#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkv h ILE 575 N 0.00 0.00 -1.93 -0.61 2.04 -2.15 -3.43 117.51 111.43 2qkv h ILE 575 Ca 0.00 0.00 -0.64 0.00 1.00 0.00 0.00 64.86 65.22 2qkv h ILE 575 Cb 0.00 0.00 0.03 0.00 -0.74 0.00 0.00 36.82 36.11 2qkv h ILE 575 CO 0.00 0.00 0.92 -2.65 0.00 0.00 0.00 178.15 176.42 2qkv n PRO 576 N -3.01 1.83 -3.23 2.37 -0.02 -1.26 -4.94 135.00 126.73 2qkv n PRO 576 Ca -0.04 0.67 -0.02 0.00 -2.02 0.00 0.00 63.50 62.09 2qkv n PRO 576 Cb 0.14 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.14 2qkv n PRO 576 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2qkv s ARG 577 N 2.85 0.48 0.23 -0.52 3.52 -1.26 -5.16 118.95 119.09 2qkv s ARG 577 Ca 0.90 0.74 -0.00 0.00 -0.13 0.00 0.00 55.73 57.24 2qkv s ARG 577 Cb -0.80 0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 32.65 2qkv s ARG 577 CO 0.51 -0.69 0.42 -0.80 -0.81 0.00 0.00 175.30 173.93 2qkv s ASN 578 N 2.72 6.37 -0.14 -2.12 -0.87 -1.26 -5.08 114.94 114.57 2qkv s ASN 578 Ca 0.16 0.41 -0.17 0.00 -1.57 0.00 0.00 52.86 51.69 2qkv s ASN 578 Cb -0.15 -2.01 -0.04 0.00 -0.02 0.00 0.00 41.25 39.03 2qkv s ASN 578 CO -0.20 -0.09 0.45 -0.94 -2.57 0.00 0.00 177.10 173.74 2qkv s SER 579 N -3.34 6.61 0.30 -1.22 1.04 -1.26 -5.05 113.70 110.78 2qkv s SER 579 Ca 0.39 0.72 -0.25 0.00 0.48 0.00 0.00 55.95 57.28 2qkv s SER 579 Cb -0.11 -2.27 -0.10 0.00 0.10 0.00 0.00 66.02 63.65 2qkv s SER 579 CO 0.30 -0.01 0.91 -0.76 0.98 0.00 0.00 173.24 174.65 2qkv s LEU 580 N 0.79 4.37 0.20 2.42 1.43 -1.26 -5.02 118.68 121.61 2qkv s LEU 580 Ca 0.24 1.78 -0.30 0.00 -1.03 0.00 0.00 54.13 54.81 2qkv s LEU 580 Cb -0.15 -3.90 -0.09 0.00 0.03 0.00 0.00 46.19 42.08 2qkv s LEU 580 CO 0.09 -0.03 1.35 -0.70 0.23 0.00 0.00 176.35 177.30 2qkv s GLU 581 N -1.95 4.35 -0.00 1.70 2.12 -1.26 -5.03 118.70 118.63 2qkv s GLU 581 Ca 0.48 2.12 0.08 0.00 0.36 0.00 0.00 54.97 58.01 2qkv s GLU 581 Cb -0.19 -3.18 -0.02 0.00 0.26 0.00 0.00 34.13 31.00 2qkv s GLU 581 CO 0.24 -0.32 -0.25 0.15 -0.54 0.00 0.00 175.26 174.53 2qkv s LYS 582 N 0.02 1.96 0.21 4.30 -0.14 -1.26 -4.28 119.74 120.55 2qkv s LYS 582 Ca 0.59 -0.96 0.08 0.00 -1.36 0.00 0.00 55.97 54.31 2qkv s LYS 582 Cb -0.38 -1.96 -0.05 0.00 -1.68 0.00 0.00 37.83 33.76 2qkv s LYS 582 CO 0.38 0.53 -0.15 -0.59 -0.76 0.00 0.00 175.35 174.76 2qkv s PHE 583 N -0.66 1.72 -0.01 3.18 -0.12 0.10 -4.92 117.98 117.28 2qkv s PHE 583 Ca 0.10 -0.57 -0.01 0.00 -0.05 0.00 0.00 56.93 56.40 2qkv s PHE 583 Cb -0.10 -0.80 -0.04 0.00 -0.63 0.00 0.00 43.02 41.46 2qkv s PHE 583 CO -0.00 0.37 0.11 -0.80 -0.05 0.00 0.00 175.22 174.85 2qkv s ASN 584 N -3.32 5.91 -0.09 1.98 -0.87 -1.26 -0.82 114.94 116.47 2qkv s ASN 584 Ca 0.23 0.22 -0.00 0.00 -1.57 0.00 0.00 52.86 51.74 2qkv s ASN 584 Cb -0.01 -1.76 0.02 0.00 -0.02 0.00 0.00 41.25 39.48 2qkv s ASN 584 CO 0.07 0.28 -0.06 -0.69 -2.57 0.00 0.00 177.10 174.13 2qkv s VAL 585 N -1.22 0.85 -0.05 1.60 1.01 -0.46 -4.99 120.40 117.13 2qkv s VAL 585 Ca 0.24 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.04 2qkv s VAL 585 Cb -0.12 -0.89 0.01 0.00 0.00 0.00 0.00 36.38 35.38 2qkv s VAL 585 CO 0.15 0.33 -0.13 -1.81 0.00 0.00 0.00 175.10 173.63 2qkv s ASP 586 N 1.58 1.83 0.24 3.32 1.11 -1.26 -0.60 116.67 122.89 2qkv s ASP 586 Ca 0.01 -0.30 -0.15 0.00 0.18 0.00 0.00 52.55 52.29 2qkv s ASP 586 Cb -0.13 -0.71 0.00 0.00 1.07 0.00 0.00 42.92 43.16 2qkv s ASP 586 CO -0.05 0.07 0.52 -1.48 1.18 0.00 0.00 175.17 175.41 2qkv s LEU 587 N 0.42 0.21 -0.26 1.23 0.05 -0.52 -4.83 118.68 114.98 2qkv s LEU 587 Ca -0.10 -0.81 -0.02 0.00 0.05 0.00 0.00 54.13 53.25 2qkv s LEU 587 Cb -0.14 1.97 0.03 0.00 -2.05 0.00 0.00 46.19 46.00 2qkv s LEU 587 CO 0.03 -1.15 -0.04 -0.32 -0.55 0.00 0.00 176.35 174.31 2qkv s MET 588 N -3.98 2.77 0.41 1.48 -2.45 -1.26 -1.00 119.30 115.28 2qkv s MET 588 Ca 0.18 -1.02 -0.25 0.00 -1.25 0.00 0.00 55.69 53.35 2qkv s MET 588 Cb -0.01 -3.04 -0.08 0.00 1.25 0.00 0.00 34.83 32.94 2qkv s MET 588 CO 0.07 -0.44 1.21 0.21 1.05 0.00 0.00 175.02 177.12 2qkv s LYS 589 N 1.32 3.96 -0.01 4.11 2.20 0.25 -4.98 119.74 126.58 2qkv s LYS 589 Ca -0.01 1.93 0.06 0.00 -0.36 0.00 0.00 55.97 57.60 2qkv s LYS 589 Cb -0.17 -2.65 -0.02 0.00 -1.51 0.00 0.00 37.83 33.48 2qkv s LYS 589 CO -0.03 -0.43 -0.21 0.15 -0.36 0.00 0.00 175.35 174.47 2qkv s LYS 590 N -2.35 1.67 0.35 4.03 -0.14 -1.26 -4.59 119.74 117.45 2qkv s LYS 590 Ca 0.58 -0.75 -0.28 0.00 -1.36 0.00 0.00 55.97 54.17 2qkv s LYS 590 Cb -0.33 -1.62 -0.12 0.00 -1.68 0.00 0.00 37.83 34.08 2qkv s LYS 590 CO 0.41 0.44 1.30 0.00 -0.76 0.00 0.00 175.35 176.74 2qkv n ALA 591 N 2.55 1.36 -0.82 5.17 0.00 -1.26 -1.57 120.51 125.94 2qkv n ALA 591 Ca -0.15 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2qkv n ALA 591 Cb 0.53 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.71 2qkv n ALA 591 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkv n GLY 592 N 0.75 1.25 2.93 0.00 0.00 -1.26 -4.97 105.19 103.90 2qkv n GLY 592 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 2qkv n GLY 592 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qkv s LYS 593 N -0.04 1.47 0.67 1.61 2.20 -0.61 -5.11 119.74 119.94 2qkv s LYS 593 Ca 0.00 -1.96 -0.16 0.00 -0.36 0.00 0.00 55.97 53.49 2qkv s LYS 593 Cb 0.00 -2.98 0.01 0.00 -1.51 0.00 0.00 37.83 33.35 2qkv s LYS 593 CO 0.00 -1.01 1.19 -1.21 -0.36 0.00 0.00 175.35 173.96 2qkv s GLU 594 N 0.66 2.54 0.40 4.03 2.02 -1.26 -4.44 118.70 122.65 2qkv s GLU 594 Ca 0.13 1.71 0.09 0.00 0.02 0.00 0.00 54.97 56.92 2qkv s GLU 594 Cb -0.21 -1.89 0.82 0.00 0.10 0.00 0.00 34.13 32.95 2qkv s GLU 594 CO -0.08 -1.52 1.96 -0.07 0.02 0.00 0.00 175.26 175.58 2qkv h LEU 595 N 0.16 0.30 0.11 1.80 3.38 -1.98 -3.46 115.31 115.62 2qkv h LEU 595 Ca -0.48 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.42 2qkv h LEU 595 Cb 1.29 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2qkv h LEU 595 CO 0.52 0.36 -0.03 0.61 0.09 0.00 0.00 178.44 180.00 2qkv n GLY 596 N -1.07 0.41 3.36 0.83 0.00 -1.26 -4.79 105.19 102.67 2qkv n GLY 596 Ca 0.00 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 2qkv n GLY 596 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qkv s LEU 597 N -0.32 2.85 -0.22 0.99 1.43 -1.26 -0.94 118.68 121.20 2qkv s LEU 597 Ca 0.00 -0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 52.62 2qkv s LEU 597 Cb 0.00 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 2qkv s LEU 597 CO 0.00 0.09 0.39 -0.44 0.23 0.00 0.00 176.35 176.62 2qkv s SER 598 N 0.80 6.38 0.04 2.29 0.01 0.08 -4.99 113.70 118.31 2qkv s SER 598 Ca -0.03 0.45 0.02 0.00 1.31 0.00 0.00 55.95 57.69 2qkv s SER 598 Cb -0.15 -2.22 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 2qkv s SER 598 CO 0.01 -0.10 0.05 -0.76 0.41 0.00 0.00 173.24 172.85 2qkv s LEU 599 N 1.51 3.72 -0.15 2.44 1.43 -1.26 -0.21 118.68 126.16 2qkv s LEU 599 Ca 0.18 0.02 -0.00 0.00 -1.03 0.00 0.00 54.13 53.29 2qkv s LEU 599 Cb -0.15 -2.27 0.03 0.00 0.03 0.00 0.00 46.19 43.83 2qkv s LEU 599 CO 0.08 0.23 -0.08 -0.55 0.23 0.00 0.00 176.35 176.26 2qkv s SER 600 N -1.98 2.66 0.44 2.29 0.15 -0.06 -4.85 113.70 112.35 2qkv s SER 600 Ca 0.25 -0.54 -0.22 0.00 0.70 0.00 0.00 55.95 56.14 2qkv s SER 600 Cb -0.12 -0.98 -0.09 0.00 -1.71 0.00 0.00 66.02 63.12 2qkv s SER 600 CO 0.16 -0.13 1.06 -2.16 1.20 0.00 0.00 173.24 173.37 2qkv s PRO 601 N 1.60 3.96 0.30 5.44 0.04 -1.26 -0.50 135.00 144.58 2qkv s PRO 601 Ca 0.03 1.49 -0.09 0.00 0.04 0.00 0.00 61.00 62.46 2qkv s PRO 601 Cb -0.14 -2.35 0.01 0.00 0.04 0.00 0.00 34.50 32.06 2qkv s PRO 601 CO -0.09 -0.31 0.53 0.54 0.04 0.00 0.00 177.00 177.71 2qkv s ASN 602 N -1.70 0.29 0.46 6.66 6.03 -0.28 -4.90 114.94 121.50 2qkv s ASN 602 Ca 0.62 -1.17 0.14 0.00 -1.03 0.00 0.00 52.86 51.43 2qkv s ASN 602 Cb -0.21 0.66 1.10 0.00 -3.03 0.00 0.00 41.25 39.77 2qkv s ASN 602 CO 0.25 -1.29 2.04 -0.33 -2.03 0.00 0.00 177.10 175.75 2qkv h GLU 603 N 2.16 0.28 0.00 3.55 4.39 -1.95 -2.90 114.58 120.11 2qkv h GLU 603 Ca -0.28 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2qkv h GLU 603 Cb 1.25 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2qkv h GLU 603 CO 0.37 0.19 -1.04 0.44 -1.16 0.00 0.00 179.01 177.81 2qkv n ILE 604 N -4.47 0.03 -1.07 3.13 -5.35 -1.26 -0.70 119.36 109.67 2qkv n ILE 604 Ca 0.05 -0.10 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 2qkv n ILE 604 Cb 0.26 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 38.81 2qkv n ILE 604 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qkv n GLY 605 N 1.45 -0.57 3.22 3.28 0.00 -1.10 -3.57 105.19 107.90 2qkv n GLY 605 Ca 0.03 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 2qkv n GLY 605 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkv s THR 607 N 1.37 3.80 -0.77 0.00 2.01 0.34 -0.94 115.64 121.45 2qkv s THR 607 Ca 0.04 1.79 -0.25 0.00 0.31 0.00 0.00 61.69 63.58 2qkv s THR 607 Cb -0.15 -4.14 0.05 0.00 0.01 0.00 0.00 72.50 68.28 2qkv s THR 607 CO -0.07 0.41 1.21 -0.63 -0.69 0.00 0.00 174.62 174.86 2qkv s ILE 608 N -1.07 3.98 0.26 1.82 1.01 0.10 -0.88 121.20 126.41 2qkv s ILE 608 Ca 0.43 -0.11 0.17 0.00 0.00 0.00 0.00 60.65 61.15 2qkv s ILE 608 Cb -0.29 -4.87 0.12 0.00 0.01 0.00 0.00 42.46 37.43 2qkv s ILE 608 CO 0.36 -1.74 1.78 0.00 0.00 0.00 0.00 174.94 175.33 2qkv h ALA 609 N 9.79 1.11 -2.17 9.38 0.00 -0.92 -0.13 119.26 136.32 2qkv h ALA 609 Ca -0.18 -0.35 0.06 0.00 0.00 0.00 0.00 54.91 54.45 2qkv h ALA 609 Cb 1.05 -0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.61 2qkv h ALA 609 CO 1.27 0.47 0.43 0.34 0.00 0.00 0.00 179.25 181.76 2qkv s ASP 610 N -6.57 -0.43 -0.11 0.00 -1.08 -1.18 -4.83 116.67 102.47 2qkv s ASP 610 Ca -0.01 0.19 -0.18 0.00 -0.52 0.00 0.00 52.55 52.03 2qkv s ASP 610 Cb 0.12 0.41 0.04 0.00 -1.46 0.00 0.00 42.92 42.04 2qkv s ASP 610 CO 0.69 -0.60 0.46 -1.48 0.52 0.00 0.00 175.17 174.76 2qkv s LEU 611 N -2.02 0.26 -0.33 -1.34 2.34 -1.26 -0.74 118.68 115.60 2qkv s LEU 611 Ca 0.01 0.66 -0.13 0.00 0.06 0.00 0.00 54.13 54.72 2qkv s LEU 611 Cb -0.01 1.65 -0.02 0.00 -0.56 0.00 0.00 46.19 47.25 2qkv s LEU 611 CO -0.05 -0.32 0.27 0.27 -1.06 0.00 0.00 176.35 175.47 2qkv s ILE 612 N -0.44 5.26 0.51 1.48 -4.36 -0.12 -5.02 121.20 118.52 2qkv s ILE 612 Ca -0.06 -0.04 -0.21 0.00 -0.26 0.00 0.00 60.65 60.08 2qkv s ILE 612 Cb -0.03 -3.71 -0.06 0.00 1.25 0.00 0.00 42.46 39.91 2qkv s ILE 612 CO 0.03 0.03 1.21 -1.10 0.24 0.00 0.00 174.94 175.35 2qkv s GLN 613 N 1.82 3.43 0.00 0.37 1.11 -1.26 -3.86 119.66 121.27 2qkv s GLN 613 Ca 0.08 1.85 0.00 0.00 0.01 0.00 0.00 55.36 57.30 2qkv s GLN 613 Cb -0.17 -2.23 0.00 0.00 -1.01 0.00 0.00 33.01 29.60 2qkv s GLN 613 CO 0.11 -0.85 0.00 0.41 0.01 0.00 0.00 175.29 174.97 2qkv n GLY 614 N 0.47 0.49 0.07 3.09 0.00 -1.26 -5.00 105.19 103.05 2qkv n GLY 614 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.03 2qkv n GLY 614 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qkv h GLN 615 N 4.81 0.00 -4.23 1.61 1.08 -1.90 -3.47 115.11 113.02 2qkv h GLN 615 Ca 0.00 0.00 -0.38 0.00 -1.45 0.00 0.00 58.65 56.82 2qkv h GLN 615 Cb 0.00 0.00 -0.31 0.00 -0.05 0.00 0.00 27.48 27.12 2qkv h GLN 615 CO 0.00 0.54 -0.77 0.71 -0.95 0.00 0.00 178.83 178.36 2qkv s TYR 616 N -1.97 0.65 0.26 2.96 1.51 -1.26 -5.03 117.35 114.46 2qkv s TYR 616 Ca -0.12 -0.15 -0.02 0.00 -1.01 0.00 0.00 57.07 55.77 2qkv s TYR 616 Cb -0.01 -0.51 0.45 0.00 -0.11 0.00 0.00 41.96 41.79 2qkv s TYR 616 CO 0.38 -0.10 1.82 -1.35 -1.11 0.00 0.00 175.55 175.19 2qkv h PRO 617 N 6.58 0.82 -0.37 -1.71 0.11 -1.99 -1.32 132.00 134.13 2qkv h PRO 617 Ca -0.34 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.67 2qkv h PRO 617 Cb 1.17 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 2qkv h PRO 617 CO 0.49 0.55 0.00 1.05 -0.21 0.00 0.00 178.00 179.88 2qkv h GLU 618 N 0.85 0.58 -0.11 1.05 9.09 -1.97 0.36 114.58 124.44 2qkv h GLU 618 Ca 0.43 -0.13 -0.07 0.00 0.05 0.00 0.00 59.36 59.64 2qkv h GLU 618 Cb 0.42 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 2qkv h GLU 618 CO -0.26 0.61 -0.22 0.82 0.05 0.00 0.00 179.01 180.01 2qkv h ILE 619 N 0.56 1.39 -0.80 -1.06 2.04 -1.74 -1.11 117.51 116.79 2qkv h ILE 619 Ca 0.12 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.48 2qkv h ILE 619 Cb 0.35 2.10 -0.04 0.00 -0.74 0.00 0.00 36.82 38.49 2qkv h ILE 619 CO 0.01 0.43 0.50 0.44 0.00 0.00 0.00 178.15 179.53 2qkv h ASP 620 N -0.10 0.94 0.88 1.72 3.32 -0.97 0.19 116.42 122.41 2qkv h ASP 620 Ca 0.00 -0.04 -0.23 0.00 0.02 0.00 0.00 57.03 56.78 2qkv h ASP 620 Cb 0.81 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 2qkv h ASP 620 CO 0.05 0.71 -1.14 0.77 -1.72 0.00 0.00 179.24 177.91 2qkv h SER 621 N 1.09 0.04 0.00 6.45 4.64 -0.92 -3.40 113.55 121.45 2qkv h SER 621 Ca 0.29 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2qkv h SER 621 Cb -0.07 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2qkv h SER 621 CO -0.06 1.03 -1.11 0.29 -0.87 0.00 0.00 176.83 176.11 2qkv n LYS 622 N -3.32 1.22 -4.15 4.77 5.02 -0.42 -5.05 118.16 116.23 2qkv n LYS 622 Ca -0.04 -0.05 -0.29 0.00 -2.02 0.00 0.00 58.31 55.91 2qkv n LYS 622 Cb 0.97 -1.10 -0.08 0.00 -0.02 0.00 0.00 35.03 34.79 2qkv n LYS 622 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qkv s LEU 623 N -3.25 3.41 0.05 -0.35 1.43 0.04 -5.05 118.68 114.95 2qkv s LEU 623 Ca -0.01 -0.23 -0.04 0.00 -1.03 0.00 0.00 54.13 52.81 2qkv s LEU 623 Cb 0.05 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 2qkv s LEU 623 CO 0.31 0.16 0.07 -1.10 0.23 0.00 0.00 176.35 176.01 2qkv s GLN 624 N -2.44 0.60 0.25 1.70 -0.21 -1.26 -4.76 119.66 113.54 2qkv s GLN 624 Ca 0.26 -0.89 -0.31 0.00 0.02 0.00 0.00 55.36 54.44 2qkv s GLN 624 Cb -0.11 0.23 -0.13 0.00 1.00 0.00 0.00 33.01 34.00 2qkv s GLN 624 CO 0.18 -0.14 1.48 -2.13 -2.12 0.00 0.00 175.29 172.55 2qkv n ARG 625 N 0.56 2.25 0.00 2.91 0.63 -1.26 -1.62 116.66 120.12 2qkv n ARG 625 Ca -0.18 0.80 0.00 0.00 -0.92 0.00 0.00 57.85 57.55 2qkv n ARG 625 Cb 0.59 -2.50 0.00 0.00 0.45 0.00 0.00 32.46 31.00 2qkv n ARG 625 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qkv n GLY 626 N 2.27 3.15 3.75 5.14 0.00 -0.06 -5.01 105.19 114.43 2qkv n GLY 626 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 2qkv n GLY 626 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qkv s ASP 627 N -1.11 4.95 -0.21 1.61 1.01 -0.64 -4.53 116.67 117.75 2qkv s ASP 627 Ca 0.00 2.37 -0.01 0.00 0.71 0.00 0.00 52.55 55.62 2qkv s ASP 627 Cb 0.00 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.35 2qkv s ASP 627 CO 0.00 -1.75 -0.12 -0.63 0.21 0.00 0.00 175.17 172.87 2qkv s ILE 628 N -1.71 2.55 -0.19 0.77 1.01 0.00 -0.72 121.20 122.91 2qkv s ILE 628 Ca 0.76 -0.93 -0.28 0.00 0.00 0.00 0.00 60.65 60.20 2qkv s ILE 628 Cb -0.30 -2.19 -0.00 0.00 0.01 0.00 0.00 42.46 39.98 2qkv s ILE 628 CO 0.36 0.38 0.98 -0.63 0.00 0.00 0.00 174.94 176.03 2qkv s ILE 629 N 1.32 4.75 -0.34 2.92 1.01 -0.12 -0.92 121.20 129.82 2qkv s ILE 629 Ca 0.03 1.93 0.12 0.00 0.00 0.00 0.00 60.65 62.73 2qkv s ILE 629 Cb -0.15 -4.27 -0.16 0.00 0.01 0.00 0.00 42.46 37.90 2qkv s ILE 629 CO -0.08 -0.09 0.42 0.35 0.00 0.00 0.00 174.94 175.54 2qkv n THR 630 N 5.02 0.00 -3.77 2.92 -2.24 0.02 -0.83 114.28 115.41 2qkv n THR 630 Ca 0.09 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 2qkv n THR 630 Cb 0.47 0.67 -0.12 0.00 -2.10 0.00 0.00 70.33 69.26 2qkv n THR 630 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qkv s LYS 631 N -2.45 0.27 -0.09 -0.78 2.20 -1.12 -0.66 119.74 117.12 2qkv s LYS 631 Ca 0.01 0.41 -0.01 0.00 -0.36 0.00 0.00 55.97 56.03 2qkv s LYS 631 Cb 0.09 0.07 0.03 0.00 -1.51 0.00 0.00 37.83 36.50 2qkv s LYS 631 CO 0.51 -0.07 -0.05 0.12 -0.36 0.00 0.00 175.35 175.50 2qkv s PHE 632 N 0.47 1.18 -1.57 4.03 5.36 -0.35 -1.75 117.98 125.35 2qkv s PHE 632 Ca -0.03 -0.52 -0.05 0.00 -0.96 0.00 0.00 56.93 55.38 2qkv s PHE 632 Cb -0.04 -1.06 0.05 0.00 -0.34 0.00 0.00 43.02 41.62 2qkv s PHE 632 CO -0.02 -0.43 0.27 0.09 -1.46 0.00 0.00 175.22 173.66 2qkv n ASN 633 N 4.94 -0.15 0.00 6.13 3.02 0.45 -1.13 115.26 128.53 2qkv n ASN 633 Ca -0.11 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.26 2qkv n ASN 633 Cb 0.50 -2.11 0.00 0.00 -0.61 0.00 0.00 39.78 37.56 2qkv n ASN 633 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qkv n GLY 634 N -2.12 2.56 3.63 7.41 0.00 -1.26 -5.03 105.19 110.39 2qkv n GLY 634 Ca -0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 2qkv n GLY 634 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qkv s ASP 635 N -1.84 6.29 0.22 1.61 1.01 -0.28 -5.05 116.67 118.63 2qkv s ASP 635 Ca 0.00 0.34 -0.30 0.00 0.71 0.00 0.00 52.55 53.30 2qkv s ASP 635 Cb 0.00 -2.21 -0.10 0.00 1.01 0.00 0.00 42.92 41.63 2qkv s ASP 635 CO 0.00 -0.13 1.41 0.00 0.21 0.00 0.00 175.17 176.66 2qkv s ALA 636 N 1.76 3.61 -0.97 5.23 0.00 -1.26 -1.21 121.76 128.91 2qkv s ALA 636 Ca 0.15 1.25 0.24 0.00 0.00 0.00 0.00 51.96 53.61 2qkv s ALA 636 Cb -0.15 -3.54 0.32 0.00 0.00 0.00 0.00 23.12 19.75 2qkv s ALA 636 CO 0.09 -0.68 1.28 1.28 0.00 0.00 0.00 175.76 177.73 2qkv n LEU 637 N 2.65 0.62 -4.68 0.00 4.77 0.17 -4.85 117.00 115.67 2qkv n LEU 637 Ca 0.07 -0.10 -0.45 0.00 -0.03 0.00 0.00 56.01 55.50 2qkv n LEU 637 Cb 0.41 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2qkv n LEU 637 CO 0.60 0.14 1.19 -1.84 -1.33 0.00 0.00 177.39 176.15 2qkv n GLU 638 N -1.54 2.26 -0.52 3.23 0.00 -1.23 -2.05 120.64 120.79 2qkv n GLU 638 Ca 0.05 0.81 0.00 0.00 0.00 0.00 0.00 57.16 58.02 2qkv n GLU 638 Cb 0.34 -2.57 0.00 0.00 0.00 0.00 0.00 31.44 29.21 2qkv n GLU 638 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2qkv n GLY 639 N 3.20 1.22 3.78 -1.84 0.00 0.13 -5.00 105.19 106.67 2qkv n GLY 639 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 2qkv n GLY 639 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qkv s LEU 640 N 0.00 4.29 0.53 0.99 1.43 -0.87 -5.01 118.68 120.03 2qkv s LEU 640 Ca 0.00 1.94 -0.21 0.00 -1.03 0.00 0.00 54.13 54.83 2qkv s LEU 640 Cb 0.00 -4.04 -0.06 0.00 0.03 0.00 0.00 46.19 42.12 2qkv s LEU 640 CO 0.00 -0.22 1.23 -2.84 0.23 0.00 0.00 176.35 174.75 2qkv s PRO 641 N -2.16 3.35 0.48 1.29 0.02 -1.26 -4.80 135.00 131.92 2qkv s PRO 641 Ca 0.52 1.90 0.15 0.00 0.02 0.00 0.00 61.00 63.60 2qkv s PRO 641 Cb -0.21 -2.21 1.14 0.00 0.02 0.00 0.00 34.50 33.25 2qkv s PRO 641 CO 0.26 -0.93 2.08 0.35 -0.33 0.00 0.00 177.00 178.43 2qkv h PHE 642 N 1.51 0.01 0.00 6.54 3.57 -1.98 -0.42 116.94 126.17 2qkv h PHE 642 Ca -0.50 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 60.99 2qkv h PHE 642 Cb 1.28 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.01 2qkv h PHE 642 CO 0.49 0.09 -0.04 1.96 -2.23 0.00 0.00 178.31 178.58 2qkv h GLN 643 N 0.01 0.00 0.00 1.11 7.50 -1.99 0.24 115.11 121.98 2qkv h GLN 643 Ca 0.00 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.07 2qkv h GLN 643 Cb 0.15 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.67 2qkv h GLN 643 CO 0.01 0.04 -0.52 0.28 -1.50 0.00 0.00 178.83 177.14 2qkv h VAL 644 N 0.00 1.02 -0.45 -0.54 2.07 -1.46 -3.14 116.25 113.74 2qkv h VAL 644 Ca -0.00 -1.94 0.06 0.00 0.82 0.00 0.00 66.70 65.64 2qkv h VAL 644 Cb 0.08 2.10 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 2qkv h VAL 644 CO 0.00 0.34 0.14 0.28 0.02 0.00 0.00 177.57 178.36 2qkv h SER 645 N -1.00 0.13 -0.86 0.57 0.02 -1.12 -1.50 113.55 109.79 2qkv h SER 645 Ca -0.13 0.06 0.02 0.00 -0.84 0.00 0.00 61.79 60.90 2qkv h SER 645 Cb 0.91 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.46 2qkv h SER 645 CO -0.08 0.10 0.56 0.22 -1.14 0.00 0.00 176.83 176.50 2qkv h TYR 646 N 0.30 1.06 -0.77 3.45 3.20 -0.70 -1.61 116.97 121.91 2qkv h TYR 646 Ca 0.22 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.13 2qkv h TYR 646 Cb 0.23 -0.36 -0.04 0.00 1.54 0.00 0.00 36.73 38.10 2qkv h TYR 646 CO -0.17 0.64 0.51 0.00 -1.64 0.00 0.00 178.16 177.50 2qkv h ALA 647 N 1.34 1.50 -0.26 1.82 0.00 -1.29 0.26 119.26 122.64 2qkv h ALA 647 Ca 0.33 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2qkv h ALA 647 Cb -0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2qkv h ALA 647 CO -0.09 0.44 0.05 -0.07 0.00 0.00 0.00 179.25 179.58 2qkv h LEU 648 N 0.99 0.39 -0.21 0.00 3.38 -0.35 -0.46 115.31 119.05 2qkv h LEU 648 Ca 0.30 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qkv h LEU 648 Cb -0.03 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2qkv h LEU 648 CO -0.08 0.53 0.11 -0.26 0.09 0.00 0.00 178.44 178.83 2qkv h PHE 649 N 0.24 0.29 0.00 1.13 -1.00 -0.91 -2.86 116.94 113.82 2qkv h PHE 649 Ca 0.08 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.82 2qkv h PHE 649 Cb 0.30 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 39.76 2qkv h PHE 649 CO 0.02 0.28 -0.15 -0.22 -1.61 0.00 0.00 178.31 176.63 2qkv h LYS 650 N 0.21 0.00 -0.00 1.51 1.63 -0.83 -2.66 116.57 116.43 2qkv h LYS 650 Ca 0.07 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2qkv h LYS 650 Cb 0.09 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 2qkv h LYS 650 CO -0.01 0.15 -0.04 0.41 -3.45 0.00 0.00 179.45 176.51 2qkv n GLY 651 N -1.08 -1.15 3.59 5.01 0.00 -0.19 -4.77 105.19 106.60 2qkv n GLY 651 Ca -0.03 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 2qkv n GLY 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkv s ALA 652 N -2.49 3.33 -0.47 4.61 0.00 -1.01 -4.88 121.76 120.86 2qkv s ALA 652 Ca 0.30 -0.56 0.21 0.00 0.00 0.00 0.00 51.96 51.91 2qkv s ALA 652 Cb 0.20 -3.61 -0.28 0.00 0.00 0.00 0.00 23.12 19.44 2qkv s ALA 652 CO 0.46 -1.81 0.65 0.09 0.00 0.00 0.00 175.76 175.14 2qkv n ASN 653 N 7.00 0.57 0.00 0.00 5.03 -1.26 -4.98 115.26 121.62 2qkv n ASN 653 Ca 0.07 -0.46 0.00 0.00 0.87 0.00 0.00 54.58 55.06 2qkv n ASN 653 Cb 0.48 1.50 0.00 0.00 -1.02 0.00 0.00 39.78 40.75 2qkv n ASN 653 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qkv n GLY 654 N 1.39 2.46 3.75 7.41 0.00 -1.26 -4.61 105.19 114.32 2qkv n GLY 654 Ca -0.00 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2qkv n GLY 654 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkv s LYS 655 N 1.76 4.16 -0.09 1.61 -0.14 -1.26 -0.59 119.74 125.19 2qkv s LYS 655 Ca 0.00 2.51 -0.00 0.00 -1.36 0.00 0.00 55.97 57.12 2qkv s LYS 655 Cb 0.00 -3.05 0.02 0.00 -1.68 0.00 0.00 37.83 33.12 2qkv s LYS 655 CO 0.00 -0.59 -0.06 0.08 -0.76 0.00 0.00 175.35 174.02 2qkv s VAL 656 N 0.11 0.84 -0.15 3.17 1.01 -0.17 -4.91 120.40 120.31 2qkv s VAL 656 Ca 0.63 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.41 2qkv s VAL 656 Cb -0.46 -0.88 0.03 0.00 0.00 0.00 0.00 36.38 35.07 2qkv s VAL 656 CO 0.45 0.33 -0.07 -0.55 0.00 0.00 0.00 175.10 175.26 2qkv s SER 657 N 1.55 2.65 0.13 3.32 0.15 -1.26 -1.44 113.70 118.80 2qkv s SER 657 Ca 0.01 -0.55 0.09 0.00 0.70 0.00 0.00 55.95 56.20 2qkv s SER 657 Cb -0.13 -0.94 -0.04 0.00 -1.71 0.00 0.00 66.02 63.20 2qkv s SER 657 CO -0.05 -0.15 -0.22 -0.04 1.20 0.00 0.00 173.24 173.98 2qkv s MET 658 N 1.62 1.25 -0.08 5.44 -1.94 0.23 -0.41 119.30 125.41 2qkv s MET 658 Ca 0.02 -1.28 -0.00 0.00 -1.71 0.00 0.00 55.69 52.72 2qkv s MET 658 Cb -0.14 -1.53 -0.03 0.00 2.01 0.00 0.00 34.83 35.13 2qkv s MET 658 CO -0.08 0.35 -0.05 -1.21 -0.01 0.00 0.00 175.02 174.02 2qkv s GLU 659 N -2.16 2.91 0.01 2.03 2.02 -0.72 -1.36 118.70 121.44 2qkv s GLU 659 Ca 0.11 -0.52 -0.02 0.00 0.02 0.00 0.00 54.97 54.56 2qkv s GLU 659 Cb -0.09 -2.67 -0.01 0.00 0.10 0.00 0.00 34.13 31.46 2qkv s GLU 659 CO 0.06 0.62 0.02 0.08 0.02 0.00 0.00 175.26 176.05 2qkv s VAL 660 N -0.68 0.10 0.03 2.63 1.01 -0.00 -0.80 120.40 122.69 2qkv s VAL 660 Ca 0.10 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.32 2qkv s VAL 660 Cb -0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.94 2qkv s VAL 660 CO 0.02 -0.46 -0.20 0.28 0.00 0.00 0.00 175.10 174.74 2qkv s THR 661 N -1.42 1.57 -0.47 3.92 -1.32 -0.10 -0.72 115.64 117.10 2qkv s THR 661 Ca -0.15 -1.09 -0.12 0.00 -1.21 0.00 0.00 61.69 59.12 2qkv s THR 661 Cb -0.09 -1.35 0.10 0.00 -1.51 0.00 0.00 72.50 69.64 2qkv s THR 661 CO -0.00 0.23 0.36 -0.60 -2.21 0.00 0.00 174.62 172.41 2qkv s ARG 662 N -1.00 2.72 -1.35 7.08 3.52 -1.26 -0.82 118.95 127.83 2qkv s ARG 662 Ca 0.07 -1.58 -0.13 0.00 -0.13 0.00 0.00 55.73 53.96 2qkv s ARG 662 Cb -0.08 -4.00 -0.04 0.00 -1.56 0.00 0.00 34.95 29.26 2qkv s ARG 662 CO 0.01 -1.12 2.41 -0.35 -0.81 0.00 0.00 175.30 175.44 2qkv n PRO 663 N 5.04 2.85 -3.86 5.12 -0.04 -1.26 -4.81 135.00 138.03 2qkv n PRO 663 Ca -0.11 -2.24 -0.29 0.00 -0.04 0.00 0.00 63.50 60.83 2qkv n PRO 663 Cb 0.42 -2.99 -0.13 0.00 -0.04 0.00 0.00 33.50 30.76 2qkv n PRO 663 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2qkv s LYS 664 N 3.15 1.99 0.00 0.54 1.02 -1.26 -5.08 119.74 120.10 2qkv s LYS 664 Ca 0.55 -2.77 0.28 0.00 0.02 0.00 0.00 55.97 54.05 2qkv s LYS 664 Cb 0.15 -3.10 1.67 0.00 -0.52 0.00 0.00 37.83 36.03 2qkv s LYS 664 CO -0.04 -1.20 2.02 -2.30 -0.92 0.00 0.00 175.35 172.90