#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2m h ASN 574 N 0.00 0.00 0.00 1.61 2.35 -2.04 -3.46 115.58 114.04 1k2m h ASN 574 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1k2m h ASN 574 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1k2m h ASN 574 CO 0.00 0.17 0.00 0.61 -1.65 0.00 0.00 177.43 176.56 1k2m n GLY 575 N 0.58 0.58 3.71 2.83 0.00 -1.26 -5.10 105.19 106.54 1k2m n GLY 575 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 2.93 0.04 1.61 3.00 -1.26 -0.41 118.95 124.86 1k2m s ARG 576 Ca 0.00 -0.51 0.00 0.00 -1.00 0.00 0.00 55.73 54.22 1k2m s ARG 576 Cb 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 34.95 32.19 1k2m s ARG 576 CO 0.00 0.66 0.00 0.34 0.00 0.00 0.00 175.30 176.30 1k2m n PHE 577 N 1.59 -0.32 -4.75 5.12 -0.00 -0.94 -4.23 117.46 113.93 1k2m n PHE 577 Ca -0.16 0.06 -0.32 0.00 -0.00 0.00 0.00 57.45 57.03 1k2m n PHE 577 Cb 0.53 0.34 -0.13 0.00 -0.00 0.00 0.00 39.48 40.22 1k2m n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1k2m s LEU 578 N -5.66 2.74 -0.19 -2.13 2.96 -1.06 -1.33 118.68 114.01 1k2m s LEU 578 Ca 0.00 -0.28 0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1k2m s LEU 578 Cb 0.00 -1.58 0.03 0.00 0.50 0.00 0.00 46.19 45.14 1k2m s LEU 578 CO 0.00 0.30 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.30 1k2m s THR 579 N -0.84 1.81 -0.40 3.68 2.01 0.10 0.17 115.64 122.17 1k2m s THR 579 Ca 0.14 -0.99 -0.12 0.00 0.31 0.00 0.00 61.69 61.02 1k2m s THR 579 Cb -0.11 -1.78 0.04 0.00 0.01 0.00 0.00 72.50 70.66 1k2m s THR 579 CO 0.03 0.30 0.25 -0.76 -0.69 0.00 0.00 174.62 173.76 1k2m s LEU 580 N 1.35 4.96 -0.47 4.42 1.43 0.35 0.14 118.68 130.87 1k2m s LEU 580 Ca 0.01 -1.08 -0.05 0.00 -1.03 0.00 0.00 54.13 51.97 1k2m s LEU 580 Cb -0.15 -2.06 0.12 0.00 0.03 0.00 0.00 46.19 44.13 1k2m s LEU 580 CO -0.10 -0.45 0.30 -0.54 0.23 0.00 0.00 176.35 175.79 1k2m s LYS 581 N 1.57 2.28 -0.49 1.70 1.02 0.16 0.22 119.74 126.21 1k2m s LYS 581 Ca 0.03 -1.92 -0.34 0.00 0.02 0.00 0.00 55.97 53.76 1k2m s LYS 581 Cb -0.20 -3.74 -0.13 0.00 -0.52 0.00 0.00 37.83 33.23 1k2m s LYS 581 CO 0.07 -1.14 2.30 -2.30 -0.92 0.00 0.00 175.35 173.37 1k2m n PRO 582 N 4.52 0.81 -1.77 -1.68 -0.02 0.94 -2.03 135.00 135.77 1k2m n PRO 582 Ca -0.02 0.17 -0.32 0.00 -2.02 0.00 0.00 63.50 61.31 1k2m n PRO 582 Cb 0.41 -2.38 0.04 0.00 -0.02 0.00 0.00 33.50 31.54 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 8.24 3.30 0.60 2.45 2.34 -0.89 -1.58 118.68 133.14 1k2m s LEU 583 Ca 1.13 1.74 0.29 0.00 0.06 0.00 0.00 54.13 57.35 1k2m s LEU 583 Cb -0.87 -4.52 1.61 0.00 -0.56 0.00 0.00 46.19 41.85 1k2m s LEU 583 CO 0.47 -1.37 2.01 1.55 -1.06 0.00 0.00 176.35 177.95 1k2m h PRO 584 N -0.19 0.00 0.00 1.48 0.13 -1.90 0.09 132.00 131.61 1k2m h PRO 584 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 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 -0.02 -0.44 -0.23 0.00 0.00 178.00 177.87 1k2m h ASP 585 N 0.00 0.00 -2.80 1.44 5.19 -1.92 -3.42 116.42 114.91 1k2m h ASP 585 Ca 0.12 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.99 1k2m h ASP 585 Cb 0.76 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.25 1k2m h ASP 585 CO -0.00 0.02 -0.37 -0.55 -3.12 0.00 0.00 179.24 175.22 1k2m s SER 586 N -5.67 6.38 0.65 6.45 0.15 0.02 -4.86 113.70 116.81 1k2m s SER 586 Ca -0.04 0.35 0.26 0.00 0.70 0.00 0.00 55.95 57.22 1k2m s SER 586 Cb 0.13 -1.99 1.39 0.00 -1.71 0.00 0.00 66.02 63.84 1k2m s SER 586 CO 0.49 0.00 1.79 0.16 1.20 0.00 0.00 173.24 176.89 1k2m h ILE 587 N 1.63 0.09 -3.67 6.45 3.07 -1.80 -3.35 117.51 119.93 1k2m h ILE 587 Ca -0.48 0.00 -0.65 0.00 1.55 0.00 0.00 64.86 65.28 1k2m h ILE 587 Cb 1.19 0.56 -0.22 0.00 -0.27 0.00 0.00 36.82 38.08 1k2m h ILE 587 CO 0.69 0.00 -0.60 -0.63 -1.05 0.00 0.00 178.15 176.56 1k2m s ILE 588 N -4.22 4.47 -0.65 0.16 1.01 -1.26 -5.01 121.20 115.70 1k2m s ILE 588 Ca -0.03 -0.21 0.04 0.00 0.00 0.00 0.00 60.65 60.45 1k2m s ILE 588 Cb 0.09 -3.15 0.34 0.00 0.01 0.00 0.00 42.46 39.76 1k2m s ILE 588 CO 0.31 0.26 1.10 0.00 0.00 0.00 0.00 174.94 176.61 1k2m n GLN 589 N 4.95 3.60 -4.56 2.79 6.02 -1.26 -3.80 117.38 125.13 1k2m n GLN 589 Ca -0.15 -4.82 -0.26 0.00 -0.01 0.00 0.00 57.00 51.76 1k2m n GLN 589 Cb 0.51 -2.28 -0.10 0.00 1.02 0.00 0.00 30.24 29.39 1k2m n GLN 589 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1k2m s GLU 590 N -3.62 1.87 -0.07 -1.09 2.02 -0.62 -4.88 118.70 112.31 1k2m s GLU 590 Ca 0.47 -2.09 0.04 0.00 0.02 0.00 0.00 54.97 53.41 1k2m s GLU 590 Cb 0.27 -1.15 0.00 0.00 0.10 0.00 0.00 34.13 33.35 1k2m s GLU 590 CO -0.14 -0.22 -0.19 -1.12 0.02 0.00 0.00 175.26 173.61 1k2m s SER 591 N -3.63 2.45 0.01 -0.19 0.01 -1.26 -0.04 113.70 111.04 1k2m s SER 591 Ca 0.29 -0.42 0.04 0.00 1.31 0.00 0.00 55.95 57.17 1k2m s SER 591 Cb 0.07 -1.00 -0.03 0.00 0.21 0.00 0.00 66.02 65.27 1k2m s SER 591 CO 0.14 0.12 -0.10 -0.76 0.41 0.00 0.00 173.24 173.05 1k2m s LEU 592 N 0.34 2.98 -0.18 2.44 1.43 0.60 -4.93 118.68 121.35 1k2m s LEU 592 Ca -0.13 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1k2m s LEU 592 Cb -0.16 -1.71 0.03 0.00 0.03 0.00 0.00 46.19 44.39 1k2m s LEU 592 CO 0.05 0.28 -0.12 -1.61 0.23 0.00 0.00 176.35 175.19 1k2m s GLU 593 N -1.34 2.18 -0.49 1.70 2.02 -1.26 0.13 118.70 121.63 1k2m s GLU 593 Ca 0.16 -0.76 -0.28 0.00 0.02 0.00 0.00 54.97 54.12 1k2m s GLU 593 Cb -0.11 -2.33 0.03 0.00 0.10 0.00 0.00 34.13 31.82 1k2m s GLU 593 CO 0.06 -0.35 1.07 0.42 0.02 0.00 0.00 175.26 176.48 1k2m s ILE 594 N 1.41 4.27 -0.14 -1.63 1.01 0.46 -4.96 121.20 121.61 1k2m s ILE 594 Ca 0.01 0.98 -0.29 0.00 0.00 0.00 0.00 60.65 61.35 1k2m s ILE 594 Cb -0.15 -4.57 -0.05 0.00 0.01 0.00 0.00 42.46 37.70 1k2m s ILE 594 CO -0.09 -1.01 1.83 -1.10 0.00 0.00 0.00 174.94 174.57 1k2m s GLN 595 N 4.29 3.77 0.54 2.79 1.11 -1.26 -2.22 119.66 128.68 1k2m s GLN 595 Ca 0.43 2.02 0.39 0.00 0.01 0.00 0.00 55.36 58.21 1k2m s GLN 595 Cb -0.08 -4.13 1.57 0.00 -1.01 0.00 0.00 33.01 29.35 1k2m s GLN 595 CO 0.29 -1.34 1.75 -0.56 0.01 0.00 0.00 175.29 175.44 1k2m h GLN 596 N 11.51 0.02 0.00 2.91 -0.00 -0.97 1.12 115.11 129.69 1k2m h GLN 596 Ca -0.40 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.25 1k2m h GLN 596 Cb 1.19 -0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.67 1k2m h GLN 596 CO 0.97 0.01 -0.01 0.78 -0.00 0.00 0.00 178.83 180.59 1k2m h GLY 597 N 0.02 0.00 -7.76 0.06 0.00 -1.88 -3.41 103.07 90.10 1k2m h GLY 597 Ca 0.65 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.33 1k2m h GLY 597 CO -0.03 0.00 -0.53 0.14 0.00 0.00 0.00 176.54 176.11 1k2m s VAL 598 N -3.78 5.10 -0.04 4.60 1.01 0.39 -5.06 120.40 122.62 1k2m s VAL 598 Ca -0.00 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 1k2m s VAL 598 Cb 0.10 -3.47 0.03 0.00 0.00 0.00 0.00 36.38 33.04 1k2m s VAL 598 CO 0.52 0.21 0.05 0.21 0.00 0.00 0.00 175.10 176.08 1k2m s ASN 599 N 1.72 1.05 0.44 3.32 2.47 -1.26 -3.98 114.94 118.69 1k2m s ASN 599 Ca 0.07 0.05 -0.03 0.00 0.42 0.00 0.00 52.86 53.37 1k2m s ASN 599 Cb -0.16 -0.17 -0.03 0.00 -1.45 0.00 0.00 41.25 39.43 1k2m s ASN 599 CO 0.09 -0.22 0.70 -2.16 -3.72 0.00 0.00 177.10 171.79 1k2m s PRO 600 N 1.98 3.47 -0.32 0.43 0.04 -1.26 -5.03 135.00 134.30 1k2m s PRO 600 Ca 0.03 -0.03 -0.19 0.00 0.04 0.00 0.00 61.00 60.84 1k2m s PRO 600 Cb -0.12 -2.48 -0.01 0.00 0.04 0.00 0.00 34.50 31.93 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 -2.60 3.20 -0.01 0.56 5.36 0.25 -4.86 117.98 119.88 1k2m s PHE 601 Ca 0.45 0.45 -0.16 0.00 -0.96 0.00 0.00 56.93 56.72 1k2m s PHE 601 Cb -0.10 -2.97 -0.06 0.00 -0.34 0.00 0.00 43.02 39.55 1k2m s PHE 601 CO 0.41 -0.50 0.44 -0.06 -1.46 0.00 0.00 175.22 174.06 1k2m s PHE 602 N 2.55 3.71 0.01 10.12 0.08 -1.26 0.88 117.98 134.06 1k2m s PHE 602 Ca 0.23 1.01 0.05 0.00 0.12 0.00 0.00 56.93 58.34 1k2m s PHE 602 Cb -0.15 -2.35 -0.01 0.00 -0.57 0.00 0.00 43.02 39.93 1k2m s PHE 602 CO 0.12 0.57 -0.15 0.42 -0.10 0.00 0.00 175.22 176.09 1k2m s ILE 603 N -0.84 1.15 -4.28 0.64 1.09 0.57 0.16 121.20 119.68 1k2m s ILE 603 Ca 0.25 -0.75 0.00 0.00 -1.10 0.00 0.00 60.65 59.05 1k2m s ILE 603 Cb -0.17 -0.98 0.00 0.00 -1.06 0.00 0.00 42.46 40.25 1k2m s ILE 603 CO 0.14 0.23 0.00 0.61 -0.10 0.00 0.00 174.94 175.81 1k2m n GLY 604 N 2.45 -1.39 0.02 6.18 0.00 -1.17 -0.72 105.19 110.56 1k2m n GLY 604 Ca -0.15 -1.17 0.14 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.02 1.02 -3.62 1.61 0.63 0.03 -0.19 116.66 116.13 1k2m n ARG 605 Ca 0.00 -0.03 -0.38 0.00 -0.92 0.00 0.00 57.85 56.52 1k2m n ARG 605 Cb 0.00 -1.43 -0.11 0.00 0.45 0.00 0.00 32.46 31.37 1k2m n ARG 605 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1k2m s SER 606 N -1.86 5.85 0.61 6.15 0.15 -0.85 -4.77 113.70 118.98 1k2m s SER 606 Ca 0.41 -0.07 0.28 0.00 0.70 0.00 0.00 55.95 57.27 1k2m s SER 606 Cb 0.19 -2.08 1.45 0.00 -1.71 0.00 0.00 66.02 63.87 1k2m s SER 606 CO 0.32 -0.06 1.86 1.05 1.20 0.00 0.00 173.24 177.61 1k2m h GLU 607 N 8.35 0.00 0.00 5.44 4.11 -1.88 0.50 114.58 131.10 1k2m h GLU 607 Ca -0.35 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.07 1k2m h GLU 607 Cb 1.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1k2m h GLU 607 CO 0.56 0.00 -0.05 0.22 0.07 0.00 0.00 179.01 179.81 1k2m h ASP 608 N 0.00 0.00 -3.05 3.06 1.82 -1.92 -3.42 116.42 112.91 1k2m h ASP 608 Ca 0.18 0.00 -0.53 0.00 -0.39 0.00 0.00 57.03 56.29 1k2m h ASP 608 Cb 1.18 0.00 0.01 0.00 0.68 0.00 0.00 39.33 41.20 1k2m h ASP 608 CO -0.00 0.05 0.69 0.00 -1.61 0.00 0.00 179.24 178.36 1k2m h ASN 610 N 7.05 0.21 -3.25 0.00 -0.26 -1.01 -3.36 115.58 114.96 1k2m h ASN 610 Ca -0.41 0.10 -0.67 0.00 -0.56 0.00 0.00 56.30 54.76 1k2m h ASN 610 Cb 1.20 0.08 -0.14 0.00 -1.06 0.00 0.00 38.32 38.41 1k2m h ASN 610 CO 0.85 -0.10 -0.61 0.00 -1.06 0.00 0.00 177.43 176.51 1k2m s LYS 612 N -1.09 2.52 -0.20 0.00 1.02 -1.26 -3.03 119.74 117.71 1k2m s LYS 612 Ca 0.15 -1.19 -0.04 0.00 0.02 0.00 0.00 55.97 54.91 1k2m s LYS 612 Cb -0.11 -3.09 0.07 0.00 -0.52 0.00 0.00 37.83 34.17 1k2m s LYS 612 CO 0.05 -0.55 0.07 0.42 -0.92 0.00 0.00 175.35 174.42 1k2m s ILE 613 N 1.25 0.17 -0.42 2.17 -1.09 0.73 -4.94 121.20 119.08 1k2m s ILE 613 Ca -0.04 -0.41 -0.11 0.00 -2.23 0.00 0.00 60.65 57.85 1k2m s ILE 613 Cb -0.19 -0.82 0.06 0.00 -1.58 0.00 0.00 42.46 39.93 1k2m s ILE 613 CO -0.03 -0.32 0.28 -1.61 -1.23 0.00 0.00 174.94 172.04 1k2m s GLU 614 N 2.01 2.77 -0.08 2.79 8.01 -1.26 -0.79 118.70 132.16 1k2m s GLU 614 Ca 0.02 -1.31 0.01 0.00 0.01 0.00 0.00 54.97 53.70 1k2m s GLU 614 Cb -0.16 -3.86 0.02 0.00 -4.31 0.00 0.00 34.13 25.82 1k2m s GLU 614 CO -0.12 -0.89 -0.08 0.34 0.01 0.00 0.00 175.26 174.51 1k2m s ASP 615 N 2.06 1.74 0.47 -0.19 -1.08 -1.26 -5.01 116.67 113.39 1k2m s ASP 615 Ca 0.03 -0.25 0.33 0.00 -0.52 0.00 0.00 52.55 52.13 1k2m s ASP 615 Cb -0.22 -0.73 1.45 0.00 -1.46 0.00 0.00 42.92 41.96 1k2m s ASP 615 CO 0.05 -0.05 1.66 0.78 0.52 0.00 0.00 175.17 178.13 1k2m h ASN 616 N 7.50 0.20 0.16 -0.34 2.35 -2.02 1.07 115.58 124.51 1k2m h ASN 616 Ca -0.31 0.09 -0.28 0.00 -0.55 0.00 0.00 56.30 55.24 1k2m h ASN 616 Cb 1.16 0.07 0.02 0.00 0.05 0.00 0.00 38.32 39.62 1k2m h ASN 616 CO 0.44 -0.09 -1.17 0.03 -1.65 0.00 0.00 177.43 174.99 1k2m h ARG 617 N 0.10 0.59 -7.21 0.81 2.47 -2.01 -3.46 114.38 105.68 1k2m h ARG 617 Ca 0.77 -0.75 -0.53 0.00 -1.26 0.00 0.00 59.98 58.21 1k2m h ARG 617 Cb 2.58 0.24 0.19 0.00 -1.65 0.00 0.00 29.97 31.33 1k2m h ARG 617 CO -0.27 1.33 0.23 1.28 0.56 0.00 0.00 179.97 183.09 1k2m n LEU 618 N -3.78 3.62 -4.76 3.04 4.32 0.37 -4.81 117.00 115.01 1k2m n LEU 618 Ca -0.12 0.49 -0.23 0.00 -0.02 0.00 0.00 56.01 56.13 1k2m n LEU 618 Cb 0.95 -1.48 -0.06 0.00 -1.62 0.00 0.00 43.42 41.22 1k2m n LEU 618 CO 0.57 -2.04 -0.19 -0.55 -1.22 0.00 0.00 177.39 173.96 1k2m s SER 619 N -2.38 4.87 0.17 -1.43 0.15 -1.26 -4.75 113.70 109.08 1k2m s SER 619 Ca 0.69 -0.65 -0.24 0.00 0.70 0.00 0.00 55.95 56.46 1k2m s SER 619 Cb -0.26 -0.86 0.07 0.00 -1.71 0.00 0.00 66.02 63.26 1k2m s SER 619 CO 0.55 -0.25 1.58 0.08 1.20 0.00 0.00 173.24 176.41 1k2m h ARG 620 N 1.52 -0.21 -2.35 5.44 0.11 -1.93 -0.55 114.38 116.41 1k2m h ARG 620 Ca -0.44 0.01 -0.70 0.00 0.10 0.00 0.00 59.98 58.95 1k2m h ARG 620 Cb 1.25 0.05 -0.35 0.00 1.11 0.00 0.00 29.97 32.03 1k2m h ARG 620 CO 0.62 -0.14 0.16 0.28 0.10 0.00 0.00 179.97 180.99 1k2m n VAL 621 N -5.42 4.38 -0.24 0.08 0.31 -1.26 -2.02 118.33 114.16 1k2m n VAL 621 Ca 0.02 -5.73 0.04 0.00 -0.01 0.00 0.00 64.34 58.66 1k2m n VAL 621 Cb 0.35 -1.65 0.13 0.00 -0.91 0.00 0.00 33.84 31.76 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 3.94 -0.09 -2.13 3.52 2.76 -0.49 -3.29 115.15 119.37 1k2m h HIS 622 Ca 0.29 0.05 0.09 0.00 -2.20 0.00 0.00 60.37 58.61 1k2m h HIS 622 Cb 0.48 0.15 -0.17 0.00 1.55 0.00 0.00 27.41 29.42 1k2m h HIS 622 CO 1.02 -0.23 0.48 0.00 -1.30 0.00 0.00 177.93 177.90 1k2m s PHE 624 N -2.57 -0.08 -0.18 0.00 -0.12 0.36 0.21 117.98 115.60 1k2m s PHE 624 Ca 0.02 0.18 -0.09 0.00 -0.05 0.00 0.00 56.93 57.00 1k2m s PHE 624 Cb -0.01 0.01 -0.05 0.00 -0.63 0.00 0.00 43.02 42.35 1k2m s PHE 624 CO -0.06 -0.15 0.10 0.42 -0.05 0.00 0.00 175.22 175.48 1k2m s ILE 625 N -0.47 5.16 -0.07 -4.49 1.01 0.25 0.17 121.20 122.76 1k2m s ILE 625 Ca -0.06 0.10 0.04 0.00 0.00 0.00 0.00 60.65 60.73 1k2m s ILE 625 Cb -0.04 -3.33 -0.00 0.00 0.01 0.00 0.00 42.46 39.11 1k2m s ILE 625 CO 0.01 0.47 -0.21 0.12 0.00 0.00 0.00 174.94 175.32 1k2m s PHE 626 N 0.19 2.20 -0.12 3.97 5.36 0.55 0.88 117.98 131.00 1k2m s PHE 626 Ca 0.07 -0.77 -0.10 0.00 -0.96 0.00 0.00 56.93 55.16 1k2m s PHE 626 Cb -0.12 -1.48 -0.05 0.00 -0.34 0.00 0.00 43.02 41.04 1k2m s PHE 626 CO -0.01 -0.29 0.22 0.21 -1.46 0.00 0.00 175.22 173.89 1k2m s LYS 627 N 0.19 3.80 0.09 10.12 2.20 -1.26 0.17 119.74 135.05 1k2m s LYS 627 Ca -0.11 -0.00 0.02 0.00 -0.36 0.00 0.00 55.97 55.51 1k2m s LYS 627 Cb -0.15 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.85 1k2m s LYS 627 CO 0.05 0.59 -0.07 0.21 -0.36 0.00 0.00 175.35 175.77 1k2m s LYS 628 N -0.54 0.80 -0.35 4.03 2.36 0.17 -4.93 119.74 121.27 1k2m s LYS 628 Ca 0.16 -1.26 -0.29 0.00 -2.55 0.00 0.00 55.97 52.03 1k2m s LYS 628 Cb -0.13 -0.22 0.01 0.00 -1.05 0.00 0.00 37.83 36.44 1k2m s LYS 628 CO 0.05 -0.01 1.26 -0.98 1.55 0.00 0.00 175.35 177.22 1k2m s ARG 629 N -3.53 3.84 -0.04 4.03 1.04 -1.26 0.19 118.95 123.22 1k2m s ARG 629 Ca 0.09 1.05 -0.30 0.00 -1.04 0.00 0.00 55.73 55.53 1k2m s ARG 629 Cb 0.03 -3.89 -0.05 0.00 -2.04 0.00 0.00 34.95 29.00 1k2m s ARG 629 CO -0.04 -1.22 1.46 -1.58 -0.04 0.00 0.00 175.30 173.89 1k2m s HIS 630 N 4.49 2.59 0.00 5.89 5.65 0.50 -4.84 115.29 129.57 1k2m s HIS 630 Ca 0.54 0.65 0.00 0.00 0.25 0.00 0.00 55.06 56.50 1k2m s HIS 630 Cb -0.14 -3.73 0.00 0.00 -1.18 0.00 0.00 32.58 27.54 1k2m s HIS 630 CO 0.25 -2.80 0.00 0.00 -0.65 0.00 0.00 174.74 171.54 1k2m n ALA 631 N 6.05 0.00 -1.91 1.58 0.00 -1.26 -2.54 120.51 122.42 1k2m n ALA 631 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.29 1k2m n ALA 631 Cb 0.43 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.01 1k2m n ALA 631 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1k2m s VAL 632 N 0.00 2.01 -0.64 0.00 -7.23 -1.26 -4.93 120.40 108.35 1k2m s VAL 632 Ca 0.00 -0.01 -0.26 0.00 -1.81 0.00 0.00 61.98 59.90 1k2m s VAL 632 Cb 0.00 -3.00 -0.04 0.00 0.56 0.00 0.00 36.38 33.90 1k2m s VAL 632 CO 0.00 0.00 2.04 -0.83 -0.31 0.00 0.00 175.10 176.00 1k2m s GLY 633 N -4.70 -0.03 0.56 2.32 0.00 -1.26 -4.68 107.32 99.54 1k2m s GLY 633 Ca 0.66 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.75 1k2m s GLY 633 CO 0.50 3.66 0.00 1.17 0.00 0.00 0.00 173.10 178.43 1k2m n LYS 634 N 9.07 -3.69 -1.40 2.90 4.81 -1.26 -4.55 118.16 124.05 1k2m n LYS 634 Ca 0.29 2.90 -0.30 0.00 -0.87 0.00 0.00 58.31 60.33 1k2m n LYS 634 Cb 0.51 -3.73 0.03 0.00 0.02 0.00 0.00 35.03 31.87 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 -2.93 7.10 -4.61 3.14 3.41 -1.26 -4.96 113.62 113.52 1k2m n SER 635 Ca -0.02 -3.50 -0.43 0.00 -0.26 0.00 0.00 58.87 54.66 1k2m n SER 635 Cb 0.50 -1.08 -0.03 0.00 -0.26 0.00 0.00 64.21 63.35 1k2m n SER 635 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1k2m s MET 636 N -2.94 3.43 0.00 4.33 -1.94 -1.26 -4.07 119.30 116.86 1k2m s MET 636 Ca 0.53 1.67 0.00 0.00 -1.71 0.00 0.00 55.69 56.18 1k2m s MET 636 Cb 0.40 -4.20 0.00 0.00 2.01 0.00 0.00 34.83 33.04 1k2m s MET 636 CO -0.15 -1.74 0.00 0.98 -0.01 0.00 0.00 175.02 174.10 1k2m n TYR 637 N 10.04 0.00 -2.56 -0.03 4.19 -1.26 -4.85 117.16 122.69 1k2m n TYR 637 Ca 0.23 0.00 -0.38 0.00 3.31 0.00 0.00 57.90 61.06 1k2m n TYR 637 Cb 0.46 0.00 -0.05 0.00 0.49 0.00 0.00 39.34 40.24 1k2m n TYR 637 CO 0.00 0.00 0.00 -1.21 0.91 0.00 0.00 176.86 176.56 1k2m s GLU 638 N 0.00 4.44 -0.53 2.98 0.41 -1.26 -5.03 118.70 119.72 1k2m s GLU 638 Ca 0.00 1.60 -0.00 0.00 -0.41 0.00 0.00 54.97 56.15 1k2m s GLU 638 Cb 0.00 -2.87 0.14 0.00 -1.78 0.00 0.00 34.13 29.62 1k2m s GLU 638 CO 0.00 0.09 0.31 -1.54 -0.49 0.00 0.00 175.26 173.62 1k2m s SER 639 N -1.29 4.96 0.00 -0.19 1.04 -1.26 -4.55 113.70 112.41 1k2m s SER 639 Ca 0.51 -2.66 0.00 0.00 0.48 0.00 0.00 55.95 54.28 1k2m s SER 639 Cb -0.26 -1.77 0.00 0.00 0.10 0.00 0.00 66.02 64.09 1k2m s SER 639 CO 0.32 -0.37 0.00 -2.65 0.98 0.00 0.00 173.24 171.52 1k2m n PRO 640 N 3.69 2.32 -0.91 4.02 -0.02 -1.26 -4.84 135.00 138.00 1k2m n PRO 640 Ca 0.05 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.34 1k2m n PRO 640 Cb 0.37 0.00 0.07 0.00 -0.02 0.00 0.00 33.50 33.93 1k2m n PRO 640 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k2m n ALA 641 N -3.00 5.04 -0.02 3.55 0.00 -1.26 -4.93 120.51 119.90 1k2m n ALA 641 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 53.44 51.43 1k2m n ALA 641 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.05 1k2m n ALA 641 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1k2m n GLN 642 N -0.20 0.00 0.00 0.00 6.02 -1.26 -3.51 117.38 118.43 1k2m n GLN 642 Ca 0.38 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.37 1k2m n GLN 642 Cb 0.85 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.11 1k2m n GLN 642 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1k2m n GLY 643 N 0.00 -1.81 0.00 1.08 0.00 -1.26 -4.91 105.19 98.30 1k2m n GLY 643 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.73 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 -4.38 0.99 4.32 -1.05 -4.78 117.00 112.10 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 -0.14 0.00 -1.62 0.00 0.00 43.42 41.66 1k2m n LEU 644 CO 0.00 0.00 -0.56 -1.81 -1.22 0.00 0.00 177.39 173.80 1k2m s ASP 645 N -1.00 3.30 0.20 -1.43 1.01 -0.43 0.19 116.67 118.51 1k2m s ASP 645 Ca 0.00 -0.64 0.07 0.00 0.71 0.00 0.00 52.55 52.69 1k2m s ASP 645 Cb 0.00 -0.29 -0.05 0.00 1.01 0.00 0.00 42.92 43.59 1k2m s ASP 645 CO 0.00 0.22 -0.14 -1.81 0.21 0.00 0.00 175.17 173.66 1k2m s ASP 646 N -1.62 2.50 -0.22 0.27 1.11 0.51 -2.90 116.67 116.32 1k2m s ASP 646 Ca 0.13 -1.03 -0.04 0.00 0.18 0.00 0.00 52.55 51.80 1k2m s ASP 646 Cb -0.10 -0.12 -0.01 0.00 1.07 0.00 0.00 42.92 43.75 1k2m s ASP 646 CO 0.04 -0.19 -0.03 0.27 1.18 0.00 0.00 175.17 176.44 1k2m s ILE 647 N -3.01 3.49 -0.13 0.77 -4.36 -1.26 0.41 121.20 117.10 1k2m s ILE 647 Ca 0.22 -0.46 -0.06 0.00 -0.26 0.00 0.00 60.65 60.10 1k2m s ILE 647 Cb -0.00 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 41.08 1k2m s ILE 647 CO 0.06 0.42 0.08 0.26 0.24 0.00 0.00 174.94 176.00 1k2m s TRP 648 N 1.38 3.36 -0.29 1.37 0.52 0.46 -0.92 118.94 124.82 1k2m s TRP 648 Ca 0.05 0.28 -0.12 0.00 0.02 0.00 0.00 56.10 56.33 1k2m s TRP 648 Cb -0.14 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.18 1k2m s TRP 648 CO -0.02 0.46 0.24 -0.47 0.02 0.00 0.00 176.95 177.18 1k2m s TYR 649 N -0.47 3.23 -0.04 -1.98 5.04 0.53 0.20 117.35 123.85 1k2m s TYR 649 Ca 0.10 0.14 0.01 0.00 -2.44 0.00 0.00 57.07 54.89 1k2m s TYR 649 Cb -0.12 -2.44 -0.03 0.00 0.35 0.00 0.00 41.96 39.72 1k2m s TYR 649 CO 0.02 -0.20 -0.05 0.00 -1.34 0.00 0.00 175.55 173.97 1k2m s HIS 651 N -0.91 2.49 -0.35 0.00 2.46 -0.61 0.13 115.29 118.50 1k2m s HIS 651 Ca 0.15 -1.34 0.06 0.00 0.47 0.00 0.00 55.06 54.40 1k2m s HIS 651 Cb -0.11 -1.74 0.16 0.00 -0.13 0.00 0.00 32.58 30.77 1k2m s HIS 651 CO 0.04 -0.66 1.13 0.25 -2.47 0.00 0.00 174.74 173.04 1k2m n THR 652 N 4.38 1.14 -3.22 0.89 -2.24 -0.14 0.15 114.28 115.23 1k2m n THR 652 Ca -0.20 -1.15 -0.39 0.00 -2.27 0.00 0.00 64.05 60.05 1k2m n THR 652 Cb 0.51 0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 69.08 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 -1.20 2.71 0.00 3.38 0.00 0.41 -4.71 107.32 107.91 1k2m s GLY 653 Ca 0.13 0.09 0.18 0.00 0.00 0.00 0.00 44.72 45.12 1k2m s GLY 653 CO 0.06 0.54 1.58 2.41 0.00 0.00 0.00 173.10 177.70 1k2m n THR 654 N 1.75 0.61 1.62 0.90 -1.04 -1.26 -2.59 114.28 114.28 1k2m n THR 654 Ca -0.09 0.15 0.12 0.00 -2.04 0.00 0.00 64.05 62.19 1k2m n THR 654 Cb 0.50 -0.84 0.54 0.00 -1.82 0.00 0.00 70.33 68.72 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 -1.41 0.89 -1.65 8.00 4.13 -1.26 -4.87 115.26 119.09 1k2m n ASN 655 Ca 0.06 -1.47 0.00 0.00 1.68 0.00 0.00 54.58 54.85 1k2m n ASN 655 Cb 0.19 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.39 1k2m n ASN 655 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1k2m n VAL 656 N -0.23 -4.04 -4.36 2.41 0.24 -1.07 -4.70 118.33 106.57 1k2m n VAL 656 Ca 0.17 1.93 -0.24 0.00 -2.04 0.00 0.00 64.34 64.16 1k2m n VAL 656 Cb 0.22 -2.92 -0.09 0.00 -1.47 0.00 0.00 33.84 29.59 1k2m n VAL 656 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1k2m s SER 657 N -4.71 4.14 -0.06 -1.34 0.15 0.17 -4.08 113.70 107.98 1k2m s SER 657 Ca 0.00 -0.91 -0.02 0.00 0.70 0.00 0.00 55.95 55.72 1k2m s SER 657 Cb 0.00 -0.56 0.03 0.00 -1.71 0.00 0.00 66.02 63.78 1k2m s SER 657 CO 0.00 -0.12 0.03 -0.31 1.20 0.00 0.00 173.24 174.04 1k2m s TYR 658 N -2.47 0.41 -0.27 3.44 1.51 0.61 0.30 117.35 120.88 1k2m s TYR 658 Ca 0.33 0.01 -0.06 0.00 -1.01 0.00 0.00 57.07 56.34 1k2m s TYR 658 Cb -0.03 -0.66 -0.00 0.00 -0.11 0.00 0.00 41.96 41.17 1k2m s TYR 658 CO 0.19 -0.26 0.06 -1.17 -1.11 0.00 0.00 175.55 173.25 1k2m s LEU 659 N 2.02 3.60 0.00 -1.29 0.20 -0.21 0.12 118.68 123.13 1k2m s LEU 659 Ca 0.04 -0.56 0.00 0.00 0.69 0.00 0.00 54.13 54.30 1k2m s LEU 659 Cb -0.12 -1.86 0.00 0.00 -0.43 0.00 0.00 46.19 43.78 1k2m s LEU 659 CO -0.04 -0.13 0.00 -3.20 -0.29 0.00 0.00 176.35 172.69 1k2m n ASN 660 N 4.86 0.00 0.00 3.68 4.05 -1.05 -0.63 115.26 126.17 1k2m n ASN 660 Ca -0.15 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.88 1k2m n ASN 660 Cb 0.49 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.50 1k2m n ASN 660 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1k2m n ASN 661 N 1.95 0.18 -4.82 1.20 2.85 -1.26 -5.07 115.26 110.29 1k2m n ASN 661 Ca 0.00 -1.03 -0.36 0.00 -0.11 0.00 0.00 54.58 53.08 1k2m n ASN 661 Cb 0.00 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 40.95 1k2m n ASN 661 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 1k2m s ASN 662 N -0.03 6.02 0.02 1.20 3.04 0.20 -5.10 114.94 120.28 1k2m s ASN 662 Ca 0.00 0.34 -0.12 0.00 0.04 0.00 0.00 52.86 53.11 1k2m s ASN 662 Cb 0.00 -1.86 -0.06 0.00 -1.54 0.00 0.00 41.25 37.79 1k2m s ASN 662 CO 0.00 0.37 0.38 -0.60 -3.04 0.00 0.00 177.10 174.22 1k2m s ARG 663 N -1.17 3.83 0.01 0.43 3.52 -1.26 -1.04 118.95 123.27 1k2m s ARG 663 Ca 0.17 0.29 0.01 0.00 -0.13 0.00 0.00 55.73 56.07 1k2m s ARG 663 Cb -0.12 -3.14 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 1k2m s ARG 663 CO 0.06 0.66 -0.03 0.00 -0.81 0.00 0.00 175.30 175.17 1k2m s MET 664 N -1.35 0.26 0.35 5.12 0.23 0.15 -4.79 119.30 119.26 1k2m s MET 664 Ca 0.26 -0.25 0.08 0.00 -1.03 0.00 0.00 55.69 54.75 1k2m s MET 664 Cb -0.15 -0.17 -0.04 0.00 -1.53 0.00 0.00 34.83 32.93 1k2m s MET 664 CO 0.14 0.04 0.14 0.96 -2.03 0.00 0.00 175.02 174.27 1k2m s ILE 665 N -0.42 2.91 -0.33 3.16 -4.36 -1.26 0.42 121.20 121.32 1k2m s ILE 665 Ca -0.03 -1.71 -0.40 0.00 -0.26 0.00 0.00 60.65 58.25 1k2m s ILE 665 Cb -0.03 -2.96 -0.16 0.00 1.25 0.00 0.00 42.46 40.56 1k2m s ILE 665 CO -0.00 -0.16 1.84 1.67 0.24 0.00 0.00 174.94 178.53 1k2m n GLN 666 N -1.15 0.95 0.00 0.37 7.27 -1.21 -1.30 117.38 122.31 1k2m n GLN 666 Ca -0.03 0.33 0.00 0.00 0.07 0.00 0.00 57.00 57.37 1k2m n GLN 666 Cb 0.62 -2.06 0.00 0.00 2.41 0.00 0.00 30.24 31.20 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 4.85 1.36 3.69 1.69 0.00 0.39 -4.94 105.19 112.22 1k2m n GLY 667 Ca 0.32 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.11 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 3.28 0.02 2.61 -4.23 -0.42 0.25 115.64 115.15 1k2m s THR 668 Ca 0.00 -1.80 0.02 0.00 -1.18 0.00 0.00 61.69 58.73 1k2m s THR 668 Cb 0.00 -2.93 -0.02 0.00 1.34 0.00 0.00 72.50 70.90 1k2m s THR 668 CO 0.00 -0.28 -0.08 -0.75 -0.54 0.00 0.00 174.62 172.97 1k2m s LYS 669 N -3.76 0.56 -0.09 3.99 2.20 0.20 -1.57 119.74 121.27 1k2m s LYS 669 Ca 0.34 -0.52 -0.06 0.00 -0.36 0.00 0.00 55.97 55.37 1k2m s LYS 669 Cb -0.04 -0.46 0.03 0.00 -1.51 0.00 0.00 37.83 35.85 1k2m s LYS 669 CO 0.21 0.11 0.22 0.12 -0.36 0.00 0.00 175.35 175.65 1k2m s PHE 670 N -0.76 -0.27 0.33 4.03 2.19 0.18 0.10 117.98 123.79 1k2m s PHE 670 Ca -0.03 0.66 -0.28 0.00 0.33 0.00 0.00 56.93 57.61 1k2m s PHE 670 Cb -0.06 0.05 -0.10 0.00 -1.31 0.00 0.00 43.02 41.60 1k2m s PHE 670 CO 0.00 -0.17 1.25 -1.17 1.83 0.00 0.00 175.22 176.96 1k2m s LEU 671 N 0.75 4.42 -0.21 6.12 0.20 -1.26 0.20 118.68 128.90 1k2m s LEU 671 Ca -0.05 2.57 -0.04 0.00 0.69 0.00 0.00 54.13 57.29 1k2m s LEU 671 Cb -0.07 -3.69 -0.02 0.00 -0.43 0.00 0.00 46.19 41.98 1k2m s LEU 671 CO -0.04 -0.49 -0.02 -0.76 -0.29 0.00 0.00 176.35 174.75 1k2m s LEU 672 N -1.83 3.09 -0.12 -0.68 1.43 -0.10 -4.82 118.68 115.66 1k2m s LEU 672 Ca 0.49 -0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 53.26 1k2m s LEU 672 Cb -0.37 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 1k2m s LEU 672 CO 0.49 0.03 0.06 -1.10 0.23 0.00 0.00 176.35 176.05 1k2m s GLN 673 N 1.20 3.35 -0.55 1.70 -0.21 -1.26 -4.53 119.66 119.36 1k2m s GLN 673 Ca 0.03 -0.31 -0.42 0.00 0.02 0.00 0.00 55.36 54.68 1k2m s GLN 673 Cb -0.14 -3.01 -0.19 0.00 1.00 0.00 0.00 33.01 30.67 1k2m s GLN 673 CO 0.00 0.62 2.21 -3.47 -2.12 0.00 0.00 175.29 172.53 1k2m n ASP 674 N 2.42 0.76 -0.01 5.90 -0.08 0.49 -0.58 116.55 125.44 1k2m n ASP 674 Ca -0.19 0.61 0.00 0.00 -1.51 0.00 0.00 54.79 53.70 1k2m n ASP 674 Cb 0.54 -0.92 0.00 0.00 2.34 0.00 0.00 41.12 43.08 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 7.34 1.40 3.64 0.27 0.00 0.31 -4.89 105.19 113.27 1k2m n GLY 675 Ca 0.56 -0.04 -0.38 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 -2.05 6.32 -0.45 1.61 2.15 0.25 -4.82 116.67 119.68 1k2m s ASP 676 Ca 0.00 0.37 -0.18 0.00 0.43 0.00 0.00 52.55 53.17 1k2m s ASP 676 Cb 0.00 -2.21 0.04 0.00 -0.30 0.00 0.00 42.92 40.45 1k2m s ASP 676 CO 0.00 -0.11 0.50 -0.70 -0.17 0.00 0.00 175.17 174.69 1k2m s GLU 677 N 1.64 3.10 -0.15 4.34 2.12 -1.26 0.18 118.70 128.67 1k2m s GLU 677 Ca 0.16 -0.82 -0.05 0.00 0.36 0.00 0.00 54.97 54.62 1k2m s GLU 677 Cb -0.15 -4.02 -0.03 0.00 0.26 0.00 0.00 34.13 30.19 1k2m s GLU 677 CO 0.08 -0.98 0.01 0.96 -0.54 0.00 0.00 175.26 174.80 1k2m s ILE 678 N 2.27 4.33 -0.20 -3.70 -4.36 0.13 -2.53 121.20 117.13 1k2m s ILE 678 Ca 0.13 -0.21 -0.08 0.00 -0.26 0.00 0.00 60.65 60.23 1k2m s ILE 678 Cb -0.18 -2.90 -0.04 0.00 1.25 0.00 0.00 42.46 40.59 1k2m s ILE 678 CO 0.13 0.50 0.07 -0.54 0.24 0.00 0.00 174.94 175.35 1k2m s LYS 679 N 0.11 3.90 -0.02 0.37 1.02 0.33 0.47 119.74 125.92 1k2m s LYS 679 Ca 0.02 -0.37 0.19 0.00 0.02 0.00 0.00 55.97 55.82 1k2m s LYS 679 Cb -0.13 -3.27 -0.21 0.00 -0.52 0.00 0.00 37.83 33.70 1k2m s LYS 679 CO 0.02 0.14 0.56 -0.89 -0.92 0.00 0.00 175.35 174.25 1k2m n ILE 680 N 3.95 0.92 -3.67 2.17 5.41 -0.92 0.23 119.36 127.44 1k2m n ILE 680 Ca -0.16 -0.68 -0.09 0.00 1.00 0.00 0.00 62.75 62.81 1k2m n ILE 680 Cb 0.52 -0.47 -0.09 0.00 -0.71 0.00 0.00 39.64 38.89 1k2m n ILE 680 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1k2m s ILE 681 N -2.98 -0.01 -0.04 1.39 2.07 -1.24 -3.86 121.20 116.52 1k2m s ILE 681 Ca -0.06 0.05 -0.00 0.00 -1.41 0.00 0.00 60.65 59.23 1k2m s ILE 681 Cb 0.09 -0.78 0.03 0.00 0.13 0.00 0.00 42.46 41.93 1k2m s ILE 681 CO 0.84 0.02 -0.01 0.86 -1.91 0.00 0.00 174.94 174.74 1k2m s TRP 682 N 1.35 0.48 -0.22 3.50 -0.00 -1.26 -1.17 118.94 121.62 1k2m s TRP 682 Ca -0.09 -0.07 -0.01 0.00 -0.00 0.00 0.00 56.10 55.94 1k2m s TRP 682 Cb -0.07 -0.57 0.02 0.00 -0.00 0.00 0.00 33.47 32.86 1k2m s TRP 682 CO -0.14 -0.20 -0.10 -0.51 -0.00 0.00 0.00 176.95 176.00 1k2m s ASP 683 N 1.31 3.98 0.07 5.86 1.11 0.05 -4.98 116.67 124.05 1k2m s ASP 683 Ca -0.06 -0.77 -0.20 0.00 0.18 0.00 0.00 52.55 51.71 1k2m s ASP 683 Cb -0.13 -1.61 -0.11 0.00 1.07 0.00 0.00 42.92 42.13 1k2m s ASP 683 CO -0.02 -0.08 1.47 0.11 1.18 0.00 0.00 175.17 177.83 1k2m h LYS 684 N 7.99 0.37 0.24 8.23 1.57 -1.94 0.52 116.57 133.55 1k2m h LYS 684 Ca -0.37 -0.13 -0.32 0.00 -1.87 0.00 0.00 60.65 57.95 1k2m h LYS 684 Cb 1.12 -0.02 0.04 0.00 0.08 0.00 0.00 32.23 33.44 1k2m h LYS 684 CO 0.59 0.60 -1.42 -0.91 -0.57 0.00 0.00 179.45 177.75 1k2m h ASN 685 N 0.10 0.83 1.97 0.86 2.35 -1.99 -3.30 115.58 116.40 1k2m h ASN 685 Ca 0.05 -0.92 -0.01 0.00 -0.55 0.00 0.00 56.30 54.88 1k2m h ASN 685 Cb 0.46 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 1k2m h ASN 685 CO 0.02 1.69 -0.02 -1.13 -1.65 0.00 0.00 177.43 176.33 1k2m h ASN 686 N 0.11 0.00 0.00 5.81 -1.24 -1.98 -3.47 115.58 114.81 1k2m h ASN 686 Ca -0.25 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.76 1k2m h ASN 686 Cb 2.12 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.17 1k2m h ASN 686 CO 0.27 0.02 0.00 1.17 -1.29 0.00 0.00 177.43 177.60 1k2m n LYS 687 N -3.11 -1.14 -2.43 6.67 0.00 0.18 -4.92 118.16 113.42 1k2m n LYS 687 Ca 0.04 0.28 -0.42 0.00 0.00 0.00 0.00 58.31 58.22 1k2m n LYS 687 Cb 0.54 -4.22 -0.03 0.00 0.00 0.00 0.00 35.03 31.33 1k2m n LYS 687 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 1k2m s PHE 688 N -1.44 2.34 -0.17 5.64 5.36 -1.18 -4.82 117.98 123.71 1k2m s PHE 688 Ca 0.00 0.45 0.01 0.00 -0.96 0.00 0.00 56.93 56.43 1k2m s PHE 688 Cb 0.00 -4.42 0.02 0.00 -0.34 0.00 0.00 43.02 38.27 1k2m s PHE 688 CO 0.00 -1.92 -0.20 0.54 -1.46 0.00 0.00 175.22 172.18 1k2m s VAL 689 N 5.86 2.12 -0.16 3.12 0.11 -1.26 -0.77 120.40 129.41 1k2m s VAL 689 Ca 0.50 -0.93 0.01 0.00 -2.93 0.00 0.00 61.98 58.63 1k2m s VAL 689 Cb -0.10 -1.87 0.02 0.00 -1.53 0.00 0.00 36.38 32.89 1k2m s VAL 689 CO 0.25 0.54 -0.20 -0.51 -3.33 0.00 0.00 175.10 171.85 1k2m s ILE 690 N 1.12 1.97 -0.01 7.04 2.07 -0.32 -3.24 121.20 129.83 1k2m s ILE 690 Ca 0.01 -0.90 -0.00 0.00 -1.41 0.00 0.00 60.65 58.34 1k2m s ILE 690 Cb -0.14 -1.78 0.01 0.00 0.13 0.00 0.00 42.46 40.68 1k2m s ILE 690 CO -0.09 0.53 0.02 -0.83 -1.91 0.00 0.00 174.94 172.66 1k2m s GLY 691 N 1.19 0.01 -0.02 1.50 0.00 -1.26 -2.17 107.32 106.57 1k2m s GLY 691 Ca 0.02 0.10 0.04 0.00 0.00 0.00 0.00 44.72 44.88 1k2m s GLY 691 CO -0.10 0.18 -0.12 -1.36 0.00 0.00 0.00 173.10 171.70 1k2m s PHE 692 N 0.23 2.74 -0.31 1.90 0.08 0.18 -2.09 117.98 120.71 1k2m s PHE 692 Ca -0.02 -0.13 -0.11 0.00 0.12 0.00 0.00 56.93 56.79 1k2m s PHE 692 Cb -0.03 -1.59 -0.03 0.00 -0.57 0.00 0.00 43.02 40.80 1k2m s PHE 692 CO -0.01 0.27 0.20 0.21 -0.10 0.00 0.00 175.22 175.79 1k2m s LYS 693 N -1.09 3.65 -0.19 0.44 2.20 -0.86 0.22 119.74 124.11 1k2m s LYS 693 Ca 0.14 -0.53 -0.26 0.00 -0.36 0.00 0.00 55.97 54.96 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 -0.33 0.87 0.08 -0.36 0.00 0.00 175.35 175.65 1k2m s VAL 694 N 1.72 4.84 -0.21 4.02 1.01 0.47 0.40 120.40 132.65 1k2m s VAL 694 Ca 0.06 1.70 -0.02 0.00 0.00 0.00 0.00 61.98 63.72 1k2m s VAL 694 Cb -0.17 -4.17 0.06 0.00 0.00 0.00 0.00 36.38 32.11 1k2m s VAL 694 CO 0.10 -0.02 0.02 -0.70 0.00 0.00 0.00 175.10 174.50 1k2m s GLU 695 N 2.42 0.81 -0.48 2.72 2.56 0.38 0.11 118.70 127.22 1k2m s GLU 695 Ca 0.39 -0.54 -0.29 0.00 0.00 0.00 0.00 54.97 54.54 1k2m s GLU 695 Cb -0.16 -2.18 0.02 0.00 2.00 0.00 0.00 34.13 33.80 1k2m s GLU 695 CO 0.11 -0.65 1.31 0.42 -0.56 0.00 0.00 175.26 175.88 1k2m s ILE 696 N 1.78 3.98 -0.16 -3.70 1.01 -1.26 -0.72 121.20 122.12 1k2m s ILE 696 Ca -0.01 0.96 -0.11 0.00 0.00 0.00 0.00 60.65 61.49 1k2m s ILE 696 Cb -0.17 -4.43 -0.23 0.00 0.01 0.00 0.00 42.46 37.64 1k2m s ILE 696 CO -0.08 -0.98 0.24 0.59 0.00 0.00 0.00 174.94 174.70 1k2m n ASN 697 N 8.65 2.03 -4.60 3.58 3.02 -0.44 -4.91 115.26 122.58 1k2m n ASN 697 Ca 0.13 0.25 -0.33 0.00 -0.03 0.00 0.00 54.58 54.60 1k2m n ASN 697 Cb 0.49 -0.86 -0.11 0.00 -0.61 0.00 0.00 39.78 38.69 1k2m n ASN 697 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1k2m s ASP 698 N -6.98 4.72 -0.39 6.41 -1.08 -1.06 -5.05 116.67 113.25 1k2m s ASP 698 Ca -0.26 -0.04 -0.02 0.00 -0.52 0.00 0.00 52.55 51.71 1k2m s ASP 698 Cb 0.07 -1.18 0.11 0.00 -1.46 0.00 0.00 42.92 40.45 1k2m s ASP 698 CO 0.69 0.34 0.17 0.42 0.52 0.00 0.00 175.17 177.31 1k2m s THR 699 N -0.89 3.12 -1.23 1.71 -4.23 -1.26 -4.60 115.64 108.26 1k2m s THR 699 Ca 0.14 -2.06 -0.08 0.00 -1.18 0.00 0.00 61.69 58.51 1k2m s THR 699 Cb -0.11 -3.14 -0.05 0.00 1.34 0.00 0.00 72.50 70.53 1k2m s THR 699 CO 0.04 -0.65 2.90 0.41 -0.54 0.00 0.00 174.62 176.78 1k2m n THR 700 N 4.54 4.30 -2.21 3.99 -1.04 -1.26 -4.37 114.28 118.23 1k2m n THR 700 Ca -0.02 -2.90 0.00 0.00 -2.04 0.00 0.00 64.05 59.09 1k2m n THR 700 Cb 0.42 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 66.61 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 2.75 0.87 3.73 3.41 0.00 -1.26 -4.81 105.19 109.87 1k2m n GLY 701 Ca 0.67 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.74 4.48 0.49 0.99 2.01 -1.26 -1.32 118.68 123.33 1k2m s LEU 702 Ca 0.00 1.94 0.35 0.00 0.01 0.00 0.00 54.13 56.43 1k2m s LEU 702 Cb 0.00 -3.59 1.50 0.00 0.01 0.00 0.00 46.19 44.10 1k2m s LEU 702 CO 0.00 -0.18 1.66 2.19 1.01 0.00 0.00 176.35 181.04 1k2m h PHE 703 N 5.53 0.30 0.00 0.29 -0.00 -1.83 -3.38 116.94 117.85 1k2m h PHE 703 Ca -0.43 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.55 1k2m h PHE 703 Cb 1.21 -0.08 0.00 0.00 -0.00 0.00 0.00 35.95 37.09 1k2m h PHE 703 CO 0.64 -0.08 0.00 -1.71 -0.00 0.00 0.00 178.31 177.16 1k2m n ASN 704 N -4.39 -1.67 0.00 -0.68 5.15 -1.26 -5.02 115.26 107.39 1k2m n ASN 704 Ca 0.35 0.60 0.00 0.00 -0.60 0.00 0.00 54.58 54.94 1k2m n ASN 704 Cb 1.48 1.70 0.00 0.00 -0.53 0.00 0.00 39.78 42.43 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 -3.38 0.00 -2.15 1.20 0.28 -1.26 -4.97 120.64 110.36 1k2m n GLU 705 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 56.99 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 -0.60 0.01 -1.84 0.00 -1.26 -2.87 105.19 98.63 1k2m n GLY 706 Ca 0.00 0.08 0.07 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.42 0.69 0.00 0.99 7.99 -1.26 0.18 117.00 124.17 1k2m n LEU 707 Ca -0.00 -0.51 0.00 0.00 -0.01 0.00 0.00 56.01 55.49 1k2m n LEU 707 Cb 0.51 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.82 1k2m n LEU 707 CO 0.22 0.17 0.00 0.61 -1.51 0.00 0.00 177.39 176.88 1k2m n GLY 708 N 1.32 0.62 0.00 -0.72 0.00 -1.26 -5.01 105.19 100.14 1k2m n GLY 708 Ca 0.03 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1k2m n GLY 708 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1k2m n MET 709 N 0.00 0.00 0.00 1.61 1.56 -1.26 -5.00 117.12 114.03 1k2m n MET 709 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1k2m n MET 709 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 1k2m n MET 709 CO 0.00 0.00 0.00 -0.11 -0.73 0.00 0.00 175.97 175.13 1k2m n LEU 710 N 0.00 0.00 0.00 -0.89 7.94 -1.26 -3.58 117.00 119.21 1k2m n LEU 710 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1k2m n LEU 710 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1k2m n LEU 710 CO 0.00 -0.60 0.00 0.00 -1.11 0.00 0.00 177.39 175.68 1k2m n GLN 711 N -0.23 0.00 -3.83 1.96 6.02 -1.26 -4.50 117.38 115.54 1k2m n GLN 711 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 1k2m n GLN 711 Cb 0.00 -0.27 -0.12 0.00 1.02 0.00 0.00 30.24 30.87 1k2m n GLN 711 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1k2m s GLU 712 N 0.00 1.93 -0.07 -1.09 -1.05 -1.26 -5.08 118.70 112.09 1k2m s GLU 712 Ca 0.00 -1.93 0.04 0.00 -0.15 0.00 0.00 54.97 52.93 1k2m s GLU 712 Cb 0.00 -3.50 -0.02 0.00 -0.44 0.00 0.00 34.13 30.17 1k2m s GLU 712 CO 0.00 -1.05 -0.19 -1.14 0.95 0.00 0.00 175.26 173.83 1k2m s GLN 713 N 0.93 2.68 0.00 -4.83 2.00 -1.23 -4.99 119.66 114.21 1k2m s GLN 713 Ca 0.10 -0.78 0.00 0.00 -2.00 0.00 0.00 55.36 52.68 1k2m s GLN 713 Cb -0.22 -2.33 0.00 0.00 0.80 0.00 0.00 33.01 31.26 1k2m s GLN 713 CO -0.05 0.45 0.00 0.54 -0.50 0.00 0.00 175.29 175.73 1k2m n ARG 714 N 2.80 0.00 -4.35 1.67 5.12 -1.26 -4.69 116.66 115.95 1k2m n ARG 714 Ca -0.17 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.50 1k2m n ARG 714 Cb 0.52 0.00 -0.13 0.00 -1.16 0.00 0.00 32.46 31.69 1k2m n ARG 714 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1k2m s VAL 715 N 0.00 1.73 -0.25 1.55 -7.23 -1.26 -4.89 120.40 110.06 1k2m s VAL 715 Ca 0.00 -1.50 -0.29 0.00 -1.81 0.00 0.00 61.98 58.38 1k2m s VAL 715 Cb 0.00 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.38 1k2m s VAL 715 CO 0.00 -0.01 1.14 -0.69 -0.31 0.00 0.00 175.10 175.23 1k2m s VAL 716 N -1.10 4.47 0.51 1.32 1.01 -1.26 -4.67 120.40 120.68 1k2m s VAL 716 Ca 0.07 1.74 0.06 0.00 0.00 0.00 0.00 61.98 63.85 1k2m s VAL 716 Cb -0.10 -4.24 0.04 0.00 0.00 0.00 0.00 36.38 32.08 1k2m s VAL 716 CO 0.04 -0.29 0.70 -0.76 0.00 0.00 0.00 175.10 174.80 1k2m s LEU 717 N 3.54 3.40 0.14 3.92 1.02 0.29 -4.89 118.68 126.10 1k2m s LEU 717 Ca 0.49 -0.36 0.03 0.00 0.02 0.00 0.00 54.13 54.30 1k2m s LEU 717 Cb -0.16 -2.50 -0.04 0.00 0.02 0.00 0.00 46.19 43.51 1k2m s LEU 717 CO 0.13 -1.06 0.24 -0.54 0.02 0.00 0.00 176.35 175.13 1k2m s LYS 718 N -4.59 3.29 0.34 1.70 1.02 -1.26 0.61 119.74 120.85 1k2m s LYS 718 Ca 0.58 -0.65 -0.05 0.00 0.02 0.00 0.00 55.97 55.87 1k2m s LYS 718 Cb -0.09 -2.89 -0.05 0.00 -0.52 0.00 0.00 37.83 34.28 1k2m s LYS 718 CO 0.37 0.52 0.61 -0.65 -0.92 0.00 0.00 175.35 175.27 1k2m s GLN 719 N -3.11 3.61 0.19 1.68 -0.21 0.14 -4.57 119.66 117.38 1k2m s GLN 719 Ca 0.34 0.02 0.01 0.00 0.02 0.00 0.00 55.36 55.75 1k2m s GLN 719 Cb -0.11 -2.58 -0.00 0.00 1.00 0.00 0.00 33.01 31.31 1k2m s GLN 719 CO 0.27 0.12 0.03 0.25 -2.12 0.00 0.00 175.29 173.84 1k2m n THR 720 N -1.30 0.00 -0.09 -0.19 -2.24 -1.26 -4.98 114.28 104.22 1k2m n THR 720 Ca -0.01 -0.99 0.13 0.00 -2.27 0.00 0.00 64.05 60.91 1k2m n THR 720 Cb 0.54 0.29 0.51 0.00 -2.10 0.00 0.00 70.33 69.58 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 1.21 2.07 0.01 6.98 0.00 -1.99 -1.44 119.26 126.10 1k2m h ALA 721 Ca -0.15 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1k2m h ALA 721 Cb 0.51 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1k2m h ALA 721 CO 0.24 -0.22 -0.03 1.49 0.00 0.00 0.00 179.25 180.73 1k2m h GLU 722 N 0.38 -0.06 0.02 0.00 4.81 -1.99 0.26 114.58 118.00 1k2m h GLU 722 Ca 0.29 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1k2m h GLU 722 Cb 0.63 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1k2m h GLU 722 CO -0.08 -0.04 -0.01 0.93 -0.73 0.00 0.00 179.01 179.08 1k2m h GLU 723 N -0.06 -0.02 -0.44 1.92 4.39 -1.75 -2.86 114.58 115.74 1k2m h GLU 723 Ca 0.01 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.77 1k2m h GLU 723 Cb 0.08 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1k2m h GLU 723 CO -0.03 0.25 0.30 -0.22 -1.16 0.00 0.00 179.01 178.15 1k2m h LYS 724 N -0.30 0.35 -0.68 2.33 3.11 -1.20 -1.35 116.57 118.83 1k2m h LYS 724 Ca -0.00 -0.02 -0.05 0.00 -2.81 0.00 0.00 60.65 57.77 1k2m h LYS 724 Cb 0.29 -0.08 -0.03 0.00 -1.00 0.00 0.00 32.23 31.41 1k2m h LYS 724 CO 0.00 0.23 0.22 0.22 -2.81 0.00 0.00 179.45 177.32 1k2m h ASP 725 N 0.36 0.96 -0.52 4.20 1.82 -0.27 -0.16 116.42 122.81 1k2m h ASP 725 Ca 0.19 -0.16 -0.00 0.00 -0.39 0.00 0.00 57.03 56.66 1k2m h ASP 725 Cb 0.31 -0.25 -0.02 0.00 0.68 0.00 0.00 39.33 40.04 1k2m h ASP 725 CO -0.05 0.89 0.30 -0.07 -1.61 0.00 0.00 179.24 178.71 1k2m h LEU 726 N 1.00 0.63 -0.75 2.28 3.38 -1.04 -2.27 115.31 118.53 1k2m h LEU 726 Ca 0.22 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 1k2m h LEU 726 Cb 0.27 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1k2m h LEU 726 CO -0.01 0.51 -0.46 1.62 0.09 0.00 0.00 178.44 180.19 1k2m h VAL 727 N 0.69 1.01 -0.22 1.22 3.04 -1.40 -3.04 116.25 117.56 1k2m h VAL 727 Ca 0.18 -1.80 0.04 0.00 -1.01 0.00 0.00 66.70 64.12 1k2m h VAL 727 Cb 0.00 2.07 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 1k2m h VAL 727 CO -0.03 0.45 0.15 0.50 -1.01 0.00 0.00 177.57 177.63 1k2m h LYS 728 N 0.00 0.11 0.00 4.17 3.64 -0.42 -0.19 116.57 123.88 1k2m h LYS 728 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1k2m h LYS 728 Cb 1.03 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1k2m h LYS 728 CO 0.06 0.08 -0.63 0.87 -2.27 0.00 0.00 179.45 177.56 1k2m h LYS 729 N 0.12 0.00 0.00 1.90 1.57 -1.41 -3.51 116.57 115.23 1k2m h LYS 729 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1k2m h LYS 729 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1k2m h LYS 729 CO -0.01 0.00 0.00 -0.11 -0.57 0.00 0.00 179.45 178.76