#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 -2.00 -3.48 115.58 114.06 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 0.11 0.00 0.61 -1.65 0.00 0.00 177.43 176.50 1k2m n GLY 575 N 1.15 3.73 3.52 2.83 0.00 -1.26 -5.12 105.19 110.04 1k2m n GLY 575 Ca 0.03 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 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 2.36 0.05 1.61 3.52 -1.26 -2.77 118.95 122.47 1k2m s ARG 576 Ca 0.00 -0.82 -0.00 0.00 -0.13 0.00 0.00 55.73 54.78 1k2m s ARG 576 Cb 0.00 -2.36 -0.00 0.00 -1.56 0.00 0.00 34.95 31.03 1k2m s ARG 576 CO 0.00 0.58 -0.00 0.34 -0.81 0.00 0.00 175.30 175.41 1k2m n PHE 577 N 1.69 0.00 -4.69 5.12 -0.00 -0.93 -3.72 117.46 114.93 1k2m n PHE 577 Ca -0.16 0.00 -0.32 0.00 -0.00 0.00 0.00 57.45 56.97 1k2m n PHE 577 Cb 0.52 -0.00 -0.12 0.00 -0.00 0.00 0.00 39.48 39.88 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 -6.53 2.87 -0.21 -2.13 2.96 -1.13 -0.93 118.68 113.57 1k2m s LEU 578 Ca -0.00 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.71 1k2m s LEU 578 Cb 0.00 -1.64 0.04 0.00 0.50 0.00 0.00 46.19 45.10 1k2m s LEU 578 CO 0.00 0.31 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.33 1k2m s THR 579 N -0.86 1.85 -0.38 3.68 2.01 0.52 0.12 115.64 122.58 1k2m s THR 579 Ca 0.14 -1.18 -0.09 0.00 0.31 0.00 0.00 61.69 60.87 1k2m s THR 579 Cb -0.11 -1.90 0.04 0.00 0.01 0.00 0.00 72.50 70.55 1k2m s THR 579 CO 0.04 0.16 0.19 -0.76 -0.69 0.00 0.00 174.62 173.56 1k2m s LEU 580 N 1.30 4.72 -0.41 4.42 1.02 0.42 0.18 118.68 130.33 1k2m s LEU 580 Ca -0.03 -1.15 -0.04 0.00 0.02 0.00 0.00 54.13 52.93 1k2m s LEU 580 Cb -0.17 -1.98 0.11 0.00 0.02 0.00 0.00 46.19 44.17 1k2m s LEU 580 CO -0.08 -0.41 0.21 -1.59 0.02 0.00 0.00 176.35 174.50 1k2m s LYS 581 N 1.48 2.10 -0.85 1.70 0.00 0.05 0.21 119.74 124.44 1k2m s LYS 581 Ca 0.01 -1.76 -0.29 0.00 0.00 0.00 0.00 55.97 53.93 1k2m s LYS 581 Cb -0.20 -3.60 -0.18 0.00 0.00 0.00 0.00 37.83 33.85 1k2m s LYS 581 CO 0.05 -1.05 2.61 -2.30 0.00 0.00 0.00 175.35 174.66 1k2m n PRO 582 N 4.64 0.31 -1.73 1.78 -0.02 0.97 -2.77 135.00 138.18 1k2m n PRO 582 Ca -0.04 -0.01 -0.32 0.00 -2.02 0.00 0.00 63.50 61.12 1k2m n PRO 582 Cb 0.41 -2.08 0.04 0.00 -0.02 0.00 0.00 33.50 31.86 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 9.86 3.26 0.60 2.45 2.34 -1.08 -1.96 118.68 134.15 1k2m s LEU 583 Ca 1.25 1.69 0.28 0.00 0.06 0.00 0.00 54.13 57.40 1k2m s LEU 583 Cb -0.93 -4.51 1.32 0.00 -0.56 0.00 0.00 46.19 41.52 1k2m s LEU 583 CO 0.42 -1.36 1.72 -0.65 -1.06 0.00 0.00 176.35 175.43 1k2m h PRO 584 N -0.33 0.00 0.00 1.48 0.11 -1.90 0.69 132.00 132.06 1k2m h PRO 584 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 1k2m h PRO 584 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1k2m h PRO 584 CO 0.57 0.00 -0.07 -0.44 -0.21 0.00 0.00 178.00 177.85 1k2m h ASP 585 N 0.00 0.00 -2.95 -2.05 3.32 -1.91 -3.42 116.42 109.42 1k2m h ASP 585 Ca 0.28 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.79 1k2m h ASP 585 Cb 1.65 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.18 1k2m h ASP 585 CO -0.00 0.07 -0.29 -0.55 -1.72 0.00 0.00 179.24 176.74 1k2m s SER 586 N -6.55 6.41 0.14 6.45 0.15 0.24 -4.75 113.70 115.80 1k2m s SER 586 Ca -0.04 0.48 0.08 0.00 0.70 0.00 0.00 55.95 57.17 1k2m s SER 586 Cb 0.15 -2.05 0.45 0.00 -1.71 0.00 0.00 66.02 62.87 1k2m s SER 586 CO 0.62 -0.07 1.20 2.30 1.20 0.00 0.00 173.24 178.49 1k2m n ILE 587 N -0.64 1.34 -4.05 6.45 -5.35 -0.56 -4.36 119.36 112.19 1k2m n ILE 587 Ca -0.04 0.61 -0.35 0.00 -0.27 0.00 0.00 62.75 62.70 1k2m n ILE 587 Cb 0.54 -1.61 -0.13 0.00 -1.74 0.00 0.00 39.64 36.70 1k2m n ILE 587 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1k2m s ILE 588 N -3.13 3.66 -0.80 7.28 1.01 -1.26 -5.02 121.20 122.94 1k2m s ILE 588 Ca -0.01 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.24 1k2m s ILE 588 Cb 0.02 -2.65 0.34 0.00 0.01 0.00 0.00 42.46 40.19 1k2m s ILE 588 CO 0.08 0.43 1.53 0.00 0.00 0.00 0.00 174.94 176.97 1k2m n GLN 589 N 4.44 4.11 -4.55 2.79 3.00 -1.25 -3.62 117.38 122.30 1k2m n GLN 589 Ca -0.18 -4.51 -0.25 0.00 -0.01 0.00 0.00 57.00 52.05 1k2m n GLN 589 Cb 0.51 -2.34 -0.10 0.00 0.00 0.00 0.00 30.24 28.31 1k2m n GLN 589 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1k2m s GLU 590 N -3.95 1.85 -0.08 -1.09 2.02 -0.83 -4.99 118.70 111.64 1k2m s GLU 590 Ca 0.45 -2.06 0.03 0.00 0.02 0.00 0.00 54.97 53.41 1k2m s GLU 590 Cb 0.28 -1.18 0.01 0.00 0.10 0.00 0.00 34.13 33.34 1k2m s GLU 590 CO -0.19 -0.19 -0.16 -1.12 0.02 0.00 0.00 175.26 173.62 1k2m s SER 591 N -3.62 2.18 -0.06 -0.19 0.01 -1.26 -0.02 113.70 110.73 1k2m s SER 591 Ca 0.31 -0.38 0.02 0.00 1.31 0.00 0.00 55.95 57.21 1k2m s SER 591 Cb 0.08 -1.00 -0.03 0.00 0.21 0.00 0.00 66.02 65.28 1k2m s SER 591 CO 0.15 0.07 -0.11 -0.76 0.41 0.00 0.00 173.24 173.01 1k2m s LEU 592 N 0.55 2.95 -0.21 2.44 1.43 0.57 -4.92 118.68 121.48 1k2m s LEU 592 Ca -0.16 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 52.84 1k2m s LEU 592 Cb -0.16 -1.62 0.05 0.00 0.03 0.00 0.00 46.19 44.48 1k2m s LEU 592 CO 0.05 0.34 -0.09 -1.61 0.23 0.00 0.00 176.35 175.28 1k2m s GLU 593 N -0.71 1.95 -0.45 1.70 8.01 -1.26 0.16 118.70 128.10 1k2m s GLU 593 Ca 0.11 -0.93 -0.29 0.00 0.01 0.00 0.00 54.97 53.87 1k2m s GLU 593 Cb -0.11 -2.51 0.02 0.00 -4.31 0.00 0.00 34.13 27.22 1k2m s GLU 593 CO 0.01 -0.48 1.29 0.42 0.01 0.00 0.00 175.26 176.51 1k2m s ILE 594 N 1.36 4.02 -0.20 -1.63 1.01 0.33 -4.96 121.20 121.13 1k2m s ILE 594 Ca -0.03 1.03 -0.29 0.00 0.00 0.00 0.00 60.65 61.36 1k2m s ILE 594 Cb -0.17 -4.39 -0.03 0.00 0.01 0.00 0.00 42.46 37.87 1k2m s ILE 594 CO -0.07 -0.90 1.72 -1.58 0.00 0.00 0.00 174.94 174.11 1k2m s GLN 595 N 4.77 3.74 0.57 2.79 2.00 -1.26 -2.18 119.66 130.08 1k2m s GLN 595 Ca 0.55 1.78 0.37 0.00 -2.00 0.00 0.00 55.36 56.06 1k2m s GLN 595 Cb -0.11 -4.09 1.48 0.00 0.80 0.00 0.00 33.01 31.09 1k2m s GLN 595 CO 0.32 -1.37 1.67 -0.56 -0.50 0.00 0.00 175.29 174.84 1k2m h GLN 596 N 11.27 0.00 0.00 1.67 -0.00 -1.80 0.99 115.11 127.23 1k2m h GLN 596 Ca -0.36 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.25 1k2m h GLN 596 Cb 1.17 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.64 1k2m h GLN 596 CO 0.99 0.00 -0.20 0.78 -0.00 0.00 0.00 178.83 180.40 1k2m h GLY 597 N 0.00 0.00 -7.77 0.06 0.00 -1.88 -3.41 103.07 90.07 1k2m h GLY 597 Ca 0.60 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.28 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 -3.97 5.11 -0.04 4.60 1.01 0.34 -5.06 120.40 122.39 1k2m s VAL 598 Ca -0.02 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1k2m s VAL 598 Cb 0.12 -3.46 0.03 0.00 0.00 0.00 0.00 36.38 33.07 1k2m s VAL 598 CO 0.62 0.23 0.04 0.21 0.00 0.00 0.00 175.10 176.20 1k2m s ASN 599 N 1.73 0.94 0.44 3.32 2.47 -1.26 -4.00 114.94 118.57 1k2m s ASN 599 Ca 0.07 0.04 -0.03 0.00 0.42 0.00 0.00 52.86 53.35 1k2m s ASN 599 Cb -0.16 -0.18 -0.03 0.00 -1.45 0.00 0.00 41.25 39.43 1k2m s ASN 599 CO 0.10 -0.20 0.71 -2.16 -3.72 0.00 0.00 177.10 171.82 1k2m s PRO 600 N 1.81 3.46 -0.35 0.43 0.04 -1.26 -5.03 135.00 134.11 1k2m s PRO 600 Ca 0.01 -0.02 -0.20 0.00 0.04 0.00 0.00 61.00 60.83 1k2m s PRO 600 Cb -0.12 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.94 1k2m s PRO 600 CO -0.03 -0.12 0.61 0.12 0.04 0.00 0.00 177.00 177.62 1k2m s PHE 601 N -2.61 3.16 -0.00 0.56 5.36 0.31 -4.89 117.98 119.87 1k2m s PHE 601 Ca 0.45 0.33 -0.16 0.00 -0.96 0.00 0.00 56.93 56.59 1k2m s PHE 601 Cb -0.10 -3.08 -0.06 0.00 -0.34 0.00 0.00 43.02 39.44 1k2m s PHE 601 CO 0.42 -0.60 0.46 -0.06 -1.46 0.00 0.00 175.22 173.98 1k2m s PHE 602 N 2.63 3.71 0.05 10.12 0.40 -1.26 0.11 117.98 133.74 1k2m s PHE 602 Ca 0.23 1.04 0.07 0.00 -0.60 0.00 0.00 56.93 57.68 1k2m s PHE 602 Cb -0.15 -2.38 -0.03 0.00 0.51 0.00 0.00 43.02 40.97 1k2m s PHE 602 CO 0.14 0.55 -0.20 0.42 0.70 0.00 0.00 175.22 176.83 1k2m s ILE 603 N -0.78 1.63 -4.54 0.64 1.09 0.89 0.15 121.20 120.28 1k2m s ILE 603 Ca 0.25 -1.24 0.00 0.00 -1.10 0.00 0.00 60.65 58.56 1k2m s ILE 603 Cb -0.17 -1.43 0.00 0.00 -1.06 0.00 0.00 42.46 39.80 1k2m s ILE 603 CO 0.14 0.15 0.00 0.61 -0.10 0.00 0.00 174.94 175.74 1k2m n GLY 604 N 1.73 -1.84 0.16 6.18 0.00 -1.12 -2.67 105.19 107.62 1k2m n GLY 604 Ca -0.18 -1.23 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 1k2m n GLY 604 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1k2m h ARG 605 N 0.00 -0.29 -6.65 1.61 3.08 0.78 0.61 114.38 113.52 1k2m h ARG 605 Ca 0.00 0.02 -0.52 0.00 0.07 0.00 0.00 59.98 59.55 1k2m h ARG 605 Cb 0.00 0.07 0.06 0.00 0.08 0.00 0.00 29.97 30.17 1k2m h ARG 605 CO 0.00 0.05 1.00 -1.12 -1.07 0.00 0.00 179.97 178.83 1k2m s SER 606 N -5.22 6.40 0.60 7.04 0.01 -1.08 -4.52 113.70 116.93 1k2m s SER 606 Ca -0.14 2.84 0.33 0.00 1.31 0.00 0.00 55.95 60.29 1k2m s SER 606 Cb 0.02 -2.60 1.80 0.00 0.21 0.00 0.00 66.02 65.45 1k2m s SER 606 CO 0.57 -0.96 2.00 -0.08 0.41 0.00 0.00 173.24 175.18 1k2m h GLU 607 N 6.87 0.00 -0.63 12.44 4.81 -1.89 -0.96 114.58 135.21 1k2m h GLU 607 Ca -0.43 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 58.98 1k2m h GLU 607 Cb 1.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1k2m h GLU 607 CO 0.95 0.00 0.46 -0.44 -0.73 0.00 0.00 179.01 179.25 1k2m h ASP 608 N 0.00 0.00 -3.46 1.04 3.32 -1.91 -3.40 116.42 112.01 1k2m h ASP 608 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1k2m h ASP 608 Cb 0.34 -0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.90 1k2m h ASP 608 CO 0.00 0.00 0.54 0.00 -1.72 0.00 0.00 179.24 178.06 1k2m h ASN 610 N 5.45 0.00 -3.88 0.00 2.35 -0.37 -3.37 115.58 115.76 1k2m h ASN 610 Ca -0.44 0.00 -0.69 0.00 -0.55 0.00 0.00 56.30 54.62 1k2m h ASN 610 Cb 1.21 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.37 1k2m h ASN 610 CO 0.75 0.00 -0.75 0.00 -1.65 0.00 0.00 177.43 175.78 1k2m s LYS 612 N -1.05 2.41 -0.18 0.00 1.02 -1.26 -2.80 119.74 117.88 1k2m s LYS 612 Ca 0.14 -1.46 -0.04 0.00 0.02 0.00 0.00 55.97 54.62 1k2m s LYS 612 Cb -0.11 -3.55 0.06 0.00 -0.52 0.00 0.00 37.83 33.72 1k2m s LYS 612 CO 0.03 -0.86 0.08 0.42 -0.92 0.00 0.00 175.35 174.10 1k2m s ILE 613 N 1.31 0.08 -0.42 2.17 -1.09 0.21 -4.93 121.20 118.53 1k2m s ILE 613 Ca 0.02 -0.27 -0.12 0.00 -2.23 0.00 0.00 60.65 58.04 1k2m s ILE 613 Cb -0.22 -0.70 0.06 0.00 -1.58 0.00 0.00 42.46 40.02 1k2m s ILE 613 CO -0.00 -0.27 0.29 -0.70 -1.23 0.00 0.00 174.94 173.03 1k2m s GLU 614 N 2.06 2.79 -0.24 2.79 -6.30 -1.26 -0.03 118.70 118.52 1k2m s GLU 614 Ca 0.01 -1.30 -0.01 0.00 -2.50 0.00 0.00 54.97 51.18 1k2m s GLU 614 Cb -0.16 -3.88 0.07 0.00 0.00 0.00 0.00 34.13 30.15 1k2m s GLU 614 CO -0.09 -0.90 0.01 0.34 0.02 0.00 0.00 175.26 174.65 1k2m s ASP 615 N 2.08 3.58 0.54 -1.70 2.15 -1.26 -5.00 116.67 117.06 1k2m s ASP 615 Ca 0.03 -1.17 0.47 0.00 0.43 0.00 0.00 52.55 52.31 1k2m s ASP 615 Cb -0.22 -0.92 1.62 0.00 -0.30 0.00 0.00 42.92 43.09 1k2m s ASP 615 CO 0.05 -0.30 1.49 0.59 -0.17 0.00 0.00 175.17 176.83 1k2m n ASN 616 N 4.83 0.00 -0.09 -0.34 3.02 -1.26 0.69 115.26 122.11 1k2m n ASN 616 Ca -0.08 0.94 -0.14 0.00 -0.03 0.00 0.00 54.58 55.27 1k2m n ASN 616 Cb 0.45 -0.46 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 1k2m n ASN 616 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1k2m h ARG 617 N 0.00 0.80 -6.85 3.52 2.47 -2.02 -3.45 114.38 108.85 1k2m h ARG 617 Ca 0.88 -0.45 -0.49 0.00 -1.26 0.00 0.00 59.98 58.65 1k2m h ARG 617 Cb 3.61 0.03 0.02 0.00 -1.65 0.00 0.00 29.97 31.98 1k2m h ARG 617 CO -0.01 1.08 0.07 -0.48 0.56 0.00 0.00 179.97 181.19 1k2m s LEU 618 N -8.87 3.73 0.89 3.04 0.05 0.22 -4.76 118.68 112.98 1k2m s LEU 618 Ca -0.12 0.90 -0.13 0.00 0.05 0.00 0.00 54.13 54.83 1k2m s LEU 618 Cb 0.09 -3.83 0.13 0.00 -2.05 0.00 0.00 46.19 40.54 1k2m s LEU 618 CO 0.86 -0.49 1.20 -0.55 -0.55 0.00 0.00 176.35 176.81 1k2m s SER 619 N -3.87 3.74 0.37 1.48 0.15 -1.26 -4.72 113.70 109.59 1k2m s SER 619 Ca 0.47 0.69 0.14 0.00 0.70 0.00 0.00 55.95 57.95 1k2m s SER 619 Cb -0.10 -1.08 0.99 0.00 -1.71 0.00 0.00 66.02 64.12 1k2m s SER 619 CO 0.41 -2.38 1.79 0.03 1.20 0.00 0.00 173.24 174.28 1k2m h ARG 620 N -1.39 0.49 -2.14 5.44 -0.00 -1.95 -2.50 114.38 112.34 1k2m h ARG 620 Ca -0.47 -0.03 -0.58 0.00 -0.50 0.00 0.00 59.98 58.41 1k2m h ARG 620 Cb 1.31 -0.11 -0.41 0.00 0.00 0.00 0.00 29.97 30.75 1k2m h ARG 620 CO 0.57 0.33 -0.79 0.28 0.00 0.00 0.00 179.97 180.35 1k2m n VAL 621 N -4.65 1.46 -0.21 2.04 0.31 -1.26 -1.40 118.33 114.62 1k2m n VAL 621 Ca 0.23 -4.92 0.01 0.00 -0.01 0.00 0.00 64.34 59.66 1k2m n VAL 621 Cb 0.75 -1.77 0.10 0.00 -0.91 0.00 0.00 33.84 32.01 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 3.81 -0.07 -2.88 3.52 2.76 -1.22 -3.39 115.15 117.68 1k2m h HIS 622 Ca 0.14 0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 58.34 1k2m h HIS 622 Cb 0.72 0.13 -0.13 0.00 1.55 0.00 0.00 27.41 29.68 1k2m h HIS 622 CO 0.63 -0.18 0.21 0.00 -1.30 0.00 0.00 177.93 177.28 1k2m s PHE 624 N -3.44 0.11 -0.17 0.00 -0.12 0.29 -0.08 117.98 114.58 1k2m s PHE 624 Ca -0.00 -0.27 -0.07 0.00 -0.05 0.00 0.00 56.93 56.53 1k2m s PHE 624 Cb -0.01 -0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.25 1k2m s PHE 624 CO -0.10 -0.27 0.08 0.42 -0.05 0.00 0.00 175.22 175.30 1k2m s ILE 625 N -1.51 5.01 -0.06 -4.49 1.01 0.30 0.22 121.20 121.68 1k2m s ILE 625 Ca -0.14 0.04 0.04 0.00 0.00 0.00 0.00 60.65 60.58 1k2m s ILE 625 Cb -0.08 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1k2m s ILE 625 CO 0.00 0.49 -0.18 0.12 0.00 0.00 0.00 174.94 175.38 1k2m s PHE 626 N 0.03 1.88 -0.12 3.97 5.36 0.51 0.11 117.98 129.72 1k2m s PHE 626 Ca 0.07 -0.63 -0.10 0.00 -0.96 0.00 0.00 56.93 55.31 1k2m s PHE 626 Cb -0.12 -1.28 -0.05 0.00 -0.34 0.00 0.00 43.02 41.24 1k2m s PHE 626 CO 0.00 -0.25 0.20 0.21 -1.46 0.00 0.00 175.22 173.93 1k2m s LYS 627 N 0.24 3.78 0.09 10.12 2.20 -1.26 0.17 119.74 135.08 1k2m s LYS 627 Ca -0.09 -0.03 0.02 0.00 -0.36 0.00 0.00 55.97 55.50 1k2m s LYS 627 Cb -0.14 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.86 1k2m s LYS 627 CO 0.04 0.59 -0.07 0.21 -0.36 0.00 0.00 175.35 175.76 1k2m s LYS 628 N -0.54 0.81 -0.37 4.03 2.36 0.69 -4.94 119.74 121.79 1k2m s LYS 628 Ca 0.15 -1.26 -0.29 0.00 -2.55 0.00 0.00 55.97 52.02 1k2m s LYS 628 Cb -0.13 -0.26 0.01 0.00 -1.05 0.00 0.00 37.83 36.41 1k2m s LYS 628 CO 0.04 0.00 1.27 0.50 1.55 0.00 0.00 175.35 178.71 1k2m s ARG 629 N -3.51 3.80 0.05 4.03 6.06 -1.26 0.19 118.95 128.31 1k2m s ARG 629 Ca 0.09 1.00 -0.30 0.00 -2.50 0.00 0.00 55.73 54.02 1k2m s ARG 629 Cb 0.03 -3.91 -0.05 0.00 0.06 0.00 0.00 34.95 31.08 1k2m s ARG 629 CO -0.04 -1.28 1.05 -1.58 -2.50 0.00 0.00 175.30 170.95 1k2m s HIS 630 N 4.61 3.62 0.15 5.12 5.65 0.46 -4.85 115.29 130.06 1k2m s HIS 630 Ca 0.55 1.61 0.03 0.00 0.25 0.00 0.00 55.06 57.49 1k2m s HIS 630 Cb -0.13 -3.20 -0.04 0.00 -1.18 0.00 0.00 32.58 28.02 1k2m s HIS 630 CO 0.27 -0.36 -0.06 0.00 -0.65 0.00 0.00 174.74 173.94 1k2m s ALA 631 N 0.70 1.36 0.53 1.58 0.00 -1.26 -1.34 121.76 123.34 1k2m s ALA 631 Ca 0.52 -1.51 0.03 0.00 0.00 0.00 0.00 51.96 51.01 1k2m s ALA 631 Cb -0.24 0.22 0.03 0.00 0.00 0.00 0.00 23.12 23.12 1k2m s ALA 631 CO 0.29 -0.19 0.26 1.33 0.00 0.00 0.00 175.76 177.46 1k2m n VAL 632 N -0.19 0.00 0.00 0.00 0.24 -1.26 -5.01 118.33 112.10 1k2m n VAL 632 Ca -0.09 -2.26 0.00 0.00 -2.04 0.00 0.00 64.34 59.95 1k2m n VAL 632 Cb 0.61 0.16 0.00 0.00 -1.47 0.00 0.00 33.84 33.14 1k2m n VAL 632 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k2m n GLY 633 N -1.42 0.18 1.99 7.63 0.00 -1.26 -5.06 105.19 107.25 1k2m n GLY 633 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.09 0.80 -3.15 1.61 4.81 -1.26 -5.13 118.16 115.74 1k2m n LYS 634 Ca 0.00 -1.59 0.06 0.00 -0.87 0.00 0.00 58.31 55.90 1k2m n LYS 634 Cb 0.00 -0.12 -0.02 0.00 0.02 0.00 0.00 35.03 34.91 1k2m n LYS 634 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1k2m s SER 635 N -2.84 -0.24 -0.42 3.14 1.04 -1.26 -4.84 113.70 108.28 1k2m s SER 635 Ca 0.31 0.15 -0.14 0.00 0.48 0.00 0.00 55.95 56.76 1k2m s SER 635 Cb -0.02 1.20 0.04 0.00 0.10 0.00 0.00 66.02 67.34 1k2m s SER 635 CO 0.20 -0.05 0.31 -0.04 0.98 0.00 0.00 173.24 174.64 1k2m s MET 636 N 2.97 2.91 0.00 4.02 1.00 -1.26 -4.76 119.30 124.18 1k2m s MET 636 Ca -0.06 -1.17 0.00 0.00 0.00 0.00 0.00 55.69 54.46 1k2m s MET 636 Cb -0.09 -3.96 0.00 0.00 0.00 0.00 0.00 34.83 30.77 1k2m s MET 636 CO -0.09 -0.84 0.00 0.98 0.00 0.00 0.00 175.02 175.07 1k2m n TYR 637 N 5.12 0.00 -2.55 -0.03 9.36 -1.26 -4.84 117.16 122.97 1k2m n TYR 637 Ca -0.11 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.73 1k2m n TYR 637 Cb 0.45 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.12 1k2m n TYR 637 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1k2m s GLU 638 N 0.00 4.39 -0.44 2.98 2.56 -1.26 -5.02 118.70 121.90 1k2m s GLU 638 Ca 0.00 1.59 -0.11 0.00 0.00 0.00 0.00 54.97 56.45 1k2m s GLU 638 Cb 0.00 -2.81 0.08 0.00 2.00 0.00 0.00 34.13 33.40 1k2m s GLU 638 CO 0.00 0.04 0.31 -1.12 -0.56 0.00 0.00 175.26 173.94 1k2m s SER 639 N -1.32 5.82 0.00 -1.70 0.01 -1.26 -4.76 113.70 110.48 1k2m s SER 639 Ca 0.52 -1.49 0.00 0.00 1.31 0.00 0.00 55.95 56.29 1k2m s SER 639 Cb -0.25 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 63.92 1k2m s SER 639 CO 0.32 -0.59 0.00 -2.65 0.41 0.00 0.00 173.24 170.73 1k2m n PRO 640 N 5.02 2.03 -0.07 12.44 -0.02 -1.26 -4.62 135.00 148.51 1k2m n PRO 640 Ca -0.11 0.00 0.25 0.00 -2.02 0.00 0.00 63.50 61.63 1k2m n PRO 640 Cb 0.43 0.00 0.65 0.00 -0.02 0.00 0.00 33.50 34.56 1k2m n PRO 640 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k2m h ALA 641 N -2.03 2.55 -0.21 3.55 0.00 -1.97 -3.45 119.26 117.70 1k2m h ALA 641 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1k2m h ALA 641 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1k2m h ALA 641 CO 0.00 -1.15 0.00 0.94 0.00 0.00 0.00 179.25 179.04 1k2m n GLN 642 N -3.61 0.00 0.00 0.00 7.27 -1.26 -4.16 117.38 115.62 1k2m n GLN 642 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.22 1k2m n GLN 642 Cb 1.02 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.67 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 -2.02 0.00 1.69 0.00 -1.26 -4.16 105.19 99.45 1k2m n GLY 643 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 46.02 47.01 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 -4.43 0.99 4.32 -0.45 -4.88 117.00 112.55 1k2m n LEU 644 Ca 0.00 0.00 -0.29 0.00 -0.02 0.00 0.00 56.01 55.70 1k2m n LEU 644 Cb 0.00 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 41.68 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 0.57 3.58 -0.05 -1.43 1.01 -1.26 0.18 116.67 119.27 1k2m s ASP 645 Ca 0.00 -0.64 0.01 0.00 0.71 0.00 0.00 52.55 52.63 1k2m s ASP 645 Cb 0.00 -0.38 0.02 0.00 1.01 0.00 0.00 42.92 43.57 1k2m s ASP 645 CO 0.00 0.19 -0.05 -1.81 0.21 0.00 0.00 175.17 173.71 1k2m s ASP 646 N -2.01 1.02 -0.18 0.27 1.11 0.51 -3.89 116.67 113.50 1k2m s ASP 646 Ca 0.16 -0.14 -0.23 0.00 0.18 0.00 0.00 52.55 52.52 1k2m s ASP 646 Cb -0.10 -0.47 -0.02 0.00 1.07 0.00 0.00 42.92 43.39 1k2m s ASP 646 CO 0.07 -0.05 0.73 0.27 1.18 0.00 0.00 175.17 177.37 1k2m s ILE 647 N 0.93 4.95 -0.16 0.77 -4.36 -1.26 -0.22 121.20 121.85 1k2m s ILE 647 Ca -0.11 1.41 -0.04 0.00 -0.26 0.00 0.00 60.65 61.65 1k2m s ILE 647 Cb -0.14 -4.04 -0.03 0.00 1.25 0.00 0.00 42.46 39.50 1k2m s ILE 647 CO 0.00 0.07 -0.03 0.26 0.24 0.00 0.00 174.94 175.48 1k2m s TRP 648 N 2.03 3.03 -0.34 1.37 0.52 0.45 -0.30 118.94 125.69 1k2m s TRP 648 Ca 0.33 -0.32 -0.21 0.00 0.02 0.00 0.00 56.10 55.93 1k2m s TRP 648 Cb -0.16 -1.97 -0.00 0.00 -1.15 0.00 0.00 33.47 30.18 1k2m s TRP 648 CO 0.11 -0.06 0.65 -0.47 0.02 0.00 0.00 176.95 177.20 1k2m s TYR 649 N 0.43 3.17 -0.08 -1.98 5.04 0.27 0.19 117.35 124.40 1k2m s TYR 649 Ca -0.03 0.46 -0.05 0.00 -2.44 0.00 0.00 57.07 55.01 1k2m s TYR 649 Cb -0.14 -3.10 -0.04 0.00 0.35 0.00 0.00 41.96 39.03 1k2m s TYR 649 CO 0.03 -0.58 0.12 0.00 -1.34 0.00 0.00 175.55 173.78 1k2m s HIS 651 N -1.09 2.01 0.00 0.00 2.46 -0.31 0.10 115.29 118.47 1k2m s HIS 651 Ca 0.18 -0.73 0.00 0.00 0.47 0.00 0.00 55.06 54.98 1k2m s HIS 651 Cb -0.12 -1.37 0.00 0.00 -0.13 0.00 0.00 32.58 30.96 1k2m s HIS 651 CO 0.08 -0.30 0.53 0.25 -2.47 0.00 0.00 174.74 172.82 1k2m n THR 652 N 3.48 0.21 -2.76 0.89 -2.24 0.76 0.14 114.28 114.77 1k2m n THR 652 Ca -0.20 -0.50 -0.38 0.00 -2.27 0.00 0.00 64.05 60.70 1k2m n THR 652 Cb 0.52 1.05 -0.06 0.00 -2.10 0.00 0.00 70.33 69.75 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 -0.21 2.94 0.13 3.38 0.00 0.45 -4.79 107.32 109.22 1k2m s GLY 653 Ca 0.00 0.57 0.24 0.00 0.00 0.00 0.00 44.72 45.53 1k2m s GLY 653 CO 0.00 1.07 1.74 2.41 0.00 0.00 0.00 173.10 178.32 1k2m n THR 654 N 0.95 0.58 1.75 0.90 -1.04 -1.26 -2.82 114.28 113.35 1k2m n THR 654 Ca 0.00 0.02 0.12 0.00 -2.04 0.00 0.00 64.05 62.15 1k2m n THR 654 Cb 0.49 -0.79 0.60 0.00 -1.82 0.00 0.00 70.33 68.81 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 -1.92 0.59 -1.60 8.00 4.13 -1.26 -4.90 115.26 118.30 1k2m n ASN 655 Ca 0.05 -1.40 0.00 0.00 1.68 0.00 0.00 54.58 54.91 1k2m n ASN 655 Cb 0.31 -0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.52 1k2m n ASN 655 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09 1k2m n VAL 656 N -0.45 -3.20 -3.72 2.41 3.14 -1.13 -4.83 118.33 110.55 1k2m n VAL 656 Ca 0.18 1.48 -0.21 0.00 -2.96 0.00 0.00 64.34 62.83 1k2m n VAL 656 Cb 0.18 -1.96 -0.03 0.00 -1.06 0.00 0.00 33.84 30.97 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 -2.30 5.34 -0.13 6.55 1.04 0.16 -4.67 113.70 119.69 1k2m s SER 657 Ca 0.00 -0.50 -0.00 0.00 0.48 0.00 0.00 55.95 55.93 1k2m s SER 657 Cb 0.00 -0.93 0.02 0.00 0.10 0.00 0.00 66.02 65.21 1k2m s SER 657 CO 0.00 -0.41 -0.10 -0.31 0.98 0.00 0.00 173.24 173.40 1k2m s TYR 658 N -2.32 1.75 -0.54 5.02 1.51 0.25 0.46 117.35 123.49 1k2m s TYR 658 Ca 0.43 -0.93 -0.15 0.00 -1.01 0.00 0.00 57.07 55.40 1k2m s TYR 658 Cb -0.06 -1.37 0.13 0.00 -0.11 0.00 0.00 41.96 40.55 1k2m s TYR 658 CO 0.27 -0.58 0.49 -1.17 -1.11 0.00 0.00 175.55 173.46 1k2m s LEU 659 N 1.62 6.16 0.00 -1.29 2.96 0.07 0.24 118.68 128.44 1k2m s LEU 659 Ca 0.05 -1.83 0.00 0.00 -0.22 0.00 0.00 54.13 52.13 1k2m s LEU 659 Cb -0.13 -2.19 0.00 0.00 0.50 0.00 0.00 46.19 44.37 1k2m s LEU 659 CO -0.09 -0.84 0.00 0.59 -1.32 0.00 0.00 176.35 174.69 1k2m n ASN 660 N 5.18 0.00 0.00 3.68 4.13 -0.41 -0.20 115.26 127.65 1k2m n ASN 660 Ca -0.13 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.13 1k2m n ASN 660 Cb 0.40 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.64 1k2m n ASN 660 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1k2m n ASN 661 N 1.31 0.45 -4.47 6.41 2.85 -1.26 -5.05 115.26 115.48 1k2m n ASN 661 Ca 0.00 -1.12 -0.33 0.00 -0.11 0.00 0.00 54.58 53.01 1k2m n ASN 661 Cb 0.00 0.00 -0.13 0.00 1.24 0.00 0.00 39.78 40.89 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 -0.12 4.63 0.34 1.20 3.84 0.72 -5.09 114.94 120.46 1k2m s ASN 662 Ca 0.00 -0.17 -0.28 0.00 0.21 0.00 0.00 52.86 52.63 1k2m s ASN 662 Cb 0.00 -1.73 -0.09 0.00 -0.55 0.00 0.00 41.25 38.87 1k2m s ASN 662 CO 0.00 0.17 1.21 -0.60 -2.79 0.00 0.00 177.10 175.09 1k2m s ARG 663 N 0.32 4.32 -0.31 0.43 3.52 -1.26 -0.75 118.95 125.21 1k2m s ARG 663 Ca -0.05 1.98 0.02 0.00 -0.13 0.00 0.00 55.73 57.55 1k2m s ARG 663 Cb -0.14 -2.96 0.09 0.00 -1.56 0.00 0.00 34.95 30.38 1k2m s ARG 663 CO 0.04 -0.14 0.06 1.41 -0.81 0.00 0.00 175.30 175.85 1k2m s MET 664 N -1.88 1.20 0.57 5.12 -2.45 0.17 -4.81 119.30 117.23 1k2m s MET 664 Ca 0.51 -1.45 -0.04 0.00 -1.25 0.00 0.00 55.69 53.45 1k2m s MET 664 Cb -0.35 -2.65 0.01 0.00 1.25 0.00 0.00 34.83 33.10 1k2m s MET 664 CO 0.45 -0.91 0.86 0.96 1.05 0.00 0.00 175.02 177.43 1k2m s ILE 665 N 1.24 3.51 -0.24 10.11 -4.36 -1.26 0.40 121.20 130.60 1k2m s ILE 665 Ca 0.08 -0.16 -0.29 0.00 -0.26 0.00 0.00 60.65 60.02 1k2m s ILE 665 Cb -0.18 -3.38 -0.06 0.00 1.25 0.00 0.00 42.46 40.09 1k2m s ILE 665 CO -0.15 -0.36 2.23 1.67 0.24 0.00 0.00 174.94 178.57 1k2m n GLN 666 N -2.51 1.82 0.00 0.37 7.27 -1.24 -2.36 117.38 120.73 1k2m n GLN 666 Ca 0.05 0.49 0.00 0.00 0.07 0.00 0.00 57.00 57.60 1k2m n GLN 666 Cb 0.58 -3.15 0.00 0.00 2.41 0.00 0.00 30.24 30.08 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 5.89 1.53 3.14 1.69 0.00 0.38 -4.93 105.19 112.89 1k2m n GLY 667 Ca 0.32 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.21 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 0.73 0.15 2.61 -4.23 -1.00 -0.30 115.64 111.60 1k2m s THR 668 Ca 0.00 -1.54 0.07 0.00 -1.18 0.00 0.00 61.69 59.03 1k2m s THR 668 Cb 0.00 -1.21 -0.04 0.00 1.34 0.00 0.00 72.50 72.59 1k2m s THR 668 CO 0.00 -0.59 -0.15 -1.59 -0.54 0.00 0.00 174.62 171.75 1k2m s LYS 669 N -2.70 1.13 -0.05 3.99 -2.85 0.75 -1.16 119.74 118.84 1k2m s LYS 669 Ca 0.02 -1.35 -0.11 0.00 -1.00 0.00 0.00 55.97 53.54 1k2m s LYS 669 Cb -0.03 -1.00 0.02 0.00 -2.06 0.00 0.00 37.83 34.76 1k2m s LYS 669 CO -0.01 0.19 0.25 0.12 0.10 0.00 0.00 175.35 175.99 1k2m s PHE 670 N -2.36 -0.18 0.22 1.78 5.36 -0.37 0.18 117.98 122.62 1k2m s PHE 670 Ca 0.13 0.36 -0.30 0.00 -0.96 0.00 0.00 56.93 56.16 1k2m s PHE 670 Cb -0.04 0.06 -0.09 0.00 -0.34 0.00 0.00 43.02 42.61 1k2m s PHE 670 CO 0.04 -0.26 1.38 -1.17 -1.46 0.00 0.00 175.22 173.75 1k2m s LEU 671 N -0.72 4.40 -0.19 6.12 1.98 -1.26 0.94 118.68 129.95 1k2m s LEU 671 Ca -0.08 2.54 -0.05 0.00 -2.89 0.00 0.00 54.13 53.65 1k2m s LEU 671 Cb -0.04 -3.62 -0.03 0.00 0.66 0.00 0.00 46.19 43.16 1k2m s LEU 671 CO 0.02 -0.62 -0.01 -0.76 -1.89 0.00 0.00 176.35 173.09 1k2m s LEU 672 N -0.20 3.27 0.17 -0.68 1.43 0.58 -4.85 118.68 118.40 1k2m s LEU 672 Ca 0.58 -0.17 0.08 0.00 -1.03 0.00 0.00 54.13 53.60 1k2m s LEU 672 Cb -0.39 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 1k2m s LEU 672 CO 0.40 0.10 -0.07 -1.10 0.23 0.00 0.00 176.35 175.91 1k2m s GLN 673 N 0.80 2.16 -0.62 1.70 -0.21 -0.64 -4.33 119.66 118.51 1k2m s GLN 673 Ca 0.00 -1.21 -0.29 0.00 0.02 0.00 0.00 55.36 53.88 1k2m s GLN 673 Cb -0.14 -2.22 -0.12 0.00 1.00 0.00 0.00 33.01 31.53 1k2m s GLN 673 CO 0.02 0.44 2.47 -3.47 -2.12 0.00 0.00 175.29 172.64 1k2m n ASP 674 N 0.04 1.70 0.00 5.90 2.03 -1.26 -0.49 116.55 124.47 1k2m n ASP 674 Ca -0.11 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.03 1k2m n ASP 674 Cb 0.55 -1.34 0.00 0.00 -0.72 0.00 0.00 41.12 39.61 1k2m n ASP 674 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k2m n GLY 675 N 6.22 1.93 3.61 0.27 0.00 0.66 -4.88 105.19 113.00 1k2m n GLY 675 Ca 0.46 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.07 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 6.59 -0.43 1.61 2.15 0.36 -4.74 116.67 120.22 1k2m s ASP 676 Ca 0.00 0.56 -0.18 0.00 0.43 0.00 0.00 52.55 53.36 1k2m s ASP 676 Cb 0.00 -2.38 0.02 0.00 -0.30 0.00 0.00 42.92 40.27 1k2m s ASP 676 CO 0.00 -0.57 0.46 -1.61 -0.17 0.00 0.00 175.17 173.29 1k2m s GLU 677 N 2.83 3.11 -0.17 4.34 2.02 -1.26 0.13 118.70 129.70 1k2m s GLU 677 Ca 0.30 -0.74 -0.06 0.00 0.02 0.00 0.00 54.97 54.49 1k2m s GLU 677 Cb -0.14 -3.97 -0.04 0.00 0.10 0.00 0.00 34.13 30.08 1k2m s GLU 677 CO 0.12 -0.89 0.02 0.96 0.02 0.00 0.00 175.26 175.50 1k2m s ILE 678 N 2.21 4.42 -0.33 -1.63 -4.36 0.41 -1.28 121.20 120.65 1k2m s ILE 678 Ca 0.13 -0.17 -0.17 0.00 -0.26 0.00 0.00 60.65 60.18 1k2m s ILE 678 Cb -0.17 -2.96 -0.01 0.00 1.25 0.00 0.00 42.46 40.56 1k2m s ILE 678 CO 0.14 0.48 0.47 -0.54 0.24 0.00 0.00 174.94 175.73 1k2m s LYS 679 N 0.29 3.70 0.05 0.37 1.02 0.66 -0.13 119.74 125.71 1k2m s LYS 679 Ca 0.01 -0.14 -0.13 0.00 0.02 0.00 0.00 55.97 55.73 1k2m s LYS 679 Cb -0.13 -3.77 -0.31 0.00 -0.52 0.00 0.00 37.83 33.09 1k2m s LYS 679 CO 0.01 -0.54 1.07 0.97 -0.92 0.00 0.00 175.35 175.94 1k2m h ILE 680 N 5.55 1.33 -2.34 2.17 2.10 -1.83 0.73 117.51 125.21 1k2m h ILE 680 Ca -0.29 -2.71 -0.07 0.00 1.08 0.00 0.00 64.86 62.87 1k2m h ILE 680 Cb 1.13 2.92 -0.23 0.00 -1.09 0.00 0.00 36.82 39.55 1k2m h ILE 680 CO 0.73 0.81 -0.08 -0.51 -1.08 0.00 0.00 178.15 178.03 1k2m s ILE 681 N -2.73 -0.00 -0.06 2.19 1.10 -1.26 -4.34 121.20 116.09 1k2m s ILE 681 Ca -0.08 0.02 -0.01 0.00 -0.51 0.00 0.00 60.65 60.07 1k2m s ILE 681 Cb 0.05 -0.80 0.03 0.00 0.15 0.00 0.00 42.46 41.89 1k2m s ILE 681 CO 0.93 0.01 0.01 0.86 -2.11 0.00 0.00 174.94 174.63 1k2m s TRP 682 N 0.73 0.53 -0.18 3.50 -0.00 -1.24 -0.56 118.94 121.72 1k2m s TRP 682 Ca -0.03 -0.08 0.01 0.00 -0.00 0.00 0.00 56.10 55.99 1k2m s TRP 682 Cb -0.05 -0.68 0.03 0.00 -0.00 0.00 0.00 33.47 32.77 1k2m s TRP 682 CO -0.05 -0.26 -0.13 0.34 -0.00 0.00 0.00 176.95 176.84 1k2m s ASP 683 N 1.76 3.17 0.06 5.86 -1.08 0.21 -4.95 116.67 121.70 1k2m s ASP 683 Ca 0.01 -0.74 -0.20 0.00 -0.52 0.00 0.00 52.55 51.10 1k2m s ASP 683 Cb -0.13 -1.27 -0.11 0.00 -1.46 0.00 0.00 42.92 39.96 1k2m s ASP 683 CO -0.04 -0.10 1.46 0.11 0.52 0.00 0.00 175.17 177.12 1k2m h LYS 684 N 7.98 0.37 0.18 4.34 1.57 -1.94 0.31 116.57 129.38 1k2m h LYS 684 Ca -0.33 -0.14 -0.30 0.00 -1.87 0.00 0.00 60.65 58.00 1k2m h LYS 684 Cb 1.11 -0.02 0.03 0.00 0.08 0.00 0.00 32.23 33.43 1k2m h LYS 684 CO 0.52 0.62 -1.29 -0.91 -0.57 0.00 0.00 179.45 177.81 1k2m h ASN 685 N 0.09 0.83 0.80 0.86 -0.26 -1.98 -3.27 115.58 112.66 1k2m h ASN 685 Ca 0.05 -0.87 0.00 0.00 -0.56 0.00 0.00 56.30 54.92 1k2m h ASN 685 Cb 0.48 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 1k2m h ASN 685 CO 0.02 1.63 -0.15 -3.20 -1.06 0.00 0.00 177.43 174.67 1k2m n ASN 686 N -3.80 0.17 -1.27 5.81 5.15 -1.24 -4.90 115.26 115.17 1k2m n ASN 686 Ca -0.15 0.20 -0.17 0.00 -0.60 0.00 0.00 54.58 53.86 1k2m n ASN 686 Cb 1.02 -0.26 -0.07 0.00 -0.53 0.00 0.00 39.78 39.94 1k2m n ASN 686 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1k2m n LYS 687 N -1.46 -1.53 -2.41 1.20 5.02 0.11 -4.89 118.16 114.20 1k2m n LYS 687 Ca 0.07 1.08 -0.41 0.00 -2.02 0.00 0.00 58.31 57.03 1k2m n LYS 687 Cb 0.33 -5.47 -0.03 0.00 -0.02 0.00 0.00 35.03 29.84 1k2m n LYS 687 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1k2m s PHE 688 N -2.43 2.29 -0.17 2.13 2.19 -1.00 -4.83 117.98 116.16 1k2m s PHE 688 Ca 0.00 0.43 0.01 0.00 0.33 0.00 0.00 56.93 57.70 1k2m s PHE 688 Cb 0.00 -4.41 0.01 0.00 -1.31 0.00 0.00 43.02 37.31 1k2m s PHE 688 CO 0.00 -1.96 -0.18 0.54 1.83 0.00 0.00 175.22 175.45 1k2m s VAL 689 N 6.03 2.35 0.15 3.12 0.11 -1.26 0.66 120.40 131.56 1k2m s VAL 689 Ca 0.51 -0.86 0.08 0.00 -2.93 0.00 0.00 61.98 58.78 1k2m s VAL 689 Cb -0.10 -1.99 -0.04 0.00 -1.53 0.00 0.00 36.38 32.72 1k2m s VAL 689 CO 0.24 0.52 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.73 1k2m s ILE 690 N 1.09 1.68 0.00 7.04 -1.09 0.27 -1.50 121.20 128.70 1k2m s ILE 690 Ca -0.00 -1.83 0.00 0.00 -2.23 0.00 0.00 60.65 56.59 1k2m s ILE 690 Cb -0.14 -1.74 0.00 0.00 -1.58 0.00 0.00 42.46 39.00 1k2m s ILE 690 CO -0.06 -0.32 0.00 0.61 -1.23 0.00 0.00 174.94 173.94 1k2m n GLY 691 N 0.43 1.06 3.54 6.18 0.00 -1.26 -3.78 105.19 111.36 1k2m n GLY 691 Ca -0.14 0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1k2m n GLY 691 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k2m s PHE 692 N 0.00 2.75 -0.32 1.61 0.08 0.82 -2.65 117.98 120.27 1k2m s PHE 692 Ca 0.00 -0.13 -0.12 0.00 0.12 0.00 0.00 56.93 56.80 1k2m s PHE 692 Cb 0.00 -1.53 -0.02 0.00 -0.57 0.00 0.00 43.02 40.89 1k2m s PHE 692 CO 0.00 0.33 0.20 0.21 -0.10 0.00 0.00 175.22 175.87 1k2m s LYS 693 N -1.53 3.56 -0.09 0.44 2.20 -1.12 -0.44 119.74 122.77 1k2m s LYS 693 Ca 0.17 -0.59 -0.27 0.00 -0.36 0.00 0.00 55.97 54.92 1k2m s LYS 693 Cb -0.11 -3.71 -0.02 0.00 -1.51 0.00 0.00 37.83 32.48 1k2m s LYS 693 CO 0.08 -0.38 0.89 0.08 -0.36 0.00 0.00 175.35 175.66 1k2m s VAL 694 N 1.70 4.89 -0.21 4.02 1.01 0.34 -0.77 120.40 131.38 1k2m s VAL 694 Ca 0.06 1.81 -0.03 0.00 0.00 0.00 0.00 61.98 63.82 1k2m s VAL 694 Cb -0.17 -4.21 0.07 0.00 0.00 0.00 0.00 36.38 32.07 1k2m s VAL 694 CO 0.09 0.11 0.04 -1.61 0.00 0.00 0.00 175.10 173.73 1k2m s GLU 695 N 1.51 0.66 -0.54 2.72 0.41 0.48 0.24 118.70 124.19 1k2m s GLU 695 Ca 0.44 -0.52 -0.28 0.00 -0.41 0.00 0.00 54.97 54.21 1k2m s GLU 695 Cb -0.18 -2.07 0.01 0.00 -1.78 0.00 0.00 34.13 30.10 1k2m s GLU 695 CO 0.19 -0.70 1.51 0.42 -0.49 0.00 0.00 175.26 176.20 1k2m s ILE 696 N 1.83 3.70 -0.17 -1.63 1.01 -1.26 -0.36 121.20 124.32 1k2m s ILE 696 Ca 0.01 0.59 -0.23 0.00 0.00 0.00 0.00 60.65 61.01 1k2m s ILE 696 Cb -0.17 -4.29 -0.20 0.00 0.01 0.00 0.00 42.46 37.81 1k2m s ILE 696 CO -0.11 -1.05 0.41 0.78 0.00 0.00 0.00 174.94 174.96 1k2m h ASN 697 N 11.76 0.00 -3.78 3.58 -0.26 -1.35 -3.47 115.58 122.06 1k2m h ASN 697 Ca -0.27 -0.66 -0.68 0.00 -0.56 0.00 0.00 56.30 54.12 1k2m h ASN 697 Cb 1.11 0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 38.15 1k2m h ASN 697 CO 1.17 1.23 -0.74 -0.62 -1.06 0.00 0.00 177.43 177.41 1k2m s ASP 698 N -6.50 4.30 -0.37 5.81 -1.08 -1.11 -5.04 116.67 112.68 1k2m s ASP 698 Ca -0.23 -0.14 0.01 0.00 -0.52 0.00 0.00 52.55 51.67 1k2m s ASP 698 Cb 0.02 -1.10 0.10 0.00 -1.46 0.00 0.00 42.92 40.48 1k2m s ASP 698 CO 0.59 0.32 0.11 0.42 0.52 0.00 0.00 175.17 177.14 1k2m s THR 699 N -0.59 2.71 -1.15 1.71 -4.23 -1.26 -4.41 115.64 108.42 1k2m s THR 699 Ca 0.08 -2.22 -0.22 0.00 -1.18 0.00 0.00 61.69 58.15 1k2m s THR 699 Cb -0.12 -2.93 -0.09 0.00 1.34 0.00 0.00 72.50 70.71 1k2m s THR 699 CO 0.02 -0.64 1.92 0.35 -0.54 0.00 0.00 174.62 175.73 1k2m n THR 700 N 4.40 2.00 -3.88 3.99 -2.24 -1.26 -3.81 114.28 113.48 1k2m n THR 700 Ca 0.01 -2.05 -0.30 0.00 -2.27 0.00 0.00 64.05 59.45 1k2m n THR 700 Cb 0.42 -2.20 0.03 0.00 -2.10 0.00 0.00 70.33 66.48 1k2m n THR 700 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k2m n GLY 701 N 5.62 -0.50 3.88 3.38 0.00 -1.26 -4.89 105.19 111.41 1k2m n GLY 701 Ca 0.46 0.19 -0.35 0.00 0.00 0.00 0.00 46.02 46.32 1k2m n GLY 701 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1k2m s LEU 702 N -7.26 4.38 -0.18 0.99 0.20 -1.25 -4.37 118.68 111.20 1k2m s LEU 702 Ca 0.66 0.61 -0.30 0.00 0.69 0.00 0.00 54.13 55.79 1k2m s LEU 702 Cb -0.33 -2.62 -0.07 0.00 -0.43 0.00 0.00 46.19 42.74 1k2m s LEU 702 CO 0.81 0.27 2.15 2.22 -0.29 0.00 0.00 176.35 181.51 1k2m n PHE 703 N 1.27 2.04 0.00 5.38 1.16 -1.25 -3.97 117.46 122.08 1k2m n PHE 703 Ca -0.12 -0.11 0.00 0.00 -1.87 0.00 0.00 57.45 55.35 1k2m n PHE 703 Cb 0.53 -2.71 0.00 0.00 -1.61 0.00 0.00 39.48 35.69 1k2m n PHE 703 CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 1k2m n ASN 704 N 10.30 0.00 0.00 5.98 5.15 -1.26 -2.86 115.26 132.57 1k2m n ASN 704 Ca 0.29 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 1k2m n ASN 704 Cb 0.40 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.65 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 0.00 0.00 0.00 1.20 0.28 -1.25 -4.98 120.64 115.89 1k2m n GLU 705 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 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 0.00 0.14 -1.84 0.00 -1.13 -4.72 105.19 97.63 1k2m n GLY 706 Ca 0.00 0.00 0.14 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 0.00 0.43 -3.38 0.99 4.32 -1.26 -1.62 117.00 116.47 1k2m n LEU 707 Ca 0.00 -0.15 -0.27 0.00 -0.02 0.00 0.00 56.01 55.57 1k2m n LEU 707 Cb 0.00 -0.01 0.03 0.00 -1.62 0.00 0.00 43.42 41.82 1k2m n LEU 707 CO 0.00 0.08 -0.33 0.61 -1.22 0.00 0.00 177.39 176.53 1k2m n GLY 708 N 1.01 -0.03 3.22 -0.72 0.00 -1.26 -4.94 105.19 102.47 1k2m n GLY 708 Ca 0.21 0.84 -0.33 0.00 0.00 0.00 0.00 46.02 46.74 1k2m n GLY 708 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1k2m s MET 709 N -2.04 3.11 -0.03 1.61 0.23 -1.26 -4.67 119.30 116.25 1k2m s MET 709 Ca 0.27 -0.80 -0.17 0.00 -1.03 0.00 0.00 55.69 53.95 1k2m s MET 709 Cb -0.03 -2.52 0.06 0.00 -1.53 0.00 0.00 34.83 30.80 1k2m s MET 709 CO 0.63 0.00 0.76 1.47 -2.03 0.00 0.00 175.02 175.85 1k2m n LEU 710 N 4.06 0.00 -0.32 0.18 -0.00 -1.26 -5.00 117.00 114.66 1k2m n LEU 710 Ca -0.20 -0.16 0.27 0.00 -0.00 0.00 0.00 56.01 55.92 1k2m n LEU 710 Cb 0.52 1.01 0.59 0.00 -0.00 0.00 0.00 43.42 45.54 1k2m n LEU 710 CO 0.28 -0.05 1.25 0.06 -0.00 0.00 0.00 177.39 178.92 1k2m h GLN 711 N 0.00 0.26 -6.23 1.47 3.07 -2.04 -3.39 115.11 108.25 1k2m h GLN 711 Ca -0.12 -0.02 -0.55 0.00 0.09 0.00 0.00 58.65 58.06 1k2m h GLN 711 Cb 0.68 -0.06 -0.04 0.00 0.08 0.00 0.00 27.48 28.14 1k2m h GLN 711 CO 0.18 0.17 0.12 -1.21 0.09 0.00 0.00 178.83 178.18 1k2m s GLU 712 N -5.32 4.46 -0.57 0.06 2.02 -1.26 -5.03 118.70 113.06 1k2m s GLU 712 Ca -0.08 0.99 -0.18 0.00 0.02 0.00 0.00 54.97 55.73 1k2m s GLU 712 Cb 0.25 -3.37 0.11 0.00 0.10 0.00 0.00 34.13 31.22 1k2m s GLU 712 CO 0.80 0.27 0.62 -1.14 0.02 0.00 0.00 175.26 175.82 1k2m s GLN 713 N 0.03 3.02 -0.36 1.61 2.00 -1.26 -4.74 119.66 119.96 1k2m s GLN 713 Ca 0.37 -1.49 -0.27 0.00 -2.00 0.00 0.00 55.36 51.97 1k2m s GLN 713 Cb -0.20 -4.28 0.04 0.00 0.80 0.00 0.00 33.01 29.37 1k2m s GLN 713 CO 0.21 -1.45 0.49 0.54 -0.50 0.00 0.00 175.29 174.58 1k2m n ARG 714 N 5.86 -1.40 -4.80 1.67 5.12 -1.26 -4.97 116.66 116.88 1k2m n ARG 714 Ca -0.11 1.00 -0.26 0.00 -1.93 0.00 0.00 57.85 56.55 1k2m n ARG 714 Cb 0.41 -1.49 -0.15 0.00 -1.16 0.00 0.00 32.46 30.08 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 -1.23 1.62 0.01 1.55 -7.23 -1.26 -4.91 120.40 108.94 1k2m s VAL 715 Ca 0.26 -1.03 -0.30 0.00 -1.81 0.00 0.00 61.98 59.10 1k2m s VAL 715 Cb -0.03 -1.38 -0.03 0.00 0.56 0.00 0.00 36.38 35.50 1k2m s VAL 715 CO 0.65 0.32 1.01 -0.69 -0.31 0.00 0.00 175.10 176.08 1k2m s VAL 716 N -0.64 4.76 0.44 1.32 1.01 -1.26 -4.72 120.40 121.31 1k2m s VAL 716 Ca 0.07 1.99 0.08 0.00 0.00 0.00 0.00 61.98 64.12 1k2m s VAL 716 Cb -0.08 -4.27 0.02 0.00 0.00 0.00 0.00 36.38 32.04 1k2m s VAL 716 CO 0.01 0.16 0.60 -0.76 0.00 0.00 0.00 175.10 175.11 1k2m s LEU 717 N 0.98 3.59 0.20 3.92 1.02 0.13 -4.92 118.68 123.59 1k2m s LEU 717 Ca 0.53 -0.42 0.01 0.00 0.02 0.00 0.00 54.13 54.27 1k2m s LEU 717 Cb -0.22 -2.60 -0.04 0.00 0.02 0.00 0.00 46.19 43.35 1k2m s LEU 717 CO 0.28 -0.84 0.36 -0.75 0.02 0.00 0.00 176.35 175.42 1k2m s LYS 718 N -4.41 3.48 0.28 1.70 2.20 -1.26 -0.18 119.74 121.55 1k2m s LYS 718 Ca 0.56 -0.50 0.01 0.00 -0.36 0.00 0.00 55.97 55.68 1k2m s LYS 718 Cb -0.10 -2.88 -0.03 0.00 -1.51 0.00 0.00 37.83 33.30 1k2m s LYS 718 CO 0.34 0.44 0.46 -0.65 -0.36 0.00 0.00 175.35 175.58 1k2m s GLN 719 N -3.44 3.49 0.31 4.03 -0.21 0.58 -4.60 119.66 119.82 1k2m s GLN 719 Ca 0.36 -0.44 0.02 0.00 0.02 0.00 0.00 55.36 55.32 1k2m s GLN 719 Cb -0.11 -2.76 -0.01 0.00 1.00 0.00 0.00 33.01 31.13 1k2m s GLN 719 CO 0.29 0.29 0.06 0.25 -2.12 0.00 0.00 175.29 174.06 1k2m n THR 720 N -1.39 0.00 -0.10 -0.19 -2.24 -1.26 -4.94 114.28 104.16 1k2m n THR 720 Ca -0.06 -1.64 0.21 0.00 -2.27 0.00 0.00 64.05 60.29 1k2m n THR 720 Cb 0.56 0.48 0.64 0.00 -2.10 0.00 0.00 70.33 69.90 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 1.34 2.46 -0.22 6.98 0.00 -2.00 -0.56 119.26 127.27 1k2m h ALA 721 Ca -0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1k2m h ALA 721 Cb 0.86 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1k2m h ALA 721 CO 0.40 -0.66 0.14 1.49 0.00 0.00 0.00 179.25 180.63 1k2m h GLU 722 N 0.13 0.29 0.03 0.00 4.57 -1.99 0.80 114.58 118.41 1k2m h GLU 722 Ca 0.34 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.50 1k2m h GLU 722 Cb 1.14 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 1k2m h GLU 722 CO -0.05 0.20 -0.01 0.93 -1.18 0.00 0.00 179.01 178.90 1k2m h GLU 723 N 0.29 -0.04 -0.60 1.92 4.39 -1.52 -2.86 114.58 116.17 1k2m h GLU 723 Ca 0.08 0.00 0.12 0.00 0.34 0.00 0.00 59.36 59.90 1k2m h GLU 723 Cb -0.03 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 1k2m h GLU 723 CO -0.02 0.28 0.41 -0.22 -1.16 0.00 0.00 179.01 178.30 1k2m h LYS 724 N -0.36 0.30 -0.51 2.33 3.64 -1.24 0.01 116.57 120.75 1k2m h LYS 724 Ca -0.00 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 1k2m h LYS 724 Cb 0.34 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1k2m h LYS 724 CO 0.01 0.20 0.03 -0.44 -2.27 0.00 0.00 179.45 176.97 1k2m h ASP 725 N 0.31 0.79 -0.58 4.20 5.19 -0.62 -0.15 116.42 125.57 1k2m h ASP 725 Ca 0.28 -0.18 0.01 0.00 -0.62 0.00 0.00 57.03 56.52 1k2m h ASP 725 Cb 0.69 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 39.96 1k2m h ASP 725 CO -0.07 0.84 0.38 -0.07 -3.12 0.00 0.00 179.24 177.20 1k2m h LEU 726 N 0.78 0.64 -0.23 1.55 3.38 -0.78 -2.00 115.31 118.66 1k2m h LEU 726 Ca 0.16 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1k2m h LEU 726 Cb 0.43 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1k2m h LEU 726 CO 0.02 0.46 -0.14 1.62 0.09 0.00 0.00 178.44 180.49 1k2m h VAL 727 N 0.76 0.25 -0.76 1.22 3.04 -1.40 -3.24 116.25 116.12 1k2m h VAL 727 Ca 0.22 -1.25 0.00 0.00 -1.01 0.00 0.00 66.70 64.66 1k2m h VAL 727 Cb -0.06 2.04 -0.04 0.00 -2.01 0.00 0.00 31.29 31.22 1k2m h VAL 727 CO -0.06 0.13 0.48 0.11 -1.01 0.00 0.00 177.57 177.22 1k2m h LYS 728 N 0.00 1.02 -0.00 4.17 1.57 -0.25 -1.14 116.57 121.94 1k2m h LYS 728 Ca -0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1k2m h LYS 728 Cb 1.03 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1k2m h LYS 728 CO 0.02 0.70 -0.17 1.63 -0.57 0.00 0.00 179.45 181.05 1k2m n LYS 729 N -4.40 0.04 0.00 3.15 5.02 -1.14 -5.09 118.16 115.74 1k2m n LYS 729 Ca 0.08 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1k2m n LYS 729 Cb 0.05 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 1k2m n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77