#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2m n ASN 574 N 0.00 0.54 0.00 1.61 6.94 -1.26 -4.95 115.26 118.14 1k2m n ASN 574 Ca 0.00 0.22 0.00 0.00 -0.02 0.00 0.00 54.58 54.78 1k2m n ASN 574 Cb 0.00 0.87 0.00 0.00 -2.36 0.00 0.00 39.78 38.29 1k2m n ASN 574 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1k2m n GLY 575 N 1.31 0.54 3.71 4.83 0.00 -1.26 -5.10 105.19 109.22 1k2m n GLY 575 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1k2m n GLY 575 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k2m s ARG 576 N 0.00 3.04 0.17 1.61 3.00 -1.26 -0.99 118.95 124.52 1k2m s ARG 576 Ca 0.00 -0.37 0.00 0.00 -1.00 0.00 0.00 55.73 54.36 1k2m s ARG 576 Cb 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 34.95 32.10 1k2m s ARG 576 CO 0.00 0.71 0.00 0.34 0.00 0.00 0.00 175.30 176.35 1k2m n PHE 577 N 2.08 -1.08 -4.31 5.12 7.35 -0.97 -4.21 117.46 121.45 1k2m n PHE 577 Ca -0.19 0.19 -0.34 0.00 -0.76 0.00 0.00 57.45 56.35 1k2m n PHE 577 Cb 0.54 0.27 -0.09 0.00 0.35 0.00 0.00 39.48 40.55 1k2m n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1k2m s LEU 578 N -6.77 3.63 -0.19 -2.13 0.20 -1.05 -0.93 118.68 111.44 1k2m s LEU 578 Ca 0.00 0.13 0.01 0.00 0.69 0.00 0.00 54.13 54.96 1k2m s LEU 578 Cb 0.00 -1.91 0.02 0.00 -0.43 0.00 0.00 46.19 43.87 1k2m s LEU 578 CO 0.00 0.35 -0.19 -0.89 -0.29 0.00 0.00 176.35 175.34 1k2m s THR 579 N -0.96 2.15 -0.39 3.68 2.01 0.10 0.17 115.64 122.40 1k2m s THR 579 Ca 0.15 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 61.11 1k2m s THR 579 Cb -0.11 -1.92 0.05 0.00 0.01 0.00 0.00 72.50 70.52 1k2m s THR 579 CO 0.05 0.51 0.23 -0.76 -0.69 0.00 0.00 174.62 173.97 1k2m s LEU 580 N 1.30 4.91 -0.45 4.42 1.43 0.43 0.14 118.68 130.86 1k2m s LEU 580 Ca 0.05 -1.17 -0.04 0.00 -1.03 0.00 0.00 54.13 51.94 1k2m s LEU 580 Cb -0.13 -2.02 0.12 0.00 0.03 0.00 0.00 46.19 44.18 1k2m s LEU 580 CO -0.12 -0.45 0.25 -1.59 0.23 0.00 0.00 176.35 174.67 1k2m s LYS 581 N 1.52 2.13 -0.70 1.70 0.00 -0.33 0.22 119.74 124.28 1k2m s LYS 581 Ca 0.02 -1.91 -0.30 0.00 0.00 0.00 0.00 55.97 53.78 1k2m s LYS 581 Cb -0.21 -3.64 -0.15 0.00 0.00 0.00 0.00 37.83 33.83 1k2m s LYS 581 CO 0.05 -1.10 2.50 -2.30 0.00 0.00 0.00 175.35 174.51 1k2m n PRO 582 N 4.48 0.54 -1.68 1.78 -0.02 0.10 -2.82 135.00 137.38 1k2m n PRO 582 Ca -0.01 0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.19 1k2m n PRO 582 Cb 0.41 -2.36 0.04 0.00 -0.02 0.00 0.00 33.50 31.57 1k2m n PRO 582 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1k2m s LEU 583 N 9.88 3.24 0.56 2.45 2.34 -1.13 -1.57 118.68 134.45 1k2m s LEU 583 Ca 1.18 1.71 0.32 0.00 0.06 0.00 0.00 54.13 57.40 1k2m s LEU 583 Cb -0.81 -4.51 1.47 0.00 -0.56 0.00 0.00 46.19 41.78 1k2m s LEU 583 CO 0.41 -1.43 1.83 1.55 -1.06 0.00 0.00 176.35 177.65 1k2m h PRO 584 N -0.40 0.00 0.00 1.48 0.13 -1.90 0.86 132.00 132.18 1k2m h PRO 584 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1k2m h PRO 584 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1k2m h PRO 584 CO 0.56 0.00 0.00 0.22 -0.23 0.00 0.00 178.00 178.55 1k2m h ASP 585 N 0.00 0.00 -2.88 1.44 1.82 -1.91 -3.42 116.42 111.46 1k2m h ASP 585 Ca 0.41 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.51 1k2m h ASP 585 Cb 1.80 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.78 1k2m h ASP 585 CO -0.00 0.00 -0.34 -0.55 -1.61 0.00 0.00 179.24 176.74 1k2m s SER 586 N -4.90 6.40 0.66 2.28 0.15 0.30 -4.84 113.70 113.75 1k2m s SER 586 Ca -0.02 0.42 0.35 0.00 0.70 0.00 0.00 55.95 57.40 1k2m s SER 586 Cb 0.10 -2.02 1.90 0.00 -1.71 0.00 0.00 66.02 64.29 1k2m s SER 586 CO 0.39 -0.02 2.08 0.16 1.20 0.00 0.00 173.24 177.04 1k2m h ILE 587 N 1.63 0.02 -3.50 6.45 3.07 -1.70 -3.36 117.51 120.13 1k2m h ILE 587 Ca -0.48 0.00 -0.66 0.00 1.55 0.00 0.00 64.86 65.27 1k2m h ILE 587 Cb 1.19 0.78 -0.27 0.00 -0.27 0.00 0.00 36.82 38.25 1k2m h ILE 587 CO 0.69 0.00 -0.68 -0.63 -1.05 0.00 0.00 178.15 176.47 1k2m s ILE 588 N -4.14 3.65 -0.83 0.16 1.01 -1.26 -5.01 121.20 114.77 1k2m s ILE 588 Ca -0.04 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.12 1k2m s ILE 588 Cb 0.10 -2.73 0.34 0.00 0.01 0.00 0.00 42.46 40.19 1k2m s ILE 588 CO 0.33 0.32 1.58 0.00 0.00 0.00 0.00 174.94 177.18 1k2m n GLN 589 N 4.83 4.25 -4.56 2.79 1.13 -1.25 -3.75 117.38 120.81 1k2m n GLN 589 Ca -0.17 -4.50 -0.26 0.00 -1.94 0.00 0.00 57.00 50.13 1k2m n GLN 589 Cb 0.50 -2.36 -0.10 0.00 0.11 0.00 0.00 30.24 28.39 1k2m n GLN 589 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1k2m s GLU 590 N -4.01 1.87 -0.09 -1.09 8.01 -0.61 -4.91 118.70 117.88 1k2m s GLU 590 Ca 0.45 -2.09 0.02 0.00 0.01 0.00 0.00 54.97 53.35 1k2m s GLU 590 Cb 0.28 -1.16 0.01 0.00 -4.31 0.00 0.00 34.13 28.95 1k2m s GLU 590 CO -0.19 -0.22 -0.14 -1.54 0.01 0.00 0.00 175.26 173.17 1k2m s SER 591 N -3.63 2.21 0.06 -0.19 1.04 -1.26 0.03 113.70 111.95 1k2m s SER 591 Ca 0.29 -0.38 0.06 0.00 0.48 0.00 0.00 55.95 56.40 1k2m s SER 591 Cb 0.07 -1.00 -0.04 0.00 0.10 0.00 0.00 66.02 65.16 1k2m s SER 591 CO 0.14 0.03 -0.11 -0.76 0.98 0.00 0.00 173.24 173.52 1k2m s LEU 592 N 0.81 2.98 -0.11 2.42 1.43 0.58 -4.93 118.68 121.86 1k2m s LEU 592 Ca -0.11 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.68 1k2m s LEU 592 Cb -0.16 -1.76 0.01 0.00 0.03 0.00 0.00 46.19 44.32 1k2m s LEU 592 CO 0.02 0.23 -0.15 -1.61 0.23 0.00 0.00 176.35 175.06 1k2m s GLU 593 N -1.81 2.20 -0.48 1.70 2.02 -1.26 0.16 118.70 121.23 1k2m s GLU 593 Ca 0.19 -0.55 -0.25 0.00 0.02 0.00 0.00 54.97 54.37 1k2m s GLU 593 Cb -0.11 -1.87 0.03 0.00 0.10 0.00 0.00 34.13 32.28 1k2m s GLU 593 CO 0.10 -0.06 0.90 0.42 0.02 0.00 0.00 175.26 176.64 1k2m s ILE 594 N 0.98 4.49 -0.07 -1.63 1.01 0.45 -4.94 121.20 121.49 1k2m s ILE 594 Ca -0.07 0.57 -0.29 0.00 0.00 0.00 0.00 60.65 60.85 1k2m s ILE 594 Cb -0.15 -4.44 -0.06 0.00 0.01 0.00 0.00 42.46 37.82 1k2m s ILE 594 CO -0.01 -0.88 1.83 -1.10 0.00 0.00 0.00 174.94 174.77 1k2m s GLN 595 N 3.70 3.98 0.55 2.79 1.11 -1.26 -2.28 119.66 128.26 1k2m s GLN 595 Ca 0.34 2.24 0.39 0.00 0.01 0.00 0.00 55.36 58.34 1k2m s GLN 595 Cb -0.11 -4.10 1.58 0.00 -1.01 0.00 0.00 33.01 29.36 1k2m s GLN 595 CO 0.24 -1.10 1.75 -0.56 0.01 0.00 0.00 175.29 175.63 1k2m h GLN 596 N 10.74 0.00 0.00 2.91 -0.00 -1.31 0.93 115.11 128.38 1k2m h GLN 596 Ca -0.42 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.20 1k2m h GLN 596 Cb 1.20 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.68 1k2m h GLN 596 CO 0.96 0.00 -0.12 0.78 -0.00 0.00 0.00 178.83 180.45 1k2m h GLY 597 N 0.00 0.00 -7.77 0.06 0.00 -1.88 -3.42 103.07 90.07 1k2m h GLY 597 Ca 0.63 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.31 1k2m h GLY 597 CO -0.01 0.00 -0.53 0.14 0.00 0.00 0.00 176.54 176.14 1k2m s VAL 598 N -3.78 5.12 -0.04 4.60 1.01 0.32 -5.06 120.40 122.57 1k2m s VAL 598 Ca -0.00 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.98 1k2m s VAL 598 Cb 0.10 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 33.04 1k2m s VAL 598 CO 0.59 0.21 0.05 0.21 0.00 0.00 0.00 175.10 176.15 1k2m s ASN 599 N 1.72 0.99 0.44 3.32 2.47 -1.26 -3.98 114.94 118.65 1k2m s ASN 599 Ca 0.07 0.06 -0.03 0.00 0.42 0.00 0.00 52.86 53.37 1k2m s ASN 599 Cb -0.16 -0.16 -0.03 0.00 -1.45 0.00 0.00 41.25 39.45 1k2m s ASN 599 CO 0.10 -0.22 0.71 -2.16 -3.72 0.00 0.00 177.10 171.81 1k2m s PRO 600 N 1.95 3.49 -0.33 0.43 0.04 -1.26 -5.02 135.00 134.31 1k2m s PRO 600 Ca 0.02 0.01 -0.20 0.00 0.04 0.00 0.00 61.00 60.88 1k2m s PRO 600 Cb -0.12 -2.47 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 1k2m s PRO 600 CO -0.03 -0.11 0.59 0.12 0.04 0.00 0.00 177.00 177.61 1k2m s PHE 601 N -2.61 3.19 -0.01 0.56 2.19 0.25 -4.87 117.98 116.68 1k2m s PHE 601 Ca 0.45 0.41 -0.16 0.00 0.33 0.00 0.00 56.93 57.96 1k2m s PHE 601 Cb -0.10 -2.99 -0.06 0.00 -1.31 0.00 0.00 43.02 38.56 1k2m s PHE 601 CO 0.42 -0.52 0.45 -0.06 1.83 0.00 0.00 175.22 177.34 1k2m s PHE 602 N 2.56 3.70 0.05 10.12 0.08 -1.26 0.98 117.98 134.20 1k2m s PHE 602 Ca 0.23 1.02 0.07 0.00 0.12 0.00 0.00 56.93 58.36 1k2m s PHE 602 Cb -0.15 -2.38 -0.03 0.00 -0.57 0.00 0.00 43.02 39.90 1k2m s PHE 602 CO 0.13 0.54 -0.19 0.42 -0.10 0.00 0.00 175.22 176.02 1k2m s ILE 603 N -0.74 1.49 -3.40 0.64 1.09 0.28 0.15 121.20 120.72 1k2m s ILE 603 Ca 0.25 -1.18 0.00 0.00 -1.10 0.00 0.00 60.65 58.62 1k2m s ILE 603 Cb -0.17 -1.32 0.00 0.00 -1.06 0.00 0.00 42.46 39.91 1k2m s ILE 603 CO 0.14 0.10 0.00 0.61 -0.10 0.00 0.00 174.94 175.69 1k2m n GLY 604 N 1.76 -1.98 0.00 6.18 0.00 -1.14 -1.91 105.19 108.09 1k2m n GLY 604 Ca -0.18 -1.18 0.13 0.00 0.00 0.00 0.00 46.02 44.80 1k2m n GLY 604 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1k2m n ARG 605 N -0.43 0.25 -3.71 1.61 0.63 -0.57 -1.10 116.66 113.34 1k2m n ARG 605 Ca 0.00 0.03 -0.36 0.00 -0.92 0.00 0.00 57.85 56.60 1k2m n ARG 605 Cb 0.00 -1.50 -0.07 0.00 0.45 0.00 0.00 32.46 31.34 1k2m n ARG 605 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1k2m s SER 606 N -2.73 6.34 0.62 6.15 0.01 -1.15 -4.78 113.70 118.16 1k2m s SER 606 Ca 0.22 0.40 0.32 0.00 1.31 0.00 0.00 55.95 58.19 1k2m s SER 606 Cb 0.18 -2.11 1.82 0.00 0.21 0.00 0.00 66.02 66.12 1k2m s SER 606 CO 0.45 0.23 2.14 -0.33 0.41 0.00 0.00 173.24 176.15 1k2m h GLU 607 N 6.11 0.00 -0.12 12.44 5.08 -1.88 -0.62 114.58 135.59 1k2m h GLU 607 Ca -0.45 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.94 1k2m h GLU 607 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 1k2m h GLU 607 CO 0.70 0.00 0.13 0.38 -1.00 0.00 0.00 179.01 179.23 1k2m h ASP 608 N 0.00 0.00 -3.45 1.42 3.04 -1.92 -3.41 116.42 112.11 1k2m h ASP 608 Ca 0.05 0.00 -0.53 0.00 -3.24 0.00 0.00 57.03 53.31 1k2m h ASP 608 Cb 0.37 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.65 1k2m h ASP 608 CO -0.00 0.00 0.40 0.00 -2.04 0.00 0.00 179.24 177.60 1k2m h ASN 610 N 6.24 0.08 -3.44 0.00 -0.26 -0.54 -3.37 115.58 114.28 1k2m h ASN 610 Ca -0.42 0.02 -0.67 0.00 -0.56 0.00 0.00 56.30 54.67 1k2m h ASN 610 Cb 1.22 0.01 -0.15 0.00 -1.06 0.00 0.00 38.32 38.33 1k2m h ASN 610 CO 0.75 -0.01 -0.66 0.00 -1.06 0.00 0.00 177.43 176.45 1k2m s LYS 612 N -1.26 2.69 -0.18 0.00 2.36 -1.26 -2.90 119.74 119.18 1k2m s LYS 612 Ca 0.17 -1.05 -0.04 0.00 -2.55 0.00 0.00 55.97 52.50 1k2m s LYS 612 Cb -0.11 -2.74 0.06 0.00 -1.05 0.00 0.00 37.83 33.99 1k2m s LYS 612 CO 0.06 -0.37 0.07 0.42 1.55 0.00 0.00 175.35 177.09 1k2m s ILE 613 N 1.22 0.13 -0.60 5.43 -1.09 -0.26 -4.96 121.20 121.08 1k2m s ILE 613 Ca -0.01 -0.34 -0.23 0.00 -2.23 0.00 0.00 60.65 57.84 1k2m s ILE 613 Cb -0.16 -0.76 0.05 0.00 -1.58 0.00 0.00 42.46 40.01 1k2m s ILE 613 CO -0.09 -0.28 0.95 -0.70 -1.23 0.00 0.00 174.94 173.59 1k2m s GLU 614 N 2.03 3.23 -0.17 2.79 2.12 -1.26 -2.63 118.70 124.81 1k2m s GLU 614 Ca 0.01 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 54.83 1k2m s GLU 614 Cb -0.16 -4.12 0.05 0.00 0.26 0.00 0.00 34.13 30.15 1k2m s GLU 614 CO -0.10 -1.62 -0.00 -0.51 -0.54 0.00 0.00 175.26 172.49 1k2m s ASP 615 N 3.18 2.82 0.48 -1.70 1.11 -1.26 -5.01 116.67 116.29 1k2m s ASP 615 Ca 0.27 -0.72 0.35 0.00 0.18 0.00 0.00 52.55 52.63 1k2m s ASP 615 Cb -0.14 -0.73 1.50 0.00 1.07 0.00 0.00 42.92 44.61 1k2m s ASP 615 CO 0.15 -0.25 1.65 -0.55 1.18 0.00 0.00 175.17 177.35 1k2m h ASN 616 N 8.19 0.16 0.11 0.27 7.08 -2.02 0.83 115.58 130.19 1k2m h ASN 616 Ca -0.19 0.08 -0.30 0.00 -3.08 0.00 0.00 56.30 52.81 1k2m h ASN 616 Cb 1.11 0.07 0.03 0.00 -2.08 0.00 0.00 38.32 37.45 1k2m h ASN 616 CO 0.35 -0.09 -1.22 0.03 -2.08 0.00 0.00 177.43 174.42 1k2m h ARG 617 N 0.08 0.64 -7.26 4.14 2.47 -2.00 -3.46 114.38 109.00 1k2m h ARG 617 Ca 0.80 -0.83 -0.52 0.00 -1.26 0.00 0.00 59.98 58.16 1k2m h ARG 617 Cb 2.75 0.27 0.19 0.00 -1.65 0.00 0.00 29.97 31.53 1k2m h ARG 617 CO -0.25 1.38 0.25 -0.51 0.56 0.00 0.00 179.97 181.40 1k2m s LEU 618 N -7.91 2.91 0.40 3.04 1.02 0.29 -4.87 118.68 113.55 1k2m s LEU 618 Ca -0.09 2.24 0.08 0.00 0.02 0.00 0.00 54.13 56.37 1k2m s LEU 618 Cb 0.06 -4.57 -0.04 0.00 0.02 0.00 0.00 46.19 41.65 1k2m s LEU 618 CO 0.93 -3.04 0.23 -0.44 0.02 0.00 0.00 176.35 174.06 1k2m s SER 619 N -2.54 4.69 0.28 2.29 0.01 -1.26 -4.77 113.70 112.40 1k2m s SER 619 Ca 0.68 -0.90 0.02 0.00 1.31 0.00 0.00 55.95 57.06 1k2m s SER 619 Cb -0.24 -0.57 0.68 0.00 0.21 0.00 0.00 66.02 66.10 1k2m s SER 619 CO 0.56 -0.52 1.68 0.03 0.41 0.00 0.00 173.24 175.40 1k2m h ARG 620 N 1.33 0.32 -2.20 12.44 3.08 -1.93 -1.32 114.38 126.09 1k2m h ARG 620 Ca -0.43 -0.02 -0.57 0.00 0.07 0.00 0.00 59.98 59.04 1k2m h ARG 620 Cb 1.26 -0.07 -0.41 0.00 0.08 0.00 0.00 29.97 30.82 1k2m h ARG 620 CO 0.64 0.21 -0.77 0.28 -1.07 0.00 0.00 179.97 179.26 1k2m n VAL 621 N -5.11 2.12 -0.20 2.04 0.31 -1.26 -2.94 118.33 113.29 1k2m n VAL 621 Ca 0.21 -5.25 0.00 0.00 -0.01 0.00 0.00 64.34 59.29 1k2m n VAL 621 Cb 0.63 -1.29 0.09 0.00 -0.91 0.00 0.00 33.84 32.37 1k2m n VAL 621 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1k2m h HIS 622 N 3.20 -0.05 -2.08 3.52 2.76 -1.01 -3.34 115.15 118.15 1k2m h HIS 622 Ca 0.13 0.04 0.10 0.00 -2.20 0.00 0.00 60.37 58.45 1k2m h HIS 622 Cb 0.64 0.11 -0.17 0.00 1.55 0.00 0.00 27.41 29.54 1k2m h HIS 622 CO 0.72 -0.16 0.50 0.00 -1.30 0.00 0.00 177.93 177.70 1k2m s PHE 624 N -2.56 0.05 -0.20 0.00 -0.12 0.33 0.10 117.98 115.57 1k2m s PHE 624 Ca 0.03 -0.12 -0.09 0.00 -0.05 0.00 0.00 56.93 56.70 1k2m s PHE 624 Cb -0.01 -0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.28 1k2m s PHE 624 CO -0.06 -0.20 0.10 0.42 -0.05 0.00 0.00 175.22 175.43 1k2m s ILE 625 N -1.03 5.04 -0.09 -4.49 1.01 0.27 0.20 121.20 122.11 1k2m s ILE 625 Ca -0.11 0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.64 1k2m s ILE 625 Cb -0.06 -3.30 -0.00 0.00 0.01 0.00 0.00 42.46 39.10 1k2m s ILE 625 CO 0.01 0.42 -0.24 0.12 0.00 0.00 0.00 174.94 175.25 1k2m s PHE 626 N 0.58 2.54 -0.12 3.97 5.36 0.52 0.87 117.98 131.71 1k2m s PHE 626 Ca 0.05 -0.96 -0.10 0.00 -0.96 0.00 0.00 56.93 54.96 1k2m s PHE 626 Cb -0.12 -1.69 -0.05 0.00 -0.34 0.00 0.00 43.02 40.82 1k2m s PHE 626 CO 0.01 -0.36 0.22 0.21 -1.46 0.00 0.00 175.22 173.84 1k2m s LYS 627 N 0.22 3.83 0.11 10.12 2.20 -1.26 0.18 119.74 135.13 1k2m s LYS 627 Ca -0.15 0.01 0.03 0.00 -0.36 0.00 0.00 55.97 55.50 1k2m s LYS 627 Cb -0.17 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1k2m s LYS 627 CO 0.08 0.57 -0.08 0.21 -0.36 0.00 0.00 175.35 175.77 1k2m s LYS 628 N -0.51 0.90 -0.27 4.03 2.36 0.24 -4.92 119.74 121.57 1k2m s LYS 628 Ca 0.16 -1.34 -0.29 0.00 -2.55 0.00 0.00 55.97 51.95 1k2m s LYS 628 Cb -0.13 -0.38 0.00 0.00 -1.05 0.00 0.00 37.83 36.27 1k2m s LYS 628 CO 0.05 0.03 1.26 0.50 1.55 0.00 0.00 175.35 178.74 1k2m s ARG 629 N -3.64 4.00 0.24 4.03 6.06 -1.26 0.20 118.95 128.58 1k2m s ARG 629 Ca 0.12 1.31 -0.31 0.00 -2.50 0.00 0.00 55.73 54.36 1k2m s ARG 629 Cb 0.03 -3.83 -0.11 0.00 0.06 0.00 0.00 34.95 31.09 1k2m s ARG 629 CO -0.02 -1.00 1.62 -1.58 -2.50 0.00 0.00 175.30 171.82 1k2m s HIS 630 N 4.09 2.88 0.00 5.12 5.65 0.50 -4.85 115.29 128.68 1k2m s HIS 630 Ca 0.54 0.62 0.00 0.00 0.25 0.00 0.00 55.06 56.47 1k2m s HIS 630 Cb -0.17 -4.05 0.00 0.00 -1.18 0.00 0.00 32.58 27.18 1k2m s HIS 630 CO 0.20 -3.75 0.00 0.00 -0.65 0.00 0.00 174.74 170.54 1k2m n ALA 631 N 3.15 0.00 -3.19 1.58 0.00 -1.26 -3.81 120.51 116.99 1k2m n ALA 631 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.45 1k2m n ALA 631 Cb 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.78 1k2m n ALA 631 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1k2m s VAL 632 N -0.56 0.04 0.00 0.00 0.11 -1.26 -4.37 120.40 114.36 1k2m s VAL 632 Ca 0.00 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 1k2m s VAL 632 Cb 0.00 -1.09 0.00 0.00 -1.53 0.00 0.00 36.38 33.76 1k2m s VAL 632 CO 0.00 -0.18 0.00 0.61 -3.33 0.00 0.00 175.10 172.20 1k2m n GLY 633 N -0.24 5.11 3.75 6.54 0.00 -1.26 -5.06 105.19 114.03 1k2m n GLY 633 Ca -0.17 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 1k2m n GLY 633 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k2m n LYS 634 N 0.00 2.71 -2.55 1.61 4.81 -1.26 -4.94 118.16 118.54 1k2m n LYS 634 Ca 0.00 0.96 -0.18 0.00 -0.87 0.00 0.00 58.31 58.22 1k2m n LYS 634 Cb 0.00 -2.74 0.02 0.00 0.02 0.00 0.00 35.03 32.32 1k2m n LYS 634 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1k2m n SER 635 N 2.04 3.23 -4.56 3.14 3.41 -1.26 -4.69 113.62 114.92 1k2m n SER 635 Ca 0.08 -3.24 -0.38 0.00 -0.26 0.00 0.00 58.87 55.07 1k2m n SER 635 Cb 0.37 -0.49 -0.03 0.00 -0.26 0.00 0.00 64.21 63.80 1k2m n SER 635 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1k2m s MET 636 N -3.37 2.48 0.00 4.33 0.00 -1.26 -4.06 119.30 117.42 1k2m s MET 636 Ca 0.39 1.39 0.00 0.00 0.00 0.00 0.00 55.69 57.47 1k2m s MET 636 Cb 0.42 -4.48 0.00 0.00 0.00 0.00 0.00 34.83 30.77 1k2m s MET 636 CO -0.08 -2.86 0.00 0.98 0.00 0.00 0.00 175.02 173.07 1k2m n TYR 637 N 14.14 0.00 -2.54 4.11 4.19 -1.26 -4.84 117.16 130.97 1k2m n TYR 637 Ca 0.32 0.00 -0.41 0.00 3.31 0.00 0.00 57.90 61.12 1k2m n TYR 637 Cb 0.52 0.00 -0.04 0.00 0.49 0.00 0.00 39.34 40.31 1k2m n TYR 637 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 1k2m s GLU 638 N 0.00 4.64 -0.44 2.98 2.12 -1.26 -5.01 118.70 121.74 1k2m s GLU 638 Ca 0.00 1.71 -0.22 0.00 0.36 0.00 0.00 54.97 56.82 1k2m s GLU 638 Cb 0.00 -3.25 0.02 0.00 0.26 0.00 0.00 34.13 31.16 1k2m s GLU 638 CO 0.00 0.18 0.70 0.45 -0.54 0.00 0.00 175.26 176.05 1k2m s SER 639 N -0.48 6.37 0.29 -1.70 0.15 -1.26 -4.52 113.70 112.55 1k2m s SER 639 Ca 0.47 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1k2m s SER 639 Cb -0.30 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.67 1k2m s SER 639 CO 0.36 -0.82 0.00 -0.81 1.20 0.00 0.00 173.24 173.17 1k2m n PRO 640 N 6.43 0.49 -0.28 5.44 -0.04 -1.26 -4.81 135.00 140.96 1k2m n PRO 640 Ca -0.00 0.00 0.34 0.00 -0.04 0.00 0.00 63.50 63.80 1k2m n PRO 640 Cb 0.48 0.00 0.72 0.00 -0.04 0.00 0.00 33.50 34.66 1k2m n PRO 640 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k2m h ALA 641 N -2.00 3.03 -0.07 0.55 0.00 -1.92 -3.44 119.26 115.41 1k2m h ALA 641 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1k2m h ALA 641 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1k2m h ALA 641 CO 0.00 -1.50 0.00 0.94 0.00 0.00 0.00 179.25 178.69 1k2m n GLN 642 N -3.93 0.00 0.00 0.00 7.27 -1.26 -3.36 117.38 116.11 1k2m n GLN 642 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.31 1k2m n GLN 642 Cb 1.28 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.93 1k2m n GLN 642 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1k2m n GLY 643 N 0.00 -1.79 0.00 1.69 0.00 -1.26 -4.49 105.19 99.34 1k2m n GLY 643 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 46.02 46.86 1k2m n GLY 643 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k2m n LEU 644 N 0.00 0.00 -4.41 0.99 4.32 -1.21 -4.85 117.00 111.84 1k2m n LEU 644 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.69 1k2m n LEU 644 Cb 0.00 0.00 -0.13 0.00 -1.62 0.00 0.00 43.42 41.67 1k2m n LEU 644 CO 0.00 0.00 -0.53 -1.81 -1.22 0.00 0.00 177.39 173.83 1k2m s ASP 645 N -0.39 3.50 0.22 -1.43 1.01 0.28 0.19 116.67 120.06 1k2m s ASP 645 Ca 0.00 -0.57 0.08 0.00 0.71 0.00 0.00 52.55 52.77 1k2m s ASP 645 Cb 0.00 -0.41 -0.05 0.00 1.01 0.00 0.00 42.92 43.47 1k2m s ASP 645 CO 0.00 0.23 -0.15 -1.81 0.21 0.00 0.00 175.17 173.65 1k2m s ASP 646 N -1.63 2.75 -0.22 0.27 1.01 0.55 -3.07 116.67 116.33 1k2m s ASP 646 Ca 0.14 -1.04 -0.05 0.00 0.71 0.00 0.00 52.55 52.32 1k2m s ASP 646 Cb -0.10 -0.17 -0.02 0.00 1.01 0.00 0.00 42.92 43.64 1k2m s ASP 646 CO 0.05 -0.15 -0.01 0.27 0.21 0.00 0.00 175.17 175.54 1k2m s ILE 647 N -2.90 3.75 -0.21 0.77 -4.36 -1.26 0.79 121.20 117.78 1k2m s ILE 647 Ca 0.24 -0.37 -0.07 0.00 -0.26 0.00 0.00 60.65 60.19 1k2m s ILE 647 Cb -0.01 -2.71 -0.03 0.00 1.25 0.00 0.00 42.46 40.96 1k2m s ILE 647 CO 0.09 0.41 0.05 0.26 0.24 0.00 0.00 174.94 175.98 1k2m s TRP 648 N 1.30 3.14 -0.32 1.37 0.52 0.48 0.46 118.94 125.88 1k2m s TRP 648 Ca 0.04 -0.20 -0.21 0.00 0.02 0.00 0.00 56.10 55.75 1k2m s TRP 648 Cb -0.15 -2.12 -0.00 0.00 -1.15 0.00 0.00 33.47 30.05 1k2m s TRP 648 CO 0.00 -0.10 0.66 -0.47 0.02 0.00 0.00 176.95 177.07 1k2m s TYR 649 N 0.89 3.19 -0.13 -1.98 5.04 0.55 0.20 117.35 125.11 1k2m s TYR 649 Ca 0.03 0.56 -0.06 0.00 -2.44 0.00 0.00 57.07 55.16 1k2m s TYR 649 Cb -0.14 -3.09 -0.04 0.00 0.35 0.00 0.00 41.96 39.05 1k2m s TYR 649 CO 0.02 -0.54 0.08 0.00 -1.34 0.00 0.00 175.55 173.77 1k2m s HIS 651 N -0.59 2.80 -0.40 0.00 2.46 0.52 0.12 115.29 120.20 1k2m s HIS 651 Ca 0.11 -1.21 0.04 0.00 0.47 0.00 0.00 55.06 54.47 1k2m s HIS 651 Cb -0.12 -1.93 0.10 0.00 -0.13 0.00 0.00 32.58 30.51 1k2m s HIS 651 CO 0.02 -0.59 1.00 0.25 -2.47 0.00 0.00 174.74 172.96 1k2m n THR 652 N 4.34 0.79 -3.16 0.89 -2.24 0.29 0.16 114.28 115.35 1k2m n THR 652 Ca -0.19 -0.90 -0.36 0.00 -2.27 0.00 0.00 64.05 60.33 1k2m n THR 652 Cb 0.51 0.62 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 1k2m n THR 652 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k2m s GLY 653 N -0.87 2.55 0.00 3.38 0.00 0.61 -4.76 107.32 108.23 1k2m s GLY 653 Ca 0.08 0.08 0.22 0.00 0.00 0.00 0.00 44.72 45.11 1k2m s GLY 653 CO 0.06 0.41 1.72 2.41 0.00 0.00 0.00 173.10 177.69 1k2m n THR 654 N 0.63 0.45 1.54 0.90 -1.04 -1.26 -2.80 114.28 112.70 1k2m n THR 654 Ca -0.02 0.11 0.12 0.00 -2.04 0.00 0.00 64.05 62.22 1k2m n THR 654 Cb 0.51 -0.73 0.54 0.00 -1.82 0.00 0.00 70.33 68.83 1k2m n THR 654 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1k2m n ASN 655 N -1.48 1.15 -1.76 8.00 3.02 -1.26 -4.92 115.26 118.01 1k2m n ASN 655 Ca 0.06 -1.49 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 1k2m n ASN 655 Cb 0.25 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1k2m n ASN 655 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1k2m n VAL 656 N -0.07 -4.10 -3.26 2.41 3.14 -1.12 -4.89 118.33 110.45 1k2m n VAL 656 Ca 0.18 1.56 -0.20 0.00 -2.96 0.00 0.00 64.34 62.92 1k2m n VAL 656 Cb 0.27 -2.19 0.00 0.00 -1.06 0.00 0.00 33.84 30.87 1k2m n VAL 656 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1k2m s SER 657 N -1.28 5.88 -0.12 6.55 1.04 -1.07 -4.73 113.70 119.97 1k2m s SER 657 Ca 0.00 -0.06 -0.00 0.00 0.48 0.00 0.00 55.95 56.37 1k2m s SER 657 Cb 0.00 -1.26 0.03 0.00 0.10 0.00 0.00 66.02 64.88 1k2m s SER 657 CO 0.00 -0.57 -0.09 -0.31 0.98 0.00 0.00 173.24 173.26 1k2m s TYR 658 N -2.32 1.63 -0.54 5.02 1.51 0.35 -1.80 117.35 121.19 1k2m s TYR 658 Ca 0.47 -0.86 -0.19 0.00 -1.01 0.00 0.00 57.07 55.49 1k2m s TYR 658 Cb -0.10 -1.31 0.08 0.00 -0.11 0.00 0.00 41.96 40.53 1k2m s TYR 658 CO 0.33 -0.55 0.63 -1.17 -1.11 0.00 0.00 175.55 173.69 1k2m s LEU 659 N 1.66 5.27 0.00 -1.29 1.98 -0.71 0.18 118.68 125.77 1k2m s LEU 659 Ca 0.05 -1.22 0.00 0.00 -2.89 0.00 0.00 54.13 50.07 1k2m s LEU 659 Cb -0.13 -2.35 0.00 0.00 0.66 0.00 0.00 46.19 44.37 1k2m s LEU 659 CO -0.09 -0.97 0.00 -3.20 -1.89 0.00 0.00 176.35 170.21 1k2m n ASN 660 N 6.12 0.00 0.00 3.68 2.85 -1.05 -1.13 115.26 125.72 1k2m n ASN 660 Ca -0.09 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.38 1k2m n ASN 660 Cb 0.44 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.46 1k2m n ASN 660 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1k2m n ASN 661 N 1.54 0.00 -4.87 1.20 3.02 -1.26 -5.00 115.26 109.89 1k2m n ASN 661 Ca 0.00 -0.79 -0.36 0.00 -0.03 0.00 0.00 54.58 53.39 1k2m n ASN 661 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1k2m n ASN 661 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1k2m s ASN 662 N 0.00 6.53 0.18 6.41 -0.87 -0.29 -5.08 114.94 121.81 1k2m s ASN 662 Ca 0.00 0.62 -0.23 0.00 -1.57 0.00 0.00 52.86 51.68 1k2m s ASN 662 Cb 0.00 -2.12 -0.08 0.00 -0.02 0.00 0.00 41.25 39.03 1k2m s ASN 662 CO 0.00 0.33 0.74 -0.60 -2.57 0.00 0.00 177.10 175.00 1k2m s ARG 663 N -1.32 4.42 -0.08 -0.60 3.52 -1.26 -1.73 118.95 121.90 1k2m s ARG 663 Ca 0.22 1.02 0.00 0.00 -0.13 0.00 0.00 55.73 56.84 1k2m s ARG 663 Cb -0.14 -3.12 0.02 0.00 -1.56 0.00 0.00 34.95 30.16 1k2m s ARG 663 CO 0.11 0.51 -0.07 -1.64 -0.81 0.00 0.00 175.30 173.40 1k2m s MET 664 N -1.44 1.31 0.28 5.12 -1.94 -0.75 -4.76 119.30 117.12 1k2m s MET 664 Ca 0.38 -0.22 -0.01 0.00 -1.71 0.00 0.00 55.69 54.13 1k2m s MET 664 Cb -0.20 -1.30 -0.04 0.00 2.01 0.00 0.00 34.83 35.30 1k2m s MET 664 CO 0.24 -0.15 0.48 0.96 -0.01 0.00 0.00 175.02 176.54 1k2m s ILE 665 N 1.29 5.13 -0.14 2.53 -4.36 -1.26 -2.58 121.20 121.80 1k2m s ILE 665 Ca -0.04 -0.34 -0.38 0.00 -0.26 0.00 0.00 60.65 59.63 1k2m s ILE 665 Cb -0.14 -3.79 -0.15 0.00 1.25 0.00 0.00 42.46 39.64 1k2m s ILE 665 CO -0.03 -0.36 1.70 1.67 0.24 0.00 0.00 174.94 178.16 1k2m n GLN 666 N -1.18 1.47 -0.23 0.37 7.27 -1.25 -1.89 117.38 121.94 1k2m n GLN 666 Ca -0.04 0.54 0.00 0.00 0.07 0.00 0.00 57.00 57.56 1k2m n GLN 666 Cb 0.55 -2.26 0.00 0.00 2.41 0.00 0.00 30.24 30.94 1k2m n GLN 666 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1k2m n GLY 667 N 3.92 1.40 3.39 1.69 0.00 0.44 -4.95 105.19 111.08 1k2m n GLY 667 Ca 0.24 -0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1k2m n GLY 667 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k2m s THR 668 N -2.00 2.13 0.21 2.61 -4.23 -0.79 0.21 115.64 113.78 1k2m s THR 668 Ca 0.00 -2.09 0.09 0.00 -1.18 0.00 0.00 61.69 58.51 1k2m s THR 668 Cb 0.00 -2.06 -0.05 0.00 1.34 0.00 0.00 72.50 71.74 1k2m s THR 668 CO 0.00 -0.30 -0.18 -1.59 -0.54 0.00 0.00 174.62 172.02 1k2m s LYS 669 N -3.00 1.42 -0.04 3.99 -2.85 -0.44 -0.36 119.74 118.46 1k2m s LYS 669 Ca 0.21 -1.58 -0.10 0.00 -1.00 0.00 0.00 55.97 53.50 1k2m s LYS 669 Cb -0.06 -1.40 0.02 0.00 -2.06 0.00 0.00 37.83 34.33 1k2m s LYS 669 CO 0.10 0.26 0.24 0.12 0.10 0.00 0.00 175.35 176.17 1k2m s PHE 670 N -2.49 -0.16 0.15 1.78 2.19 0.16 -2.31 117.98 117.30 1k2m s PHE 670 Ca 0.22 0.33 -0.31 0.00 0.33 0.00 0.00 56.93 57.50 1k2m s PHE 670 Cb -0.04 0.06 -0.09 0.00 -1.31 0.00 0.00 43.02 41.64 1k2m s PHE 670 CO 0.09 -0.26 1.46 -1.17 1.83 0.00 0.00 175.22 177.17 1k2m s LEU 671 N -0.75 4.37 -0.28 6.12 1.98 -1.26 0.21 118.68 129.07 1k2m s LEU 671 Ca -0.08 2.47 -0.05 0.00 -2.89 0.00 0.00 54.13 53.58 1k2m s LEU 671 Cb -0.05 -3.59 0.01 0.00 0.66 0.00 0.00 46.19 43.23 1k2m s LEU 671 CO 0.02 -0.72 0.04 -0.76 -1.89 0.00 0.00 176.35 173.03 1k2m s LEU 672 N 0.97 3.65 -0.15 -0.68 1.43 0.17 -4.83 118.68 119.25 1k2m s LEU 672 Ca 0.66 -0.76 -0.09 0.00 -1.03 0.00 0.00 54.13 52.91 1k2m s LEU 672 Cb -0.40 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 1k2m s LEU 672 CO 0.32 -0.17 0.17 -1.10 0.23 0.00 0.00 176.35 175.80 1k2m s GLN 673 N 1.44 3.83 -0.52 1.70 -0.21 -1.26 -4.45 119.66 120.20 1k2m s GLN 673 Ca 0.02 -0.10 -0.42 0.00 0.02 0.00 0.00 55.36 54.87 1k2m s GLN 673 Cb -0.17 -3.30 -0.19 0.00 1.00 0.00 0.00 33.01 30.35 1k2m s GLN 673 CO 0.00 0.54 2.18 -3.47 -2.12 0.00 0.00 175.29 172.42 1k2m n ASP 674 N 2.70 0.84 0.00 5.90 -0.08 0.76 -0.63 116.55 126.04 1k2m n ASP 674 Ca -0.17 0.62 0.00 0.00 -1.51 0.00 0.00 54.79 53.73 1k2m n ASP 674 Cb 0.53 -0.93 0.00 0.00 2.34 0.00 0.00 41.12 43.06 1k2m n ASP 674 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k2m n GLY 675 N 7.36 1.55 3.56 0.27 0.00 0.38 -4.86 105.19 113.45 1k2m n GLY 675 Ca 0.55 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.15 1k2m n GLY 675 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k2m s ASP 676 N -2.00 6.33 -0.45 1.61 -1.08 0.20 -4.77 116.67 116.51 1k2m s ASP 676 Ca 0.00 0.01 -0.18 0.00 -0.52 0.00 0.00 52.55 51.86 1k2m s ASP 676 Cb 0.00 -2.27 0.04 0.00 -1.46 0.00 0.00 42.92 39.22 1k2m s ASP 676 CO 0.00 -0.48 0.49 -0.70 0.52 0.00 0.00 175.17 175.00 1k2m s GLU 677 N 2.41 3.10 -0.11 4.34 2.12 -1.26 0.11 118.70 129.41 1k2m s GLU 677 Ca 0.19 -0.83 -0.03 0.00 0.36 0.00 0.00 54.97 54.66 1k2m s GLU 677 Cb -0.15 -4.01 -0.03 0.00 0.26 0.00 0.00 34.13 30.19 1k2m s GLU 677 CO 0.13 -0.96 0.01 0.42 -0.54 0.00 0.00 175.26 174.32 1k2m s ILE 678 N 2.23 4.36 -0.34 -3.70 1.01 0.27 -2.53 121.20 122.51 1k2m s ILE 678 Ca 0.12 -0.21 -0.19 0.00 0.00 0.00 0.00 60.65 60.37 1k2m s ILE 678 Cb -0.18 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.42 1k2m s ILE 678 CO 0.13 0.57 0.58 -0.75 0.00 0.00 0.00 174.94 175.46 1k2m s LYS 679 N -0.50 3.73 0.03 2.79 2.47 0.47 -0.62 119.74 128.11 1k2m s LYS 679 Ca 0.09 0.04 -0.06 0.00 -1.56 0.00 0.00 55.97 54.49 1k2m s LYS 679 Cb -0.12 -3.78 -0.29 0.00 -1.46 0.00 0.00 37.83 32.18 1k2m s LYS 679 CO 0.02 -0.64 0.98 0.82 0.16 0.00 0.00 175.35 176.69 1k2m h ILE 680 N 5.61 1.30 -2.39 5.43 2.04 -0.12 1.00 117.51 130.37 1k2m h ILE 680 Ca -0.27 -2.88 -0.06 0.00 1.00 0.00 0.00 64.86 62.65 1k2m h ILE 680 Cb 1.12 2.87 -0.24 0.00 -0.74 0.00 0.00 36.82 39.83 1k2m h ILE 680 CO 0.80 0.85 -0.16 -0.63 0.00 0.00 0.00 178.15 179.00 1k2m s ILE 681 N -2.63 -0.01 -0.05 -0.67 1.01 -1.09 -4.34 121.20 113.42 1k2m s ILE 681 Ca -0.07 0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.62 1k2m s ILE 681 Cb 0.06 -0.76 0.03 0.00 0.01 0.00 0.00 42.46 41.80 1k2m s ILE 681 CO 0.88 0.02 0.00 0.86 0.00 0.00 0.00 174.94 176.70 1k2m s TRP 682 N 1.36 0.50 -0.17 3.97 -0.00 -1.22 0.17 118.94 123.54 1k2m s TRP 682 Ca -0.09 -0.07 0.01 0.00 -0.00 0.00 0.00 56.10 55.95 1k2m s TRP 682 Cb -0.07 -0.61 0.03 0.00 -0.00 0.00 0.00 33.47 32.82 1k2m s TRP 682 CO -0.14 -0.22 -0.12 -0.51 -0.00 0.00 0.00 176.95 175.96 1k2m s ASP 683 N 1.51 3.03 0.07 5.86 1.11 0.18 -4.94 116.67 123.50 1k2m s ASP 683 Ca -0.02 -0.69 -0.20 0.00 0.18 0.00 0.00 52.55 51.82 1k2m s ASP 683 Cb -0.13 -1.20 -0.11 0.00 1.07 0.00 0.00 42.92 42.56 1k2m s ASP 683 CO -0.03 -0.10 1.48 0.11 1.18 0.00 0.00 175.17 177.81 1k2m h LYS 684 N 8.02 0.37 0.12 8.23 1.57 -1.94 0.81 116.57 133.74 1k2m h LYS 684 Ca -0.33 -0.13 -0.29 0.00 -1.87 0.00 0.00 60.65 58.03 1k2m h LYS 684 Cb 1.12 -0.03 0.03 0.00 0.08 0.00 0.00 32.23 33.43 1k2m h LYS 684 CO 0.50 0.59 -1.21 -0.91 -0.57 0.00 0.00 179.45 177.85 1k2m h ASN 685 N 0.11 0.86 1.07 0.86 2.35 -1.99 -3.27 115.58 115.56 1k2m h ASN 685 Ca 0.05 -0.83 0.00 0.00 -0.55 0.00 0.00 56.30 54.98 1k2m h ASN 685 Cb 0.44 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1k2m h ASN 685 CO 0.01 1.60 -0.30 -3.20 -1.65 0.00 0.00 177.43 173.89 1k2m n ASN 686 N -3.82 0.64 -1.14 5.81 4.05 -1.24 -4.91 115.26 114.64 1k2m n ASN 686 Ca -0.14 0.30 -0.15 0.00 0.45 0.00 0.00 54.58 55.04 1k2m n ASN 686 Cb 0.97 -0.27 -0.06 0.00 1.23 0.00 0.00 39.78 41.65 1k2m n ASN 686 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 1k2m n LYS 687 N -2.03 -1.44 -2.51 1.20 4.81 0.28 -4.90 118.16 113.58 1k2m n LYS 687 Ca 0.05 1.01 -0.42 0.00 -0.87 0.00 0.00 58.31 58.08 1k2m n LYS 687 Cb 0.41 -5.33 -0.03 0.00 0.02 0.00 0.00 35.03 30.10 1k2m n LYS 687 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1k2m s PHE 688 N -2.35 2.45 -0.18 5.64 5.36 -1.06 -4.81 117.98 123.03 1k2m s PHE 688 Ca 0.00 0.38 0.00 0.00 -0.96 0.00 0.00 56.93 56.35 1k2m s PHE 688 Cb 0.00 -4.49 0.01 0.00 -0.34 0.00 0.00 43.02 38.20 1k2m s PHE 688 CO 0.00 -1.79 -0.16 0.54 -1.46 0.00 0.00 175.22 172.35 1k2m s VAL 689 N 5.47 2.46 -0.16 3.12 0.11 -1.26 0.51 120.40 130.65 1k2m s VAL 689 Ca 0.45 -0.82 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 1k2m s VAL 689 Cb -0.09 -2.05 0.03 0.00 -1.53 0.00 0.00 36.38 32.74 1k2m s VAL 689 CO 0.24 0.51 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.76 1k2m s ILE 690 N 1.16 1.59 -0.12 7.04 -1.09 0.46 -2.20 121.20 128.04 1k2m s ILE 690 Ca 0.01 -0.70 -0.06 0.00 -2.23 0.00 0.00 60.65 57.68 1k2m s ILE 690 Cb -0.14 -1.52 0.05 0.00 -1.58 0.00 0.00 42.46 39.27 1k2m s ILE 690 CO -0.07 0.41 0.29 -0.83 -1.23 0.00 0.00 174.94 173.51 1k2m s GLY 691 N 1.47 -0.19 -0.01 6.18 0.00 -1.26 0.60 107.32 114.11 1k2m s GLY 691 Ca 0.04 1.14 0.04 0.00 0.00 0.00 0.00 44.72 45.94 1k2m s GLY 691 CO -0.10 1.39 -0.12 -1.36 0.00 0.00 0.00 173.10 172.91 1k2m s PHE 692 N 1.33 2.75 -0.31 1.90 0.08 0.20 -2.83 117.98 121.10 1k2m s PHE 692 Ca -0.09 -0.13 -0.11 0.00 0.12 0.00 0.00 56.93 56.72 1k2m s PHE 692 Cb -0.10 -1.59 -0.02 0.00 -0.57 0.00 0.00 43.02 40.74 1k2m s PHE 692 CO -0.10 0.28 0.20 0.21 -0.10 0.00 0.00 175.22 175.71 1k2m s LYS 693 N -1.16 3.59 -0.14 0.44 2.20 -1.13 -0.56 119.74 122.98 1k2m s LYS 693 Ca 0.14 -0.56 -0.29 0.00 -0.36 0.00 0.00 55.97 54.90 1k2m s LYS 693 Cb -0.11 -3.69 -0.01 0.00 -1.51 0.00 0.00 37.83 32.51 1k2m s LYS 693 CO 0.04 -0.35 0.99 0.08 -0.36 0.00 0.00 175.35 175.74 1k2m s VAL 694 N 1.70 4.78 -0.21 4.02 1.01 0.31 -1.19 120.40 130.82 1k2m s VAL 694 Ca 0.06 1.97 -0.01 0.00 0.00 0.00 0.00 61.98 64.01 1k2m s VAL 694 Cb -0.17 -4.28 0.06 0.00 0.00 0.00 0.00 36.38 31.99 1k2m s VAL 694 CO 0.09 -0.03 -0.01 -1.61 0.00 0.00 0.00 175.10 173.54 1k2m s GLU 695 N 2.29 1.19 -0.58 2.72 0.41 0.38 0.15 118.70 125.24 1k2m s GLU 695 Ca 0.46 -0.72 -0.27 0.00 -0.41 0.00 0.00 54.97 54.02 1k2m s GLU 695 Cb -0.17 -2.36 0.03 0.00 -1.78 0.00 0.00 34.13 29.85 1k2m s GLU 695 CO 0.14 -0.61 1.14 0.42 -0.49 0.00 0.00 175.26 175.86 1k2m s ILE 696 N 1.61 4.08 -0.16 -1.63 1.01 -1.26 0.01 121.20 124.86 1k2m s ILE 696 Ca -0.03 0.73 -0.11 0.00 0.00 0.00 0.00 60.65 61.23 1k2m s ILE 696 Cb -0.18 -4.70 -0.23 0.00 0.01 0.00 0.00 42.46 37.36 1k2m s ILE 696 CO -0.07 -1.33 0.25 0.59 0.00 0.00 0.00 174.94 174.39 1k2m n ASN 697 N 8.28 2.03 -4.61 3.58 5.03 -0.11 -4.91 115.26 124.54 1k2m n ASN 697 Ca 0.07 0.27 -0.33 0.00 0.87 0.00 0.00 54.58 55.45 1k2m n ASN 697 Cb 0.49 -0.87 -0.11 0.00 -1.02 0.00 0.00 39.78 38.27 1k2m n ASN 697 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1k2m s ASP 698 N -6.98 4.74 -0.41 6.41 -1.08 -1.04 -5.05 116.67 113.26 1k2m s ASP 698 Ca -0.26 -0.05 -0.03 0.00 -0.52 0.00 0.00 52.55 51.69 1k2m s ASP 698 Cb 0.07 -1.18 0.11 0.00 -1.46 0.00 0.00 42.92 40.46 1k2m s ASP 698 CO 0.69 0.33 0.21 0.42 0.52 0.00 0.00 175.17 177.34 1k2m s THR 699 N -0.91 3.32 -0.75 1.71 -4.23 -1.26 -4.61 115.64 108.91 1k2m s THR 699 Ca 0.15 -2.04 -0.05 0.00 -1.18 0.00 0.00 61.69 58.57 1k2m s THR 699 Cb -0.11 -3.27 -0.00 0.00 1.34 0.00 0.00 72.50 70.46 1k2m s THR 699 CO 0.05 -0.69 2.85 0.41 -0.54 0.00 0.00 174.62 176.70 1k2m n THR 700 N 4.61 3.92 -0.79 3.99 -1.04 -1.26 -4.43 114.28 119.28 1k2m n THR 700 Ca -0.03 -3.03 0.00 0.00 -2.04 0.00 0.00 64.05 58.95 1k2m n THR 700 Cb 0.41 -1.93 0.00 0.00 -1.82 0.00 0.00 70.33 67.00 1k2m n THR 700 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1k2m n GLY 701 N 1.74 1.21 3.73 3.41 0.00 -1.26 -4.86 105.19 109.16 1k2m n GLY 701 Ca 0.55 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.89 1k2m n GLY 701 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k2m s LEU 702 N -0.17 4.39 0.49 0.99 2.01 -1.26 0.10 118.68 125.23 1k2m s LEU 702 Ca 0.00 1.44 0.36 0.00 0.01 0.00 0.00 54.13 55.94 1k2m s LEU 702 Cb 0.00 -3.29 1.50 0.00 0.01 0.00 0.00 46.19 44.41 1k2m s LEU 702 CO 0.00 -0.10 1.66 2.19 1.01 0.00 0.00 176.35 181.11 1k2m h PHE 703 N 6.28 0.30 0.00 0.29 -0.00 -1.84 -3.37 116.94 118.60 1k2m h PHE 703 Ca -0.42 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.56 1k2m h PHE 703 Cb 1.21 -0.08 0.00 0.00 -0.00 0.00 0.00 35.95 37.08 1k2m h PHE 703 CO 0.66 -0.09 0.00 -1.71 -0.00 0.00 0.00 178.31 177.17 1k2m n ASN 704 N -4.39 -1.34 0.00 -0.68 5.15 -1.26 -4.93 115.26 107.80 1k2m n ASN 704 Ca 0.36 0.42 0.00 0.00 -0.60 0.00 0.00 54.58 54.76 1k2m n ASN 704 Cb 1.51 1.41 0.00 0.00 -0.53 0.00 0.00 39.78 42.17 1k2m n ASN 704 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1k2m n GLU 705 N -3.08 0.00 -2.44 1.20 0.28 -1.26 -4.96 120.64 110.38 1k2m n GLU 705 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.98 1k2m n GLU 705 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1k2m n GLU 705 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1k2m n GLY 706 N 0.00 -0.98 0.00 -1.84 0.00 -1.26 -2.17 105.19 98.94 1k2m n GLY 706 Ca 0.00 0.45 0.07 0.00 0.00 0.00 0.00 46.02 46.55 1k2m n GLY 706 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k2m n LEU 707 N -1.03 0.73 -2.90 0.99 7.99 -1.26 0.27 117.00 121.80 1k2m n LEU 707 Ca 0.03 -0.50 -0.00 0.00 -0.01 0.00 0.00 56.01 55.53 1k2m n LEU 707 Cb 0.41 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.72 1k2m n LEU 707 CO 0.32 0.18 -0.49 0.61 -1.51 0.00 0.00 177.39 176.50 1k2m n GLY 708 N 1.37 -2.67 3.49 -0.72 0.00 -1.26 -4.76 105.19 100.63 1k2m n GLY 708 Ca 0.03 0.34 -0.53 0.00 0.00 0.00 0.00 46.02 45.86 1k2m n GLY 708 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1k2m n MET 709 N 1.01 0.28 0.00 1.61 0.00 -1.26 -4.55 117.12 114.20 1k2m n MET 709 Ca -0.02 0.10 0.00 0.00 0.00 0.00 0.00 57.70 57.78 1k2m n MET 709 Cb 0.21 -1.44 0.00 0.00 0.00 0.00 0.00 33.22 31.99 1k2m n MET 709 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1k2m n LEU 710 N 1.79 0.00 0.00 3.17 4.32 -1.26 -3.81 117.00 121.21 1k2m n LEU 710 Ca 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.17 1k2m n LEU 710 Cb 0.17 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.97 1k2m n LEU 710 CO 0.59 -1.07 0.00 0.00 -1.22 0.00 0.00 177.39 175.69 1k2m n GLN 711 N -1.35 0.00 -3.83 3.23 10.64 -1.26 -4.59 117.38 120.23 1k2m n GLN 711 Ca 0.00 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.82 1k2m n GLN 711 Cb 0.00 -0.17 -0.12 0.00 -0.86 0.00 0.00 30.24 29.09 1k2m n GLN 711 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1k2m s GLU 712 N 0.00 1.98 -0.37 2.61 0.41 -1.26 -4.94 118.70 117.13 1k2m s GLU 712 Ca 0.00 -1.99 0.01 0.00 -0.41 0.00 0.00 54.97 52.58 1k2m s GLU 712 Cb 0.00 -3.52 0.10 0.00 -1.78 0.00 0.00 34.13 28.94 1k2m s GLU 712 CO 0.00 -1.06 0.12 -1.14 -0.49 0.00 0.00 175.26 172.68 1k2m s GLN 713 N 0.82 1.77 0.00 1.61 -0.44 -1.25 -5.02 119.66 117.15 1k2m s GLN 713 Ca 0.11 -1.82 0.00 0.00 -2.50 0.00 0.00 55.36 51.15 1k2m s GLN 713 Cb -0.22 -3.38 0.00 0.00 -1.64 0.00 0.00 33.01 27.77 1k2m s GLN 713 CO -0.05 -0.98 0.00 2.89 0.50 0.00 0.00 175.29 177.65 1k2m n ARG 714 N 4.43 0.00 -4.40 1.67 -4.01 -1.26 -4.66 116.66 108.43 1k2m n ARG 714 Ca 0.00 0.00 -0.22 0.00 -1.04 0.00 0.00 57.85 56.59 1k2m n ARG 714 Cb 0.42 0.00 -0.11 0.00 -3.04 0.00 0.00 32.46 29.73 1k2m n ARG 714 CO 0.00 0.00 0.00 0.14 -3.04 0.00 0.00 177.63 174.73 1k2m s VAL 715 N -0.12 2.10 -0.01 8.89 -7.23 -1.26 -5.01 120.40 117.76 1k2m s VAL 715 Ca 0.00 -2.19 -0.30 0.00 -1.81 0.00 0.00 61.98 57.68 1k2m s VAL 715 Cb 0.00 -2.10 -0.04 0.00 0.56 0.00 0.00 36.38 34.81 1k2m s VAL 715 CO 0.00 -0.39 1.09 -0.69 -0.31 0.00 0.00 175.10 174.79 1k2m s VAL 716 N -2.41 4.49 0.34 1.32 1.01 -1.26 -4.69 120.40 119.20 1k2m s VAL 716 Ca 0.23 1.79 0.09 0.00 0.00 0.00 0.00 61.98 64.09 1k2m s VAL 716 Cb -0.04 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 1k2m s VAL 716 CO 0.10 0.09 0.07 -0.76 0.00 0.00 0.00 175.10 174.61 1k2m s LEU 717 N 1.39 3.13 0.12 3.92 1.02 -0.98 -4.99 118.68 122.30 1k2m s LEU 717 Ca 0.54 -0.87 -0.17 0.00 0.02 0.00 0.00 54.13 53.66 1k2m s LEU 717 Cb -0.24 -1.56 -0.07 0.00 0.02 0.00 0.00 46.19 44.35 1k2m s LEU 717 CO 0.26 -0.25 0.57 -0.75 0.02 0.00 0.00 176.35 176.20 1k2m s LYS 718 N -3.77 4.09 0.73 1.70 2.20 -1.26 -1.32 119.74 122.09 1k2m s LYS 718 Ca 0.36 0.62 -0.12 0.00 -0.36 0.00 0.00 55.97 56.47 1k2m s LYS 718 Cb -0.02 -3.05 0.03 0.00 -1.51 0.00 0.00 37.83 33.29 1k2m s LYS 718 CO 0.21 0.53 1.09 -0.65 -0.36 0.00 0.00 175.35 176.17 1k2m s GLN 719 N -1.63 2.55 0.45 4.03 -0.21 0.13 -4.77 119.66 120.21 1k2m s GLN 719 Ca 0.35 1.18 0.00 0.00 0.02 0.00 0.00 55.36 56.91 1k2m s GLN 719 Cb -0.17 -1.93 0.00 0.00 1.00 0.00 0.00 33.01 31.91 1k2m s GLN 719 CO 0.19 -1.42 0.04 0.25 -2.12 0.00 0.00 175.29 172.23 1k2m n THR 720 N -3.14 0.00 0.03 -0.19 -2.24 -1.26 -4.97 114.28 102.51 1k2m n THR 720 Ca 0.09 -2.08 0.20 0.00 -2.27 0.00 0.00 64.05 59.99 1k2m n THR 720 Cb 0.53 0.37 0.71 0.00 -2.10 0.00 0.00 70.33 69.84 1k2m n THR 720 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k2m h ALA 721 N 1.17 2.40 -0.00 6.98 0.00 -1.98 -1.34 119.26 126.48 1k2m h ALA 721 Ca -0.36 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1k2m h ALA 721 Cb 1.12 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1k2m h ALA 721 CO 0.60 -0.63 -0.00 0.93 0.00 0.00 0.00 179.25 180.15 1k2m h GLU 722 N 0.00 0.00 0.06 0.00 5.08 -1.99 -1.78 114.58 115.95 1k2m h GLU 722 Ca 0.23 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1k2m h GLU 722 Cb 0.99 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1k2m h GLU 722 CO -0.00 0.35 -0.03 0.93 -1.00 0.00 0.00 179.01 179.26 1k2m h GLU 723 N -0.34 -0.08 -0.60 2.33 3.07 -1.67 -2.71 114.58 114.59 1k2m h GLU 723 Ca 0.00 0.01 0.12 0.00 -0.50 0.00 0.00 59.36 58.98 1k2m h GLU 723 Cb 0.35 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.24 1k2m h GLU 723 CO 0.00 0.13 0.40 -0.22 -1.40 0.00 0.00 179.01 177.93 1k2m h LYS 724 N -0.27 0.30 -0.42 2.33 3.64 -1.35 -0.27 116.57 120.53 1k2m h LYS 724 Ca -0.01 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1k2m h LYS 724 Cb 0.24 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1k2m h LYS 724 CO 0.01 0.20 -0.11 -0.44 -2.27 0.00 0.00 179.45 176.84 1k2m h ASP 725 N 0.31 0.73 -0.58 4.20 3.32 -1.01 0.73 116.42 124.12 1k2m h ASP 725 Ca 0.28 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 57.12 1k2m h ASP 725 Cb 0.68 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 1k2m h ASP 725 CO -0.07 0.87 0.38 -0.07 -1.72 0.00 0.00 179.24 178.64 1k2m h LEU 726 N 0.68 0.67 -0.09 1.55 3.38 -0.76 -2.56 115.31 118.17 1k2m h LEU 726 Ca 0.12 -0.02 -0.19 0.00 0.09 0.00 0.00 57.88 57.88 1k2m h LEU 726 Cb 0.58 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1k2m h LEU 726 CO 0.04 0.49 -0.89 1.62 0.09 0.00 0.00 178.44 179.79 1k2m h VAL 727 N 0.79 1.56 -0.45 1.22 3.04 -1.40 -3.23 116.25 117.78 1k2m h VAL 727 Ca 0.21 -3.11 0.12 0.00 -1.01 0.00 0.00 66.70 62.91 1k2m h VAL 727 Cb -0.09 2.71 -0.02 0.00 -2.01 0.00 0.00 31.29 31.88 1k2m h VAL 727 CO -0.05 0.87 0.32 0.50 -1.01 0.00 0.00 177.57 178.20 1k2m h LYS 728 N 0.00 0.06 0.00 4.17 3.11 -0.44 0.94 116.57 124.41 1k2m h LYS 728 Ca -0.01 -0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.72 1k2m h LYS 728 Cb 1.64 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 32.84 1k2m h LYS 728 CO 0.12 0.04 -0.89 0.87 -2.81 0.00 0.00 179.45 176.78 1k2m h LYS 729 N 0.07 0.00 0.00 1.90 1.57 -1.54 -3.51 116.57 115.06 1k2m h LYS 729 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1k2m h LYS 729 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1k2m h LYS 729 CO -0.02 0.29 0.00 -0.11 -0.57 0.00 0.00 179.45 179.05