#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j4l n ASN 574 N 0.00 2.85 0.00 1.61 3.02 -1.26 -4.76 115.26 116.72 1j4l n ASN 574 Ca 0.00 -2.04 0.00 0.00 -0.03 0.00 0.00 54.58 52.51 1j4l n ASN 574 Cb 0.00 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 1j4l n ASN 574 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j4l n GLY 575 N 1.27 -0.81 3.61 7.41 0.00 -1.26 -5.07 105.19 110.34 1j4l n GLY 575 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1j4l n GLY 575 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1j4l s ARG 576 N 0.00 3.13 0.07 1.61 3.00 -1.26 -0.20 118.95 125.30 1j4l s ARG 576 Ca 0.00 -0.47 0.00 0.00 -1.00 0.00 0.00 55.73 54.26 1j4l s ARG 576 Cb 0.00 -2.79 0.00 0.00 0.00 0.00 0.00 34.95 32.16 1j4l s ARG 576 CO 0.00 0.56 0.00 0.34 0.00 0.00 0.00 175.30 176.20 1j4l n PHE 577 N 2.56 -0.19 -4.64 5.12 -0.00 -0.83 -4.11 117.46 115.38 1j4l n PHE 577 Ca -0.18 0.03 -0.32 0.00 -0.00 0.00 0.00 57.45 56.98 1j4l n PHE 577 Cb 0.53 0.07 -0.12 0.00 -0.00 0.00 0.00 39.48 39.96 1j4l n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1j4l s LEU 578 N -6.49 2.92 -0.22 -2.13 2.96 -1.16 -1.05 118.68 113.50 1j4l s LEU 578 Ca 0.00 -0.22 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 1j4l s LEU 578 Cb 0.00 -1.66 0.04 0.00 0.50 0.00 0.00 46.19 45.07 1j4l s LEU 578 CO 0.00 0.30 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.29 1j4l s THR 579 N -0.89 2.11 -0.38 3.68 2.01 0.05 0.13 115.64 122.34 1j4l s THR 579 Ca 0.15 -1.30 -0.10 0.00 0.31 0.00 0.00 61.69 60.75 1j4l s THR 579 Cb -0.11 -2.07 0.04 0.00 0.01 0.00 0.00 72.50 70.37 1j4l s THR 579 CO 0.05 0.24 0.21 -0.76 -0.69 0.00 0.00 174.62 173.67 1j4l s LEU 580 N 1.20 4.77 -0.42 4.42 1.02 0.64 0.18 118.68 130.48 1j4l s LEU 580 Ca -0.02 -1.11 -0.04 0.00 0.02 0.00 0.00 54.13 52.98 1j4l s LEU 580 Cb -0.17 -2.00 0.11 0.00 0.02 0.00 0.00 46.19 44.15 1j4l s LEU 580 CO -0.09 -0.41 0.23 -1.59 0.02 0.00 0.00 176.35 174.51 1j4l s LYS 581 N 1.51 2.08 -0.82 1.70 -2.85 0.26 0.21 119.74 121.84 1j4l s LYS 581 Ca 0.02 -1.83 -0.29 0.00 -1.00 0.00 0.00 55.97 52.87 1j4l s LYS 581 Cb -0.20 -3.64 -0.17 0.00 -2.06 0.00 0.00 37.83 31.76 1j4l s LYS 581 CO 0.05 -1.09 2.59 -2.30 0.10 0.00 0.00 175.35 174.69 1j4l n PRO 582 N 4.61 0.37 -1.82 1.78 -0.02 0.72 -2.76 135.00 137.88 1j4l n PRO 582 Ca -0.03 -0.02 -0.32 0.00 -2.02 0.00 0.00 63.50 61.12 1j4l n PRO 582 Cb 0.41 -2.20 0.03 0.00 -0.02 0.00 0.00 33.50 31.72 1j4l n PRO 582 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1j4l s LEU 583 N 10.01 3.32 0.59 2.45 2.34 -1.10 -1.99 118.68 134.31 1j4l s LEU 583 Ca 1.22 1.72 0.29 0.00 0.06 0.00 0.00 54.13 57.42 1j4l s LEU 583 Cb -0.85 -4.51 1.38 0.00 -0.56 0.00 0.00 46.19 41.65 1j4l s LEU 583 CO 0.41 -1.30 1.78 -0.65 -1.06 0.00 0.00 176.35 175.53 1j4l h PRO 584 N -0.12 0.00 0.00 1.48 0.11 -1.90 0.61 132.00 132.19 1j4l h PRO 584 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1j4l h PRO 584 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1j4l h PRO 584 CO 0.57 0.00 -0.07 0.22 -0.21 0.00 0.00 178.00 178.51 1j4l h ASP 585 N 0.00 0.00 -2.94 -2.05 1.82 -1.91 -3.42 116.42 107.92 1j4l h ASP 585 Ca 0.28 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.38 1j4l h ASP 585 Cb 1.54 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.53 1j4l h ASP 585 CO -0.00 0.07 -0.30 -0.55 -1.61 0.00 0.00 179.24 176.85 1j4l s SER 586 N -6.46 6.41 0.19 2.28 0.15 0.21 -4.77 113.70 111.72 1j4l s SER 586 Ca -0.04 0.48 0.10 0.00 0.70 0.00 0.00 55.95 57.19 1j4l s SER 586 Cb 0.15 -2.04 0.55 0.00 -1.71 0.00 0.00 66.02 62.96 1j4l s SER 586 CO 0.60 -0.06 1.23 2.30 1.20 0.00 0.00 173.24 178.52 1j4l n ILE 587 N -0.63 1.14 -4.06 6.45 -5.35 -0.38 -4.36 119.36 112.18 1j4l n ILE 587 Ca -0.04 0.64 -0.35 0.00 -0.27 0.00 0.00 62.75 62.73 1j4l n ILE 587 Cb 0.54 -1.64 -0.13 0.00 -1.74 0.00 0.00 39.64 36.67 1j4l n ILE 587 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1j4l s ILE 588 N -3.17 3.96 -0.74 7.28 1.01 -1.26 -5.02 121.20 123.26 1j4l s ILE 588 Ca -0.01 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1j4l s ILE 588 Cb 0.03 -2.79 0.35 0.00 0.01 0.00 0.00 42.46 40.06 1j4l s ILE 588 CO 0.09 0.43 1.44 0.00 0.00 0.00 0.00 174.94 176.89 1j4l n GLN 589 N 4.28 3.88 -4.54 2.79 3.00 -1.25 -3.60 117.38 121.93 1j4l n GLN 589 Ca -0.17 -4.51 -0.25 0.00 -0.01 0.00 0.00 57.00 52.06 1j4l n GLN 589 Cb 0.52 -2.32 -0.10 0.00 0.00 0.00 0.00 30.24 28.34 1j4l n GLN 589 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1j4l s GLU 590 N -3.86 1.83 -0.09 -1.09 2.02 -0.84 -4.99 118.70 111.69 1j4l s GLU 590 Ca 0.46 -2.05 0.01 0.00 0.02 0.00 0.00 54.97 53.41 1j4l s GLU 590 Cb 0.30 -1.16 0.02 0.00 0.10 0.00 0.00 34.13 33.39 1j4l s GLU 590 CO -0.19 -0.19 -0.12 -1.54 0.02 0.00 0.00 175.26 173.24 1j4l s SER 591 N -3.61 2.01 -0.08 -0.19 1.04 -1.26 -0.20 113.70 111.41 1j4l s SER 591 Ca 0.32 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.43 1j4l s SER 591 Cb 0.08 -0.88 -0.03 0.00 0.10 0.00 0.00 66.02 65.29 1j4l s SER 591 CO 0.15 -0.01 -0.11 -0.76 0.98 0.00 0.00 173.24 173.49 1j4l s LEU 592 N 1.01 2.93 -0.20 2.42 1.43 0.55 -4.94 118.68 121.88 1j4l s LEU 592 Ca -0.08 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1j4l s LEU 592 Cb -0.15 -1.63 0.04 0.00 0.03 0.00 0.00 46.19 44.48 1j4l s LEU 592 CO -0.01 0.30 -0.11 -1.61 0.23 0.00 0.00 176.35 175.16 1j4l s GLU 593 N -0.45 2.07 -0.38 1.70 8.01 -1.26 0.23 118.70 128.63 1j4l s GLU 593 Ca 0.06 -0.86 -0.29 0.00 0.01 0.00 0.00 54.97 53.90 1j4l s GLU 593 Cb -0.12 -2.43 -0.00 0.00 -4.31 0.00 0.00 34.13 27.26 1j4l s GLU 593 CO 0.02 -0.42 1.61 0.42 0.01 0.00 0.00 175.26 176.89 1j4l s ILE 594 N 1.38 3.68 -0.35 -1.63 1.01 0.35 -4.92 121.20 120.72 1j4l s ILE 594 Ca -0.01 0.69 -0.28 0.00 0.00 0.00 0.00 60.65 61.05 1j4l s ILE 594 Cb -0.16 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 1j4l s ILE 594 CO -0.08 -0.60 1.94 -1.10 0.00 0.00 0.00 174.94 175.10 1j4l s GLN 595 N 5.33 3.11 0.53 2.79 1.11 -1.26 -1.96 119.66 129.32 1j4l s GLN 595 Ca 0.70 1.46 0.44 0.00 0.01 0.00 0.00 55.36 57.96 1j4l s GLN 595 Cb -0.18 -4.29 1.64 0.00 -1.01 0.00 0.00 33.01 29.18 1j4l s GLN 595 CO 0.33 -2.13 1.64 -0.56 0.01 0.00 0.00 175.29 174.58 1j4l h GLN 596 N 14.14 0.02 0.00 2.91 -0.00 -0.84 1.55 115.11 132.88 1j4l h GLN 596 Ca -0.33 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.29 1j4l h GLN 596 Cb 1.19 -0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.66 1j4l h GLN 596 CO 1.05 0.01 -0.10 0.78 -0.00 0.00 0.00 178.83 180.57 1j4l h GLY 597 N 0.02 0.00 -7.76 0.06 0.00 -1.87 -3.41 103.07 90.11 1j4l h GLY 597 Ca 0.83 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.51 1j4l h GLY 597 CO -0.08 0.00 -0.54 0.14 0.00 0.00 0.00 176.54 176.07 1j4l s VAL 598 N -3.99 5.09 -0.04 4.60 1.01 0.53 -5.06 120.40 122.54 1j4l s VAL 598 Ca -0.02 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1j4l s VAL 598 Cb 0.12 -3.44 0.03 0.00 0.00 0.00 0.00 36.38 33.08 1j4l s VAL 598 CO 0.57 0.24 0.04 0.21 0.00 0.00 0.00 175.10 176.15 1j4l s ASN 599 N 1.72 0.87 0.44 3.32 2.47 -1.26 -4.02 114.94 118.48 1j4l s ASN 599 Ca 0.07 0.04 -0.03 0.00 0.42 0.00 0.00 52.86 53.35 1j4l s ASN 599 Cb -0.16 -0.17 -0.03 0.00 -1.45 0.00 0.00 41.25 39.44 1j4l s ASN 599 CO 0.09 -0.20 0.70 -2.16 -3.72 0.00 0.00 177.10 171.82 1j4l s PRO 600 N 1.76 3.46 -0.36 0.43 0.04 -1.26 -5.05 135.00 134.01 1j4l s PRO 600 Ca -0.00 -0.04 -0.20 0.00 0.04 0.00 0.00 61.00 60.81 1j4l s PRO 600 Cb -0.12 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 31.94 1j4l s PRO 600 CO -0.03 -0.11 0.60 0.12 0.04 0.00 0.00 177.00 177.61 1j4l s PHE 601 N -2.60 3.15 -0.01 0.56 5.36 0.31 -4.91 117.98 119.84 1j4l s PHE 601 Ca 0.45 0.25 -0.16 0.00 -0.96 0.00 0.00 56.93 56.51 1j4l s PHE 601 Cb -0.10 -3.09 -0.06 0.00 -0.34 0.00 0.00 43.02 39.43 1j4l s PHE 601 CO 0.41 -0.62 0.46 -0.06 -1.46 0.00 0.00 175.22 173.95 1j4l s PHE 602 N 2.62 3.70 0.05 10.12 0.40 -1.26 0.10 117.98 133.71 1j4l s PHE 602 Ca 0.22 1.03 0.07 0.00 -0.60 0.00 0.00 56.93 57.66 1j4l s PHE 602 Cb -0.15 -2.39 -0.03 0.00 0.51 0.00 0.00 43.02 40.97 1j4l s PHE 602 CO 0.15 0.53 -0.19 0.42 0.70 0.00 0.00 175.22 176.83 1j4l s ILE 603 N -0.73 1.57 -4.74 0.64 1.09 0.11 0.12 121.20 119.26 1j4l s ILE 603 Ca 0.25 -1.23 0.00 0.00 -1.10 0.00 0.00 60.65 58.57 1j4l s ILE 603 Cb -0.17 -1.38 0.00 0.00 -1.06 0.00 0.00 42.46 39.85 1j4l s ILE 603 CO 0.14 0.11 0.00 0.61 -0.10 0.00 0.00 174.94 175.70 1j4l n GLY 604 N 1.70 -1.75 0.17 6.18 0.00 -1.14 -2.64 105.19 107.71 1j4l n GLY 604 Ca -0.18 -1.23 -0.13 0.00 0.00 0.00 0.00 46.02 44.48 1j4l n GLY 604 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1j4l h ARG 605 N 0.00 -0.32 -6.59 1.61 3.08 0.63 0.45 114.38 113.24 1j4l h ARG 605 Ca 0.00 0.02 -0.52 0.00 0.07 0.00 0.00 59.98 59.55 1j4l h ARG 605 Cb 0.00 0.07 0.05 0.00 0.08 0.00 0.00 29.97 30.17 1j4l h ARG 605 CO 0.00 0.01 1.05 -1.12 -1.07 0.00 0.00 179.97 178.84 1j4l s SER 606 N -5.18 6.41 0.62 7.04 0.01 -1.15 -4.53 113.70 116.92 1j4l s SER 606 Ca -0.14 2.81 0.30 0.00 1.31 0.00 0.00 55.95 60.23 1j4l s SER 606 Cb 0.02 -2.58 1.66 0.00 0.21 0.00 0.00 66.02 65.33 1j4l s SER 606 CO 0.56 -0.98 1.93 -0.08 0.41 0.00 0.00 173.24 175.07 1j4l h GLU 607 N 7.59 0.00 -0.60 12.44 4.81 -1.89 -0.49 114.58 136.43 1j4l h GLU 607 Ca -0.44 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 58.96 1j4l h GLU 607 Cb 1.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 1j4l h GLU 607 CO 0.95 0.00 0.45 -0.44 -0.73 0.00 0.00 179.01 179.24 1j4l h ASP 608 N 0.00 0.00 -3.41 1.04 3.32 -1.91 -3.40 116.42 112.06 1j4l h ASP 608 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1j4l h ASP 608 Cb 0.53 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.09 1j4l h ASP 608 CO 0.00 0.00 0.54 0.00 -1.72 0.00 0.00 179.24 178.06 1j4l h ASN 610 N 5.72 0.00 -3.74 0.00 2.35 -0.28 -3.37 115.58 116.24 1j4l h ASN 610 Ca -0.43 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 54.63 1j4l h ASN 610 Cb 1.21 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 39.39 1j4l h ASN 610 CO 0.76 0.00 -0.72 0.00 -1.65 0.00 0.00 177.43 175.82 1j4l s LYS 612 N -1.11 2.41 -0.18 0.00 -0.14 -1.26 -2.87 119.74 116.58 1j4l s LYS 612 Ca 0.14 -1.48 -0.04 0.00 -1.36 0.00 0.00 55.97 53.23 1j4l s LYS 612 Cb -0.11 -3.57 0.06 0.00 -1.68 0.00 0.00 37.83 32.53 1j4l s LYS 612 CO 0.04 -0.88 0.08 0.42 -0.76 0.00 0.00 175.35 174.25 1j4l s ILE 613 N 1.31 0.04 -0.41 2.17 -1.09 0.16 -4.94 121.20 118.44 1j4l s ILE 613 Ca 0.02 -0.28 -0.10 0.00 -2.23 0.00 0.00 60.65 58.06 1j4l s ILE 613 Cb -0.22 -0.69 0.06 0.00 -1.58 0.00 0.00 42.46 40.04 1j4l s ILE 613 CO -0.00 -0.29 0.25 -0.70 -1.23 0.00 0.00 174.94 172.97 1j4l s GLU 614 N 2.08 2.69 -0.23 2.79 2.12 -1.26 0.00 118.70 126.89 1j4l s GLU 614 Ca 0.02 -1.35 -0.01 0.00 0.36 0.00 0.00 54.97 53.99 1j4l s GLU 614 Cb -0.16 -3.79 0.07 0.00 0.26 0.00 0.00 34.13 30.51 1j4l s GLU 614 CO -0.10 -0.89 0.01 0.34 -0.54 0.00 0.00 175.26 174.08 1j4l s ASP 615 N 1.99 3.52 0.58 -1.70 2.15 -1.26 -5.00 116.67 116.95 1j4l s ASP 615 Ca 0.03 -1.13 0.41 0.00 0.43 0.00 0.00 52.55 52.28 1j4l s ASP 615 Cb -0.22 -0.90 1.42 0.00 -0.30 0.00 0.00 42.92 42.92 1j4l s ASP 615 CO 0.04 -0.30 1.47 -0.55 -0.17 0.00 0.00 175.17 175.65 1j4l h ASN 616 N 8.09 0.00 -0.29 -0.34 -1.07 -1.99 0.62 115.58 120.60 1j4l h ASN 616 Ca -0.16 0.00 -0.18 0.00 0.07 0.00 0.00 56.30 56.03 1j4l h ASN 616 Cb 1.08 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.33 1j4l h ASN 616 CO 0.39 0.00 -0.52 0.03 0.07 0.00 0.00 177.43 177.41 1j4l h ARG 617 N 0.00 0.87 -6.79 4.14 -0.00 -2.02 -3.45 114.38 107.13 1j4l h ARG 617 Ca 0.76 -0.54 -0.49 0.00 -0.50 0.00 0.00 59.98 59.21 1j4l h ARG 617 Cb 3.44 0.06 0.02 0.00 0.00 0.00 0.00 29.97 33.49 1j4l h ARG 617 CO -0.01 1.18 0.01 -0.48 0.00 0.00 0.00 179.97 180.67 1j4l s LEU 618 N -8.73 3.77 0.80 3.04 0.05 0.22 -4.66 118.68 113.17 1j4l s LEU 618 Ca -0.11 0.80 -0.12 0.00 0.05 0.00 0.00 54.13 54.75 1j4l s LEU 618 Cb 0.10 -3.72 0.07 0.00 -2.05 0.00 0.00 46.19 40.59 1j4l s LEU 618 CO 0.89 -0.47 1.15 -0.44 -0.55 0.00 0.00 176.35 176.93 1j4l s SER 619 N -3.96 4.60 0.40 1.48 0.01 -1.26 -4.71 113.70 110.26 1j4l s SER 619 Ca 0.45 0.91 0.18 0.00 1.31 0.00 0.00 55.95 58.80 1j4l s SER 619 Cb -0.10 -1.50 1.09 0.00 0.21 0.00 0.00 66.02 65.72 1j4l s SER 619 CO 0.41 -1.86 1.80 0.03 0.41 0.00 0.00 173.24 174.02 1j4l h ARG 620 N -1.02 0.40 -2.19 12.44 -0.00 -1.95 -2.11 114.38 119.95 1j4l h ARG 620 Ca -0.46 -0.02 -0.58 0.00 -0.50 0.00 0.00 59.98 58.42 1j4l h ARG 620 Cb 1.31 -0.09 -0.41 0.00 0.00 0.00 0.00 29.97 30.78 1j4l h ARG 620 CO 0.65 0.26 -0.75 0.28 0.00 0.00 0.00 179.97 180.41 1j4l n VAL 621 N -4.58 2.00 -0.27 2.04 0.31 -1.26 -1.55 118.33 115.02 1j4l n VAL 621 Ca 0.23 -5.16 0.08 0.00 -0.01 0.00 0.00 64.34 59.48 1j4l n VAL 621 Cb 0.81 -1.55 0.22 0.00 -0.91 0.00 0.00 33.84 32.41 1j4l n VAL 621 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1j4l h HIS 622 N 3.51 0.47 -2.41 3.52 2.76 -1.14 -3.37 115.15 118.48 1j4l h HIS 622 Ca 0.14 0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.43 1j4l h HIS 622 Cb 0.66 -0.08 -0.15 0.00 1.55 0.00 0.00 27.41 29.39 1j4l h HIS 622 CO 0.70 -0.02 0.43 0.00 -1.30 0.00 0.00 177.93 177.74 1j4l s PHE 624 N -3.20 0.03 -0.11 0.00 -0.71 0.32 0.08 117.98 114.39 1j4l s PHE 624 Ca 0.04 -0.07 -0.05 0.00 -1.04 0.00 0.00 56.93 55.80 1j4l s PHE 624 Cb -0.01 -0.05 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 1j4l s PHE 624 CO -0.10 -0.21 0.09 0.42 -1.34 0.00 0.00 175.22 174.09 1j4l s ILE 625 N -1.02 5.12 -0.03 -4.49 1.01 0.28 0.20 121.20 122.26 1j4l s ILE 625 Ca -0.11 0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.62 1j4l s ILE 625 Cb -0.06 -3.21 0.01 0.00 0.01 0.00 0.00 42.46 39.21 1j4l s ILE 625 CO 0.01 0.61 -0.08 0.12 0.00 0.00 0.00 174.94 175.60 1j4l s PHE 626 N -0.98 0.91 -0.13 3.97 5.36 0.50 0.11 117.98 127.72 1j4l s PHE 626 Ca 0.15 -0.24 -0.11 0.00 -0.96 0.00 0.00 56.93 55.77 1j4l s PHE 626 Cb -0.12 -0.68 -0.05 0.00 -0.34 0.00 0.00 43.02 41.84 1j4l s PHE 626 CO 0.04 -0.12 0.23 0.21 -1.46 0.00 0.00 175.22 174.11 1j4l s LYS 627 N 0.35 3.92 0.08 10.12 2.20 -1.26 0.19 119.74 135.35 1j4l s LYS 627 Ca -0.05 0.01 0.02 0.00 -0.36 0.00 0.00 55.97 55.58 1j4l s LYS 627 Cb -0.10 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.87 1j4l s LYS 627 CO 0.01 0.50 -0.06 0.21 -0.36 0.00 0.00 175.35 175.65 1j4l s LYS 628 N -0.30 0.76 -0.39 4.03 2.36 0.65 -4.93 119.74 121.91 1j4l s LYS 628 Ca 0.15 -1.22 -0.29 0.00 -2.55 0.00 0.00 55.97 52.07 1j4l s LYS 628 Cb -0.13 -0.18 0.02 0.00 -1.05 0.00 0.00 37.83 36.48 1j4l s LYS 628 CO 0.04 -0.01 1.22 0.50 1.55 0.00 0.00 175.35 178.65 1j4l s ARG 629 N -3.42 3.80 0.09 4.03 6.06 -1.26 0.12 118.95 128.37 1j4l s ARG 629 Ca 0.07 0.90 -0.31 0.00 -2.50 0.00 0.00 55.73 53.90 1j4l s ARG 629 Cb 0.03 -3.89 -0.07 0.00 0.06 0.00 0.00 34.95 31.08 1j4l s ARG 629 CO -0.04 -1.27 1.25 -1.58 -2.50 0.00 0.00 175.30 171.15 1j4l s HIS 630 N 4.50 3.39 -0.19 5.12 5.65 0.62 -4.86 115.29 129.51 1j4l s HIS 630 Ca 0.52 1.23 -0.11 0.00 0.25 0.00 0.00 55.06 56.95 1j4l s HIS 630 Cb -0.12 -3.49 0.06 0.00 -1.18 0.00 0.00 32.58 27.86 1j4l s HIS 630 CO 0.27 -1.55 0.47 0.00 -0.65 0.00 0.00 174.74 173.28 1j4l s ALA 631 N 0.90 -1.21 0.71 1.58 0.00 -1.26 -2.24 121.76 120.24 1j4l s ALA 631 Ca 0.59 1.66 0.00 0.00 0.00 0.00 0.00 51.96 54.22 1j4l s ALA 631 Cb -0.32 -1.00 0.13 0.00 0.00 0.00 0.00 23.12 21.94 1j4l s ALA 631 CO 0.31 -0.28 0.93 1.33 0.00 0.00 0.00 175.76 178.05 1j4l n VAL 632 N 4.07 0.00 0.00 0.00 0.24 -1.26 -5.07 118.33 116.31 1j4l n VAL 632 Ca -0.21 -1.50 0.00 0.00 -2.04 0.00 0.00 64.34 60.59 1j4l n VAL 632 Cb 0.56 -0.90 0.00 0.00 -1.47 0.00 0.00 33.84 32.03 1j4l n VAL 632 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1j4l n GLY 633 N -2.18 -1.30 3.56 7.63 0.00 -1.26 -4.99 105.19 106.65 1j4l n GLY 633 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 1j4l n GLY 633 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j4l s LYS 634 N -1.65 1.99 -0.30 1.61 3.01 -1.26 -5.08 119.74 118.05 1j4l s LYS 634 Ca 0.00 -2.23 0.17 0.00 -1.01 0.00 0.00 55.97 52.90 1j4l s LYS 634 Cb 0.00 -0.75 0.48 0.00 -1.01 0.00 0.00 37.83 36.55 1j4l s LYS 634 CO 0.00 -0.47 1.08 -1.13 0.51 0.00 0.00 175.35 175.33 1j4l n SER 635 N -1.34 2.44 -4.66 2.83 3.41 -1.26 -4.88 113.62 110.17 1j4l n SER 635 Ca -0.08 -2.70 -0.42 0.00 -0.26 0.00 0.00 58.87 55.41 1j4l n SER 635 Cb 0.65 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 1j4l n SER 635 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1j4l n MET 636 N -0.45 2.87 0.00 4.33 2.81 -1.26 -3.91 117.12 121.51 1j4l n MET 636 Ca 0.17 1.05 0.00 0.00 -1.81 0.00 0.00 57.70 57.11 1j4l n MET 636 Cb 0.82 -3.02 0.00 0.00 -0.71 0.00 0.00 33.22 30.31 1j4l n MET 636 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 1j4l n TYR 637 N 7.60 0.00 -2.75 2.03 4.19 -1.26 -4.80 117.16 122.17 1j4l n TYR 637 Ca 0.20 0.00 -0.38 0.00 3.31 0.00 0.00 57.90 61.03 1j4l n TYR 637 Cb 0.41 0.00 -0.06 0.00 0.49 0.00 0.00 39.34 40.18 1j4l n TYR 637 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 1j4l s GLU 638 N 0.00 4.66 -0.50 2.98 2.02 -1.25 -5.03 118.70 121.57 1j4l s GLU 638 Ca 0.00 1.40 -0.03 0.00 0.02 0.00 0.00 54.97 56.35 1j4l s GLU 638 Cb 0.00 -2.95 0.13 0.00 0.10 0.00 0.00 34.13 31.41 1j4l s GLU 638 CO 0.00 0.34 0.31 -1.12 0.02 0.00 0.00 175.26 174.81 1j4l s SER 639 N -1.46 5.29 0.00 -0.19 0.01 -1.26 -4.52 113.70 111.58 1j4l s SER 639 Ca 0.47 -2.34 0.00 0.00 1.31 0.00 0.00 55.95 55.39 1j4l s SER 639 Cb -0.21 -1.86 0.00 0.00 0.21 0.00 0.00 66.02 64.16 1j4l s SER 639 CO 0.27 -0.49 0.00 -2.65 0.41 0.00 0.00 173.24 170.78 1j4l n PRO 640 N 4.19 1.56 0.21 12.44 -0.02 -1.26 -4.77 135.00 147.36 1j4l n PRO 640 Ca 0.01 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.64 1j4l n PRO 640 Cb 0.40 0.00 0.74 0.00 -0.02 0.00 0.00 33.50 34.62 1j4l n PRO 640 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j4l h ALA 641 N -2.00 1.00 0.00 3.55 0.00 -1.96 -3.46 119.26 116.39 1j4l h ALA 641 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1j4l h ALA 641 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1j4l h ALA 641 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.29 1j4l n GLN 642 N -2.55 0.00 0.00 0.00 6.02 -1.26 -4.19 117.38 115.41 1j4l n GLN 642 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 1j4l n GLN 642 Cb 0.11 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.37 1j4l n GLN 642 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1j4l n GLY 643 N 0.00 -2.05 0.00 1.08 0.00 -1.26 -4.66 105.19 98.31 1j4l n GLY 643 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 46.02 47.01 1j4l n GLY 643 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j4l n LEU 644 N 0.00 0.00 -4.47 0.99 4.32 -0.95 -4.87 117.00 112.03 1j4l n LEU 644 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.69 1j4l n LEU 644 Cb 0.00 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 41.68 1j4l n LEU 644 CO 0.00 -0.06 -0.50 -1.81 -1.22 0.00 0.00 177.39 173.80 1j4l s ASP 645 N -0.35 3.80 -0.01 -1.43 1.01 -0.93 0.23 116.67 118.99 1j4l s ASP 645 Ca 0.00 -0.52 0.02 0.00 0.71 0.00 0.00 52.55 52.76 1j4l s ASP 645 Cb 0.00 -0.54 -0.00 0.00 1.01 0.00 0.00 42.92 43.38 1j4l s ASP 645 CO 0.00 0.21 -0.06 -1.81 0.21 0.00 0.00 175.17 173.72 1j4l s ASP 646 N -1.84 0.76 -0.08 0.27 1.01 0.32 -2.23 116.67 114.88 1j4l s ASP 646 Ca 0.16 -0.12 -0.21 0.00 0.71 0.00 0.00 52.55 53.10 1j4l s ASP 646 Cb -0.10 -0.11 -0.04 0.00 1.01 0.00 0.00 42.92 43.67 1j4l s ASP 646 CO 0.08 0.07 0.60 0.27 0.21 0.00 0.00 175.17 176.39 1j4l s ILE 647 N -0.06 5.10 -0.00 0.77 -4.36 -1.26 -0.25 121.20 121.13 1j4l s ILE 647 Ca 0.01 1.22 0.03 0.00 -0.26 0.00 0.00 60.65 61.66 1j4l s ILE 647 Cb -0.04 -3.94 -0.03 0.00 1.25 0.00 0.00 42.46 39.70 1j4l s ILE 647 CO -0.00 0.30 -0.08 0.26 0.24 0.00 0.00 174.94 175.66 1j4l s TRP 648 N 0.65 2.87 -0.27 1.37 0.52 0.51 -1.64 118.94 122.95 1j4l s TRP 648 Ca 0.32 -0.05 -0.07 0.00 0.02 0.00 0.00 56.10 56.32 1j4l s TRP 648 Cb -0.17 -1.61 -0.01 0.00 -1.15 0.00 0.00 33.47 30.54 1j4l s TRP 648 CO 0.15 0.35 0.06 -0.47 0.02 0.00 0.00 176.95 177.06 1j4l s TYR 649 N -0.96 3.10 -0.11 -1.98 6.14 0.36 0.19 117.35 124.09 1j4l s TYR 649 Ca 0.16 -0.79 -0.04 0.00 0.64 0.00 0.00 57.07 57.05 1j4l s TYR 649 Cb -0.11 -2.23 -0.04 0.00 0.42 0.00 0.00 41.96 40.00 1j4l s TYR 649 CO 0.06 -0.50 0.03 0.00 0.64 0.00 0.00 175.55 175.79 1j4l s HIS 651 N -0.71 2.50 0.00 0.00 2.46 -0.50 0.12 115.29 119.16 1j4l s HIS 651 Ca 0.12 -0.82 0.00 0.00 0.47 0.00 0.00 55.06 54.82 1j4l s HIS 651 Cb -0.12 -1.65 0.00 0.00 -0.13 0.00 0.00 32.58 30.68 1j4l s HIS 651 CO 0.02 -0.28 0.58 0.25 -2.47 0.00 0.00 174.74 172.85 1j4l n THR 652 N 3.16 0.34 -2.67 0.89 -2.24 0.20 0.96 114.28 114.92 1j4l n THR 652 Ca -0.18 -0.43 -0.34 0.00 -2.27 0.00 0.00 64.05 60.84 1j4l n THR 652 Cb 0.52 1.00 -0.05 0.00 -2.10 0.00 0.00 70.33 69.70 1j4l n THR 652 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1j4l s GLY 653 N -0.34 2.45 0.15 3.38 0.00 0.53 -4.80 107.32 108.69 1j4l s GLY 653 Ca 0.00 0.50 -0.08 0.00 0.00 0.00 0.00 44.72 45.15 1j4l s GLY 653 CO 0.00 0.80 1.44 0.00 0.00 0.00 0.00 173.10 175.34 1j4l h THR 654 N 1.72 1.30 0.00 0.90 1.03 -1.90 -2.99 112.91 112.97 1j4l h THR 654 Ca -0.49 -1.80 0.00 0.00 -0.01 0.00 0.00 66.41 64.10 1j4l h THR 654 Cb 1.20 1.75 0.00 0.00 -1.07 0.00 0.00 68.15 70.03 1j4l h THR 654 CO 0.60 0.57 0.00 0.59 -0.01 0.00 0.00 175.52 177.27 1j4l n ASN 655 N -3.97 0.00 -1.91 0.00 3.02 -1.26 -4.84 115.26 106.30 1j4l n ASN 655 Ca -0.04 -0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.44 1j4l n ASN 655 Cb 0.64 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1j4l n ASN 655 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1j4l n VAL 656 N -1.19 -7.82 -2.45 2.41 3.14 -1.13 -4.90 118.33 106.38 1j4l n VAL 656 Ca 0.07 2.40 -0.25 0.00 -2.96 0.00 0.00 64.34 63.60 1j4l n VAL 656 Cb 0.08 -3.61 0.04 0.00 -1.06 0.00 0.00 33.84 29.29 1j4l n VAL 656 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1j4l s SER 657 N -1.01 5.41 -0.12 6.55 1.04 -0.63 -4.78 113.70 120.16 1j4l s SER 657 Ca 0.00 0.52 -0.00 0.00 0.48 0.00 0.00 55.95 56.95 1j4l s SER 657 Cb 0.00 -1.46 0.03 0.00 0.10 0.00 0.00 66.02 64.69 1j4l s SER 657 CO 0.00 -1.15 -0.07 -0.31 0.98 0.00 0.00 173.24 172.69 1j4l s TYR 658 N -2.97 1.47 -0.39 5.02 1.51 0.36 0.43 117.35 122.79 1j4l s TYR 658 Ca 0.55 -0.75 -0.13 0.00 -1.01 0.00 0.00 57.07 55.73 1j4l s TYR 658 Cb -0.10 -1.22 0.01 0.00 -0.11 0.00 0.00 41.96 40.54 1j4l s TYR 658 CO 0.43 -0.52 0.26 -1.17 -1.11 0.00 0.00 175.55 173.45 1j4l s LEU 659 N 1.71 4.88 0.00 -1.29 2.96 -0.01 0.23 118.68 127.17 1j4l s LEU 659 Ca 0.05 -0.83 0.00 0.00 -0.22 0.00 0.00 54.13 53.13 1j4l s LEU 659 Cb -0.13 -2.12 0.00 0.00 0.50 0.00 0.00 46.19 44.45 1j4l s LEU 659 CO -0.08 -0.39 0.00 -3.20 -1.32 0.00 0.00 176.35 171.36 1j4l n ASN 660 N 5.11 0.00 0.00 3.68 2.85 -0.74 0.25 115.26 126.40 1j4l n ASN 660 Ca -0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.35 1j4l n ASN 660 Cb 0.47 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.49 1j4l n ASN 660 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1j4l n ASN 661 N 1.28 0.31 -4.59 1.20 4.13 -1.26 -5.05 115.26 111.28 1j4l n ASN 661 Ca 0.00 -1.13 -0.33 0.00 1.68 0.00 0.00 54.58 54.79 1j4l n ASN 661 Cb 0.00 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.13 1j4l n ASN 661 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 1j4l s ASN 662 N -0.13 4.67 0.27 6.41 3.84 0.14 -5.10 114.94 125.03 1j4l s ASN 662 Ca 0.00 -0.05 -0.29 0.00 0.21 0.00 0.00 52.86 52.74 1j4l s ASN 662 Cb 0.00 -1.16 -0.09 0.00 -0.55 0.00 0.00 41.25 39.45 1j4l s ASN 662 CO 0.00 0.34 0.95 -0.60 -2.79 0.00 0.00 177.10 175.00 1j4l s ARG 663 N -0.98 4.76 -0.37 0.43 3.52 -1.26 -0.82 118.95 124.22 1j4l s ARG 663 Ca 0.14 1.45 0.00 0.00 -0.13 0.00 0.00 55.73 57.19 1j4l s ARG 663 Cb -0.11 -3.12 0.10 0.00 -1.56 0.00 0.00 34.95 30.26 1j4l s ARG 663 CO 0.03 0.43 0.12 -1.64 -0.81 0.00 0.00 175.30 173.43 1j4l s MET 664 N -1.47 1.81 0.12 5.12 -1.94 0.17 -4.88 119.30 118.22 1j4l s MET 664 Ca 0.44 -1.80 -0.20 0.00 -1.71 0.00 0.00 55.69 52.42 1j4l s MET 664 Cb -0.24 -3.39 -0.07 0.00 2.01 0.00 0.00 34.83 33.14 1j4l s MET 664 CO 0.30 -0.98 0.63 0.96 -0.01 0.00 0.00 175.02 175.91 1j4l s ILE 665 N 1.05 4.65 -0.88 2.53 -4.36 -1.26 -1.61 121.20 121.32 1j4l s ILE 665 Ca 0.08 1.29 -0.32 0.00 -0.26 0.00 0.00 60.65 61.44 1j4l s ILE 665 Cb -0.21 -3.93 -0.21 0.00 1.25 0.00 0.00 42.46 39.36 1j4l s ILE 665 CO -0.06 0.48 2.52 1.67 0.24 0.00 0.00 174.94 179.79 1j4l n GLN 666 N 1.49 0.00 0.00 0.37 7.27 -1.25 -1.53 117.38 123.73 1j4l n GLN 666 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.99 1j4l n GLN 666 Cb 0.50 -1.45 0.00 0.00 2.41 0.00 0.00 30.24 31.70 1j4l n GLN 666 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1j4l n GLY 667 N 6.48 1.28 3.40 1.69 0.00 0.27 -4.93 105.19 113.38 1j4l n GLY 667 Ca 0.62 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.43 1j4l n GLY 667 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j4l s THR 668 N -2.00 2.02 0.08 2.61 -4.23 -0.58 0.66 115.64 114.20 1j4l s THR 668 Ca 0.00 -2.28 0.06 0.00 -1.18 0.00 0.00 61.69 58.29 1j4l s THR 668 Cb 0.00 -2.17 -0.03 0.00 1.34 0.00 0.00 72.50 71.64 1j4l s THR 668 CO 0.00 -0.50 -0.17 -0.75 -0.54 0.00 0.00 174.62 172.66 1j4l s LYS 669 N -3.60 0.99 -0.07 3.99 2.20 0.43 -1.41 119.74 122.27 1j4l s LYS 669 Ca 0.26 -1.01 -0.11 0.00 -0.36 0.00 0.00 55.97 54.75 1j4l s LYS 669 Cb -0.02 -1.10 0.02 0.00 -1.51 0.00 0.00 37.83 35.22 1j4l s LYS 669 CO 0.10 0.26 0.27 0.12 -0.36 0.00 0.00 175.35 175.74 1j4l s PHE 670 N -1.14 -0.24 0.29 4.03 2.19 0.52 -0.93 117.98 122.70 1j4l s PHE 670 Ca 0.02 0.53 -0.29 0.00 0.33 0.00 0.00 56.93 57.52 1j4l s PHE 670 Cb -0.10 0.08 -0.10 0.00 -1.31 0.00 0.00 43.02 41.60 1j4l s PHE 670 CO 0.03 -0.22 1.26 -1.17 1.83 0.00 0.00 175.22 176.94 1j4l s LEU 671 N -0.40 4.46 -0.56 6.12 1.98 -1.26 0.14 118.68 129.15 1j4l s LEU 671 Ca -0.05 2.52 -0.07 0.00 -2.89 0.00 0.00 54.13 53.64 1j4l s LEU 671 Cb -0.03 -3.63 0.14 0.00 0.66 0.00 0.00 46.19 43.33 1j4l s LEU 671 CO 0.01 -0.43 0.41 -0.76 -1.89 0.00 0.00 176.35 173.69 1j4l s LEU 672 N -1.30 5.63 0.36 -0.68 1.43 -0.65 -4.83 118.68 118.65 1j4l s LEU 672 Ca 0.50 -2.34 -0.25 0.00 -1.03 0.00 0.00 54.13 51.01 1j4l s LEU 672 Cb -0.37 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 43.79 1j4l s LEU 672 CO 0.46 -0.55 1.02 -1.10 0.23 0.00 0.00 176.35 176.41 1j4l s GLN 673 N 0.71 4.35 -0.36 1.70 -0.21 -1.25 -4.55 119.66 120.05 1j4l s GLN 673 Ca 0.11 1.46 -0.39 0.00 0.02 0.00 0.00 55.36 56.57 1j4l s GLN 673 Cb -0.22 -2.67 -0.14 0.00 1.00 0.00 0.00 33.01 30.98 1j4l s GLN 673 CO -0.03 0.04 2.04 -3.47 -2.12 0.00 0.00 175.29 171.75 1j4l n ASP 674 N 0.24 1.93 -0.16 5.90 2.03 0.22 -0.62 116.55 126.08 1j4l n ASP 674 Ca 0.03 0.67 0.00 0.00 0.52 0.00 0.00 54.79 56.01 1j4l n ASP 674 Cb 0.49 -1.15 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 1j4l n ASP 674 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1j4l n GLY 675 N 6.02 1.04 3.62 0.27 0.00 0.29 -4.95 105.19 111.48 1j4l n GLY 675 Ca 0.40 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1j4l n GLY 675 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j4l s ASP 676 N -2.37 6.65 -0.44 1.61 2.15 0.21 -4.73 116.67 119.75 1j4l s ASP 676 Ca 0.00 0.69 -0.18 0.00 0.43 0.00 0.00 52.55 53.49 1j4l s ASP 676 Cb 0.00 -2.39 0.03 0.00 -0.30 0.00 0.00 42.92 40.26 1j4l s ASP 676 CO 0.00 -0.55 0.48 -1.61 -0.17 0.00 0.00 175.17 173.32 1j4l s GLU 677 N 2.83 3.10 -0.19 4.34 2.02 -1.26 0.11 118.70 129.66 1j4l s GLU 677 Ca 0.31 -0.80 -0.07 0.00 0.02 0.00 0.00 54.97 54.43 1j4l s GLU 677 Cb -0.15 -4.00 -0.03 0.00 0.10 0.00 0.00 34.13 30.05 1j4l s GLU 677 CO 0.11 -0.94 0.04 0.42 0.02 0.00 0.00 175.26 174.91 1j4l s ILE 678 N 2.22 4.47 -0.33 -1.63 1.01 0.59 -1.79 121.20 125.75 1j4l s ILE 678 Ca 0.13 -0.14 -0.20 0.00 0.00 0.00 0.00 60.65 60.43 1j4l s ILE 678 Cb -0.18 -3.02 -0.00 0.00 0.01 0.00 0.00 42.46 39.27 1j4l s ILE 678 CO 0.13 0.44 0.62 -0.54 0.00 0.00 0.00 174.94 175.59 1j4l s LYS 679 N 0.65 3.79 0.03 2.79 1.02 0.62 0.08 119.74 128.72 1j4l s LYS 679 Ca 0.02 0.16 -0.09 0.00 0.02 0.00 0.00 55.97 56.08 1j4l s LYS 679 Cb -0.13 -3.77 -0.31 0.00 -0.52 0.00 0.00 37.83 33.10 1j4l s LYS 679 CO 0.02 -0.64 0.98 0.82 -0.92 0.00 0.00 175.35 175.60 1j4l h ILE 680 N 5.60 1.28 -2.38 2.17 2.04 -1.82 1.06 117.51 125.47 1j4l h ILE 680 Ca -0.27 -2.82 -0.06 0.00 1.00 0.00 0.00 64.86 62.71 1j4l h ILE 680 Cb 1.12 2.92 -0.24 0.00 -0.74 0.00 0.00 36.82 39.87 1j4l h ILE 680 CO 0.81 0.85 -0.15 -0.51 0.00 0.00 0.00 178.15 179.15 1j4l s ILE 681 N -2.62 -0.01 -0.05 -0.67 1.10 -1.26 -4.32 121.20 113.37 1j4l s ILE 681 Ca -0.08 0.05 -0.00 0.00 -0.51 0.00 0.00 60.65 60.10 1j4l s ILE 681 Cb 0.06 -0.77 0.03 0.00 0.15 0.00 0.00 42.46 41.92 1j4l s ILE 681 CO 0.90 0.02 -0.00 0.86 -2.11 0.00 0.00 174.94 174.60 1j4l s TRP 682 N 1.33 0.53 -0.17 3.50 -0.00 -1.24 -0.22 118.94 122.68 1j4l s TRP 682 Ca -0.08 -0.09 0.00 0.00 -0.00 0.00 0.00 56.10 55.93 1j4l s TRP 682 Cb -0.07 -0.62 0.03 0.00 -0.00 0.00 0.00 33.47 32.82 1j4l s TRP 682 CO -0.14 -0.22 -0.10 0.34 -0.00 0.00 0.00 176.95 176.83 1j4l s ASP 683 N 1.45 2.92 0.07 5.86 -1.08 0.30 -4.94 116.67 121.25 1j4l s ASP 683 Ca -0.03 -0.65 -0.20 0.00 -0.52 0.00 0.00 52.55 51.15 1j4l s ASP 683 Cb -0.13 -1.11 -0.11 0.00 -1.46 0.00 0.00 42.92 40.11 1j4l s ASP 683 CO -0.03 -0.12 1.47 0.11 0.52 0.00 0.00 175.17 177.13 1j4l h LYS 684 N 8.05 0.36 0.21 4.34 1.57 -1.95 0.14 116.57 129.29 1j4l h LYS 684 Ca -0.31 -0.13 -0.34 0.00 -1.87 0.00 0.00 60.65 58.01 1j4l h LYS 684 Cb 1.12 -0.03 0.02 0.00 0.08 0.00 0.00 32.23 33.42 1j4l h LYS 684 CO 0.47 0.59 -1.61 -0.91 -0.57 0.00 0.00 179.45 177.42 1j4l h ASN 685 N 0.09 0.70 1.02 0.86 2.35 -1.98 -3.30 115.58 115.32 1j4l h ASN 685 Ca 0.05 -0.93 0.00 0.00 -0.55 0.00 0.00 56.30 54.87 1j4l h ASN 685 Cb 0.45 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1j4l h ASN 685 CO 0.01 1.75 0.00 -3.20 -1.65 0.00 0.00 177.43 174.34 1j4l n ASN 686 N -3.67 0.36 -1.05 5.81 2.85 -1.25 -4.88 115.26 113.43 1j4l n ASN 686 Ca -0.22 0.55 -0.14 0.00 -0.11 0.00 0.00 54.58 54.67 1j4l n ASN 686 Cb 1.07 -0.64 -0.06 0.00 1.24 0.00 0.00 39.78 41.39 1j4l n ASN 686 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1j4l n LYS 687 N -1.86 -1.46 -2.51 1.20 5.02 0.46 -4.90 118.16 114.11 1j4l n LYS 687 Ca 0.05 0.97 -0.42 0.00 -2.02 0.00 0.00 58.31 56.89 1j4l n LYS 687 Cb 0.32 -5.29 -0.03 0.00 -0.02 0.00 0.00 35.03 30.01 1j4l n LYS 687 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1j4l s PHE 688 N -2.26 2.44 -0.18 2.13 2.19 -1.05 -4.84 117.98 116.42 1j4l s PHE 688 Ca 0.00 0.36 0.01 0.00 0.33 0.00 0.00 56.93 57.62 1j4l s PHE 688 Cb 0.00 -4.50 0.01 0.00 -1.31 0.00 0.00 43.02 37.23 1j4l s PHE 688 CO 0.00 -1.80 -0.18 0.54 1.83 0.00 0.00 175.22 175.61 1j4l s VAL 689 N 5.46 2.28 0.13 3.12 0.11 -1.26 0.11 120.40 130.35 1j4l s VAL 689 Ca 0.45 -0.88 0.06 0.00 -2.93 0.00 0.00 61.98 58.68 1j4l s VAL 689 Cb -0.09 -1.96 -0.04 0.00 -1.53 0.00 0.00 36.38 32.76 1j4l s VAL 689 CO 0.23 0.52 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.76 1j4l s ILE 690 N 1.19 1.37 0.00 7.04 1.01 0.70 -1.25 121.20 131.25 1j4l s ILE 690 Ca 0.02 -1.78 0.00 0.00 0.00 0.00 0.00 60.65 58.89 1j4l s ILE 690 Cb -0.14 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.74 1j4l s ILE 690 CO -0.09 -0.44 0.00 0.61 0.00 0.00 0.00 174.94 175.02 1j4l n GLY 691 N 0.42 1.05 3.53 6.18 0.00 -1.26 -3.73 105.19 111.37 1j4l n GLY 691 Ca -0.15 0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1j4l n GLY 691 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j4l s PHE 692 N -0.30 2.75 -0.31 1.61 0.08 0.11 -2.70 117.98 119.22 1j4l s PHE 692 Ca 0.00 -0.13 -0.11 0.00 0.12 0.00 0.00 56.93 56.81 1j4l s PHE 692 Cb 0.00 -1.57 -0.03 0.00 -0.57 0.00 0.00 43.02 40.85 1j4l s PHE 692 CO 0.00 0.29 0.20 0.21 -0.10 0.00 0.00 175.22 175.82 1j4l s LYS 693 N -1.26 3.60 -0.25 0.44 2.20 -1.11 -0.30 119.74 123.06 1j4l s LYS 693 Ca 0.15 -0.56 -0.25 0.00 -0.36 0.00 0.00 55.97 54.95 1j4l s LYS 693 Cb -0.11 -3.68 -0.00 0.00 -1.51 0.00 0.00 37.83 32.53 1j4l s LYS 693 CO 0.05 -0.35 0.87 0.08 -0.36 0.00 0.00 175.35 175.64 1j4l s VAL 694 N 1.70 4.80 -0.25 4.02 1.01 0.30 -0.57 120.40 131.42 1j4l s VAL 694 Ca 0.06 1.61 0.01 0.00 0.00 0.00 0.00 61.98 63.66 1j4l s VAL 694 Cb -0.17 -4.16 0.07 0.00 0.00 0.00 0.00 36.38 32.12 1j4l s VAL 694 CO 0.09 -0.12 -0.02 -0.70 0.00 0.00 0.00 175.10 174.35 1j4l s GLU 695 N 2.93 1.45 -0.45 2.72 2.12 0.48 0.10 118.70 128.06 1j4l s GLU 695 Ca 0.36 -1.03 -0.28 0.00 0.36 0.00 0.00 54.97 54.38 1j4l s GLU 695 Cb -0.15 -2.55 -0.01 0.00 0.26 0.00 0.00 34.13 31.68 1j4l s GLU 695 CO 0.08 -0.67 1.67 0.42 -0.54 0.00 0.00 175.26 176.22 1j4l s ILE 696 N 1.41 3.59 -0.18 -3.70 1.01 -1.26 -0.77 121.20 121.30 1j4l s ILE 696 Ca -0.03 0.54 -0.18 0.00 0.00 0.00 0.00 60.65 60.99 1j4l s ILE 696 Cb -0.19 -3.96 -0.22 0.00 0.01 0.00 0.00 42.46 38.10 1j4l s ILE 696 CO -0.08 -0.73 0.29 0.78 0.00 0.00 0.00 174.94 175.20 1j4l h ASN 697 N 12.61 0.13 -3.70 3.58 -0.26 -1.43 -3.47 115.58 123.05 1j4l h ASN 697 Ca -0.29 -0.65 -0.68 0.00 -0.56 0.00 0.00 56.30 54.11 1j4l h ASN 697 Cb 1.14 -0.04 -0.19 0.00 -1.06 0.00 0.00 38.32 38.17 1j4l h ASN 697 CO 1.11 1.58 -0.71 -0.62 -1.06 0.00 0.00 177.43 177.73 1j4l s ASP 698 N -6.90 4.54 -0.40 5.81 -1.08 -0.83 -5.04 116.67 112.77 1j4l s ASP 698 Ca -0.26 -0.10 -0.02 0.00 -0.52 0.00 0.00 52.55 51.64 1j4l s ASP 698 Cb 0.06 -1.08 0.11 0.00 -1.46 0.00 0.00 42.92 40.55 1j4l s ASP 698 CO 0.65 0.33 0.18 0.42 0.52 0.00 0.00 175.17 177.27 1j4l s THR 699 N -0.88 3.16 -1.23 1.71 -4.23 -1.26 -4.60 115.64 108.31 1j4l s THR 699 Ca 0.14 -2.08 -0.17 0.00 -1.18 0.00 0.00 61.69 58.40 1j4l s THR 699 Cb -0.11 -3.18 -0.02 0.00 1.34 0.00 0.00 72.50 70.52 1j4l s THR 699 CO 0.04 -0.67 2.11 1.07 -0.54 0.00 0.00 174.62 176.63 1j4l n THR 700 N 4.55 2.92 -2.37 3.99 5.66 -1.26 -4.13 114.28 123.64 1j4l n THR 700 Ca -0.02 -2.57 -0.17 0.00 -3.05 0.00 0.00 64.05 58.24 1j4l n THR 700 Cb 0.41 -2.50 -0.01 0.00 -1.55 0.00 0.00 70.33 66.68 1j4l n THR 700 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1j4l n GLY 701 N 4.30 -0.34 3.73 1.09 0.00 -1.26 -4.62 105.19 108.08 1j4l n GLY 701 Ca 0.51 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 1j4l n GLY 701 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j4l s LEU 702 N -5.02 4.36 0.55 0.99 2.01 -1.26 -2.18 118.68 118.14 1j4l s LEU 702 Ca 0.02 2.84 0.39 0.00 0.01 0.00 0.00 54.13 57.38 1j4l s LEU 702 Cb -0.01 -3.61 1.57 0.00 0.01 0.00 0.00 46.19 44.15 1j4l s LEU 702 CO 0.02 -0.91 1.75 2.19 1.01 0.00 0.00 176.35 180.41 1j4l h PHE 703 N 6.10 0.00 0.00 0.29 -0.00 -1.75 -3.37 116.94 118.21 1j4l h PHE 703 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.53 1j4l h PHE 703 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 1j4l h PHE 703 CO 0.62 0.00 0.00 -1.71 -0.00 0.00 0.00 178.31 177.22 1j4l n ASN 704 N -4.09 -0.73 0.00 -0.68 5.15 -1.26 -4.93 115.26 108.71 1j4l n ASN 704 Ca 0.28 0.18 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 1j4l n ASN 704 Cb 1.37 0.99 0.00 0.00 -0.53 0.00 0.00 39.78 41.62 1j4l n ASN 704 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1j4l n GLU 705 N -2.71 0.00 0.00 1.20 0.28 -1.26 -4.98 120.64 113.17 1j4l n GLU 705 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1j4l n GLU 705 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1j4l n GLU 705 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1j4l n GLY 706 N 0.00 0.19 0.00 -1.84 0.00 -1.26 -4.30 105.19 97.97 1j4l n GLY 706 Ca 0.00 0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.12 1j4l n GLY 706 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j4l n LEU 707 N 0.00 0.64 0.00 0.99 7.99 -1.26 -0.61 117.00 124.75 1j4l n LEU 707 Ca 0.00 -0.49 0.00 0.00 -0.01 0.00 0.00 56.01 55.51 1j4l n LEU 707 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1j4l n LEU 707 CO 0.00 0.16 0.00 0.61 -1.51 0.00 0.00 177.39 176.65 1j4l n GLY 708 N 1.33 1.28 4.23 -0.72 0.00 -1.26 -4.68 105.19 105.37 1j4l n GLY 708 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1j4l n GLY 708 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1j4l n MET 709 N -0.61 -3.01 0.00 1.61 0.00 -1.26 -4.36 117.12 109.49 1j4l n MET 709 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 57.70 58.06 1j4l n MET 709 Cb 0.00 -5.02 0.00 0.00 0.00 0.00 0.00 33.22 28.20 1j4l n MET 709 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 175.97 177.44 1j4l n LEU 710 N -4.37 0.00 0.00 3.17 -0.00 -1.26 -3.92 117.00 110.62 1j4l n LEU 710 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.06 1j4l n LEU 710 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 1j4l n LEU 710 CO 0.86 -0.07 0.00 0.00 -0.00 0.00 0.00 177.39 178.18 1j4l n GLN 711 N 0.00 0.00 -1.81 1.47 1.13 -1.26 -3.46 117.38 113.44 1j4l n GLN 711 Ca 0.00 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.74 1j4l n GLN 711 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.31 1j4l n GLN 711 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1j4l s GLU 712 N 0.00 2.28 -0.59 -1.09 0.41 -1.25 -4.90 118.70 113.56 1j4l s GLU 712 Ca 0.00 0.70 -0.19 0.00 -0.41 0.00 0.00 54.97 55.06 1j4l s GLU 712 Cb 0.00 -4.62 0.09 0.00 -1.78 0.00 0.00 34.13 27.82 1j4l s GLU 712 CO 0.00 -3.28 0.74 -0.65 -0.49 0.00 0.00 175.26 171.57 1j4l s GLN 713 N 7.72 3.06 -0.20 1.61 -1.52 -1.22 -4.49 119.66 124.62 1j4l s GLN 713 Ca 0.81 -1.20 -0.08 0.00 -1.95 0.00 0.00 55.36 52.95 1j4l s GLN 713 Cb -0.13 -4.24 0.01 0.00 -0.22 0.00 0.00 33.01 28.43 1j4l s GLN 713 CO 0.17 -1.55 0.16 0.54 -0.25 0.00 0.00 175.29 174.37 1j4l n ARG 714 N 6.52 -1.60 -4.91 2.91 5.12 -1.26 -5.02 116.66 118.43 1j4l n ARG 714 Ca -0.08 1.54 -0.27 0.00 -1.93 0.00 0.00 57.85 57.11 1j4l n ARG 714 Cb 0.43 -2.75 -0.15 0.00 -1.16 0.00 0.00 32.46 28.83 1j4l n ARG 714 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1j4l s VAL 715 N -1.39 1.62 -0.11 1.55 -7.23 -1.26 -4.93 120.40 108.66 1j4l s VAL 715 Ca 0.09 -0.95 -0.19 0.00 -1.81 0.00 0.00 61.98 59.11 1j4l s VAL 715 Cb -0.01 -1.36 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 1j4l s VAL 715 CO 0.42 0.39 0.51 -0.69 -0.31 0.00 0.00 175.10 175.43 1j4l s VAL 716 N -0.56 5.16 0.39 1.32 1.01 -1.26 -4.60 120.40 121.86 1j4l s VAL 716 Ca 0.08 1.03 0.08 0.00 0.00 0.00 0.00 61.98 63.17 1j4l s VAL 716 Cb -0.08 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1j4l s VAL 716 CO -0.00 0.32 0.30 -0.76 0.00 0.00 0.00 175.10 174.95 1j4l s LEU 717 N 0.62 3.37 0.14 3.92 1.02 -0.11 -4.95 118.68 122.69 1j4l s LEU 717 Ca 0.28 -0.76 -0.04 0.00 0.02 0.00 0.00 54.13 53.63 1j4l s LEU 717 Cb -0.16 -1.94 -0.05 0.00 0.02 0.00 0.00 46.19 44.06 1j4l s LEU 717 CO 0.12 -0.53 0.36 -0.75 0.02 0.00 0.00 176.35 175.57 1j4l s LYS 718 N -4.03 3.59 0.33 1.70 2.20 -1.26 -0.42 119.74 121.84 1j4l s LYS 718 Ca 0.44 -0.15 -0.07 0.00 -0.36 0.00 0.00 55.97 55.83 1j4l s LYS 718 Cb -0.02 -2.86 -0.06 0.00 -1.51 0.00 0.00 37.83 33.37 1j4l s LYS 718 CO 0.26 0.47 0.63 -0.65 -0.36 0.00 0.00 175.35 175.71 1j4l s GLN 719 N -2.71 3.70 0.19 4.03 -0.21 0.21 -4.60 119.66 120.27 1j4l s GLN 719 Ca 0.40 0.20 0.01 0.00 0.02 0.00 0.00 55.36 55.99 1j4l s GLN 719 Cb -0.12 -2.55 -0.00 0.00 1.00 0.00 0.00 33.01 31.34 1j4l s GLN 719 CO 0.25 0.13 0.04 0.25 -2.12 0.00 0.00 175.29 173.84 1j4l n THR 720 N -1.02 0.00 -0.04 -0.19 -2.24 -1.26 -4.94 114.28 104.59 1j4l n THR 720 Ca -0.00 -1.01 0.16 0.00 -2.27 0.00 0.00 64.05 60.92 1j4l n THR 720 Cb 0.54 0.30 0.59 0.00 -2.10 0.00 0.00 70.33 69.66 1j4l n THR 720 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j4l h ALA 721 N 1.21 2.24 0.06 6.98 0.00 -1.99 -1.54 119.26 126.23 1j4l h ALA 721 Ca -0.15 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1j4l h ALA 721 Cb 0.53 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1j4l h ALA 721 CO 0.25 -0.39 -0.12 1.49 0.00 0.00 0.00 179.25 180.48 1j4l h GLU 722 N 0.21 -0.23 -0.08 0.00 4.81 -1.98 0.69 114.58 117.99 1j4l h GLU 722 Ca 0.26 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1j4l h GLU 722 Cb 0.76 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.19 1j4l h GLU 722 CO -0.05 -0.15 -0.02 0.93 -0.73 0.00 0.00 179.01 179.00 1j4l h GLU 723 N -0.24 0.16 -0.27 1.92 3.07 -1.76 -2.92 114.58 114.55 1j4l h GLU 723 Ca 0.02 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 1j4l h GLU 723 Cb 0.26 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1j4l h GLU 723 CO -0.08 0.47 0.15 -0.22 -1.40 0.00 0.00 179.01 177.94 1j4l h LYS 724 N -0.16 0.36 -0.70 2.33 3.64 -1.19 -2.12 116.57 118.74 1j4l h LYS 724 Ca 0.02 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 1j4l h LYS 724 Cb 0.41 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1j4l h LYS 724 CO 0.01 0.26 0.21 0.22 -2.27 0.00 0.00 179.45 177.89 1j4l h ASP 725 N 0.37 1.01 -0.50 4.20 3.58 0.54 -0.29 116.42 125.33 1j4l h ASP 725 Ca 0.10 -0.18 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 1j4l h ASP 725 Cb 0.00 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 1j4l h ASP 725 CO -0.02 0.94 0.25 -0.07 -2.88 0.00 0.00 179.24 177.46 1j4l h LEU 726 N 1.04 0.64 -0.77 2.28 3.38 -1.20 -2.54 115.31 118.14 1j4l h LEU 726 Ca 0.23 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1j4l h LEU 726 Cb 0.30 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1j4l h LEU 726 CO -0.01 0.58 -0.54 1.62 0.09 0.00 0.00 178.44 180.18 1j4l h VAL 727 N 0.66 1.24 -0.67 1.22 3.04 -1.41 -3.08 116.25 117.25 1j4l h VAL 727 Ca 0.17 -1.96 0.10 0.00 -1.01 0.00 0.00 66.70 63.99 1j4l h VAL 727 Cb 0.10 2.10 -0.04 0.00 -2.01 0.00 0.00 31.29 31.44 1j4l h VAL 727 CO -0.02 0.53 0.44 0.50 -1.01 0.00 0.00 177.57 178.01 1j4l h LYS 728 N 0.00 0.51 -0.96 4.17 3.64 -0.61 0.61 116.57 123.93 1j4l h LYS 728 Ca -0.01 -0.03 -0.42 0.00 -1.27 0.00 0.00 60.65 58.92 1j4l h LYS 728 Cb 1.06 -0.11 -0.25 0.00 -0.41 0.00 0.00 32.23 32.52 1j4l h LYS 728 CO 0.07 0.34 0.53 1.63 -2.27 0.00 0.00 179.45 179.75 1j4l n LYS 729 N -4.48 2.43 0.00 1.90 5.02 -1.16 -5.10 118.16 116.76 1j4l n LYS 729 Ca 0.11 -2.77 0.15 0.00 -2.02 0.00 0.00 58.31 53.78 1j4l n LYS 729 Cb 0.35 -2.10 0.75 0.00 -0.02 0.00 0.00 35.03 34.01 1j4l n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77