0.00 1.01 0.00 0.00 176.35 178.34 2kvb s ASP 696 N 1.76 6.75 0.57 0.00 -1.08 -0.95 -4.90 116.67 118.80 2kvb s ASP 696 Ca 0.27 0.89 0.36 0.00 -0.52 0.00 0.00 52.55 53.55 2kvb s ASP 696 Cb -0.14 -2.25 1.56 0.00 -1.46 0.00 0.00 42.92 40.63 2kvb s ASP 696 CO 0.15 0.24 2.05 0.03 0.52 0.00 0.00 175.17 178.16 2kvb h ARG 697 N 5.28 0.00 -3.09 4.34 2.47 -1.95 -3.38 114.38 118.04 2kvb h ARG 697 Ca -0.49 0.00 -0.47 0.00 -1.26 0.00 0.00 59.98 57.76 2kvb h ARG 697 Cb 1.21 0.00 -0.41 0.00 -1.65 0.00 0.00 29.97 29.12 2kvb h ARG 697 CO 0.65 0.00 -0.75 0.34 0.56 0.00 0.00 179.97 180.77 2kvb s ASP 698 N -5.55 2.48 -0.02 7.04 2.15 -1.26 -5.08 116.67 116.43 2kvb s ASP 698 Ca 0.00 -0.68 -0.18 0.00 0.43 0.00 0.00 52.55 52.13 2kvb s ASP 698 Cb 0.10 -0.29 0.06 0.00 -0.30 0.00 0.00 42.92 42.48 2kvb s ASP 698 CO 0.51 -0.35 0.79 0.00 -0.17 0.00 0.00 175.17 175.96 2kvb n ALA 699 N 5.25 -2.25 -2.06 3.66 0.00 -1.26 -5.00 120.51 118.85 2kvb n ALA 699 Ca -0.07 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2kvb n ALA 699 Cb 0.48 0.08 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.57 1.94 0.25 0.00 0.00 -1.26 -4.63 105.19 100.92 2kvb n GLY 700 Ca 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 46.02 45.85 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 1.28 0.00 1.61 3.04 -1.98 -2.81 116.25 117.39 2kvb h VAL 701 Ca 0.00 -1.45 0.00 0.00 -1.01 0.00 0.00 66.70 64.24 2kvb h VAL 701 Cb 0.00 1.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.65 2kvb h VAL 701 CO 0.00 0.47 0.00 0.61 -1.01 0.00 0.00 177.57 177.64 2kvb n GLY 702 N -0.11 2.72 3.43 3.17 0.00 -1.26 -4.61 105.19 108.54 2kvb n GLY 702 Ca -0.01 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.61 2.85 0.38 1.61 0.08 -1.24 -4.88 117.98 116.18 2kvb s PHE 703 Ca 0.00 -0.44 -0.20 0.00 0.12 0.00 0.00 56.93 56.41 2kvb s PHE 703 Cb 0.00 -1.83 -0.10 0.00 -0.57 0.00 0.00 43.02 40.52 2kvb s PHE 703 CO 0.00 -0.07 0.88 -1.25 -0.10 0.00 0.00 175.22 174.68 2kvb s PRO 704 N 0.10 4.20 -0.06 0.24 0.04 -1.26 -2.72 135.00 135.53 2kvb s PRO 704 Ca -0.04 1.00 0.04 0.00 0.04 0.00 0.00 61.00 62.03 2kvb s PRO 704 Cb -0.14 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.06 2kvb s PRO 704 CO 0.04 0.07 -0.17 -2.00 0.04 0.00 0.00 177.00 174.98 2kvb s GLU 705 N -2.96 2.07 -0.13 4.56 2.56 0.73 -4.87 118.70 120.65 2kvb s GLU 705 Ca 0.58 -0.61 -0.29 0.00 0.00 0.00 0.00 54.97 54.64 2kvb s GLU 705 Cb -0.11 -1.69 -0.01 0.00 2.00 0.00 0.00 34.13 34.32 2kvb s GLU 705 CO 0.16 0.16 1.04 -0.47 -0.56 0.00 0.00 175.26 175.59 2kvb s TYR 706 N 0.31 3.42 0.00 5.30 5.04 -1.26 -0.28 117.35 129.87 2kvb s TYR 706 Ca -0.11 1.51 0.00 0.00 -2.44 0.00 0.00 57.07 56.03 2kvb s TYR 706 Cb -0.14 -3.24 0.00 0.00 0.35 0.00 0.00 41.96 38.93 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 5.40 0.00 -3.65 4.97 1.13 -0.38 -4.97 117.38 119.88 2kvb n GLN 707 Ca 0.10 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 55.02 2kvb n GLN 707 Cb 0.48 -0.01 -0.08 0.00 0.11 0.00 0.00 30.24 30.74 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 0.77 -0.09 -1.09 1.03 -1.24 -5.02 118.70 113.06 2kvb s GLU 708 Ca 0.00 0.89 -0.25 0.00 0.03 0.00 0.00 54.97 55.63 2kvb s GLU 708 Cb 0.00 0.38 -0.03 0.00 -0.80 0.00 0.00 34.13 33.68 2kvb s GLU 708 CO 0.00 -0.10 0.80 -2.00 -1.33 0.00 0.00 175.26 172.63 2kvb s GLU 709 N 0.30 4.40 0.00 -4.83 -6.30 -1.26 -2.51 118.70 108.50 2kvb s GLU 709 Ca -0.00 1.02 0.00 0.00 -2.50 0.00 0.00 54.97 53.49 2kvb s GLU 709 Cb -0.04 -3.50 0.00 0.00 0.00 0.00 0.00 34.13 30.59 2kvb s GLU 709 CO 0.01 -0.10 0.00 -3.47 0.02 0.00 0.00 175.26 171.72 2kvb n ASP 710 N 4.35 0.00 -1.26 -1.70 -0.08 -1.18 -4.92 116.55 111.77 2kvb n ASP 710 Ca 0.02 0.00 -0.05 0.00 -1.51 0.00 0.00 54.79 53.25 2kvb n ASP 710 Cb 0.50 0.01 0.07 0.00 2.34 0.00 0.00 41.12 44.05 2kvb n ASP 710 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2kvb n ASN 711 N -1.52 3.02 0.00 1.67 3.02 -1.26 -4.71 115.26 115.48 2kvb n ASN 711 Ca 0.00 -2.44 0.00 0.00 -0.03 0.00 0.00 54.58 52.11 2kvb n ASN 711 Cb 0.00 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 2kvb n ASN 711 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2kvb n SER 712 N 0.05 0.00 -3.99 6.41 3.41 -1.26 -4.93 113.62 113.31 2kvb n SER 712 Ca 0.16 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.67 2kvb n SER 712 Cb 0.78 -1.06 -0.11 0.00 -0.26 0.00 0.00 64.21 63.56 2kvb n SER 712 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2kvb s THR 713 N -2.73 0.17 -0.16 6.66 -1.32 -1.26 -3.00 115.64 114.00 2kvb s THR 713 Ca 0.00 -0.90 -0.22 0.00 -1.21 0.00 0.00 61.69 59.36 2kvb s THR 713 Cb 0.00 -0.30 -0.02 0.00 -1.51 0.00 0.00 72.50 70.66 2kvb s THR 713 CO 0.00 -0.46 0.69 -0.31 -2.21 0.00 0.00 174.62 172.33 2kvb s TYR 714 N -1.39 3.43 -0.22 9.09 1.51 0.10 -3.08 117.35 126.79 2kvb s TYR 714 Ca -0.14 1.08 -0.10 0.00 -1.01 0.00 0.00 57.07 56.89 2kvb s TYR 714 Cb -0.10 -2.85 -0.05 0.00 -0.11 0.00 0.00 41.96 38.85 2kvb s TYR 714 CO -0.01 -0.13 0.16 -0.80 -1.11 0.00 0.00 175.55 173.66 2kvb s ASN 715 N 1.09 6.16 -0.03 2.29 -0.87 -1.04 0.28 114.94 122.81 2kvb s ASN 715 Ca 0.33 0.17 0.06 0.00 -1.57 0.00 0.00 52.86 51.85 2kvb s ASN 715 Cb -0.16 -2.10 -0.02 0.00 -0.02 0.00 0.00 41.25 38.94 2kvb s ASN 715 CO 0.12 0.10 -0.22 -0.36 -2.57 0.00 0.00 177.10 174.18 2kvb s PHE 716 N 0.80 2.47 -0.25 2.20 0.40 -0.52 -1.25 117.98 121.83 2kvb s PHE 716 Ca 0.08 -0.36 -0.08 0.00 -0.60 0.00 0.00 56.93 55.97 2kvb s PHE 716 Cb -0.13 -1.56 -0.04 0.00 0.51 0.00 0.00 43.02 41.81 2kvb s PHE 716 CO 0.02 0.03 0.10 1.03 0.70 0.00 0.00 175.22 177.10 2kvb s ARG 717 N -0.62 3.76 -0.33 0.44 0.52 0.61 -0.04 118.95 123.29 2kvb s ARG 717 Ca 0.10 -0.43 -0.10 0.00 -0.52 0.00 0.00 55.73 54.78 2kvb s ARG 717 Cb -0.10 -3.40 -0.00 0.00 0.52 0.00 0.00 34.95 31.96 2kvb s ARG 717 CO -0.00 -0.15 0.18 -0.46 0.02 0.00 0.00 175.30 174.89 2kvb s TRP 718 N 1.55 3.20 -0.66 -0.53 -0.11 0.16 -0.19 118.94 122.35 2kvb s TRP 718 Ca 0.06 -0.61 -0.17 0.00 1.22 0.00 0.00 56.10 56.60 2kvb s TRP 718 Cb -0.15 -2.39 0.15 0.00 -1.50 0.00 0.00 33.47 29.57 2kvb s TRP 718 CO 0.05 -0.49 0.68 0.71 -4.62 0.00 0.00 176.95 173.29 2kvb s TYR 719 N 1.61 3.30 0.03 5.86 1.51 -1.10 0.36 117.35 128.91 2kvb s TYR 719 Ca 0.04 -1.38 0.08 0.00 -1.01 0.00 0.00 57.07 54.80 2kvb s TYR 719 Cb -0.18 -3.91 -0.03 0.00 -0.11 0.00 0.00 41.96 37.74 2kvb s TYR 719 CO 0.07 -1.13 -0.25 -0.08 -1.11 0.00 0.00 175.55 173.05 2kvb s THR 720 N 1.64 1.97 0.33 -0.71 -1.32 0.25 -3.62 115.64 114.18 2kvb s THR 720 Ca 0.12 -1.25 0.25 0.00 -1.21 0.00 0.00 61.69 59.59 2kvb s THR 720 Cb -0.21 -1.68 0.26 0.00 -1.51 0.00 0.00 72.50 69.36 2kvb s THR 720 CO -0.00 0.37 1.97 -1.28 -2.21 0.00 0.00 174.62 173.48 2kvb h SER 721 N 5.00 0.00 0.60 8.08 0.87 -1.67 -2.49 113.55 123.94 2kvb h SER 721 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2kvb h SER 721 Cb 1.14 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2kvb h SER 721 CO 0.45 0.18 0.00 -1.22 -0.53 0.00 0.00 176.83 175.70 2kvb n TYR 722 N -3.60 0.26 0.83 2.24 4.02 -1.26 -2.94 117.16 116.70 2kvb n TYR 722 Ca -0.01 0.10 0.03 0.00 -0.01 0.00 0.00 57.90 58.00 2kvb n TYR 722 Cb 0.31 -0.66 0.11 0.00 -0.02 0.00 0.00 39.34 39.08 2kvb n TYR 722 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kvb n ALA 723 N -1.59 2.71 -2.93 -0.72 0.00 -1.11 -4.75 120.51 112.12 2kvb n ALA 723 Ca 0.03 -0.49 -0.35 0.00 0.00 0.00 0.00 53.44 52.63 2kvb n ALA 723 Cb 0.20 -1.01 -0.11 0.00 0.00 0.00 0.00 19.45 18.52 2kvb n ALA 723 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50