#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 -1.84 -0.39 4.31 0.00 -1.26 -4.99 121.76 117.59 2kvb s ALA 579 Ca 0.00 2.08 0.04 0.00 0.00 0.00 0.00 51.96 54.08 2kvb s ALA 579 Cb 0.00 -1.28 0.16 0.00 0.00 0.00 0.00 23.12 22.01 2kvb s ALA 579 CO 0.00 -0.33 0.44 -2.00 0.00 0.00 0.00 175.76 173.87 2kvb s GLU 580 N 0.59 0.72 0.00 0.00 2.12 -1.26 -4.91 118.70 115.97 2kvb s GLU 580 Ca -0.01 -0.87 0.18 0.00 0.36 0.00 0.00 54.97 54.62 2kvb s GLU 580 Cb -0.05 -0.59 -0.06 0.00 0.26 0.00 0.00 34.13 33.69 2kvb s GLU 580 CO -0.04 -1.22 0.86 0.00 -0.54 0.00 0.00 175.26 174.32 2kvb n ALA 581 N 4.07 3.58 -3.01 6.30 0.00 -1.26 -4.80 120.51 125.40 2kvb n ALA 581 Ca 0.13 -0.54 -0.44 0.00 0.00 0.00 0.00 53.44 52.59 2kvb n ALA 581 Cb 0.48 -0.63 -0.04 0.00 0.00 0.00 0.00 19.45 19.26 2kvb n ALA 581 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2kvb s GLU 582 N -2.24 3.14 -0.17 0.00 2.12 -1.26 -4.98 118.70 115.30 2kvb s GLU 582 Ca 0.12 -1.24 -0.16 0.00 0.36 0.00 0.00 54.97 54.06 2kvb s GLU 582 Cb 0.14 -4.32 0.05 0.00 0.26 0.00 0.00 34.13 30.25 2kvb s GLU 582 CO 0.53 -1.65 0.46 -0.59 -0.54 0.00 0.00 175.26 173.47 2kvb s PHE 583 N 3.07 -0.52 0.00 5.30 -0.71 -1.26 -4.99 117.98 118.87 2kvb s PHE 583 Ca 0.17 1.26 0.00 0.00 -1.04 0.00 0.00 56.93 57.32 2kvb s PHE 583 Cb -0.19 0.18 0.00 0.00 -1.21 0.00 0.00 43.02 41.80 2kvb s PHE 583 CO 0.05 -0.25 0.00 -0.11 -1.34 0.00 0.00 175.22 173.57 2kvb n LEU 584 N 2.92 0.00 -0.02 -1.99 0.00 -1.26 -4.82 117.00 111.83 2kvb n LEU 584 Ca -0.14 0.00 0.13 0.00 0.00 0.00 0.00 56.01 56.00 2kvb n LEU 584 Cb 0.57 0.11 0.78 0.00 0.00 0.00 0.00 43.42 44.89 2kvb n LEU 584 CO 0.11 -0.19 1.00 -1.20 0.00 0.00 0.00 177.39 177.11 2kvb n SER 585 N -1.89 0.05 -4.22 1.96 7.64 -1.26 -4.51 113.62 111.38 2kvb n SER 585 Ca 0.00 -1.18 -0.35 0.00 1.01 0.00 0.00 58.87 58.35 2kvb n SER 585 Cb 0.00 -0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 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 -2.00 2.75 -0.14 1.43 3.52 -1.25 -0.44 118.95 122.82 2kvb s ARG 586 Ca 0.40 -1.05 -0.06 0.00 -0.13 0.00 0.00 55.73 54.89 2kvb s ARG 586 Cb 0.18 -3.14 -0.04 0.00 -1.56 0.00 0.00 34.95 30.39 2kvb s ARG 586 CO 0.31 -0.49 0.06 0.99 -0.81 0.00 0.00 175.30 175.36 2kvb s THR 587 N 1.34 4.80 -0.13 4.11 2.01 0.83 -4.90 115.64 123.69 2kvb s THR 587 Ca -0.01 -0.04 -0.00 0.00 0.31 0.00 0.00 61.69 61.94 2kvb s THR 587 Cb -0.18 -3.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 2kvb s THR 587 CO -0.02 0.53 -0.13 -0.70 -0.69 0.00 0.00 174.62 173.61 2kvb s GLU 588 N -0.23 3.38 0.00 4.92 2.12 -1.26 0.76 118.70 128.40 2kvb s GLU 588 Ca 0.08 -0.68 0.00 0.00 0.36 0.00 0.00 54.97 54.73 2kvb s GLU 588 Cb -0.12 -2.63 0.00 0.00 0.26 0.00 0.00 34.13 31.64 2kvb s GLU 588 CO 0.01 0.22 0.00 0.41 -0.54 0.00 0.00 175.26 175.36 2kvb n GLY 589 N 3.51 1.08 0.00 -1.50 0.00 0.95 -4.97 105.19 104.25 2kvb n GLY 589 Ca -0.18 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 1.59 -4.65 1.61 8.00 -0.92 -4.58 116.55 117.60 2kvb n ASP 590 Ca 0.00 -0.49 -0.43 0.00 0.71 0.00 0.00 54.79 54.58 2kvb n ASP 590 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 2kvb n ASP 590 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2kvb s ASN 591 N -0.19 6.70 0.00 -2.24 2.20 -1.24 -2.15 114.94 118.01 2kvb s ASN 591 Ca 0.00 1.77 0.00 0.00 -0.94 0.00 0.00 52.86 53.69 2kvb s ASN 591 Cb 0.00 -2.54 0.00 0.00 -2.00 0.00 0.00 41.25 36.71 2kvb s ASN 591 CO 0.00 -0.96 0.00 0.00 -2.94 0.00 0.00 177.10 173.20 2kvb s THR 593 N -1.27 1.57 -0.11 0.00 -4.23 -1.25 -0.93 115.64 109.43 2kvb s THR 593 Ca 0.00 -1.18 -0.00 0.00 -1.18 0.00 0.00 61.69 59.33 2kvb s THR 593 Cb 0.00 -1.38 0.02 0.00 1.34 0.00 0.00 72.50 72.49 2kvb s THR 593 CO 0.00 0.16 -0.08 0.54 -0.54 0.00 0.00 174.62 174.70 2kvb s VAL 594 N -0.82 1.05 -0.20 2.29 0.11 0.31 -2.17 120.40 120.98 2kvb s VAL 594 Ca 0.06 -0.32 -0.04 0.00 -2.93 0.00 0.00 61.98 58.76 2kvb s VAL 594 Cb -0.09 -1.06 -0.02 0.00 -1.53 0.00 0.00 36.38 33.69 2kvb s VAL 594 CO 0.02 0.37 -0.03 0.12 -3.33 0.00 0.00 175.10 172.25 2kvb s PHE 595 N 1.62 2.99 -0.22 1.54 5.36 -1.26 -0.25 117.98 127.75 2kvb s PHE 595 Ca 0.03 -0.65 -0.07 0.00 -0.96 0.00 0.00 56.93 55.28 2kvb s PHE 595 Cb -0.13 -2.07 -0.03 0.00 -0.34 0.00 0.00 43.02 40.45 2kvb s PHE 595 CO -0.07 -0.36 0.07 0.34 -1.46 0.00 0.00 175.22 173.74 2kvb s ASP 596 N 1.13 5.31 0.23 6.13 -1.08 -0.85 -4.70 116.67 122.84 2kvb s ASP 596 Ca 0.02 -0.10 -0.00 0.00 -0.52 0.00 0.00 52.55 51.94 2kvb s ASP 596 Cb -0.15 -1.94 0.23 0.00 -1.46 0.00 0.00 42.92 39.61 2kvb s ASP 596 CO 0.00 0.04 1.59 0.77 0.52 0.00 0.00 175.17 178.10 2kvb h SER 597 N 7.66 0.54 0.53 -0.34 4.64 -1.96 0.42 113.55 125.04 2kvb h SER 597 Ca -0.37 -0.25 -0.29 0.00 -0.47 0.00 0.00 61.79 60.41 2kvb h SER 597 Cb 1.18 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 63.13 2kvb h SER 597 CO 0.62 0.91 -1.33 0.06 -0.87 0.00 0.00 176.83 176.21 2kvb h GLN 598 N 0.41 0.34 0.00 4.77 3.07 -1.96 -3.23 115.11 118.51 2kvb h GLN 598 Ca 0.03 -0.58 -0.05 0.00 0.09 0.00 0.00 58.65 58.15 2kvb h GLN 598 Cb 0.93 0.22 -0.01 0.00 0.08 0.00 0.00 27.48 28.70 2kvb h GLN 598 CO 0.08 1.27 -0.38 0.00 0.09 0.00 0.00 178.83 179.89 2kvb h ALA 599 N 0.47 0.81 -0.38 0.06 0.00 -1.98 -3.47 119.26 114.76 2kvb h ALA 599 Ca -0.17 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.36 2kvb h ALA 599 Cb 2.03 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.74 2kvb h ALA 599 CO 0.22 0.28 -0.15 0.41 0.00 0.00 0.00 179.25 180.01 2kvb n GLY 600 N 1.17 0.93 3.27 0.00 0.00 0.13 -4.99 105.19 105.71 2kvb n GLY 600 Ca 0.02 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.08 1.76 -0.10 1.61 0.08 -1.20 -4.98 117.98 113.07 2kvb s PHE 601 Ca 0.00 -0.41 0.03 0.00 0.12 0.00 0.00 56.93 56.67 2kvb s PHE 601 Cb 0.00 -0.98 -0.01 0.00 -0.57 0.00 0.00 43.02 41.46 2kvb s PHE 601 CO 0.00 0.18 -0.21 -1.54 -0.10 0.00 0.00 175.22 173.55 2kvb s SER 602 N -1.77 3.39 -0.03 1.36 1.04 -1.26 -2.00 113.70 114.43 2kvb s SER 602 Ca 0.06 -0.47 0.06 0.00 0.48 0.00 0.00 55.95 56.08 2kvb s SER 602 Cb -0.10 -1.33 -0.01 0.00 0.10 0.00 0.00 66.02 64.68 2kvb s SER 602 CO 0.04 0.19 -0.22 -0.36 0.98 0.00 0.00 173.24 173.87 2kvb s PHE 603 N 0.19 2.04 -0.29 5.02 0.08 0.65 -4.97 117.98 120.69 2kvb s PHE 603 Ca -0.12 -0.50 -0.07 0.00 0.12 0.00 0.00 56.93 56.36 2kvb s PHE 603 Cb -0.16 -1.33 0.01 0.00 -0.57 0.00 0.00 43.02 40.96 2kvb s PHE 603 CO 0.07 -0.12 0.08 -0.51 -0.10 0.00 0.00 175.22 174.64 2kvb s ASP 604 N -0.28 5.11 -0.04 1.36 1.11 -1.26 -0.53 116.67 122.13 2kvb s ASP 604 Ca 0.02 -0.70 0.16 0.00 0.18 0.00 0.00 52.55 52.21 2kvb s ASP 604 Cb -0.11 -1.88 0.50 0.00 1.07 0.00 0.00 42.92 42.50 2kvb s ASP 604 CO 0.01 -0.19 1.42 0.18 1.18 0.00 0.00 175.17 177.78 2kvb n LEU 605 N 4.86 3.66 0.03 1.23 7.99 -0.10 -4.63 117.00 130.05 2kvb n LEU 605 Ca -0.15 -2.21 -0.12 0.00 -0.01 0.00 0.00 56.01 53.53 2kvb n LEU 605 Cb 0.48 -0.40 -0.07 0.00 -0.11 0.00 0.00 43.42 43.32 2kvb n LEU 605 CO 0.31 0.81 0.87 0.74 -1.51 0.00 0.00 177.39 178.61 2kvb h THR 606 N 2.97 1.01 0.00 -5.08 2.02 -1.85 -2.73 112.91 109.25 2kvb h THR 606 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 2kvb h THR 606 Cb 1.02 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 2kvb h THR 606 CO 0.07 0.01 0.00 -0.65 0.37 0.00 0.00 175.52 175.32 2kvb h PRO 607 N 0.02 0.00 0.00 6.66 0.11 -1.92 -2.80 132.00 134.06 2kvb h PRO 607 Ca 0.01 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 2kvb h PRO 607 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 2kvb h PRO 607 CO -0.00 0.00 -0.21 -0.07 -0.21 0.00 0.00 178.00 177.51 2kvb h LEU 608 N 0.00 0.00 -9.60 2.35 -0.00 -1.81 -3.43 115.31 102.82 2kvb h LEU 608 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 57.88 57.36 2kvb h LEU 608 Cb 0.28 0.00 0.04 0.00 -0.00 0.00 0.00 40.66 40.99 2kvb h LEU 608 CO 0.00 0.21 0.92 -0.89 -0.00 0.00 0.00 178.44 178.67 2kvb s THR 609 N -3.86 2.56 0.01 0.22 2.01 -1.06 -4.60 115.64 110.93 2kvb s THR 609 Ca -0.01 0.37 0.07 0.00 0.31 0.00 0.00 61.69 62.43 2kvb s THR 609 Cb 0.11 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.36 2kvb s THR 609 CO 0.62 0.03 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.83 2kvb s LYS 610 N 1.32 1.58 0.33 4.92 1.02 -1.26 -4.98 119.74 122.66 2kvb s LYS 610 Ca 0.71 -0.86 0.15 0.00 0.02 0.00 0.00 55.97 55.99 2kvb s LYS 610 Cb -0.44 -1.62 0.52 0.00 -0.52 0.00 0.00 37.83 35.77 2kvb s LYS 610 CO 0.32 0.43 1.68 0.87 -0.92 0.00 0.00 175.35 177.72 2kvb h LYS 611 N 5.23 0.00 0.00 1.68 1.57 -1.95 -2.33 116.57 120.77 2kvb h LYS 611 Ca -0.41 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.32 2kvb h LYS 611 Cb 1.15 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2kvb h LYS 611 CO 0.46 0.49 -0.25 -0.44 -0.57 0.00 0.00 179.45 179.14 2kvb h ASP 612 N 0.00 0.00 -2.66 0.86 3.32 -1.95 -3.41 116.42 112.58 2kvb h ASP 612 Ca -0.00 0.00 0.22 0.00 0.02 0.00 0.00 57.03 57.27 2kvb h ASP 612 Cb 0.99 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.48 2kvb h ASP 612 CO 0.06 0.20 -0.30 0.00 -1.72 0.00 0.00 179.24 177.49 2kvb n ALA 613 N -2.16 -2.12 -2.69 3.45 0.00 -0.88 -4.83 120.51 111.29 2kvb n ALA 613 Ca 0.03 0.26 -0.34 0.00 0.00 0.00 0.00 53.44 53.39 2kvb n ALA 613 Cb 0.61 -0.73 -0.11 0.00 0.00 0.00 0.00 19.45 19.22 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 -1.33 2.98 -0.05 0.00 1.51 0.63 -4.93 117.35 116.15 2kvb s TYR 614 Ca 0.00 -0.04 0.06 0.00 -1.01 0.00 0.00 57.07 56.08 2kvb s TYR 614 Cb 0.00 -1.78 -0.01 0.00 -0.11 0.00 0.00 41.96 40.06 2kvb s TYR 614 CO 0.00 0.26 -0.23 0.21 -1.11 0.00 0.00 175.55 174.67 2kvb s LYS 615 N -0.54 2.50 -0.09 -0.62 2.20 -1.26 -0.39 119.74 121.56 2kvb s LYS 615 Ca 0.08 -0.87 0.02 0.00 -0.36 0.00 0.00 55.97 54.84 2kvb s LYS 615 Cb -0.12 -2.19 -0.02 0.00 -1.51 0.00 0.00 37.83 33.99 2kvb s LYS 615 CO 0.02 0.44 -0.15 0.08 -0.36 0.00 0.00 175.35 175.38 2kvb s VAL 616 N -0.29 2.93 -0.04 4.02 1.01 0.85 -4.94 120.40 123.94 2kvb s VAL 616 Ca 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.28 2kvb s VAL 616 Cb -0.13 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 2kvb s VAL 616 CO 0.02 0.56 -0.12 -1.61 0.00 0.00 0.00 175.10 173.95 2kvb s GLU 617 N -0.17 2.51 0.00 2.72 8.01 -1.26 0.04 118.70 130.55 2kvb s GLU 617 Ca -0.01 -0.70 0.00 0.00 0.01 0.00 0.00 54.97 54.27 2kvb s GLU 617 Cb -0.13 -2.41 0.00 0.00 -4.31 0.00 0.00 34.13 27.27 2kvb s GLU 617 CO 0.03 0.62 0.00 0.25 0.01 0.00 0.00 175.26 176.17 2kvb n THR 618 N 2.12 0.00 -0.11 3.63 -2.24 0.93 -4.99 114.28 113.62 2kvb n THR 618 Ca -0.17 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.51 2kvb n THR 618 Cb 0.52 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.73 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 0.51 0.00 3.42 5.19 -2.03 -3.37 116.42 120.14 2kvb h ASP 619 Ca 0.00 -0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.17 2kvb h ASP 619 Cb 0.00 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.38 2kvb h ASP 619 CO 0.00 0.62 0.00 0.29 -3.12 0.00 0.00 179.24 177.03 2kvb n LYS 620 N -4.62 4.04 -4.24 3.56 5.02 -1.26 -4.92 118.16 115.74 2kvb n LYS 620 Ca -0.02 -0.16 -0.14 0.00 -2.02 0.00 0.00 58.31 55.98 2kvb n LYS 620 Cb 0.20 -0.63 -0.10 0.00 -0.02 0.00 0.00 35.03 34.48 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 -0.62 1.22 0.04 2.13 1.51 -1.26 -0.09 117.35 120.28 2kvb s TYR 621 Ca 0.00 -0.88 0.06 0.00 -1.01 0.00 0.00 57.07 55.23 2kvb s TYR 621 Cb 0.00 -0.67 -0.02 0.00 -0.11 0.00 0.00 41.96 41.16 2kvb s TYR 621 CO 0.00 -0.06 -0.16 -1.83 -1.11 0.00 0.00 175.55 172.39 2kvb s GLU 622 N -3.83 1.08 -0.18 -0.62 -1.05 -0.82 -0.05 118.70 113.23 2kvb s GLU 622 Ca 0.19 -0.82 -0.01 0.00 -0.15 0.00 0.00 54.97 54.18 2kvb s GLU 622 Cb 0.04 -1.13 -0.00 0.00 -0.44 0.00 0.00 34.13 32.60 2kvb s GLU 622 CO 0.02 0.28 -0.11 -0.06 0.95 0.00 0.00 175.26 176.34 2kvb s PHE 623 N -0.84 2.86 -0.19 4.83 0.40 0.11 -2.20 117.98 122.95 2kvb s PHE 623 Ca 0.04 -1.06 -0.03 0.00 -0.60 0.00 0.00 56.93 55.28 2kvb s PHE 623 Cb -0.08 -1.98 -0.01 0.00 0.51 0.00 0.00 43.02 41.46 2kvb s PHE 623 CO 0.01 -0.53 -0.08 -1.58 0.70 0.00 0.00 175.22 173.74 2kvb s HIS 624 N 1.13 2.91 0.05 0.36 2.46 0.93 -0.10 115.29 123.04 2kvb s HIS 624 Ca 0.01 -0.88 0.01 0.00 0.47 0.00 0.00 55.06 54.66 2kvb s HIS 624 Cb -0.14 -2.02 -0.03 0.00 -0.13 0.00 0.00 32.58 30.26 2kvb s HIS 624 CO -0.03 -0.46 -0.05 0.96 -2.47 0.00 0.00 174.74 172.69 2kvb s ILE 625 N 1.12 0.38 0.10 0.89 -4.36 0.48 -0.18 121.20 119.63 2kvb s ILE 625 Ca 0.01 -1.51 0.04 0.00 -0.26 0.00 0.00 60.65 58.93 2kvb s ILE 625 Cb -0.15 -1.12 -0.03 0.00 1.25 0.00 0.00 42.46 42.41 2kvb s ILE 625 CO -0.02 -0.74 -0.11 0.21 0.24 0.00 0.00 174.94 174.52 2kvb s ASN 626 N -2.38 1.53 -0.35 4.36 2.47 -1.00 -0.27 114.94 119.30 2kvb s ASN 626 Ca 0.00 -0.78 -0.26 0.00 0.42 0.00 0.00 52.86 52.24 2kvb s ASN 626 Cb -0.00 -0.01 0.01 0.00 -1.45 0.00 0.00 41.25 39.80 2kvb s ASN 626 CO -0.05 -0.22 0.92 -0.69 -3.72 0.00 0.00 177.10 173.34 2kvb s VAL 627 N -2.23 4.62 0.58 -5.21 1.01 -1.26 -4.80 120.40 113.10 2kvb s VAL 627 Ca 0.05 1.28 0.00 0.00 0.00 0.00 0.00 61.98 63.30 2kvb s VAL 627 Cb -0.04 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 32.03 2kvb s VAL 627 CO 0.01 -0.47 0.00 0.00 0.00 0.00 0.00 175.10 174.64 2kvb n GLY 629 N -2.00 -0.26 3.95 0.00 0.00 0.85 -4.84 105.19 102.89 2kvb n GLY 629 Ca 0.00 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.73 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 2.35 -0.17 1.61 0.04 -1.26 -3.05 135.00 134.51 2kvb s PRO 630 Ca 0.00 -0.48 -0.06 0.00 0.04 0.00 0.00 61.00 60.50 2kvb s PRO 630 Cb 0.00 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2kvb s PRO 630 CO 0.00 -1.01 0.04 0.54 0.04 0.00 0.00 177.00 176.61 2kvb s VAL 631 N -3.04 4.59 -1.22 -0.36 0.11 0.16 -4.76 120.40 115.88 2kvb s VAL 631 Ca 0.59 -0.11 -0.11 0.00 -2.93 0.00 0.00 61.98 59.42 2kvb s VAL 631 Cb -0.11 -3.05 0.19 0.00 -1.53 0.00 0.00 36.38 31.88 2kvb s VAL 631 CO 0.42 0.48 1.57 -1.54 -3.33 0.00 0.00 175.10 172.70 2kvb n SER 632 N 3.44 5.26 -3.93 3.54 3.41 -1.26 -4.72 113.62 119.37 2kvb n SER 632 Ca -0.17 -3.05 -0.18 0.00 -0.26 0.00 0.00 58.87 55.21 2kvb n SER 632 Cb 0.52 -1.51 -0.15 0.00 -0.26 0.00 0.00 64.21 62.81 2kvb n SER 632 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2kvb s VAL 633 N 0.73 0.49 -0.21 -3.33 1.01 -1.26 -4.68 120.40 113.14 2kvb s VAL 633 Ca 0.40 -0.17 0.27 0.00 0.00 0.00 0.00 61.98 62.48 2kvb s VAL 633 Cb 0.01 -0.47 0.29 0.00 0.00 0.00 0.00 36.38 36.21 2kvb s VAL 633 CO 0.00 0.18 1.81 1.23 0.00 0.00 0.00 175.10 178.32 2kvb h GLY 634 N 6.62 0.00 1.08 4.51 0.00 -1.98 -3.07 103.07 110.23 2kvb h GLY 634 Ca -0.35 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2kvb h GLY 634 CO 0.49 0.00 0.51 0.00 0.00 0.00 0.00 176.54 177.53 2kvb h ALA 635 N 2.14 1.24 -3.06 3.60 0.00 -1.97 -3.43 119.26 117.77 2kvb h ALA 635 Ca 0.00 -0.11 -0.51 0.00 0.00 0.00 0.00 54.91 54.29 2kvb h ALA 635 Cb 0.29 -0.35 -0.19 0.00 0.00 0.00 0.00 17.79 17.54 2kvb h ALA 635 CO 0.00 0.64 -0.79 0.00 0.00 0.00 0.00 179.25 179.10 2kvb n PRO 637 N 0.49 0.45 0.04 0.00 -0.04 -1.26 -4.64 135.00 130.04 2kvb n PRO 637 Ca -0.15 0.22 0.02 0.00 -0.04 0.00 0.00 63.50 63.56 2kvb n PRO 637 Cb 0.56 -2.47 0.11 0.00 -0.04 0.00 0.00 33.50 31.67 2kvb n PRO 637 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2kvb n PRO 638 N -2.89 0.03 0.00 0.54 -0.02 -1.26 -0.48 135.00 130.92 2kvb n PRO 638 Ca 0.14 0.44 0.14 0.00 -2.02 0.00 0.00 63.50 62.21 2kvb n PRO 638 Cb 0.50 -1.70 0.66 0.00 -0.02 0.00 0.00 33.50 32.93 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 -1.57 0.00 -4.71 2.55 8.00 -1.26 -4.61 116.55 114.95 2kvb n ASP 639 Ca -0.00 0.30 -0.34 0.00 0.71 0.00 0.00 54.79 55.46 2kvb n ASP 639 Cb 0.12 -0.43 -0.09 0.00 -0.02 0.00 0.00 41.12 40.71 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 -2.86 5.34 -0.00 -2.24 0.15 0.37 0.21 113.70 114.67 2kvb s SER 640 Ca 0.18 0.11 0.14 0.00 0.70 0.00 0.00 55.95 57.09 2kvb s SER 640 Cb 0.19 -1.49 -0.16 0.00 -1.71 0.00 0.00 66.02 62.85 2kvb s SER 640 CO 0.50 0.32 0.60 0.61 1.20 0.00 0.00 173.24 176.48 2kvb n GLY 641 N 1.68 -0.38 3.23 9.45 0.00 0.52 0.36 105.19 120.05 2kvb n GLY 641 Ca -0.16 -0.41 -0.11 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.40 -0.95 -0.01 4.61 0.00 -1.18 -2.38 121.76 119.45 2kvb s ALA 642 Ca 0.05 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.43 2kvb s ALA 642 Cb 0.11 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.38 2kvb s ALA 642 CO 0.60 -0.25 0.00 0.00 0.00 0.00 0.00 175.76 176.11 2kvb s GLN 644 N 0.52 1.91 -0.04 0.00 -2.07 -0.63 -0.05 119.66 119.31 2kvb s GLN 644 Ca -0.05 -1.06 0.01 0.00 -1.82 0.00 0.00 55.36 52.44 2kvb s GLN 644 Cb -0.07 -2.08 0.02 0.00 -1.09 0.00 0.00 33.01 29.79 2kvb s GLN 644 CO -0.01 0.52 -0.04 0.54 -1.32 0.00 0.00 175.29 174.98 2kvb s VAL 645 N -0.88 0.46 -0.42 3.63 0.11 -0.94 -0.11 120.40 122.26 2kvb s VAL 645 Ca 0.13 -0.11 -0.29 0.00 -2.93 0.00 0.00 61.98 58.79 2kvb s VAL 645 Cb -0.10 -0.49 0.02 0.00 -1.53 0.00 0.00 36.38 34.29 2kvb s VAL 645 CO 0.04 0.20 1.10 -0.55 -3.33 0.00 0.00 175.10 172.56 2kvb s SER 646 N 0.77 6.73 0.54 3.54 0.15 0.19 -1.94 113.70 123.68 2kvb s SER 646 Ca -0.10 0.66 0.32 0.00 0.70 0.00 0.00 55.95 57.54 2kvb s SER 646 Cb -0.13 -2.54 1.26 0.00 -1.71 0.00 0.00 66.02 62.90 2kvb s SER 646 CO -0.00 -1.11 1.95 0.08 1.20 0.00 0.00 173.24 175.36 2kvb h ARG 647 N 8.80 0.00 0.04 5.44 0.11 -0.80 0.16 114.38 128.14 2kvb h ARG 647 Ca -0.22 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.78 2kvb h ARG 647 Cb 1.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.15 2kvb h ARG 647 CO 1.09 0.02 -0.35 1.03 0.10 0.00 0.00 179.97 181.86 2kvb h SER 648 N 0.00 0.14 0.00 0.08 0.87 -1.87 -3.39 113.55 109.39 2kvb h SER 648 Ca -0.00 -0.95 0.00 0.00 -1.23 0.00 0.00 61.79 59.61 2kvb h SER 648 Cb 0.56 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2kvb h SER 648 CO 0.00 1.16 -0.86 -0.67 -0.53 0.00 0.00 176.83 175.93 2kvb n ASP 649 N -4.44 0.80 -0.74 6.23 2.03 -1.21 -4.98 116.55 114.24 2kvb n ASP 649 Ca -0.13 -0.80 -0.08 0.00 0.52 0.00 0.00 54.79 54.29 2kvb n ASP 649 Cb 0.60 1.07 -0.03 0.00 -0.72 0.00 0.00 41.12 42.05 2kvb n ASP 649 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2kvb n ARG 650 N -1.45 -0.61 -3.65 -0.67 3.00 0.57 -5.02 116.66 108.83 2kvb n ARG 650 Ca 0.03 0.68 -0.35 0.00 -0.00 0.00 0.00 57.85 58.20 2kvb n ARG 650 Cb 0.27 -4.57 -0.05 0.00 0.00 0.00 0.00 32.46 28.11 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 -3.24 3.69 0.07 -0.14 -0.14 -1.22 -4.86 119.74 113.90 2kvb s LYS 651 Ca 0.00 0.08 0.05 0.00 -1.36 0.00 0.00 55.97 54.75 2kvb s LYS 651 Cb 0.00 -3.04 -0.03 0.00 -1.68 0.00 0.00 37.83 33.08 2kvb s LYS 651 CO 0.00 0.60 -0.15 -1.54 -0.76 0.00 0.00 175.35 173.50 2kvb s SER 652 N -1.71 1.75 0.09 2.83 1.04 -1.26 0.55 113.70 116.99 2kvb s SER 652 Ca 0.30 -0.62 0.02 0.00 0.48 0.00 0.00 55.95 56.14 2kvb s SER 652 Cb -0.14 -0.06 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 2kvb s SER 652 CO 0.17 -0.06 -0.08 0.26 0.98 0.00 0.00 173.24 174.51 2kvb s TRP 653 N -1.26 0.91 -0.23 5.02 0.51 0.85 -4.98 118.94 119.75 2kvb s TRP 653 Ca -0.01 -0.77 -0.14 0.00 -2.12 0.00 0.00 56.10 53.06 2kvb s TRP 653 Cb -0.10 -0.51 -0.04 0.00 -0.81 0.00 0.00 33.47 32.00 2kvb s TRP 653 CO 0.02 -0.09 0.34 1.21 -0.51 0.00 0.00 176.95 177.93 2kvb s ASN 654 N -2.63 6.31 -0.10 2.95 3.84 -1.26 -1.60 114.94 122.44 2kvb s ASN 654 Ca 0.06 0.35 0.17 0.00 0.21 0.00 0.00 52.86 53.66 2kvb s ASN 654 Cb 0.00 -2.20 0.62 0.00 -0.55 0.00 0.00 41.25 39.13 2kvb s ASN 654 CO -0.02 -0.09 1.54 0.18 -2.79 0.00 0.00 177.10 175.91 2kvb n LEU 655 N 4.76 4.33 0.00 3.21 4.77 0.81 -1.82 117.00 133.07 2kvb n LEU 655 Ca -0.10 -2.46 0.00 0.00 -0.03 0.00 0.00 56.01 53.42 2kvb n LEU 655 Cb 0.51 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2kvb n LEU 655 CO 0.38 0.78 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 2kvb n GLY 656 N 0.77 3.90 3.79 -0.72 0.00 -1.22 -1.67 105.19 110.04 2kvb n GLY 656 Ca 0.23 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.54 1.49 0.05 1.61 0.52 -1.24 -0.36 118.95 118.48 2kvb s ARG 657 Ca 0.00 0.45 -0.33 0.00 -0.52 0.00 0.00 55.73 55.33 2kvb s ARG 657 Cb 0.00 -1.87 -0.12 0.00 0.52 0.00 0.00 34.95 33.48 2kvb s ARG 657 CO 0.00 -1.99 1.79 -1.13 0.02 0.00 0.00 175.30 173.99 2kvb n SER 658 N -3.65 3.54 -3.72 0.23 3.41 0.13 -3.68 113.62 109.87 2kvb n SER 658 Ca 0.07 1.00 -0.12 0.00 -0.26 0.00 0.00 58.87 59.56 2kvb n SER 658 Cb 0.58 -1.44 -0.10 0.00 -0.26 0.00 0.00 64.21 62.98 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 2.82 -0.44 0.00 4.04 2.47 -1.17 -4.89 114.94 117.76 2kvb s ASN 659 Ca 0.86 0.82 0.00 0.00 0.42 0.00 0.00 52.86 54.95 2kvb s ASN 659 Cb -0.62 0.78 0.00 0.00 -1.45 0.00 0.00 41.25 39.96 2kvb s ASN 659 CO 0.43 -0.16 0.52 0.00 -3.72 0.00 0.00 177.10 174.18 2kvb n ALA 660 N 3.37 2.19 -2.44 1.71 0.00 -1.26 -0.10 120.51 123.98 2kvb n ALA 660 Ca -0.17 -0.52 -0.42 0.00 0.00 0.00 0.00 53.44 52.32 2kvb n ALA 660 Cb 0.56 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.99 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 -0.13 3.49 0.35 0.00 -0.14 -1.26 -0.25 119.74 121.80 2kvb s LYS 661 Ca 0.00 0.61 -0.16 0.00 -1.36 0.00 0.00 55.97 55.06 2kvb s LYS 661 Cb 0.00 -4.04 -0.09 0.00 -1.68 0.00 0.00 37.83 32.01 2kvb s LYS 661 CO 0.00 -1.69 0.78 -0.51 -0.76 0.00 0.00 175.35 173.17 2kvb s LEU 662 N 5.45 4.04 0.14 3.17 1.43 -0.92 -4.59 118.68 127.40 2kvb s LEU 662 Ca 0.53 1.37 0.10 0.00 -1.03 0.00 0.00 54.13 55.11 2kvb s LEU 662 Cb -0.11 -4.18 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 2kvb s LEU 662 CO 0.29 -0.24 -0.22 -0.44 0.23 0.00 0.00 176.35 175.97 2kvb s SER 663 N -2.25 3.63 -0.17 2.29 0.01 -0.45 -0.04 113.70 116.73 2kvb s SER 663 Ca 0.56 -0.68 0.01 0.00 1.31 0.00 0.00 55.95 57.15 2kvb s SER 663 Cb -0.10 -0.39 0.02 0.00 0.21 0.00 0.00 66.02 65.76 2kvb s SER 663 CO 0.16 0.17 -0.18 -0.47 0.41 0.00 0.00 173.24 173.33 2kvb s TYR 664 N -1.23 2.57 -0.08 2.43 6.14 0.23 -0.90 117.35 126.51 2kvb s TYR 664 Ca 0.17 -1.48 -0.04 0.00 0.64 0.00 0.00 57.07 56.37 2kvb s TYR 664 Cb -0.10 -1.80 -0.04 0.00 0.42 0.00 0.00 41.96 40.44 2kvb s TYR 664 CO 0.09 -0.75 0.07 -0.47 0.64 0.00 0.00 175.55 175.13 2kvb s TYR 665 N 1.32 3.36 -0.14 4.97 5.04 -0.60 -0.12 117.35 131.18 2kvb s TYR 665 Ca 0.04 0.33 -0.34 0.00 -2.44 0.00 0.00 57.07 54.66 2kvb s TYR 665 Cb -0.13 -1.84 -0.11 0.00 0.35 0.00 0.00 41.96 40.23 2kvb s TYR 665 CO -0.11 0.59 1.94 -3.47 -1.34 0.00 0.00 175.55 173.15 2kvb n ASP 666 N 1.90 3.26 0.00 4.32 2.03 0.42 -1.09 116.55 127.39 2kvb n ASP 666 Ca -0.18 0.86 0.00 0.00 0.52 0.00 0.00 54.79 55.99 2kvb n ASP 666 Cb 0.54 -1.36 0.00 0.00 -0.72 0.00 0.00 41.12 39.58 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 4.73 3.19 3.41 0.27 0.00 -1.26 -5.02 105.19 110.51 2kvb n GLY 667 Ca 0.25 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 45.18 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 0.86 0.26 1.61 0.23 -0.25 -4.91 119.30 117.11 2kvb s MET 668 Ca 0.00 0.17 -0.30 0.00 -1.03 0.00 0.00 55.69 54.53 2kvb s MET 668 Cb 0.00 0.40 -0.09 0.00 -1.53 0.00 0.00 34.83 33.61 2kvb s MET 668 CO 0.00 -0.24 1.08 0.42 -2.03 0.00 0.00 175.02 174.24 2kvb s ILE 669 N -1.03 3.61 -0.01 3.16 1.09 -1.19 -1.56 121.20 125.27 2kvb s ILE 669 Ca -0.10 1.60 0.03 0.00 -1.10 0.00 0.00 60.65 61.07 2kvb s ILE 669 Cb -0.02 -4.02 -0.00 0.00 -1.06 0.00 0.00 42.46 37.36 2kvb s ILE 669 CO 0.07 0.37 -0.09 -1.10 -0.10 0.00 0.00 174.94 174.09 2kvb s GLN 670 N -1.29 0.75 -0.15 2.79 -0.21 -0.07 0.30 119.66 121.77 2kvb s GLN 670 Ca 0.44 -0.30 0.01 0.00 0.02 0.00 0.00 55.36 55.54 2kvb s GLN 670 Cb -0.31 -0.72 0.01 0.00 1.00 0.00 0.00 33.01 32.99 2kvb s GLN 670 CO 0.39 0.16 -0.18 -1.17 -2.12 0.00 0.00 175.29 172.37 2kvb s LEU 671 N -0.09 2.29 -0.14 2.90 0.20 0.40 -1.33 118.68 122.90 2kvb s LEU 671 Ca 0.02 -0.55 -0.02 0.00 0.69 0.00 0.00 54.13 54.28 2kvb s LEU 671 Cb -0.05 -1.51 -0.02 0.00 -0.43 0.00 0.00 46.19 44.19 2kvb s LEU 671 CO -0.00 0.07 -0.09 -0.89 -0.29 0.00 0.00 176.35 175.15 2kvb s THR 672 N 0.89 3.39 0.59 3.68 2.01 -1.26 -0.37 115.64 124.58 2kvb s THR 672 Ca -0.05 -0.54 0.03 0.00 0.31 0.00 0.00 61.69 61.45 2kvb s THR 672 Cb -0.15 -2.45 0.07 0.00 0.01 0.00 0.00 72.50 69.98 2kvb s THR 672 CO -0.02 0.51 0.82 -0.31 -0.69 0.00 0.00 174.62 174.93 2kvb s TYR 673 N 0.38 2.11 0.86 4.92 2.02 0.16 -4.90 117.35 122.90 2kvb s TYR 673 Ca -0.08 -0.31 -0.13 0.00 -0.37 0.00 0.00 57.07 56.18 2kvb s TYR 673 Cb -0.15 -2.66 0.20 0.00 -0.40 0.00 0.00 41.96 38.94 2kvb s TYR 673 CO 0.04 -1.15 1.18 0.54 -1.57 0.00 0.00 175.55 174.60 2kvb n ARG 674 N -2.41 -1.01 -0.32 -0.62 5.12 -1.24 -4.44 116.66 111.73 2kvb n ARG 674 Ca 0.12 -2.00 0.18 0.00 -1.93 0.00 0.00 57.85 54.22 2kvb n ARG 674 Cb 0.60 -1.16 0.43 0.00 -1.16 0.00 0.00 32.46 31.18 2kvb n ARG 674 CO 0.00 0.00 0.00 0.38 -1.93 0.00 0.00 177.63 176.08 2kvb h ASP 675 N -1.44 0.58 0.00 0.55 2.03 -1.91 -3.30 116.42 112.94 2kvb h ASP 675 Ca -0.38 0.09 0.00 0.00 -0.73 0.00 0.00 57.03 56.01 2kvb h ASP 675 Cb 1.10 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.59 2kvb h ASP 675 CO 0.29 0.16 0.00 0.61 -1.03 0.00 0.00 179.24 179.27 2kvb n GLY 676 N -1.41 1.25 2.74 7.15 0.00 -1.26 -2.04 105.19 111.63 2kvb n GLY 676 Ca 0.24 0.41 -0.24 0.00 0.00 0.00 0.00 46.02 46.42 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 0.37 0.69 2.61 2.01 -0.75 -4.84 115.64 115.72 2kvb s THR 677 Ca 0.00 -0.09 -0.16 0.00 0.31 0.00 0.00 61.69 61.76 2kvb s THR 677 Cb 0.00 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.86 2kvb s THR 677 CO 0.00 0.08 1.19 -2.16 -0.69 0.00 0.00 174.62 173.04 2kvb s PRO 678 N 1.96 2.41 0.00 4.92 0.04 -1.26 -3.33 135.00 139.74 2kvb s PRO 678 Ca 0.03 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2kvb s PRO 678 Cb -0.14 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2kvb s PRO 678 CO -0.06 -1.62 0.51 0.66 0.04 0.00 0.00 177.00 176.53 2kvb n TYR 679 N -2.45 0.00 -1.13 0.56 4.01 -0.47 -4.85 117.16 112.84 2kvb n TYR 679 Ca 0.13 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.87 2kvb n TYR 679 Cb 0.50 -0.01 -0.00 0.00 -0.31 0.00 0.00 39.34 39.52 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 -0.83 -0.00 -4.89 7.72 0.23 -1.26 -5.07 115.26 111.16 2kvb n ASN 680 Ca 0.00 -0.02 -0.29 0.00 -0.53 0.00 0.00 54.58 53.73 2kvb n ASN 680 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 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 6.12 0.48 0.53 4.22 -1.26 -4.98 114.94 120.04 2kvb s ASN 681 Ca 0.00 0.16 0.15 0.00 -2.14 0.00 0.00 52.86 51.03 2kvb s ASN 681 Cb 0.00 -1.81 1.14 0.00 1.28 0.00 0.00 41.25 41.86 2kvb s ASN 681 CO 0.00 0.14 2.07 -0.08 -2.04 0.00 0.00 177.10 177.19 2kvb h GLU 682 N 2.86 0.21 0.00 3.55 4.81 -2.03 0.13 114.58 124.12 2kvb h GLU 682 Ca -0.46 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 58.67 2kvb h GLU 682 Cb 1.17 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2kvb h GLU 682 CO 0.71 0.14 -0.40 -0.22 -0.73 0.00 0.00 179.01 178.51 2kvb h LYS 683 N 0.22 0.00 -4.74 1.92 3.11 -2.06 -3.48 116.57 111.54 2kvb h LYS 683 Ca 0.13 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.97 2kvb h LYS 683 Cb 0.24 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.43 2kvb h LYS 683 CO -0.02 0.40 -1.00 0.54 -2.81 0.00 0.00 179.45 176.55 2kvb n ARG 684 N -3.34 -3.25 -3.40 1.90 1.74 0.47 -4.98 116.66 105.79 2kvb n ARG 684 Ca 0.01 2.62 -0.43 0.00 -0.77 0.00 0.00 57.85 59.28 2kvb n ARG 684 Cb 0.60 -4.59 -0.09 0.00 -1.02 0.00 0.00 32.46 27.36 2kvb n ARG 684 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2kvb s THR 685 N -1.10 5.19 0.41 0.55 2.01 -1.26 -4.97 115.64 116.47 2kvb s THR 685 Ca -0.08 -0.57 -0.26 0.00 0.31 0.00 0.00 61.69 61.08 2kvb s THR 685 Cb 0.01 -3.99 -0.09 0.00 0.01 0.00 0.00 72.50 68.43 2kvb s THR 685 CO 0.66 -0.38 1.38 -2.16 -0.69 0.00 0.00 174.62 173.43 2kvb s PRO 686 N 1.86 3.92 -0.17 4.92 0.04 -1.26 -1.36 135.00 142.94 2kvb s PRO 686 Ca 0.08 2.32 -0.21 0.00 0.04 0.00 0.00 61.00 63.23 2kvb s PRO 686 Cb -0.19 -2.78 -0.03 0.00 0.04 0.00 0.00 34.50 31.55 2kvb s PRO 686 CO 0.11 -0.59 0.62 1.03 0.04 0.00 0.00 177.00 178.20 2kvb s ARG 687 N -2.26 4.25 0.14 4.56 0.52 -0.87 -4.78 118.95 120.52 2kvb s ARG 687 Ca 0.57 0.62 0.07 0.00 -0.52 0.00 0.00 55.73 56.47 2kvb s ARG 687 Cb -0.42 -3.54 -0.04 0.00 0.52 0.00 0.00 34.95 31.47 2kvb s ARG 687 CO 0.54 -0.15 -0.15 0.00 0.02 0.00 0.00 175.30 175.56 2kvb s ALA 688 N 1.61 1.66 -0.11 2.13 0.00 -1.21 -3.38 121.76 122.45 2kvb s ALA 688 Ca 0.29 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2kvb s ALA 688 Cb -0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 2kvb s ALA 688 CO 0.11 0.12 -0.12 0.99 0.00 0.00 0.00 175.76 176.86 2kvb s THR 689 N -2.25 3.17 -0.23 0.00 2.01 -0.67 0.36 115.64 118.02 2kvb s THR 689 Ca 0.12 -0.64 0.02 0.00 0.31 0.00 0.00 61.69 61.50 2kvb s THR 689 Cb -0.04 -2.32 0.04 0.00 0.01 0.00 0.00 72.50 70.19 2kvb s THR 689 CO 0.04 0.54 -0.14 -0.22 -0.69 0.00 0.00 174.62 174.15 2kvb s LEU 690 N 0.07 2.92 -0.27 4.42 1.98 0.19 -0.67 118.68 127.34 2kvb s LEU 690 Ca -0.05 -1.05 -0.09 0.00 -2.89 0.00 0.00 54.13 50.05 2kvb s LEU 690 Cb -0.14 -1.54 -0.04 0.00 0.66 0.00 0.00 46.19 45.13 2kvb s LEU 690 CO 0.04 -0.11 0.14 -0.63 -1.89 0.00 0.00 176.35 173.90 2kvb s ILE 691 N 1.20 4.86 -0.30 6.68 1.01 0.51 -1.10 121.20 134.06 2kvb s ILE 691 Ca -0.03 0.01 -0.10 0.00 0.00 0.00 0.00 60.65 60.53 2kvb s ILE 691 Cb -0.17 -3.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 2kvb s ILE 691 CO -0.08 0.29 0.17 -0.89 0.00 0.00 0.00 174.94 174.43 2kvb s THR 692 N 1.69 4.98 -0.22 2.92 2.01 0.12 -0.45 115.64 126.69 2kvb s THR 692 Ca 0.07 -0.10 -0.13 0.00 0.31 0.00 0.00 61.69 61.83 2kvb s THR 692 Cb -0.16 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2kvb s THR 692 CO 0.08 0.17 0.28 -0.36 -0.69 0.00 0.00 174.62 174.09 2kvb s PHE 693 N 1.70 3.34 0.10 4.92 0.40 0.15 0.68 117.98 129.26 2kvb s PHE 693 Ca 0.06 0.41 0.07 0.00 -0.60 0.00 0.00 56.93 56.88 2kvb s PHE 693 Cb -0.16 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 2kvb s PHE 693 CO 0.09 0.01 -0.11 -0.51 0.70 0.00 0.00 175.22 175.40 2kvb s LEU 694 N 1.23 3.02 -0.26 -0.37 2.01 0.21 -3.16 118.68 121.36 2kvb s LEU 694 Ca 0.13 -0.39 -0.22 0.00 0.01 0.00 0.00 54.13 53.67 2kvb s LEU 694 Cb -0.14 -1.81 -0.01 0.00 0.01 0.00 0.00 46.19 44.23 2kvb s LEU 694 CO 0.06 0.18 0.70 0.00 1.01 0.00 0.00 176.35 178.31 2kvb s ASP 696 N 1.48 1.86 0.24 0.00 2.15 -1.25 -4.96 116.67 116.19 2kvb s ASP 696 Ca 0.29 -0.49 -0.06 0.00 0.43 0.00 0.00 52.55 52.73 2kvb s ASP 696 Cb -0.15 -0.12 0.42 0.00 -0.30 0.00 0.00 42.92 42.77 2kvb s ASP 696 CO 0.09 0.05 1.71 0.03 -0.17 0.00 0.00 175.17 176.88 2kvb h ARG 697 N 4.84 0.34 -2.92 4.34 3.08 -1.96 -3.40 114.38 118.70 2kvb h ARG 697 Ca -0.39 -0.02 -0.40 0.00 0.07 0.00 0.00 59.98 59.23 2kvb h ARG 697 Cb 1.18 -0.08 -0.39 0.00 0.08 0.00 0.00 29.97 30.76 2kvb h ARG 697 CO 0.43 0.22 -0.71 0.34 -1.07 0.00 0.00 179.97 179.19 2kvb s ASP 698 N -5.30 1.87 0.37 7.04 2.15 -1.26 -4.96 116.67 116.58 2kvb s ASP 698 Ca -0.13 -0.38 0.00 0.00 0.43 0.00 0.00 52.55 52.47 2kvb s ASP 698 Cb 0.20 -0.02 0.00 0.00 -0.30 0.00 0.00 42.92 42.80 2kvb s ASP 698 CO 0.76 -0.33 0.00 0.00 -0.17 0.00 0.00 175.17 175.43 2kvb n ALA 699 N 5.30 1.40 0.00 3.66 0.00 -1.26 -5.04 120.51 124.57 2kvb n ALA 699 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2kvb n ALA 699 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.10 0.85 0.12 0.00 0.00 -1.26 -3.94 105.19 100.87 2kvb n GLY 700 Ca 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 46.02 44.92 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 1.32 0.00 1.61 3.04 -1.98 -2.80 116.25 117.44 2kvb h VAL 701 Ca 0.00 -2.44 0.00 0.00 -1.01 0.00 0.00 66.70 63.25 2kvb h VAL 701 Cb 0.00 2.37 0.00 0.00 -2.01 0.00 0.00 31.29 31.65 2kvb h VAL 701 CO 0.00 0.66 0.00 0.61 -1.01 0.00 0.00 177.57 177.83 2kvb n GLY 702 N 0.76 0.19 3.55 3.17 0.00 -1.25 -4.66 105.19 106.95 2kvb n GLY 702 Ca -0.00 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.50 3.11 0.37 1.61 0.40 -1.23 -4.90 117.98 115.83 2kvb s PHE 703 Ca 0.00 -0.15 -0.25 0.00 -0.60 0.00 0.00 56.93 55.93 2kvb s PHE 703 Cb 0.00 -1.99 -0.10 0.00 0.51 0.00 0.00 43.02 41.44 2kvb s PHE 703 CO 0.00 0.05 0.98 -1.25 0.70 0.00 0.00 175.22 175.70 2kvb s PRO 704 N 0.31 4.38 -0.08 0.24 0.04 -1.26 -2.92 135.00 135.72 2kvb s PRO 704 Ca -0.01 1.36 0.03 0.00 0.04 0.00 0.00 61.00 62.42 2kvb s PRO 704 Cb -0.13 -2.61 0.01 0.00 0.04 0.00 0.00 34.50 31.80 2kvb s PRO 704 CO 0.02 0.08 -0.16 -2.00 0.04 0.00 0.00 177.00 174.99 2kvb s GLU 705 N -2.38 2.11 -0.18 4.56 2.56 0.14 -4.88 118.70 120.63 2kvb s GLU 705 Ca 0.55 -0.56 -0.29 0.00 0.00 0.00 0.00 54.97 54.67 2kvb s GLU 705 Cb -0.18 -1.68 -0.00 0.00 2.00 0.00 0.00 34.13 34.27 2kvb s GLU 705 CO 0.23 0.07 1.00 -0.47 -0.56 0.00 0.00 175.26 175.54 2kvb s TYR 706 N 0.57 3.41 0.00 5.30 5.04 -1.26 -0.18 117.35 130.22 2kvb s TYR 706 Ca -0.16 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 55.95 2kvb s TYR 706 Cb -0.16 -3.21 0.00 0.00 0.35 0.00 0.00 41.96 38.94 2kvb s TYR 706 CO 0.05 -0.37 0.00 1.04 -1.34 0.00 0.00 175.55 174.94 2kvb n GLN 707 N 5.76 0.00 -3.64 4.97 1.13 -0.80 -4.97 117.38 119.83 2kvb n GLN 707 Ca 0.10 0.01 -0.06 0.00 -1.94 0.00 0.00 57.00 55.11 2kvb n GLN 707 Cb 0.47 -0.22 -0.07 0.00 0.11 0.00 0.00 30.24 30.54 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 -0.41 0.65 -0.07 -1.09 -1.05 -1.23 -5.03 118.70 110.47 2kvb s GLU 708 Ca 0.00 1.18 -0.25 0.00 -0.15 0.00 0.00 54.97 55.75 2kvb s GLU 708 Cb 0.00 0.20 -0.03 0.00 -0.44 0.00 0.00 34.13 33.86 2kvb s GLU 708 CO 0.00 -0.15 0.78 -2.00 0.95 0.00 0.00 175.26 174.84 2kvb s GLU 709 N 1.73 4.44 0.00 -4.83 -6.30 -1.26 -2.95 118.70 109.52 2kvb s GLU 709 Ca -0.09 1.01 0.00 0.00 -2.50 0.00 0.00 54.97 53.38 2kvb s GLU 709 Cb -0.05 -3.47 0.00 0.00 0.00 0.00 0.00 34.13 30.60 2kvb s GLU 709 CO -0.19 -0.03 0.00 -3.47 0.02 0.00 0.00 175.26 171.59 2kvb n ASP 710 N 4.06 0.00 -2.02 -1.70 2.03 -1.25 -4.91 116.55 112.76 2kvb n ASP 710 Ca 0.01 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.20 2kvb n ASP 710 Cb 0.51 0.00 0.26 0.00 -0.72 0.00 0.00 41.12 41.16 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 -0.96 4.32 0.00 1.67 0.23 -1.26 -4.86 115.26 114.40 2kvb n ASN 711 Ca 0.00 -3.39 0.00 0.00 -0.53 0.00 0.00 54.58 50.66 2kvb n ASN 711 Cb 0.00 -0.77 0.00 0.00 -2.08 0.00 0.00 39.78 36.93 2kvb n ASN 711 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2kvb n SER 712 N -0.57 -0.05 -4.09 0.53 3.41 -1.26 -4.82 113.62 106.77 2kvb n SER 712 Ca 0.47 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.84 2kvb n SER 712 Cb 1.47 -0.95 -0.16 0.00 -0.26 0.00 0.00 64.21 64.31 2kvb n SER 712 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2kvb s THR 713 N -2.85 1.24 -0.24 6.66 2.01 -1.26 -3.36 115.64 117.84 2kvb s THR 713 Ca 0.00 -0.60 -0.27 0.00 0.31 0.00 0.00 61.69 61.13 2kvb s THR 713 Cb 0.00 -1.08 0.00 0.00 0.01 0.00 0.00 72.50 71.43 2kvb s THR 713 CO 0.00 0.37 0.95 -0.31 -0.69 0.00 0.00 174.62 174.94 2kvb s TYR 714 N 0.16 3.32 -0.19 4.92 1.51 0.16 -3.88 117.35 123.35 2kvb s TYR 714 Ca -0.05 1.33 -0.09 0.00 -1.01 0.00 0.00 57.07 57.24 2kvb s TYR 714 Cb -0.11 -3.19 -0.05 0.00 -0.11 0.00 0.00 41.96 38.50 2kvb s TYR 714 CO 0.02 -0.45 0.12 -0.80 -1.11 0.00 0.00 175.55 173.32 2kvb s ASN 715 N 1.27 6.09 0.04 2.29 -0.87 -1.15 0.57 114.94 123.17 2kvb s ASN 715 Ca 0.40 0.21 0.08 0.00 -1.57 0.00 0.00 52.86 51.98 2kvb s ASN 715 Cb -0.15 -2.06 -0.03 0.00 -0.02 0.00 0.00 41.25 38.99 2kvb s ASN 715 CO 0.07 0.18 -0.24 -0.36 -2.57 0.00 0.00 177.10 174.18 2kvb s PHE 716 N 0.32 2.11 -0.23 2.20 0.40 -0.26 -1.90 117.98 120.63 2kvb s PHE 716 Ca 0.07 -0.40 -0.08 0.00 -0.60 0.00 0.00 56.93 55.93 2kvb s PHE 716 Cb -0.11 -1.27 -0.04 0.00 0.51 0.00 0.00 43.02 42.11 2kvb s PHE 716 CO -0.01 0.10 0.09 1.03 0.70 0.00 0.00 175.22 177.12 2kvb s ARG 717 N -1.16 3.79 -0.27 0.44 0.52 0.74 0.12 118.95 123.13 2kvb s ARG 717 Ca 0.10 -0.41 -0.04 0.00 -0.52 0.00 0.00 55.73 54.86 2kvb s ARG 717 Cb -0.09 -3.35 0.02 0.00 0.52 0.00 0.00 34.95 32.05 2kvb s ARG 717 CO 0.02 -0.05 0.01 -0.46 0.02 0.00 0.00 175.30 174.83 2kvb s TRP 718 N 1.28 3.11 -0.51 -0.53 -0.11 0.21 0.27 118.94 122.68 2kvb s TRP 718 Ca 0.05 -1.31 -0.18 0.00 1.22 0.00 0.00 56.10 55.88 2kvb s TRP 718 Cb -0.15 -2.15 0.07 0.00 -1.50 0.00 0.00 33.47 29.74 2kvb s TRP 718 CO 0.04 -0.66 0.59 0.71 -4.62 0.00 0.00 176.95 173.01 2kvb s TYR 719 N 1.40 3.08 0.01 5.86 1.51 -1.15 0.67 117.35 128.73 2kvb s TYR 719 Ca 0.01 -0.66 0.03 0.00 -1.01 0.00 0.00 57.07 55.44 2kvb s TYR 719 Cb -0.17 -3.52 -0.01 0.00 -0.11 0.00 0.00 41.96 38.15 2kvb s TYR 719 CO -0.01 -1.02 -0.10 -0.08 -1.11 0.00 0.00 175.55 173.24 2kvb s THR 720 N 2.44 0.76 0.29 -0.71 -1.32 -0.59 -3.51 115.64 113.00 2kvb s THR 720 Ca 0.13 -0.57 0.27 0.00 -1.21 0.00 0.00 61.69 60.31 2kvb s THR 720 Cb -0.21 -0.66 0.27 0.00 -1.51 0.00 0.00 72.50 70.39 2kvb s THR 720 CO 0.10 0.10 1.97 0.28 -2.21 0.00 0.00 174.62 174.86 2kvb h SER 721 N 5.59 0.00 0.68 8.08 0.02 -1.71 -2.62 113.55 123.58 2kvb h SER 721 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2kvb h SER 721 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 2kvb h SER 721 CO 0.48 0.16 0.00 -1.22 -1.14 0.00 0.00 176.83 175.10 2kvb n TYR 722 N -3.50 0.25 0.45 3.45 4.02 -1.26 -1.65 117.16 118.93 2kvb n TYR 722 Ca -0.01 0.09 0.10 0.00 -0.01 0.00 0.00 57.90 58.07 2kvb n TYR 722 Cb 0.32 -0.65 0.26 0.00 -0.02 0.00 0.00 39.34 39.25 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 -1.58 2.43 -3.02 -0.72 0.00 -0.99 -4.60 120.51 112.03 2kvb n ALA 723 Ca 0.04 -0.88 -0.35 0.00 0.00 0.00 0.00 53.44 52.25 2kvb n ALA 723 Cb 0.22 -0.96 -0.12 0.00 0.00 0.00 0.00 19.45 18.59 2kvb n ALA 723 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50