#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 0.65 0.00 1.61 3.02 -1.26 -4.96 115.26 114.32 1k2m n ASN 574 Ca 0.00 -0.44 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 1k2m n ASN 574 Cb 0.00 0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 1k2m n ASN 574 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k2m n GLY 575 N 1.47 3.89 3.54 7.41 0.00 -1.26 -5.10 105.19 115.13 1k2m n GLY 575 Ca 0.07 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 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 2.40 0.09 1.61 3.00 -1.26 -3.14 118.95 121.65 1k2m s ARG 576 Ca 0.00 -0.80 0.00 0.00 -1.00 0.00 0.00 55.73 53.93 1k2m s ARG 576 Cb 0.00 -2.39 0.00 0.00 0.00 0.00 0.00 34.95 32.56 1k2m s ARG 576 CO 0.00 0.59 0.00 0.34 0.00 0.00 0.00 175.30 176.23 1k2m n PHE 577 N 1.65 -0.36 -4.30 5.12 7.35 -0.98 -3.85 117.46 122.09 1k2m n PHE 577 Ca -0.16 0.06 -0.34 0.00 -0.76 0.00 0.00 57.45 56.26 1k2m n PHE 577 Cb 0.52 0.12 -0.09 0.00 0.35 0.00 0.00 39.48 40.38 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 -6.29 3.60 -0.21 -2.13 0.20 -0.99 -0.91 118.68 111.96 1k2m s LEU 578 Ca 0.00 0.09 0.01 0.00 0.69 0.00 0.00 54.13 54.92 1k2m s LEU 578 Cb 0.00 -1.96 0.04 0.00 -0.43 0.00 0.00 46.19 43.84 1k2m s LEU 578 CO 0.00 0.33 -0.12 -0.89 -0.29 0.00 0.00 176.35 175.37 1k2m s THR 579 N -1.01 1.82 -0.41 3.68 2.01 0.13 0.20 115.64 122.06 1k2m s THR 579 Ca 0.17 -1.11 -0.13 0.00 0.31 0.00 0.00 61.69 60.93 1k2m s THR 579 Cb -0.11 -1.85 0.04 0.00 0.01 0.00 0.00 72.50 70.59 1k2m s THR 579 CO 0.07 0.20 0.28 -0.76 -0.69 0.00 0.00 174.62 173.72 1k2m s LEU 580 N 1.32 5.09 -0.37 4.42 1.43 0.40 0.15 118.68 131.12 1k2m s LEU 580 Ca -0.02 -1.11 0.01 0.00 -1.03 0.00 0.00 54.13 51.98 1k2m s LEU 580 Cb -0.16 -2.09 0.10 0.00 0.03 0.00 0.00 46.19 44.07 1k2m s LEU 580 CO -0.08 -0.48 0.12 -1.59 0.23 0.00 0.00 176.35 174.54 1k2m s LYS 581 N 1.59 1.77 -0.60 1.70 -2.85 -0.24 0.25 119.74 121.36 1k2m s LYS 581 Ca 0.03 -1.82 -0.34 0.00 -1.00 0.00 0.00 55.97 52.84 1k2m s LYS 581 Cb -0.21 -3.38 -0.15 0.00 -2.06 0.00 0.00 37.83 32.03 1k2m s LYS 581 CO 0.07 -0.99 2.38 -2.30 0.10 0.00 0.00 175.35 174.61 1k2m n PRO 582 N 4.43 0.54 -1.90 1.78 -0.02 0.12 -2.66 135.00 137.28 1k2m n PRO 582 Ca 0.00 0.09 -0.32 0.00 -2.02 0.00 0.00 63.50 61.25 1k2m n PRO 582 Cb 0.42 -2.16 0.02 0.00 -0.02 0.00 0.00 33.50 31.76 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 8.47 3.39 0.59 2.45 2.34 -1.08 -1.47 118.68 133.37 1k2m s LEU 583 Ca 1.18 1.76 0.29 0.00 0.06 0.00 0.00 54.13 57.42 1k2m s LEU 583 Cb -0.98 -4.52 1.44 0.00 -0.56 0.00 0.00 46.19 41.57 1k2m s LEU 583 CO 0.48 -1.26 1.85 -0.65 -1.06 0.00 0.00 176.35 175.71 1k2m h PRO 584 N 0.09 0.00 0.00 1.48 0.11 -1.90 0.25 132.00 132.04 1k2m h PRO 584 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1k2m h PRO 584 Cb 1.22 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 -0.11 -0.44 -0.21 0.00 0.00 178.00 177.81 1k2m h ASP 585 N 0.00 0.00 -2.83 -2.05 3.32 -1.91 -3.43 116.42 109.52 1k2m h ASP 585 Ca 0.24 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.74 1k2m h ASP 585 Cb 1.33 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.86 1k2m h ASP 585 CO -0.00 0.11 -0.37 -0.94 -1.72 0.00 0.00 179.24 176.32 1k2m s SER 586 N -6.46 6.39 0.63 6.45 1.04 0.88 -4.80 113.70 117.82 1k2m s SER 586 Ca -0.04 0.37 0.25 0.00 0.48 0.00 0.00 55.95 57.01 1k2m s SER 586 Cb 0.14 -1.99 1.25 0.00 0.10 0.00 0.00 66.02 65.52 1k2m s SER 586 CO 0.62 0.01 1.69 0.16 0.98 0.00 0.00 173.24 176.69 1k2m h ILE 587 N 1.67 0.14 -3.83 -1.02 3.07 -1.68 -3.35 117.51 112.52 1k2m h ILE 587 Ca -0.48 0.00 -0.65 0.00 1.55 0.00 0.00 64.86 65.29 1k2m h ILE 587 Cb 1.19 0.45 -0.17 0.00 -0.27 0.00 0.00 36.82 38.02 1k2m h ILE 587 CO 0.69 0.00 -0.47 -0.63 -1.05 0.00 0.00 178.15 176.69 1k2m s ILE 588 N -4.34 5.29 -0.53 0.16 1.01 -1.26 -4.98 121.20 116.53 1k2m s ILE 588 Ca -0.03 0.10 0.04 0.00 0.00 0.00 0.00 60.65 60.76 1k2m s ILE 588 Cb 0.11 -3.61 0.39 0.00 0.01 0.00 0.00 42.46 39.37 1k2m s ILE 588 CO 0.38 0.16 1.17 0.00 0.00 0.00 0.00 174.94 176.65 1k2m n GLN 589 N 5.11 3.40 -4.55 2.79 1.13 -1.24 -3.36 117.38 120.65 1k2m n GLN 589 Ca -0.13 -4.53 -0.26 0.00 -1.94 0.00 0.00 57.00 50.15 1k2m n GLN 589 Cb 0.51 -2.26 -0.10 0.00 0.11 0.00 0.00 30.24 28.50 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 -3.60 1.85 -0.07 -1.09 2.02 -0.54 -4.88 118.70 112.39 1k2m s GLU 590 Ca 0.48 -2.07 0.04 0.00 0.02 0.00 0.00 54.97 53.44 1k2m s GLU 590 Cb 0.36 -1.18 0.00 0.00 0.10 0.00 0.00 34.13 33.41 1k2m s GLU 590 CO -0.19 -0.19 -0.18 -1.54 0.02 0.00 0.00 175.26 173.17 1k2m s SER 591 N -3.62 2.38 -0.01 -0.19 1.04 -1.26 0.12 113.70 112.16 1k2m s SER 591 Ca 0.31 -0.41 0.04 0.00 0.48 0.00 0.00 55.95 56.37 1k2m s SER 591 Cb 0.08 -0.91 -0.03 0.00 0.10 0.00 0.00 66.02 65.26 1k2m s SER 591 CO 0.15 0.13 -0.11 -0.76 0.98 0.00 0.00 173.24 173.62 1k2m s LEU 592 N 0.29 2.93 -0.16 2.42 1.43 0.68 -4.92 118.68 121.35 1k2m s LEU 592 Ca -0.11 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 1k2m s LEU 592 Cb -0.15 -1.67 0.03 0.00 0.03 0.00 0.00 46.19 44.43 1k2m s LEU 592 CO 0.05 0.30 -0.14 -1.61 0.23 0.00 0.00 176.35 175.18 1k2m s GLU 593 N -1.20 2.27 -0.49 1.70 8.01 -1.26 0.15 118.70 127.88 1k2m s GLU 593 Ca 0.15 -0.63 -0.26 0.00 0.01 0.00 0.00 54.97 54.24 1k2m s GLU 593 Cb -0.11 -2.19 0.03 0.00 -4.31 0.00 0.00 34.13 27.55 1k2m s GLU 593 CO 0.05 -0.27 0.99 0.42 0.01 0.00 0.00 175.26 176.46 1k2m s ILE 594 N 1.46 4.36 -0.02 -1.63 1.01 0.53 -4.95 121.20 121.95 1k2m s ILE 594 Ca 0.04 0.79 -0.30 0.00 0.00 0.00 0.00 60.65 61.17 1k2m s ILE 594 Cb -0.13 -4.51 -0.06 0.00 0.01 0.00 0.00 42.46 37.76 1k2m s ILE 594 CO -0.10 -0.96 1.69 -1.58 0.00 0.00 0.00 174.94 173.98 1k2m s GLN 595 N 4.04 4.18 0.57 2.79 0.74 -1.26 -2.32 119.66 128.39 1k2m s GLN 595 Ca 0.39 2.26 0.34 0.00 0.05 0.00 0.00 55.36 58.40 1k2m s GLN 595 Cb -0.10 -3.94 1.45 0.00 1.10 0.00 0.00 33.01 31.52 1k2m s GLN 595 CO 0.26 -0.84 1.73 -0.56 -0.55 0.00 0.00 175.29 175.33 1k2m h GLN 596 N 9.45 0.00 0.00 1.67 -0.00 -1.82 0.90 115.11 125.32 1k2m h GLN 596 Ca -0.41 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.24 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 0.95 0.00 0.00 0.78 -0.00 0.00 0.00 178.83 180.56 1k2m h GLY 597 N 0.00 0.00 -7.77 0.06 0.00 -1.88 -3.42 103.07 90.06 1k2m h GLY 597 Ca 0.49 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 47.16 1k2m h GLY 597 CO -0.01 0.00 -0.51 0.14 0.00 0.00 0.00 176.54 176.16 1k2m s VAL 598 N -3.47 5.18 -0.04 4.60 1.01 0.31 -5.05 120.40 122.94 1k2m s VAL 598 Ca 0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.96 1k2m s VAL 598 Cb 0.08 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.94 1k2m s VAL 598 CO 0.57 0.15 0.06 0.21 0.00 0.00 0.00 175.10 176.09 1k2m s ASN 599 N 1.73 0.94 0.43 3.32 2.47 -1.26 -3.99 114.94 118.57 1k2m s ASN 599 Ca 0.06 0.09 -0.03 0.00 0.42 0.00 0.00 52.86 53.40 1k2m s ASN 599 Cb -0.17 -0.11 -0.04 0.00 -1.45 0.00 0.00 41.25 39.49 1k2m s ASN 599 CO 0.10 -0.23 0.69 -2.16 -3.72 0.00 0.00 177.10 171.78 1k2m s PRO 600 N 1.99 3.52 -0.35 0.43 0.04 -1.26 -5.03 135.00 134.34 1k2m s PRO 600 Ca 0.03 0.00 -0.20 0.00 0.04 0.00 0.00 61.00 60.87 1k2m s PRO 600 Cb -0.12 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.93 1k2m s PRO 600 CO -0.03 -0.07 0.61 0.12 0.04 0.00 0.00 177.00 177.67 1k2m s PHE 601 N -2.57 3.16 0.01 0.56 5.36 0.18 -4.90 117.98 119.77 1k2m s PHE 601 Ca 0.45 0.31 -0.17 0.00 -0.96 0.00 0.00 56.93 56.55 1k2m s PHE 601 Cb -0.10 -3.09 -0.06 0.00 -0.34 0.00 0.00 43.02 39.43 1k2m s PHE 601 CO 0.41 -0.61 0.47 -0.06 -1.46 0.00 0.00 175.22 173.98 1k2m s PHE 602 N 2.63 3.72 0.05 10.12 0.08 -1.26 0.29 117.98 133.62 1k2m s PHE 602 Ca 0.23 1.08 0.07 0.00 0.12 0.00 0.00 56.93 58.42 1k2m s PHE 602 Cb -0.15 -2.40 -0.03 0.00 -0.57 0.00 0.00 43.02 39.88 1k2m s PHE 602 CO 0.14 0.55 -0.19 0.42 -0.10 0.00 0.00 175.22 176.05 1k2m s ILE 603 N -0.83 1.51 -4.98 0.64 1.09 0.35 0.16 121.20 119.15 1k2m s ILE 603 Ca 0.26 -1.21 0.00 0.00 -1.10 0.00 0.00 60.65 58.60 1k2m s ILE 603 Cb -0.17 -1.34 0.00 0.00 -1.06 0.00 0.00 42.46 39.89 1k2m s ILE 603 CO 0.15 0.09 0.00 0.61 -0.10 0.00 0.00 174.94 175.69 1k2m n GLY 604 N 1.72 -2.14 0.09 6.18 0.00 -1.15 -2.78 105.19 107.10 1k2m n GLY 604 Ca -0.18 -1.28 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 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 0.15 -6.60 1.61 3.08 0.11 0.34 114.38 113.07 1k2m h ARG 605 Ca 0.00 -0.05 -0.52 0.00 0.07 0.00 0.00 59.98 59.48 1k2m h ARG 605 Cb 0.00 -0.01 0.05 0.00 0.08 0.00 0.00 29.97 30.09 1k2m h ARG 605 CO 0.00 0.40 1.03 -1.12 -1.07 0.00 0.00 179.97 179.21 1k2m s SER 606 N -5.64 6.42 0.52 7.04 0.01 -0.91 -4.52 113.70 116.61 1k2m s SER 606 Ca -0.14 2.80 0.32 0.00 1.31 0.00 0.00 55.95 60.23 1k2m s SER 606 Cb 0.05 -2.59 1.75 0.00 0.21 0.00 0.00 66.02 65.44 1k2m s SER 606 CO 0.69 -0.96 1.98 -0.08 0.41 0.00 0.00 173.24 175.28 1k2m h GLU 607 N 7.39 0.00 -0.43 12.44 4.57 -1.89 -1.00 114.58 135.66 1k2m h GLU 607 Ca -0.44 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 57.83 1k2m h GLU 607 Cb 1.21 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.77 1k2m h GLU 607 CO 0.95 0.00 0.29 -0.44 -1.18 0.00 0.00 179.01 178.63 1k2m h ASP 608 N 0.00 0.18 -3.37 1.04 3.32 -1.91 -3.41 116.42 112.26 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 0.14 -0.04 0.03 0.00 0.22 0.00 0.00 39.33 39.68 1k2m h ASP 608 CO 0.00 0.11 0.63 0.00 -1.72 0.00 0.00 179.24 178.26 1k2m h ASN 610 N 5.51 0.00 -3.78 0.00 2.35 -0.53 -3.37 115.58 115.76 1k2m h ASN 610 Ca -0.44 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 54.62 1k2m h ASN 610 Cb 1.21 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.39 1k2m h ASN 610 CO 0.77 0.00 -0.73 0.00 -1.65 0.00 0.00 177.43 175.82 1k2m s LYS 612 N -1.07 2.33 -0.19 0.00 2.36 -1.26 -2.92 119.74 119.00 1k2m s LYS 612 Ca 0.14 -1.49 -0.04 0.00 -2.55 0.00 0.00 55.97 52.03 1k2m s LYS 612 Cb -0.11 -3.48 0.06 0.00 -1.05 0.00 0.00 37.83 33.25 1k2m s LYS 612 CO 0.04 -0.85 0.08 0.42 1.55 0.00 0.00 175.35 176.58 1k2m s ILE 613 N 1.27 0.07 -0.41 5.43 -1.09 0.12 -4.94 121.20 121.64 1k2m s ILE 613 Ca 0.02 -0.33 -0.10 0.00 -2.23 0.00 0.00 60.65 58.01 1k2m s ILE 613 Cb -0.21 -0.73 0.07 0.00 -1.58 0.00 0.00 42.46 40.00 1k2m s ILE 613 CO -0.01 -0.31 0.25 -1.61 -1.23 0.00 0.00 174.94 172.03 1k2m s GLU 614 N 2.06 2.65 -0.22 2.79 2.02 -1.26 0.17 118.70 126.92 1k2m s GLU 614 Ca 0.02 -1.38 -0.01 0.00 0.02 0.00 0.00 54.97 53.62 1k2m s GLU 614 Cb -0.16 -3.77 0.06 0.00 0.10 0.00 0.00 34.13 30.35 1k2m s GLU 614 CO -0.12 -0.90 -0.01 0.34 0.02 0.00 0.00 175.26 174.59 1k2m s ASP 615 N 2.02 3.40 0.50 -0.19 2.15 -1.26 -4.99 116.67 118.29 1k2m s ASP 615 Ca 0.03 -1.01 0.45 0.00 0.43 0.00 0.00 52.55 52.45 1k2m s ASP 615 Cb -0.22 -0.89 1.56 0.00 -0.30 0.00 0.00 42.92 43.07 1k2m s ASP 615 CO 0.03 -0.27 1.40 -0.46 -0.17 0.00 0.00 175.17 175.70 1k2m n ASN 616 N 4.86 0.00 0.00 -0.34 0.23 -1.26 0.12 115.26 118.87 1k2m n ASN 616 Ca -0.10 0.89 -0.18 0.00 -0.53 0.00 0.00 54.58 54.66 1k2m n ASN 616 Cb 0.45 -0.45 -0.09 0.00 -2.08 0.00 0.00 39.78 37.62 1k2m n ASN 616 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 1k2m h ARG 617 N 0.00 0.64 -6.19 -3.83 9.65 -2.01 -3.44 114.38 109.19 1k2m h ARG 617 Ca 0.85 -0.60 -0.56 0.00 -1.10 0.00 0.00 59.98 58.56 1k2m h ARG 617 Cb 3.40 0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 32.09 1k2m h ARG 617 CO -0.01 1.21 0.01 -0.48 2.80 0.00 0.00 179.97 183.50 1k2m s LEU 618 N -8.34 4.47 1.03 3.80 0.05 0.31 -4.78 118.68 115.22 1k2m s LEU 618 Ca -0.11 1.26 -0.11 0.00 0.05 0.00 0.00 54.13 55.21 1k2m s LEU 618 Cb 0.06 -2.97 0.21 0.00 -2.05 0.00 0.00 46.19 41.44 1k2m s LEU 618 CO 0.88 0.16 1.10 -0.44 -0.55 0.00 0.00 176.35 177.49 1k2m s SER 619 N -0.56 2.02 0.56 1.48 0.01 -1.26 -4.47 113.70 111.48 1k2m s SER 619 Ca 0.31 1.93 0.27 0.00 1.31 0.00 0.00 55.95 59.78 1k2m s SER 619 Cb -0.19 -2.47 1.47 0.00 0.21 0.00 0.00 66.02 65.04 1k2m s SER 619 CO 0.19 -3.62 1.98 0.08 0.41 0.00 0.00 173.24 172.27 1k2m h ARG 620 N -2.23 0.00 -2.15 12.44 0.11 -1.93 -1.96 114.38 118.65 1k2m h ARG 620 Ca -0.51 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.03 1k2m h ARG 620 Cb 1.30 0.00 -0.41 0.00 1.11 0.00 0.00 29.97 31.97 1k2m h ARG 620 CO 0.45 0.00 -0.90 0.28 0.10 0.00 0.00 179.97 179.90 1k2m n VAL 621 N -4.08 1.52 -0.22 0.08 0.31 -1.26 -1.30 118.33 113.38 1k2m n VAL 621 Ca 0.09 -5.09 0.03 0.00 -0.01 0.00 0.00 64.34 59.36 1k2m n VAL 621 Cb 0.60 -0.95 0.13 0.00 -0.91 0.00 0.00 33.84 32.72 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 3.07 0.08 -2.19 3.52 2.76 -1.19 -3.38 115.15 117.81 1k2m h HIS 622 Ca 0.12 0.05 0.13 0.00 -2.20 0.00 0.00 60.37 58.47 1k2m h HIS 622 Cb 0.72 0.07 -0.15 0.00 1.55 0.00 0.00 27.41 29.61 1k2m h HIS 622 CO 0.65 -0.14 0.53 0.00 -1.30 0.00 0.00 177.93 177.67 1k2m s PHE 624 N -3.06 0.07 -0.20 0.00 -0.12 0.25 -0.49 117.98 114.43 1k2m s PHE 624 Ca 0.06 -0.17 -0.09 0.00 -0.05 0.00 0.00 56.93 56.69 1k2m s PHE 624 Cb -0.01 -0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.27 1k2m s PHE 624 CO -0.07 -0.23 0.10 0.42 -0.05 0.00 0.00 175.22 175.38 1k2m s ILE 625 N -1.20 5.02 -0.07 -4.49 1.09 0.15 0.16 121.20 121.86 1k2m s ILE 625 Ca -0.13 0.05 0.05 0.00 -1.10 0.00 0.00 60.65 59.52 1k2m s ILE 625 Cb -0.07 -3.29 -0.01 0.00 -1.06 0.00 0.00 42.46 38.02 1k2m s ILE 625 CO 0.01 0.42 -0.22 0.12 -0.10 0.00 0.00 174.94 175.17 1k2m s PHE 626 N 0.61 2.54 -0.13 3.97 5.36 0.45 0.52 117.98 131.29 1k2m s PHE 626 Ca 0.05 -0.69 -0.10 0.00 -0.96 0.00 0.00 56.93 55.23 1k2m s PHE 626 Cb -0.12 -1.65 -0.05 0.00 -0.34 0.00 0.00 43.02 40.86 1k2m s PHE 626 CO 0.01 -0.19 0.21 0.21 -1.46 0.00 0.00 175.22 174.00 1k2m s LYS 627 N -0.10 3.88 0.09 10.12 2.20 -1.26 0.19 119.74 134.86 1k2m s LYS 627 Ca -0.05 -0.02 0.01 0.00 -0.36 0.00 0.00 55.97 55.56 1k2m s LYS 627 Cb -0.14 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1k2m s LYS 627 CO 0.04 0.52 -0.06 0.21 -0.36 0.00 0.00 175.35 175.70 1k2m s LYS 628 N -0.35 0.80 -0.34 4.03 2.36 0.27 -4.91 119.74 121.60 1k2m s LYS 628 Ca 0.15 -1.30 -0.29 0.00 -2.55 0.00 0.00 55.97 51.98 1k2m s LYS 628 Cb -0.13 -0.17 0.00 0.00 -1.05 0.00 0.00 37.83 36.49 1k2m s LYS 628 CO 0.04 -0.02 1.36 0.50 1.55 0.00 0.00 175.35 178.78 1k2m s ARG 629 N -3.76 3.76 0.26 4.03 6.06 -1.26 0.24 118.95 128.28 1k2m s ARG 629 Ca 0.11 1.13 -0.31 0.00 -2.50 0.00 0.00 55.73 54.16 1k2m s ARG 629 Cb 0.05 -3.95 -0.11 0.00 0.06 0.00 0.00 34.95 31.00 1k2m s ARG 629 CO -0.05 -1.32 1.59 -1.58 -2.50 0.00 0.00 175.30 171.44 1k2m s HIS 630 N 4.86 2.86 -0.27 5.12 5.65 0.27 -4.86 115.29 128.93 1k2m s HIS 630 Ca 0.59 0.72 -0.04 0.00 0.25 0.00 0.00 55.06 56.58 1k2m s HIS 630 Cb -0.16 -4.02 0.09 0.00 -1.18 0.00 0.00 32.58 27.31 1k2m s HIS 630 CO 0.27 -3.55 0.12 0.00 -0.65 0.00 0.00 174.74 170.93 1k2m s ALA 631 N 0.34 0.61 1.34 1.58 0.00 -1.26 -1.87 121.76 122.50 1k2m s ALA 631 Ca 0.65 -0.96 -0.17 0.00 0.00 0.00 0.00 51.96 51.49 1k2m s ALA 631 Cb -0.47 -1.33 0.26 0.00 0.00 0.00 0.00 23.12 21.59 1k2m s ALA 631 CO 0.42 -1.56 0.60 1.33 0.00 0.00 0.00 175.76 176.55 1k2m n VAL 632 N 5.24 0.00 -0.11 0.00 0.24 -1.26 -4.91 118.33 117.53 1k2m n VAL 632 Ca -0.06 -0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.01 1k2m n VAL 632 Cb 0.43 -0.68 -0.11 0.00 -1.47 0.00 0.00 33.84 32.01 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 -3.99 -0.78 3.41 7.63 0.00 -1.26 -4.96 105.19 105.24 1k2m n GLY 633 Ca 0.09 0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 1k2m n GLY 633 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k2m s LYS 634 N -2.39 1.54 -0.29 1.61 1.02 -1.26 -5.16 119.74 114.81 1k2m s LYS 634 Ca -0.30 -1.82 -0.21 0.00 0.02 0.00 0.00 55.97 53.65 1k2m s LYS 634 Cb 0.07 -0.83 0.15 0.00 -0.52 0.00 0.00 37.83 36.71 1k2m s LYS 634 CO 0.58 -0.13 1.12 -1.54 -0.92 0.00 0.00 175.35 174.47 1k2m s SER 635 N -3.42 -0.34 -0.22 2.83 1.04 -1.26 -4.87 113.70 107.45 1k2m s SER 635 Ca 0.33 0.61 0.01 0.00 0.48 0.00 0.00 55.95 57.39 1k2m s SER 635 Cb 0.07 0.83 0.03 0.00 0.10 0.00 0.00 66.02 67.06 1k2m s SER 635 CO 0.13 -0.10 -0.14 -0.04 0.98 0.00 0.00 173.24 174.07 1k2m s MET 636 N 0.61 2.72 0.00 4.02 -1.94 -1.26 -4.90 119.30 118.55 1k2m s MET 636 Ca -0.01 -1.02 0.00 0.00 -1.71 0.00 0.00 55.69 52.95 1k2m s MET 636 Cb -0.04 -2.76 0.00 0.00 2.01 0.00 0.00 34.83 34.04 1k2m s MET 636 CO -0.11 -0.36 0.00 0.98 -0.01 0.00 0.00 175.02 175.52 1k2m n TYR 637 N 4.57 0.00 -2.59 -0.03 4.19 -1.26 -4.78 117.16 117.26 1k2m n TYR 637 Ca -0.18 0.00 -0.37 0.00 3.31 0.00 0.00 57.90 60.66 1k2m n TYR 637 Cb 0.47 0.00 -0.05 0.00 0.49 0.00 0.00 39.34 40.25 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 4.37 -0.46 2.98 2.02 -1.26 -5.02 118.70 121.33 1k2m s GLU 638 Ca 0.00 1.52 -0.14 0.00 0.02 0.00 0.00 54.97 56.37 1k2m s GLU 638 Cb 0.00 -2.74 0.07 0.00 0.10 0.00 0.00 34.13 31.56 1k2m s GLU 638 CO 0.00 0.04 0.37 -1.12 0.02 0.00 0.00 175.26 174.57 1k2m s SER 639 N -1.44 6.05 0.00 -0.19 0.01 -1.26 -4.84 113.70 112.03 1k2m s SER 639 Ca 0.53 -1.36 0.00 0.00 1.31 0.00 0.00 55.95 56.43 1k2m s SER 639 Cb -0.23 -2.15 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1k2m s SER 639 CO 0.29 -0.62 0.00 -2.65 0.41 0.00 0.00 173.24 170.67 1k2m n PRO 640 N 5.15 2.11 -0.39 12.44 -0.02 -1.26 -4.64 135.00 148.38 1k2m n PRO 640 Ca -0.12 0.00 0.39 0.00 -2.02 0.00 0.00 63.50 61.75 1k2m n PRO 640 Cb 0.44 0.00 0.74 0.00 -0.02 0.00 0.00 33.50 34.66 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 -2.00 3.26 -1.05 3.55 0.00 -1.92 -3.40 119.26 117.71 1k2m h ALA 641 Ca 0.00 -0.05 -0.51 0.00 0.00 0.00 0.00 54.91 54.35 1k2m h ALA 641 Cb 0.00 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1k2m h ALA 641 CO 0.00 -1.72 1.63 0.94 0.00 0.00 0.00 179.25 180.11 1k2m n GLN 642 N -3.98 0.76 0.00 0.00 -0.06 -1.25 -1.69 117.38 111.17 1k2m n GLN 642 Ca 0.29 0.06 0.00 0.00 -2.00 0.00 0.00 57.00 55.36 1k2m n GLN 642 Cb 1.45 -2.69 0.00 0.00 -4.06 0.00 0.00 30.24 24.94 1k2m n GLN 642 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1k2m n GLY 643 N 6.24 0.78 2.13 1.69 0.00 -0.78 -4.93 105.19 110.32 1k2m n GLY 643 Ca 0.46 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.32 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 -4.73 0.99 4.32 -0.68 -4.94 117.00 111.96 1k2m n LEU 644 Ca 0.00 -1.69 -0.32 0.00 -0.02 0.00 0.00 56.01 53.98 1k2m n LEU 644 Cb 0.00 0.05 -0.08 0.00 -1.62 0.00 0.00 43.42 41.78 1k2m n LEU 644 CO 0.00 -0.38 -0.29 -1.81 -1.22 0.00 0.00 177.39 173.69 1k2m s ASP 645 N -2.75 5.37 0.19 -1.43 1.01 -0.84 0.95 116.67 119.18 1k2m s ASP 645 Ca 0.12 0.03 0.06 0.00 0.71 0.00 0.00 52.55 53.47 1k2m s ASP 645 Cb -0.01 -1.45 -0.05 0.00 1.01 0.00 0.00 42.92 42.42 1k2m s ASP 645 CO 0.07 0.25 -0.12 -1.81 0.21 0.00 0.00 175.17 173.78 1k2m s ASP 646 N -1.81 2.24 -0.23 0.27 1.01 0.66 -3.27 116.67 115.53 1k2m s ASP 646 Ca 0.23 -1.04 -0.06 0.00 0.71 0.00 0.00 52.55 52.39 1k2m s ASP 646 Cb -0.12 -0.08 -0.02 0.00 1.01 0.00 0.00 42.92 43.71 1k2m s ASP 646 CO 0.14 -0.26 0.02 0.27 0.21 0.00 0.00 175.17 175.55 1k2m s ILE 647 N -3.14 3.96 -0.19 0.77 -4.36 -1.26 0.96 121.20 117.93 1k2m s ILE 647 Ca 0.21 -0.30 -0.07 0.00 -0.26 0.00 0.00 60.65 60.24 1k2m s ILE 647 Cb 0.01 -2.83 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 1k2m s ILE 647 CO 0.05 0.38 0.05 0.26 0.24 0.00 0.00 174.94 175.92 1k2m s TRP 648 N 1.46 3.18 -0.30 1.37 0.52 0.50 0.11 118.94 125.78 1k2m s TRP 648 Ca 0.05 -0.08 -0.20 0.00 0.02 0.00 0.00 56.10 55.89 1k2m s TRP 648 Cb -0.15 -2.10 -0.01 0.00 -1.15 0.00 0.00 33.47 30.07 1k2m s TRP 648 CO 0.01 0.02 0.62 -0.47 0.02 0.00 0.00 176.95 177.15 1k2m s TYR 649 N 0.64 3.21 -0.21 -1.98 6.14 0.24 0.17 117.35 125.57 1k2m s TYR 649 Ca 0.02 0.57 -0.09 0.00 0.64 0.00 0.00 57.07 58.22 1k2m s TYR 649 Cb -0.13 -2.97 -0.04 0.00 0.42 0.00 0.00 41.96 39.23 1k2m s TYR 649 CO 0.02 -0.47 0.10 0.00 0.64 0.00 0.00 175.55 175.84 1k2m s HIS 651 N 0.66 3.03 0.00 0.00 2.46 -0.61 0.87 115.29 121.69 1k2m s HIS 651 Ca 0.05 -0.43 0.00 0.00 0.47 0.00 0.00 55.06 55.15 1k2m s HIS 651 Cb -0.13 -2.05 0.00 0.00 -0.13 0.00 0.00 32.58 30.28 1k2m s HIS 651 CO 0.01 -0.19 0.57 0.25 -2.47 0.00 0.00 174.74 172.91 1k2m n THR 652 N 4.06 0.19 -1.68 0.89 -2.24 -0.09 0.29 114.28 115.70 1k2m n THR 652 Ca -0.17 -0.56 -0.31 0.00 -2.27 0.00 0.00 64.05 60.74 1k2m n THR 652 Cb 0.52 0.96 0.04 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 -0.19 1.66 0.16 3.38 0.00 0.56 -4.81 107.32 108.08 1k2m s GLY 653 Ca 0.00 -0.04 0.22 0.00 0.00 0.00 0.00 44.72 44.90 1k2m s GLY 653 CO 0.00 0.28 0.96 2.41 0.00 0.00 0.00 173.10 176.75 1k2m n THR 654 N -3.06 0.52 1.81 0.90 -1.04 -1.26 -3.60 114.28 108.54 1k2m n THR 654 Ca 0.07 -0.53 0.11 0.00 -2.04 0.00 0.00 64.05 61.66 1k2m n THR 654 Cb 0.54 -0.28 0.61 0.00 -1.82 0.00 0.00 70.33 69.38 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 -2.60 0.45 -1.76 8.00 3.02 -1.26 -4.86 115.26 116.25 1k2m n ASN 655 Ca -0.01 -1.38 0.00 0.00 -0.03 0.00 0.00 54.58 53.16 1k2m n ASN 655 Cb 0.55 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 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 -0.54 -3.71 -3.42 2.41 3.14 -1.25 -4.88 118.33 110.07 1k2m n VAL 656 Ca 0.17 1.72 -0.19 0.00 -2.96 0.00 0.00 64.34 63.08 1k2m n VAL 656 Cb 0.15 -2.23 -0.01 0.00 -1.06 0.00 0.00 33.84 30.70 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 -1.75 5.80 -0.11 6.55 1.04 0.65 -4.70 113.70 121.18 1k2m s SER 657 Ca 0.00 -0.29 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 1k2m s SER 657 Cb 0.00 -1.06 0.02 0.00 0.10 0.00 0.00 66.02 65.08 1k2m s SER 657 CO 0.00 -0.50 -0.08 -0.31 0.98 0.00 0.00 173.24 173.33 1k2m s TYR 658 N -2.24 1.49 -0.60 5.02 1.51 0.41 0.11 117.35 123.05 1k2m s TYR 658 Ca 0.47 -0.73 -0.19 0.00 -1.01 0.00 0.00 57.07 55.61 1k2m s TYR 658 Cb -0.09 -1.22 0.10 0.00 -0.11 0.00 0.00 41.96 40.64 1k2m s TYR 658 CO 0.31 -0.50 0.72 -1.17 -1.11 0.00 0.00 175.55 173.80 1k2m s LEU 659 N 1.63 5.38 0.00 -1.29 2.96 0.42 0.18 118.68 127.96 1k2m s LEU 659 Ca 0.04 -1.45 0.00 0.00 -0.22 0.00 0.00 54.13 52.50 1k2m s LEU 659 Cb -0.13 -2.31 0.00 0.00 0.50 0.00 0.00 46.19 44.26 1k2m s LEU 659 CO -0.07 -1.12 0.00 -3.20 -1.32 0.00 0.00 176.35 170.64 1k2m n ASN 660 N 6.35 0.00 0.00 3.68 4.05 -0.78 -0.42 115.26 128.14 1k2m n ASN 660 Ca -0.09 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.94 1k2m n ASN 660 Cb 0.43 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.44 1k2m n ASN 660 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1k2m n ASN 661 N 1.49 0.28 -4.87 1.20 4.13 -1.26 -5.01 115.26 111.22 1k2m n ASN 661 Ca 0.00 -0.72 -0.36 0.00 1.68 0.00 0.00 54.58 55.18 1k2m n ASN 661 Cb 0.00 0.16 -0.06 0.00 -1.54 0.00 0.00 39.78 38.34 1k2m n ASN 661 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1k2m s ASN 662 N -0.16 6.55 0.23 6.41 0.01 0.44 -5.08 114.94 123.35 1k2m s ASN 662 Ca 0.00 0.65 -0.26 0.00 -0.71 0.00 0.00 52.86 52.54 1k2m s ASN 662 Cb 0.00 -2.13 -0.09 0.00 0.41 0.00 0.00 41.25 39.44 1k2m s ASN 662 CO 0.00 0.32 0.85 -0.60 -1.51 0.00 0.00 177.10 176.16 1k2m s ARG 663 N -1.37 4.61 -0.36 -0.60 3.52 -1.26 -0.43 118.95 123.06 1k2m s ARG 663 Ca 0.23 1.25 0.03 0.00 -0.13 0.00 0.00 55.73 57.10 1k2m s ARG 663 Cb -0.14 -3.11 0.11 0.00 -1.56 0.00 0.00 34.95 30.25 1k2m s ARG 663 CO 0.12 0.47 0.10 -1.64 -0.81 0.00 0.00 175.30 173.54 1k2m s MET 664 N -1.48 1.33 0.39 5.12 -1.94 0.29 -4.82 119.30 118.20 1k2m s MET 664 Ca 0.41 -1.78 -0.07 0.00 -1.71 0.00 0.00 55.69 52.55 1k2m s MET 664 Cb -0.22 -2.84 -0.05 0.00 2.01 0.00 0.00 34.83 33.73 1k2m s MET 664 CO 0.27 -0.99 0.71 0.96 -0.01 0.00 0.00 175.02 175.95 1k2m s ILE 665 N 0.89 4.90 -0.45 2.53 -4.36 -1.26 -0.26 121.20 123.19 1k2m s ILE 665 Ca 0.12 0.30 -0.37 0.00 -0.26 0.00 0.00 60.65 60.44 1k2m s ILE 665 Cb -0.20 -3.78 -0.14 0.00 1.25 0.00 0.00 42.46 39.59 1k2m s ILE 665 CO -0.11 -0.56 2.23 1.67 0.24 0.00 0.00 174.94 178.41 1k2m n GLN 666 N -1.49 0.67 0.00 0.37 7.27 -1.24 -1.48 117.38 121.49 1k2m n GLN 666 Ca 0.00 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.24 1k2m n GLN 666 Cb 0.54 -2.15 0.00 0.00 2.41 0.00 0.00 30.24 31.04 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 6.79 1.42 3.50 1.69 0.00 0.14 -4.97 105.19 113.77 1k2m n GLY 667 Ca 0.47 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.24 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 2.37 0.05 2.61 -4.23 -0.55 -0.48 115.64 113.41 1k2m s THR 668 Ca 0.00 -2.32 0.04 0.00 -1.18 0.00 0.00 61.69 58.23 1k2m s THR 668 Cb 0.00 -2.46 -0.02 0.00 1.34 0.00 0.00 72.50 71.35 1k2m s THR 668 CO 0.00 -0.31 -0.11 -0.75 -0.54 0.00 0.00 174.62 172.91 1k2m s LYS 669 N -3.56 0.69 -0.05 3.99 2.20 0.29 -1.58 119.74 121.72 1k2m s LYS 669 Ca 0.31 -0.77 -0.10 0.00 -0.36 0.00 0.00 55.97 55.05 1k2m s LYS 669 Cb -0.02 -0.59 0.02 0.00 -1.51 0.00 0.00 37.83 35.73 1k2m s LYS 669 CO 0.16 0.13 0.25 0.12 -0.36 0.00 0.00 175.35 175.64 1k2m s PHE 670 N -1.14 -0.18 0.16 4.03 5.36 -0.44 -0.34 117.98 125.42 1k2m s PHE 670 Ca -0.04 0.40 -0.31 0.00 -0.96 0.00 0.00 56.93 56.02 1k2m s PHE 670 Cb -0.09 0.06 -0.08 0.00 -0.34 0.00 0.00 43.02 42.57 1k2m s PHE 670 CO 0.01 -0.24 1.33 -1.17 -1.46 0.00 0.00 175.22 173.70 1k2m s LEU 671 N -0.59 4.40 -0.21 6.12 1.98 -1.26 0.81 118.68 129.92 1k2m s LEU 671 Ca -0.07 2.35 -0.04 0.00 -2.89 0.00 0.00 54.13 53.48 1k2m s LEU 671 Cb -0.04 -3.60 -0.02 0.00 0.66 0.00 0.00 46.19 43.19 1k2m s LEU 671 CO 0.02 -0.57 -0.02 -0.76 -1.89 0.00 0.00 176.35 173.12 1k2m s LEU 672 N 0.42 3.06 -0.05 -0.68 1.43 0.31 -4.86 118.68 118.30 1k2m s LEU 672 Ca 0.60 -0.31 0.04 0.00 -1.03 0.00 0.00 54.13 53.43 1k2m s LEU 672 Cb -0.36 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.06 1k2m s LEU 672 CO 0.35 0.02 -0.16 -1.10 0.23 0.00 0.00 176.35 175.68 1k2m s GLN 673 N 1.26 2.54 -0.32 1.70 -0.21 -1.26 -4.24 119.66 119.14 1k2m s GLN 673 Ca 0.03 -0.73 -0.43 0.00 0.02 0.00 0.00 55.36 54.26 1k2m s GLN 673 Cb -0.14 -2.35 -0.19 0.00 1.00 0.00 0.00 33.01 31.32 1k2m s GLN 673 CO -0.00 0.56 1.36 -3.47 -2.12 0.00 0.00 175.29 171.62 1k2m n ASP 674 N 2.47 0.77 -0.23 5.90 2.03 0.98 -1.52 116.55 126.95 1k2m n ASP 674 Ca -0.17 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.26 1k2m n ASP 674 Cb 0.52 -0.85 0.00 0.00 -0.72 0.00 0.00 41.12 40.07 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 3.02 0.98 3.55 0.27 0.00 0.36 -4.67 105.19 108.70 1k2m n GLY 675 Ca 0.26 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.62 6.22 -0.45 1.61 2.15 -0.41 -4.78 116.67 118.39 1k2m s ASP 676 Ca 0.00 -0.18 -0.18 0.00 0.43 0.00 0.00 52.55 52.62 1k2m s ASP 676 Cb 0.00 -2.22 0.03 0.00 -0.30 0.00 0.00 42.92 40.44 1k2m s ASP 676 CO 0.00 -0.38 0.50 -0.70 -0.17 0.00 0.00 175.17 174.42 1k2m s GLU 677 N 2.12 3.11 -0.10 4.34 2.12 -1.26 0.17 118.70 129.19 1k2m s GLU 677 Ca 0.14 -0.79 -0.01 0.00 0.36 0.00 0.00 54.97 54.66 1k2m s GLU 677 Cb -0.16 -4.01 -0.03 0.00 0.26 0.00 0.00 34.13 30.19 1k2m s GLU 677 CO 0.12 -0.97 -0.04 0.42 -0.54 0.00 0.00 175.26 174.25 1k2m s ILE 678 N 2.29 3.94 -0.34 -3.70 1.01 0.55 -1.86 121.20 123.09 1k2m s ILE 678 Ca 0.13 -0.37 -0.15 0.00 0.00 0.00 0.00 60.65 60.26 1k2m s ILE 678 Cb -0.18 -2.66 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 1k2m s ILE 678 CO 0.13 0.56 0.38 -0.54 0.00 0.00 0.00 174.94 175.47 1k2m s LYS 679 N -0.43 3.59 0.03 2.79 1.02 0.48 0.20 119.74 127.41 1k2m s LYS 679 Ca 0.07 -0.37 -0.16 0.00 0.02 0.00 0.00 55.97 55.52 1k2m s LYS 679 Cb -0.12 -3.80 -0.36 0.00 -0.52 0.00 0.00 37.83 33.03 1k2m s LYS 679 CO 0.02 -0.53 0.99 0.82 -0.92 0.00 0.00 175.35 175.74 1k2m h ILE 680 N 5.54 1.29 -2.36 2.17 2.04 -0.96 1.19 117.51 126.42 1k2m h ILE 680 Ca -0.30 -2.69 -0.06 0.00 1.00 0.00 0.00 64.86 62.82 1k2m h ILE 680 Cb 1.14 3.05 -0.24 0.00 -0.74 0.00 0.00 36.82 40.04 1k2m h ILE 680 CO 0.70 0.81 -0.14 -0.63 0.00 0.00 0.00 178.15 178.88 1k2m s ILE 681 N -2.59 -0.01 -0.04 -0.67 1.01 -0.99 -4.13 121.20 113.78 1k2m s ILE 681 Ca -0.09 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.60 1k2m s ILE 681 Cb 0.04 -0.79 0.02 0.00 0.01 0.00 0.00 42.46 41.75 1k2m s ILE 681 CO 0.94 0.02 -0.02 0.86 0.00 0.00 0.00 174.94 176.74 1k2m s TRP 682 N 1.35 0.53 -0.19 3.97 -0.00 -1.26 0.14 118.94 123.48 1k2m s TRP 682 Ca -0.08 -0.10 0.01 0.00 -0.00 0.00 0.00 56.10 55.93 1k2m s TRP 682 Cb -0.06 -0.57 0.03 0.00 -0.00 0.00 0.00 33.47 32.87 1k2m s TRP 682 CO -0.14 -0.18 -0.15 0.34 -0.00 0.00 0.00 176.95 176.82 1k2m s ASP 683 N 1.12 3.34 0.06 5.86 -1.08 -0.88 -5.00 116.67 120.09 1k2m s ASP 683 Ca -0.08 -0.81 -0.20 0.00 -0.52 0.00 0.00 52.55 50.94 1k2m s ASP 683 Cb -0.14 -1.36 -0.12 0.00 -1.46 0.00 0.00 42.92 39.85 1k2m s ASP 683 CO -0.01 -0.09 1.44 0.50 0.52 0.00 0.00 175.17 177.53 1k2m h LYS 684 N 7.94 0.37 -0.92 4.34 3.64 -1.93 1.17 116.57 131.19 1k2m h LYS 684 Ca -0.35 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1k2m h LYS 684 Cb 1.11 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.87 1k2m h LYS 684 CO 0.54 0.64 0.58 -0.91 -2.27 0.00 0.00 179.45 178.03 1k2m h ASN 685 N 0.08 1.08 0.36 4.20 4.21 -1.99 -3.00 115.58 120.52 1k2m h ASN 685 Ca 0.05 -0.05 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 1k2m h ASN 685 Cb 0.51 -0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 37.44 1k2m h ASN 685 CO 0.02 0.81 -1.64 -3.20 -1.29 0.00 0.00 177.43 172.13 1k2m n ASN 686 N -4.41 0.32 0.00 5.81 5.15 -1.22 -4.96 115.26 115.94 1k2m n ASN 686 Ca 0.10 0.12 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 1k2m n ASN 686 Cb 0.04 1.40 0.00 0.00 -0.53 0.00 0.00 39.78 40.69 1k2m n ASN 686 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1k2m n LYS 687 N -2.43 -0.14 -2.41 1.20 3.00 0.40 -4.94 118.16 112.84 1k2m n LYS 687 Ca -0.03 0.04 -0.42 0.00 -0.00 0.00 0.00 58.31 57.90 1k2m n LYS 687 Cb 0.58 -3.33 -0.03 0.00 0.00 0.00 0.00 35.03 32.25 1k2m n LYS 687 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.40 176.81 1k2m s PHE 688 N -2.66 2.32 -0.09 5.64 -0.12 -1.17 -4.82 117.98 117.09 1k2m s PHE 688 Ca 0.00 0.47 0.02 0.00 -0.05 0.00 0.00 56.93 57.37 1k2m s PHE 688 Cb 0.00 -4.40 -0.02 0.00 -0.63 0.00 0.00 43.02 37.97 1k2m s PHE 688 CO 0.00 -1.94 -0.15 0.54 -0.05 0.00 0.00 175.22 173.63 1k2m s VAL 689 N 5.91 2.95 -0.18 -2.49 0.11 -1.26 -2.08 120.40 123.36 1k2m s VAL 689 Ca 0.52 -0.73 0.01 0.00 -2.93 0.00 0.00 61.98 58.85 1k2m s VAL 689 Cb -0.10 -2.19 0.02 0.00 -1.53 0.00 0.00 36.38 32.57 1k2m s VAL 689 CO 0.25 0.55 -0.20 -0.63 -3.33 0.00 0.00 175.10 171.75 1k2m s ILE 690 N -0.09 2.09 -0.05 7.04 1.01 0.38 -2.05 121.20 129.53 1k2m s ILE 690 Ca -0.02 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 59.65 1k2m s ILE 690 Cb -0.14 -1.87 0.01 0.00 0.01 0.00 0.00 42.46 40.47 1k2m s ILE 690 CO 0.04 0.54 0.14 -0.83 0.00 0.00 0.00 174.94 174.82 1k2m s GLY 691 N 1.28 -0.09 -0.02 6.18 0.00 -1.26 -0.34 107.32 113.08 1k2m s GLY 691 Ca 0.05 0.34 0.04 0.00 0.00 0.00 0.00 44.72 45.15 1k2m s GLY 691 CO -0.13 0.27 -0.13 -1.36 0.00 0.00 0.00 173.10 171.76 1k2m s PHE 692 N -0.08 2.73 -0.31 1.90 0.08 0.13 -2.64 117.98 119.79 1k2m s PHE 692 Ca -0.02 -0.14 -0.11 0.00 0.12 0.00 0.00 56.93 56.78 1k2m s PHE 692 Cb -0.02 -1.59 -0.03 0.00 -0.57 0.00 0.00 43.02 40.82 1k2m s PHE 692 CO 0.00 0.26 0.20 0.21 -0.10 0.00 0.00 175.22 175.79 1k2m s LYS 693 N -1.07 3.60 -0.11 0.44 2.47 -1.09 -0.33 119.74 123.66 1k2m s LYS 693 Ca 0.14 -0.56 -0.30 0.00 -1.56 0.00 0.00 55.97 53.69 1k2m s LYS 693 Cb -0.11 -3.69 -0.01 0.00 -1.46 0.00 0.00 37.83 32.56 1k2m s LYS 693 CO 0.03 -0.35 1.01 0.08 0.16 0.00 0.00 175.35 176.28 1k2m s VAL 694 N 1.71 4.77 -0.21 4.02 1.01 0.44 -1.07 120.40 131.06 1k2m s VAL 694 Ca 0.06 2.04 -0.02 0.00 0.00 0.00 0.00 61.98 64.05 1k2m s VAL 694 Cb -0.17 -4.31 0.06 0.00 0.00 0.00 0.00 36.38 31.97 1k2m s VAL 694 CO 0.09 0.00 0.02 -0.70 0.00 0.00 0.00 175.10 174.52 1k2m s GLU 695 N 2.04 0.81 -0.57 2.72 -6.30 0.38 0.14 118.70 117.92 1k2m s GLU 695 Ca 0.48 -0.55 -0.26 0.00 -2.50 0.00 0.00 54.97 52.15 1k2m s GLU 695 Cb -0.18 -2.18 0.04 0.00 0.00 0.00 0.00 34.13 31.80 1k2m s GLU 695 CO 0.18 -0.65 1.04 0.42 0.02 0.00 0.00 175.26 176.26 1k2m s ILE 696 N 1.77 4.24 -0.11 -3.70 1.01 -1.26 0.20 121.20 123.35 1k2m s ILE 696 Ca -0.01 0.51 -0.15 0.00 0.00 0.00 0.00 60.65 61.00 1k2m s ILE 696 Cb -0.17 -4.62 -0.26 0.00 0.01 0.00 0.00 42.46 37.41 1k2m s ILE 696 CO -0.09 -1.21 0.51 0.78 0.00 0.00 0.00 174.94 174.92 1k2m h ASN 697 N 9.41 0.36 -3.58 3.58 2.35 -1.34 -3.47 115.58 122.90 1k2m h ASN 697 Ca -0.26 -0.84 -0.68 0.00 -0.55 0.00 0.00 56.30 53.97 1k2m h ASN 697 Cb 1.07 -0.12 -0.18 0.00 0.05 0.00 0.00 38.32 39.14 1k2m h ASN 697 CO 1.13 1.65 -0.68 -0.62 -1.65 0.00 0.00 177.43 177.26 1k2m s ASP 698 N -7.03 4.76 -0.40 5.81 2.15 -1.15 -5.04 116.67 115.76 1k2m s ASP 698 Ca -0.21 -0.03 -0.02 0.00 0.43 0.00 0.00 52.55 52.71 1k2m s ASP 698 Cb 0.05 -1.20 0.11 0.00 -0.30 0.00 0.00 42.92 41.58 1k2m s ASP 698 CO 0.76 0.34 0.20 0.42 -0.17 0.00 0.00 175.17 176.71 1k2m s THR 699 N -0.89 3.23 -1.54 1.71 -4.23 -1.26 -4.58 115.64 108.07 1k2m s THR 699 Ca 0.14 -2.07 -0.09 0.00 -1.18 0.00 0.00 61.69 58.49 1k2m s THR 699 Cb -0.11 -3.22 -0.03 0.00 1.34 0.00 0.00 72.50 70.48 1k2m s THR 699 CO 0.04 -0.69 2.77 0.41 -0.54 0.00 0.00 174.62 176.62 1k2m n THR 700 N 4.57 4.51 -2.47 3.99 -1.04 -1.26 -4.40 114.28 118.18 1k2m n THR 700 Ca -0.02 -3.05 -0.05 0.00 -2.04 0.00 0.00 64.05 58.88 1k2m n THR 700 Cb 0.41 -2.48 0.03 0.00 -1.82 0.00 0.00 70.33 66.47 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 3.14 0.23 3.70 3.41 0.00 -1.26 -4.77 105.19 109.64 1k2m n GLY 701 Ca 0.73 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.28 4.28 0.23 0.99 2.01 -1.26 -1.98 118.68 119.67 1k2m s LEU 702 Ca 0.02 1.33 -0.02 0.00 0.01 0.00 0.00 54.13 55.47 1k2m s LEU 702 Cb -0.01 -3.30 0.49 0.00 0.01 0.00 0.00 46.19 43.39 1k2m s LEU 702 CO 0.22 -0.28 1.23 2.22 1.01 0.00 0.00 176.35 180.76 1k2m n PHE 703 N 4.41 0.40 -1.10 0.29 -1.74 -1.20 -2.73 117.46 115.80 1k2m n PHE 703 Ca 0.03 0.96 0.00 0.00 -0.56 0.00 0.00 57.45 57.88 1k2m n PHE 703 Cb 0.50 -1.03 0.00 0.00 1.52 0.00 0.00 39.48 40.47 1k2m n PHE 703 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1k2m n ASN 704 N -5.19 0.00 0.00 5.98 5.15 -1.26 -4.74 115.26 115.19 1k2m n ASN 704 Ca 0.16 -1.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.14 1k2m n ASN 704 Cb 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.76 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 -1.11 -3.69 120.64 117.32 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 0.46 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.33 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 1.86 0.45 -1.84 0.00 -1.26 -4.25 105.19 100.15 1k2m n GLY 706 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1k2m n GLY 706 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1k2m n LEU 707 N 0.00 1.31 -2.81 0.99 -0.00 -1.24 0.33 117.00 115.58 1k2m n LEU 707 Ca 0.00 -0.62 -0.02 0.00 -0.00 0.00 0.00 56.01 55.37 1k2m n LEU 707 Cb 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 43.42 43.28 1k2m n LEU 707 CO 0.00 0.31 -0.44 0.61 -0.00 0.00 0.00 177.39 177.87 1k2m n GLY 708 N 0.95 -3.38 3.52 -3.96 0.00 -1.26 -4.62 105.19 96.45 1k2m n GLY 708 Ca 0.11 0.50 -0.28 0.00 0.00 0.00 0.00 46.02 46.35 1k2m n GLY 708 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1k2m n MET 709 N 0.67 0.35 -2.51 1.61 2.81 -1.26 -3.71 117.12 115.08 1k2m n MET 709 Ca 0.01 -0.21 -0.03 0.00 -1.81 0.00 0.00 57.70 55.65 1k2m n MET 709 Cb 0.13 -2.30 0.00 0.00 -0.71 0.00 0.00 33.22 30.34 1k2m n MET 709 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 1k2m n LEU 710 N 12.19 -2.51 -3.50 4.03 -0.00 -1.26 -2.92 117.00 123.03 1k2m n LEU 710 Ca 0.56 0.24 -0.23 0.00 -0.00 0.00 0.00 56.01 56.58 1k2m n LEU 710 Cb 0.27 -1.15 0.05 0.00 -0.00 0.00 0.00 43.42 42.59 1k2m n LEU 710 CO 0.84 -0.91 -0.03 0.00 -0.00 0.00 0.00 177.39 177.30 1k2m n GLN 711 N 0.93 -2.35 -1.95 1.47 6.02 -1.24 -4.90 117.38 115.35 1k2m n GLN 711 Ca -0.01 0.66 -0.40 0.00 -0.01 0.00 0.00 57.00 57.24 1k2m n GLN 711 Cb 0.38 -5.02 -0.00 0.00 1.02 0.00 0.00 30.24 26.62 1k2m n GLN 711 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1k2m s GLU 712 N -5.32 4.08 0.10 -1.09 -6.30 -1.15 -4.97 118.70 104.05 1k2m s GLU 712 Ca 0.38 2.35 -0.28 0.00 -2.50 0.00 0.00 54.97 54.92 1k2m s GLU 712 Cb -0.10 -2.90 -0.06 0.00 0.00 0.00 0.00 34.13 31.08 1k2m s GLU 712 CO 0.80 -0.47 0.89 1.14 0.02 0.00 0.00 175.26 177.65 1k2m s GLN 713 N -2.10 4.64 -0.25 4.30 -2.07 -1.26 -4.98 119.66 117.94 1k2m s GLN 713 Ca 0.54 1.33 -0.09 0.00 -1.82 0.00 0.00 55.36 55.32 1k2m s GLN 713 Cb -0.42 -3.36 0.11 0.00 -1.09 0.00 0.00 33.01 28.25 1k2m s GLN 713 CO 0.56 0.27 0.54 -0.98 -1.32 0.00 0.00 175.29 174.36 1k2m s ARG 714 N -0.15 0.46 0.29 9.60 1.70 -1.26 -5.07 118.95 124.52 1k2m s ARG 714 Ca 0.44 1.24 0.10 0.00 -0.47 0.00 0.00 55.73 57.03 1k2m s ARG 714 Cb -0.23 0.57 -0.06 0.00 -0.57 0.00 0.00 34.95 34.67 1k2m s ARG 714 CO 0.28 -0.22 -0.13 0.14 -1.08 0.00 0.00 175.30 174.29 1k2m s VAL 715 N 2.66 2.14 -0.28 4.99 -7.23 -1.26 -5.01 120.40 116.41 1k2m s VAL 715 Ca -0.04 -2.26 -0.29 0.00 -1.81 0.00 0.00 61.98 57.57 1k2m s VAL 715 Cb -0.12 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.43 1k2m s VAL 715 CO -0.16 -0.35 1.20 -0.69 -0.31 0.00 0.00 175.10 174.79 1k2m s VAL 716 N -2.70 4.33 0.60 1.32 1.01 -1.26 -4.64 120.40 119.05 1k2m s VAL 716 Ca 0.30 1.54 0.01 0.00 0.00 0.00 0.00 61.98 63.83 1k2m s VAL 716 Cb -0.00 -4.23 0.06 0.00 0.00 0.00 0.00 36.38 32.21 1k2m s VAL 716 CO 0.14 -0.39 0.84 -0.76 0.00 0.00 0.00 175.10 174.92 1k2m s LEU 717 N 3.88 3.18 0.16 3.92 1.02 0.54 -4.88 118.68 126.50 1k2m s LEU 717 Ca 0.51 -0.12 0.03 0.00 0.02 0.00 0.00 54.13 54.57 1k2m s LEU 717 Cb -0.16 -2.61 -0.03 0.00 0.02 0.00 0.00 46.19 43.41 1k2m s LEU 717 CO 0.18 -1.34 0.28 -0.75 0.02 0.00 0.00 176.35 174.74 1k2m s LYS 718 N -4.87 3.41 0.22 1.70 2.20 -1.26 -0.54 119.74 120.59 1k2m s LYS 718 Ca 0.60 -0.63 -0.07 0.00 -0.36 0.00 0.00 55.97 55.50 1k2m s LYS 718 Cb -0.09 -2.94 -0.06 0.00 -1.51 0.00 0.00 37.83 33.23 1k2m s LYS 718 CO 0.40 0.51 0.51 -0.65 -0.36 0.00 0.00 175.35 175.75 1k2m s GLN 719 N -3.31 3.72 0.26 4.03 -0.21 0.37 -4.61 119.66 119.91 1k2m s GLN 719 Ca 0.34 0.12 0.01 0.00 0.02 0.00 0.00 55.36 55.86 1k2m s GLN 719 Cb -0.11 -2.70 -0.01 0.00 1.00 0.00 0.00 33.01 31.20 1k2m s GLN 719 CO 0.28 0.33 0.05 0.25 -2.12 0.00 0.00 175.29 174.09 1k2m n THR 720 N -0.25 0.00 0.27 -0.19 -2.24 -1.26 -4.98 114.28 105.63 1k2m n THR 720 Ca -0.01 -1.39 0.09 0.00 -2.27 0.00 0.00 64.05 60.47 1k2m n THR 720 Cb 0.53 0.41 0.69 0.00 -2.10 0.00 0.00 70.33 69.85 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 1.29 1.87 0.31 6.98 0.00 -1.99 -1.14 119.26 126.60 1k2m h ALA 721 Ca -0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1k2m h ALA 721 Cb 0.72 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1k2m h ALA 721 CO 0.34 0.02 -0.15 1.05 0.00 0.00 0.00 179.25 180.51 1k2m h GLU 722 N 0.00 -0.41 -0.28 0.00 4.11 -1.99 0.13 114.58 116.14 1k2m h GLU 722 Ca -0.00 0.03 -0.16 0.00 0.07 0.00 0.00 59.36 59.30 1k2m h GLU 722 Cb 0.02 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1k2m h GLU 722 CO 0.00 -0.22 -0.43 1.05 0.07 0.00 0.00 179.01 179.48 1k2m h GLU 723 N -0.50 0.79 -0.31 1.06 -0.00 -1.90 -2.96 114.58 110.77 1k2m h GLU 723 Ca -0.04 -0.47 0.01 0.00 -0.00 0.00 0.00 59.36 58.86 1k2m h GLU 723 Cb 0.37 0.04 -0.02 0.00 -0.00 0.00 0.00 28.75 29.15 1k2m h GLU 723 CO 0.07 1.10 0.21 -0.22 -0.00 0.00 0.00 179.01 180.17 1k2m h LYS 724 N 0.55 0.36 -0.44 1.06 3.64 -1.17 -1.48 116.57 119.09 1k2m h LYS 724 Ca 0.03 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 1k2m h LYS 724 Cb 1.03 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 1k2m h LYS 724 CO 0.10 0.24 -0.19 0.22 -2.27 0.00 0.00 179.45 177.55 1k2m h ASP 725 N 0.37 0.87 -0.67 4.20 3.58 -0.58 -1.26 116.42 122.95 1k2m h ASP 725 Ca 0.12 -0.31 0.07 0.00 0.42 0.00 0.00 57.03 57.33 1k2m h ASP 725 Cb 0.02 -0.24 -0.06 0.00 1.72 0.00 0.00 39.33 40.78 1k2m h ASP 725 CO -0.03 1.05 0.35 -0.07 -2.88 0.00 0.00 179.24 177.66 1k2m h LEU 726 N 0.76 0.50 -0.19 2.28 3.38 -1.12 -1.28 115.31 119.64 1k2m h LEU 726 Ca 0.11 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 1k2m h LEU 726 Cb 0.72 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1k2m h LEU 726 CO 0.06 0.31 -0.37 1.62 0.09 0.00 0.00 178.44 180.14 1k2m h VAL 727 N 0.63 0.67 -0.81 1.22 3.04 -1.42 -3.25 116.25 116.34 1k2m h VAL 727 Ca 0.31 -1.84 0.03 0.00 -1.01 0.00 0.00 66.70 64.19 1k2m h VAL 727 Cb 0.25 2.25 -0.04 0.00 -2.01 0.00 0.00 31.29 31.73 1k2m h VAL 727 CO -0.21 0.37 0.53 0.50 -1.01 0.00 0.00 177.57 177.75 1k2m h LYS 728 N 0.00 0.99 0.00 4.17 3.64 -0.02 -0.62 116.57 124.73 1k2m h LYS 728 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1k2m h LYS 728 Cb 1.22 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1k2m h LYS 728 CO 0.05 0.65 0.00 0.87 -2.27 0.00 0.00 179.45 178.75 1k2m h LYS 729 N 1.02 0.00 0.00 1.90 1.57 -1.54 -3.51 116.57 116.01 1k2m h LYS 729 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1k2m h LYS 729 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1k2m h LYS 729 CO -0.09 0.00 0.00 -0.11 -0.57 0.00 0.00 179.45 178.68