#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 -3.42 115.58 114.07 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 0.19 0.00 0.61 -1.65 0.00 0.00 177.43 176.58 1k2m n GLY 575 N 0.50 -1.87 3.57 2.83 0.00 -1.26 -4.99 105.19 103.98 1k2m n GLY 575 Ca 0.01 0.84 -0.42 0.00 0.00 0.00 0.00 46.02 46.45 1k2m n GLY 575 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k2m s ARG 576 N 0.00 3.67 -0.12 1.61 3.00 -1.26 0.72 118.95 126.57 1k2m s ARG 576 Ca 0.00 0.14 -0.14 0.00 -1.00 0.00 0.00 55.73 54.73 1k2m s ARG 576 Cb 0.00 -3.82 -0.05 0.00 0.00 0.00 0.00 34.95 31.08 1k2m s ARG 576 CO 0.00 -0.83 -0.27 0.34 0.00 0.00 0.00 175.30 174.54 1k2m n PHE 577 N 6.27 0.00 -4.30 5.12 7.35 -0.87 -3.14 117.46 127.89 1k2m n PHE 577 Ca 0.01 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.36 1k2m n PHE 577 Cb 0.48 -0.40 -0.09 0.00 0.35 0.00 0.00 39.48 39.83 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 -7.68 3.62 -0.21 -2.13 0.20 -0.40 -0.40 118.68 111.68 1k2m s LEU 578 Ca -0.23 0.11 0.01 0.00 0.69 0.00 0.00 54.13 54.72 1k2m s LEU 578 Cb 0.03 -1.94 0.04 0.00 -0.43 0.00 0.00 46.19 43.90 1k2m s LEU 578 CO 0.33 0.34 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.72 1k2m s THR 579 N -0.98 1.87 -0.41 3.68 2.01 0.75 0.19 115.64 122.74 1k2m s THR 579 Ca 0.16 -1.15 -0.12 0.00 0.31 0.00 0.00 61.69 60.89 1k2m s THR 579 Cb -0.11 -1.89 0.05 0.00 0.01 0.00 0.00 72.50 70.55 1k2m s THR 579 CO 0.06 0.20 0.28 -0.76 -0.69 0.00 0.00 174.62 173.72 1k2m s LEU 580 N 1.30 5.11 -0.44 4.42 1.43 0.45 0.18 118.68 131.13 1k2m s LEU 580 Ca -0.02 -1.16 -0.04 0.00 -1.03 0.00 0.00 54.13 51.87 1k2m s LEU 580 Cb -0.16 -2.08 0.12 0.00 0.03 0.00 0.00 46.19 44.09 1k2m s LEU 580 CO -0.08 -0.49 0.25 -0.54 0.23 0.00 0.00 176.35 175.71 1k2m s LYS 581 N 1.57 2.14 -0.81 1.70 1.02 0.17 0.27 119.74 125.80 1k2m s LYS 581 Ca 0.03 -1.85 -0.27 0.00 0.02 0.00 0.00 55.97 53.91 1k2m s LYS 581 Cb -0.21 -3.67 -0.18 0.00 -0.52 0.00 0.00 37.83 33.25 1k2m s LYS 581 CO 0.06 -1.11 2.53 -2.30 -0.92 0.00 0.00 175.35 173.61 1k2m n PRO 582 N 4.60 0.39 -1.79 -1.68 -0.02 0.82 -2.42 135.00 134.91 1k2m n PRO 582 Ca -0.03 -0.07 -0.32 0.00 -2.02 0.00 0.00 63.50 61.07 1k2m n PRO 582 Cb 0.41 -2.26 0.03 0.00 -0.02 0.00 0.00 33.50 31.66 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 9.56 3.30 0.56 2.45 2.34 -1.06 -1.86 118.68 133.96 1k2m s LEU 583 Ca 1.20 1.70 0.32 0.00 0.06 0.00 0.00 54.13 57.41 1k2m s LEU 583 Cb -0.77 -4.51 1.47 0.00 -0.56 0.00 0.00 46.19 41.82 1k2m s LEU 583 CO 0.39 -1.31 1.83 -0.65 -1.06 0.00 0.00 176.35 175.54 1k2m h PRO 584 N -0.20 0.00 0.00 1.48 0.11 -1.90 0.88 132.00 132.37 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 -0.06 0.22 -0.21 0.00 0.00 178.00 178.52 1k2m h ASP 585 N 0.00 0.00 -2.98 -2.05 3.58 -1.91 -3.42 116.42 109.64 1k2m h ASP 585 Ca 0.41 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 57.32 1k2m h ASP 585 Cb 1.81 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.84 1k2m h ASP 585 CO -0.00 0.06 -0.28 -0.55 -2.88 0.00 0.00 179.24 175.59 1k2m s SER 586 N -6.15 6.42 0.09 2.28 0.15 0.30 -4.84 113.70 111.96 1k2m s SER 586 Ca -0.04 0.51 0.05 0.00 0.70 0.00 0.00 55.95 57.17 1k2m s SER 586 Cb 0.14 -2.06 0.28 0.00 -1.71 0.00 0.00 66.02 62.67 1k2m s SER 586 CO 0.56 -0.07 1.07 0.00 1.20 0.00 0.00 173.24 176.01 1k2m n ILE 587 N -0.63 1.39 -4.41 6.45 3.06 0.23 -4.38 119.36 121.08 1k2m n ILE 587 Ca -0.04 0.57 -0.34 0.00 -2.50 0.00 0.00 62.75 60.45 1k2m n ILE 587 Cb 0.54 -1.57 -0.14 0.00 0.54 0.00 0.00 39.64 39.01 1k2m n ILE 587 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 1k2m s ILE 588 N -2.99 3.37 -0.70 9.51 1.01 -1.26 -5.02 121.20 125.12 1k2m s ILE 588 Ca -0.01 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.13 1k2m s ILE 588 Cb 0.01 -2.47 0.37 0.00 0.01 0.00 0.00 42.46 40.38 1k2m s ILE 588 CO 0.05 0.49 1.56 0.00 0.00 0.00 0.00 174.94 177.03 1k2m n GLN 589 N 3.92 3.39 -4.56 2.79 3.00 -1.24 -3.48 117.38 121.20 1k2m n GLN 589 Ca -0.18 -4.17 -0.26 0.00 -0.01 0.00 0.00 57.00 52.39 1k2m n GLN 589 Cb 0.52 -2.28 -0.10 0.00 0.00 0.00 0.00 30.24 28.37 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 -3.85 1.86 -0.06 -1.09 0.41 -0.78 -4.97 118.70 110.21 1k2m s GLU 590 Ca 0.49 -2.08 0.03 0.00 -0.41 0.00 0.00 54.97 53.00 1k2m s GLU 590 Cb 0.38 -1.19 0.01 0.00 -1.78 0.00 0.00 34.13 31.55 1k2m s GLU 590 CO -0.27 -0.20 -0.15 -1.12 -0.49 0.00 0.00 175.26 173.03 1k2m s SER 591 N -3.63 2.03 -0.03 -0.19 0.01 -1.26 -0.13 113.70 110.51 1k2m s SER 591 Ca 0.31 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 57.25 1k2m s SER 591 Cb 0.08 -0.85 -0.03 0.00 0.21 0.00 0.00 66.02 65.43 1k2m s SER 591 CO 0.15 0.08 -0.11 -0.76 0.41 0.00 0.00 173.24 173.01 1k2m s LEU 592 N 0.46 2.95 -0.18 2.44 1.43 0.77 -4.93 118.68 121.63 1k2m s LEU 592 Ca -0.13 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 1k2m s LEU 592 Cb -0.15 -1.66 0.04 0.00 0.03 0.00 0.00 46.19 44.45 1k2m s LEU 592 CO 0.04 0.32 -0.11 -1.61 0.23 0.00 0.00 176.35 175.22 1k2m s GLU 593 N -1.05 2.08 -0.48 1.70 8.01 -1.26 0.17 118.70 127.87 1k2m s GLU 593 Ca 0.14 -0.74 -0.24 0.00 0.01 0.00 0.00 54.97 54.14 1k2m s GLU 593 Cb -0.11 -2.30 0.03 0.00 -4.31 0.00 0.00 34.13 27.45 1k2m s GLU 593 CO 0.03 -0.37 0.88 0.42 0.01 0.00 0.00 175.26 176.24 1k2m s ILE 594 N 1.44 4.51 0.06 -1.63 1.01 0.51 -4.96 121.20 122.14 1k2m s ILE 594 Ca 0.01 0.52 -0.31 0.00 0.00 0.00 0.00 60.65 60.87 1k2m s ILE 594 Cb -0.15 -4.42 -0.06 0.00 0.01 0.00 0.00 42.46 37.83 1k2m s ILE 594 CO -0.09 -0.86 1.31 -1.10 0.00 0.00 0.00 174.94 174.19 1k2m s GLN 595 N 3.64 4.36 0.54 2.79 -1.52 -1.26 -1.28 119.66 126.93 1k2m s GLN 595 Ca 0.33 1.91 0.39 0.00 -1.95 0.00 0.00 55.36 56.04 1k2m s GLN 595 Cb -0.11 -3.37 1.59 0.00 -0.22 0.00 0.00 33.01 30.89 1k2m s GLN 595 CO 0.23 -0.40 1.74 -0.56 -0.25 0.00 0.00 175.29 176.06 1k2m h GLN 596 N 7.05 0.01 0.00 2.91 3.07 0.00 0.85 115.11 129.01 1k2m h GLN 596 Ca -0.41 -0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.28 1k2m h GLN 596 Cb 1.20 -0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.75 1k2m h GLN 596 CO 0.85 0.01 -0.25 0.78 0.09 0.00 0.00 178.83 180.32 1k2m h GLY 597 N 0.01 0.00 -7.64 0.06 0.00 -1.90 -3.42 103.07 90.19 1k2m h GLY 597 Ca 0.66 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 47.34 1k2m h GLY 597 CO -0.03 0.00 -0.41 0.14 0.00 0.00 0.00 176.54 176.24 1k2m s VAL 598 N -3.81 5.25 -0.05 4.60 1.01 0.30 -5.05 120.40 122.65 1k2m s VAL 598 Ca -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.00 1k2m s VAL 598 Cb 0.11 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.84 1k2m s VAL 598 CO 0.64 0.06 0.09 0.21 0.00 0.00 0.00 175.10 176.10 1k2m s ASN 599 N 1.73 0.82 0.43 3.32 2.47 -1.26 -4.03 114.94 118.41 1k2m s ASN 599 Ca 0.09 0.16 -0.03 0.00 0.42 0.00 0.00 52.86 53.49 1k2m s ASN 599 Cb -0.17 0.00 -0.04 0.00 -1.45 0.00 0.00 41.25 39.60 1k2m s ASN 599 CO 0.11 -0.23 0.70 -2.16 -3.72 0.00 0.00 177.10 171.80 1k2m s PRO 600 N 2.00 3.53 -0.35 0.43 0.04 -1.26 -5.02 135.00 134.37 1k2m s PRO 600 Ca 0.02 0.01 -0.20 0.00 0.04 0.00 0.00 61.00 60.88 1k2m s PRO 600 Cb -0.12 -2.48 -0.00 0.00 0.04 0.00 0.00 34.50 31.94 1k2m s PRO 600 CO -0.04 -0.07 0.59 0.12 0.04 0.00 0.00 177.00 177.64 1k2m s PHE 601 N -2.57 3.17 0.00 0.56 5.36 0.17 -4.90 117.98 119.77 1k2m s PHE 601 Ca 0.45 0.30 -0.17 0.00 -0.96 0.00 0.00 56.93 56.55 1k2m s PHE 601 Cb -0.10 -3.04 -0.06 0.00 -0.34 0.00 0.00 43.02 39.48 1k2m s PHE 601 CO 0.41 -0.58 0.47 -0.06 -1.46 0.00 0.00 175.22 174.00 1k2m s PHE 602 N 2.58 3.72 0.05 10.12 0.08 -1.26 0.46 117.98 133.72 1k2m s PHE 602 Ca 0.22 1.06 0.07 0.00 0.12 0.00 0.00 56.93 58.40 1k2m s PHE 602 Cb -0.15 -2.40 -0.02 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 0.00 175.22 176.04 1k2m s ILE 603 N -0.81 1.54 -3.22 0.64 1.09 0.16 0.15 121.20 120.75 1k2m s ILE 603 Ca 0.26 -1.17 0.00 0.00 -1.10 0.00 0.00 60.65 58.64 1k2m s ILE 603 Cb -0.17 -1.35 0.00 0.00 -1.06 0.00 0.00 42.46 39.88 1k2m s ILE 603 CO 0.15 0.15 0.00 0.61 -0.10 0.00 0.00 174.94 175.74 1k2m n GLY 604 N 1.83 -2.13 0.00 6.18 0.00 -1.15 -2.26 105.19 107.66 1k2m n GLY 604 Ca -0.17 -1.19 0.12 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.53 0.21 -3.73 1.61 0.63 -0.59 -1.31 116.66 112.94 1k2m n ARG 605 Ca 0.00 0.06 -0.36 0.00 -0.92 0.00 0.00 57.85 56.63 1k2m n ARG 605 Cb 0.00 -1.50 -0.08 0.00 0.45 0.00 0.00 32.46 31.33 1k2m n ARG 605 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1k2m s SER 606 N -2.75 6.28 0.61 6.15 0.01 -1.18 -4.76 113.70 118.06 1k2m s SER 606 Ca 0.19 0.31 0.31 0.00 1.31 0.00 0.00 55.95 58.07 1k2m s SER 606 Cb 0.17 -2.10 1.73 0.00 0.21 0.00 0.00 66.02 66.03 1k2m s SER 606 CO 0.42 0.21 2.08 1.05 0.41 0.00 0.00 173.24 177.41 1k2m h GLU 607 N 6.34 0.00 -0.51 12.44 4.11 -1.89 -0.51 114.58 134.56 1k2m h GLU 607 Ca -0.44 0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.14 1k2m h GLU 607 Cb 1.17 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1k2m h GLU 607 CO 0.72 0.00 0.36 -0.44 0.07 0.00 0.00 179.01 179.73 1k2m h ASP 608 N 0.00 0.02 -3.48 3.06 3.32 -1.92 -3.41 116.42 114.02 1k2m h ASP 608 Ca 0.07 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.60 1k2m h ASP 608 Cb 0.53 -0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.08 1k2m h ASP 608 CO -0.00 0.01 0.50 0.00 -1.72 0.00 0.00 179.24 178.03 1k2m h ASN 610 N 5.47 0.00 -3.82 0.00 2.35 -0.57 -3.38 115.58 115.63 1k2m h ASN 610 Ca -0.44 0.00 -0.69 0.00 -0.55 0.00 0.00 56.30 54.63 1k2m h ASN 610 Cb 1.21 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.38 1k2m h ASN 610 CO 0.74 0.00 -0.73 0.00 -1.65 0.00 0.00 177.43 175.79 1k2m s LYS 612 N -0.84 2.68 -0.18 0.00 2.20 -1.26 -2.94 119.74 119.40 1k2m s LYS 612 Ca 0.12 -1.09 -0.04 0.00 -0.36 0.00 0.00 55.97 54.61 1k2m s LYS 612 Cb -0.11 -3.09 0.06 0.00 -1.51 0.00 0.00 37.83 33.19 1k2m s LYS 612 CO 0.02 -0.49 0.07 0.42 -0.36 0.00 0.00 175.35 175.00 1k2m s ILE 613 N 1.31 0.16 -0.58 5.43 -1.09 -0.43 -4.97 121.20 121.02 1k2m s ILE 613 Ca -0.02 -0.34 -0.23 0.00 -2.23 0.00 0.00 60.65 57.83 1k2m s ILE 613 Cb -0.18 -0.77 0.05 0.00 -1.58 0.00 0.00 42.46 39.98 1k2m s ILE 613 CO -0.03 -0.27 0.92 -0.70 -1.23 0.00 0.00 174.94 173.63 1k2m s GLU 614 N 2.02 3.24 -0.20 2.79 2.12 -1.26 -2.61 118.70 124.80 1k2m s GLU 614 Ca 0.01 -0.51 -0.01 0.00 0.36 0.00 0.00 54.97 54.82 1k2m s GLU 614 Cb -0.16 -4.11 0.06 0.00 0.26 0.00 0.00 34.13 30.17 1k2m s GLU 614 CO -0.09 -1.57 -0.00 -0.51 -0.54 0.00 0.00 175.26 172.55 1k2m s ASP 615 N 3.10 3.21 0.45 -1.70 1.11 -1.26 -5.01 116.67 116.57 1k2m s ASP 615 Ca 0.26 -0.92 0.32 0.00 0.18 0.00 0.00 52.55 52.39 1k2m s ASP 615 Cb -0.15 -0.82 1.47 0.00 1.07 0.00 0.00 42.92 44.50 1k2m s ASP 615 CO 0.16 -0.27 1.60 0.78 1.18 0.00 0.00 175.17 178.62 1k2m h ASN 616 N 8.13 0.21 0.22 0.27 2.35 -2.02 1.02 115.58 125.77 1k2m h ASN 616 Ca -0.17 0.14 -0.28 0.00 -0.55 0.00 0.00 56.30 55.43 1k2m h ASN 616 Cb 1.10 0.13 0.02 0.00 0.05 0.00 0.00 38.32 39.63 1k2m h ASN 616 CO 0.37 -0.20 -1.19 0.03 -1.65 0.00 0.00 177.43 174.78 1k2m h ARG 617 N 0.05 0.55 -7.24 0.81 2.47 -2.00 -3.46 114.38 105.56 1k2m h ARG 617 Ca 0.85 -0.73 -0.52 0.00 -1.26 0.00 0.00 59.98 58.32 1k2m h ARG 617 Cb 2.75 0.24 0.20 0.00 -1.65 0.00 0.00 29.97 31.51 1k2m h ARG 617 CO -0.42 1.32 0.20 1.28 0.56 0.00 0.00 179.97 182.91 1k2m n LEU 618 N -3.75 3.34 -4.76 3.04 4.32 0.35 -4.82 117.00 114.71 1k2m n LEU 618 Ca -0.12 0.44 -0.23 0.00 -0.02 0.00 0.00 56.01 56.08 1k2m n LEU 618 Cb 0.96 -1.47 -0.06 0.00 -1.62 0.00 0.00 43.42 41.23 1k2m n LEU 618 CO 0.57 -2.16 -0.15 -0.55 -1.22 0.00 0.00 177.39 173.88 1k2m s SER 619 N -2.55 4.67 0.22 -1.43 0.15 -1.26 -4.77 113.70 108.73 1k2m s SER 619 Ca 0.67 -0.86 -0.13 0.00 0.70 0.00 0.00 55.95 56.33 1k2m s SER 619 Cb -0.24 -0.62 0.25 0.00 -1.71 0.00 0.00 66.02 63.70 1k2m s SER 619 CO 0.57 -0.44 1.62 0.03 1.20 0.00 0.00 173.24 176.22 1k2m h ARG 620 N 1.41 -0.00 -2.23 5.44 -0.00 -1.93 -1.38 114.38 115.68 1k2m h ARG 620 Ca -0.43 0.00 -0.59 0.00 -0.50 0.00 0.00 59.98 58.46 1k2m h ARG 620 Cb 1.25 0.00 -0.42 0.00 0.00 0.00 0.00 29.97 30.81 1k2m h ARG 620 CO 0.64 -0.00 -0.62 0.28 0.00 0.00 0.00 179.97 180.27 1k2m n VAL 621 N -5.45 3.08 -0.20 2.04 0.31 -1.26 -3.09 118.33 113.75 1k2m n VAL 621 Ca 0.08 -5.55 -0.00 0.00 -0.01 0.00 0.00 64.34 58.87 1k2m n VAL 621 Cb 0.34 -1.39 0.08 0.00 -0.91 0.00 0.00 33.84 31.96 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 2.97 -0.20 -2.18 3.52 2.76 -1.11 -3.37 115.15 117.54 1k2m h HIS 622 Ca 0.15 0.05 0.08 0.00 -2.20 0.00 0.00 60.37 58.45 1k2m h HIS 622 Cb 0.53 0.18 -0.17 0.00 1.55 0.00 0.00 27.41 29.50 1k2m h HIS 622 CO 0.85 -0.22 0.46 0.00 -1.30 0.00 0.00 177.93 177.71 1k2m s PHE 624 N -2.65 0.03 -0.23 0.00 -0.12 0.34 0.36 117.98 115.72 1k2m s PHE 624 Ca 0.02 -0.07 -0.09 0.00 -0.05 0.00 0.00 56.93 56.74 1k2m s PHE 624 Cb -0.01 -0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.29 1k2m s PHE 624 CO -0.06 -0.20 0.12 0.42 -0.05 0.00 0.00 175.22 175.45 1k2m s ILE 625 N -0.95 5.01 -0.09 -4.49 1.09 0.17 0.15 121.20 122.09 1k2m s ILE 625 Ca -0.10 0.05 0.03 0.00 -1.10 0.00 0.00 60.65 59.53 1k2m s ILE 625 Cb -0.06 -3.31 -0.01 0.00 -1.06 0.00 0.00 42.46 38.01 1k2m s ILE 625 CO 0.01 0.38 -0.19 0.12 -0.10 0.00 0.00 174.94 175.16 1k2m s PHE 626 N 0.97 2.64 -0.12 3.97 5.36 0.45 0.44 117.98 131.68 1k2m s PHE 626 Ca 0.06 -0.63 -0.10 0.00 -0.96 0.00 0.00 56.93 55.31 1k2m s PHE 626 Cb -0.14 -1.70 -0.05 0.00 -0.34 0.00 0.00 43.02 40.80 1k2m s PHE 626 CO 0.03 -0.16 0.20 0.21 -1.46 0.00 0.00 175.22 174.04 1k2m s LYS 627 N -0.04 3.75 0.14 10.12 2.20 -1.26 0.18 119.74 134.83 1k2m s LYS 627 Ca -0.05 -0.04 0.04 0.00 -0.36 0.00 0.00 55.97 55.56 1k2m s LYS 627 Cb -0.14 -3.27 -0.04 0.00 -1.51 0.00 0.00 37.83 32.87 1k2m s LYS 627 CO 0.04 0.61 -0.10 0.21 -0.36 0.00 0.00 175.35 175.75 1k2m s LYS 628 N -0.60 1.02 -0.29 4.03 2.36 0.27 -4.91 119.74 121.63 1k2m s LYS 628 Ca 0.15 -1.39 -0.29 0.00 -2.55 0.00 0.00 55.97 51.90 1k2m s LYS 628 Cb -0.13 -0.63 0.00 0.00 -1.05 0.00 0.00 37.83 36.02 1k2m s LYS 628 CO 0.04 0.08 1.26 0.50 1.55 0.00 0.00 175.35 178.79 1k2m s ARG 629 N -3.50 3.97 -0.02 4.03 6.06 -1.26 0.22 118.95 128.45 1k2m s ARG 629 Ca 0.14 1.26 -0.26 0.00 -2.50 0.00 0.00 55.73 54.37 1k2m s ARG 629 Cb 0.01 -3.84 -0.04 0.00 0.06 0.00 0.00 34.95 31.14 1k2m s ARG 629 CO 0.01 -1.04 0.80 -1.58 -2.50 0.00 0.00 175.30 170.98 1k2m s HIS 630 N 4.17 3.64 0.05 5.12 5.65 0.34 -4.85 115.29 129.40 1k2m s HIS 630 Ca 0.54 1.44 -0.14 0.00 0.25 0.00 0.00 55.06 57.15 1k2m s HIS 630 Cb -0.16 -2.91 0.02 0.00 -1.18 0.00 0.00 32.58 28.35 1k2m s HIS 630 CO 0.21 0.10 0.32 0.00 -0.65 0.00 0.00 174.74 174.72 1k2m s ALA 631 N 0.68 -0.74 0.23 1.58 0.00 -1.26 -2.18 121.76 120.08 1k2m s ALA 631 Ca 0.42 0.03 -0.14 0.00 0.00 0.00 0.00 51.96 52.27 1k2m s ALA 631 Cb -0.19 0.36 0.00 0.00 0.00 0.00 0.00 23.12 23.28 1k2m s ALA 631 CO 0.22 -0.44 0.49 0.54 0.00 0.00 0.00 175.76 176.57 1k2m s VAL 632 N -2.67 0.01 0.00 0.00 0.11 -1.25 -4.95 120.40 111.64 1k2m s VAL 632 Ca -0.04 -1.27 0.00 0.00 -2.93 0.00 0.00 61.98 57.73 1k2m s VAL 632 Cb -0.00 -2.05 0.00 0.00 -1.53 0.00 0.00 36.38 32.79 1k2m s VAL 632 CO -0.04 -0.05 0.00 0.61 -3.33 0.00 0.00 175.10 172.29 1k2m n GLY 633 N -0.37 -1.60 1.11 6.54 0.00 -1.26 -4.78 105.19 104.84 1k2m n GLY 633 Ca -0.04 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 1k2m n GLY 633 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k2m n LYS 634 N 0.00 -2.26 -0.93 1.61 4.01 -1.26 -4.96 118.16 114.38 1k2m n LYS 634 Ca 0.00 -0.44 0.05 0.00 -0.51 0.00 0.00 58.31 57.41 1k2m n LYS 634 Cb 0.00 -0.63 0.13 0.00 -0.51 0.00 0.00 35.03 34.02 1k2m n LYS 634 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1k2m n SER 635 N -3.23 1.41 -4.48 4.39 3.41 -1.26 -4.83 113.62 109.03 1k2m n SER 635 Ca 0.04 -3.09 -0.43 0.00 -0.26 0.00 0.00 58.87 55.14 1k2m n SER 635 Cb 0.18 -0.43 -0.04 0.00 -0.26 0.00 0.00 64.21 63.66 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 -1.88 3.18 0.00 4.33 -1.94 -1.26 -3.88 119.30 117.85 1k2m s MET 636 Ca 0.35 -0.61 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 1k2m s MET 636 Cb 0.36 -4.17 0.00 0.00 2.01 0.00 0.00 34.83 33.04 1k2m s MET 636 CO -0.10 -1.73 0.00 0.98 -0.01 0.00 0.00 175.02 174.16 1k2m n TYR 637 N 7.74 0.00 -2.98 -0.03 9.36 -1.26 -4.99 117.16 124.99 1k2m n TYR 637 Ca -0.02 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.86 1k2m n TYR 637 Cb 0.46 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.11 1k2m n TYR 637 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1k2m s GLU 638 N -0.06 4.25 0.43 2.98 2.02 -1.25 -5.05 118.70 122.02 1k2m s GLU 638 Ca 0.00 0.97 -0.08 0.00 0.02 0.00 0.00 54.97 55.87 1k2m s GLU 638 Cb 0.00 -2.60 -0.05 0.00 0.10 0.00 0.00 34.13 31.58 1k2m s GLU 638 CO 0.00 0.22 0.77 -1.54 0.02 0.00 0.00 175.26 174.73 1k2m s SER 639 N -1.92 6.41 0.74 -0.19 1.04 -1.26 -4.85 113.70 113.67 1k2m s SER 639 Ca 0.51 1.03 -0.14 0.00 0.48 0.00 0.00 55.95 57.84 1k2m s SER 639 Cb -0.14 -2.28 -0.12 0.00 0.10 0.00 0.00 66.02 63.58 1k2m s SER 639 CO 0.19 -0.46 -0.57 -2.65 0.98 0.00 0.00 173.24 170.73 1k2m n PRO 640 N -1.68 0.00 0.00 4.02 -0.02 -1.26 -4.85 135.00 131.21 1k2m n PRO 640 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1k2m n PRO 640 Cb 0.54 -0.79 0.00 0.00 -0.02 0.00 0.00 33.50 33.23 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 -1.88 0.00 -0.11 3.55 0.00 -1.26 -4.94 120.51 115.87 1k2m n ALA 641 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1k2m n ALA 641 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 1k2m n ALA 641 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1k2m n GLN 642 N 0.00 0.00 -0.92 0.00 -0.06 -1.26 -1.71 117.38 113.43 1k2m n GLN 642 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 57.00 54.96 1k2m n GLN 642 Cb 0.00 0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.14 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 0.00 0.68 0.00 1.69 0.00 -1.17 -3.88 105.19 102.51 1k2m n GLY 643 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 0.06 0.00 -4.31 0.99 7.99 -0.69 -4.54 117.00 116.50 1k2m n LEU 644 Ca -0.16 0.00 -0.27 0.00 -0.01 0.00 0.00 56.01 55.57 1k2m n LEU 644 Cb 0.71 0.00 -0.14 0.00 -0.11 0.00 0.00 43.42 43.88 1k2m n LEU 644 CO -0.09 -0.27 -0.55 -1.81 -1.51 0.00 0.00 177.39 173.17 1k2m s ASP 645 N -1.42 2.87 0.22 -1.43 1.11 -1.26 0.13 116.67 116.89 1k2m s ASP 645 Ca 0.00 -0.61 0.09 0.00 0.18 0.00 0.00 52.55 52.20 1k2m s ASP 645 Cb 0.00 -0.22 -0.05 0.00 1.07 0.00 0.00 42.92 43.72 1k2m s ASP 645 CO 0.00 0.18 -0.15 -1.81 1.18 0.00 0.00 175.17 174.57 1k2m s ASP 646 N -1.48 2.78 -0.21 0.27 1.01 0.59 -4.06 116.67 115.57 1k2m s ASP 646 Ca 0.10 -1.03 -0.05 0.00 0.71 0.00 0.00 52.55 52.28 1k2m s ASP 646 Cb -0.10 -0.17 -0.02 0.00 1.01 0.00 0.00 42.92 43.65 1k2m s ASP 646 CO 0.03 -0.14 -0.01 0.27 0.21 0.00 0.00 175.17 175.53 1k2m s ILE 647 N -2.88 3.69 -0.19 0.77 -4.36 -1.26 0.97 121.20 117.94 1k2m s ILE 647 Ca 0.24 -0.39 -0.07 0.00 -0.26 0.00 0.00 60.65 60.18 1k2m s ILE 647 Cb -0.01 -2.68 -0.04 0.00 1.25 0.00 0.00 42.46 40.98 1k2m s ILE 647 CO 0.09 0.42 0.04 0.26 0.24 0.00 0.00 174.94 175.98 1k2m s TRP 648 N 1.30 3.17 -0.30 1.37 0.52 0.48 -0.03 118.94 125.45 1k2m s TRP 648 Ca 0.04 -0.10 -0.20 0.00 0.02 0.00 0.00 56.10 55.86 1k2m s TRP 648 Cb -0.14 -2.08 -0.01 0.00 -1.15 0.00 0.00 33.47 30.08 1k2m s TRP 648 CO -0.00 0.02 0.61 -0.47 0.02 0.00 0.00 176.95 177.13 1k2m s TYR 649 N 0.59 3.22 -0.18 -1.98 6.14 0.16 0.17 117.35 125.47 1k2m s TYR 649 Ca 0.02 0.59 -0.06 0.00 0.64 0.00 0.00 57.07 58.26 1k2m s TYR 649 Cb -0.13 -2.95 -0.03 0.00 0.42 0.00 0.00 41.96 39.26 1k2m s TYR 649 CO 0.02 -0.45 0.02 0.00 0.64 0.00 0.00 175.55 175.78 1k2m s HIS 651 N 0.59 2.98 0.00 0.00 2.46 -0.82 0.13 115.29 120.63 1k2m s HIS 651 Ca 0.01 -0.53 0.00 0.00 0.47 0.00 0.00 55.06 55.01 1k2m s HIS 651 Cb -0.14 -2.01 0.00 0.00 -0.13 0.00 0.00 32.58 30.31 1k2m s HIS 651 CO 0.02 -0.23 0.78 0.25 -2.47 0.00 0.00 174.74 173.08 1k2m n THR 652 N 4.00 0.60 -2.93 0.89 -2.24 -0.03 0.11 114.28 114.68 1k2m n THR 652 Ca -0.18 -0.71 -0.35 0.00 -2.27 0.00 0.00 64.05 60.54 1k2m n THR 652 Cb 0.52 0.75 -0.06 0.00 -2.10 0.00 0.00 70.33 69.43 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 -0.60 2.57 0.22 3.38 0.00 0.67 -4.81 107.32 108.75 1k2m s GLY 653 Ca 0.00 0.32 0.26 0.00 0.00 0.00 0.00 44.72 45.29 1k2m s GLY 653 CO 0.00 0.66 1.76 2.41 0.00 0.00 0.00 173.10 177.93 1k2m n THR 654 N 0.14 0.65 1.62 0.90 -1.04 -1.26 -2.98 114.28 112.31 1k2m n THR 654 Ca 0.02 -0.16 0.11 0.00 -2.04 0.00 0.00 64.05 61.99 1k2m n THR 654 Cb 0.52 -0.73 0.52 0.00 -1.82 0.00 0.00 70.33 68.82 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 -2.26 0.87 -1.55 8.00 3.02 -1.26 -4.90 115.26 117.18 1k2m n ASN 655 Ca 0.05 -1.50 0.00 0.00 -0.03 0.00 0.00 54.58 53.10 1k2m n ASN 655 Cb 0.38 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 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 -0.24 -3.06 -3.65 2.41 3.14 -1.16 -4.84 118.33 110.94 1k2m n VAL 656 Ca 0.17 1.41 -0.20 0.00 -2.96 0.00 0.00 64.34 62.75 1k2m n VAL 656 Cb 0.21 -1.89 -0.02 0.00 -1.06 0.00 0.00 33.84 31.09 1k2m n VAL 656 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1k2m s SER 657 N -2.49 5.48 -0.12 6.55 0.15 0.37 -4.59 113.70 119.05 1k2m s SER 657 Ca 0.00 -0.43 -0.00 0.00 0.70 0.00 0.00 55.95 56.22 1k2m s SER 657 Cb 0.00 -0.99 0.02 0.00 -1.71 0.00 0.00 66.02 63.34 1k2m s SER 657 CO 0.00 -0.43 -0.09 -0.31 1.20 0.00 0.00 173.24 173.61 1k2m s TYR 658 N -2.29 1.66 -0.48 3.44 2.02 0.58 0.11 117.35 122.40 1k2m s TYR 658 Ca 0.44 -0.87 -0.12 0.00 -0.37 0.00 0.00 57.07 56.14 1k2m s TYR 658 Cb -0.07 -1.33 0.10 0.00 -0.40 0.00 0.00 41.96 40.27 1k2m s TYR 658 CO 0.28 -0.56 0.38 -1.17 -1.57 0.00 0.00 175.55 172.91 1k2m s LEU 659 N 1.65 5.67 0.00 -1.29 2.96 0.18 0.27 118.68 128.12 1k2m s LEU 659 Ca 0.05 -1.64 0.00 0.00 -0.22 0.00 0.00 54.13 52.32 1k2m s LEU 659 Cb -0.13 -2.10 0.00 0.00 0.50 0.00 0.00 46.19 44.47 1k2m s LEU 659 CO -0.09 -0.69 0.00 0.59 -1.32 0.00 0.00 176.35 174.85 1k2m n ASN 660 N 5.07 0.00 0.00 3.68 4.13 -0.99 -0.13 115.26 127.02 1k2m n ASN 660 Ca -0.11 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.15 1k2m n ASN 660 Cb 0.42 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.66 1k2m n ASN 660 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1k2m n ASN 661 N 1.48 0.36 -4.58 6.41 0.23 -1.26 -5.05 115.26 112.85 1k2m n ASN 661 Ca 0.00 -1.15 -0.33 0.00 -0.53 0.00 0.00 54.58 52.57 1k2m n ASN 661 Cb 0.00 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 37.59 1k2m n ASN 661 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 1k2m s ASN 662 N -0.15 4.61 0.30 0.53 0.02 0.82 -5.10 114.94 115.96 1k2m s ASN 662 Ca 0.00 -0.08 -0.28 0.00 -1.02 0.00 0.00 52.86 51.48 1k2m s ASN 662 Cb 0.00 -1.12 -0.09 0.00 0.02 0.00 0.00 41.25 40.06 1k2m s ASN 662 CO 0.00 0.33 1.07 -0.60 0.02 0.00 0.00 177.10 177.92 1k2m s ARG 663 N -1.04 4.57 -0.57 -0.60 3.52 -1.26 -0.65 118.95 122.93 1k2m s ARG 663 Ca 0.14 1.71 0.04 0.00 -0.13 0.00 0.00 55.73 57.49 1k2m s ARG 663 Cb -0.11 -3.07 0.15 0.00 -1.56 0.00 0.00 34.95 30.35 1k2m s ARG 663 CO 0.04 0.18 0.34 -1.64 -0.81 0.00 0.00 175.30 173.41 1k2m s MET 664 N -1.62 1.98 0.43 5.12 -1.94 0.30 -4.84 119.30 118.72 1k2m s MET 664 Ca 0.47 -2.75 -0.08 0.00 -1.71 0.00 0.00 55.69 51.62 1k2m s MET 664 Cb -0.29 -3.09 -0.05 0.00 2.01 0.00 0.00 34.83 33.40 1k2m s MET 664 CO 0.37 -1.19 0.77 0.96 -0.01 0.00 0.00 175.02 175.92 1k2m s ILE 665 N -0.58 4.85 -0.49 2.53 -4.36 -1.26 0.14 121.20 122.03 1k2m s ILE 665 Ca 0.21 0.43 -0.34 0.00 -0.26 0.00 0.00 60.65 60.68 1k2m s ILE 665 Cb -0.17 -3.79 -0.13 0.00 1.25 0.00 0.00 42.46 39.62 1k2m s ILE 665 CO -0.07 -0.65 2.29 1.67 0.24 0.00 0.00 174.94 178.43 1k2m n GLN 666 N -1.67 0.77 0.00 0.37 7.27 -1.22 -1.46 117.38 121.44 1k2m n GLN 666 Ca 0.02 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.26 1k2m n GLN 666 Cb 0.54 -2.33 0.00 0.00 2.41 0.00 0.00 30.24 30.87 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 6.59 1.76 3.46 1.69 0.00 0.30 -4.94 105.19 114.05 1k2m n GLY 667 Ca 0.46 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.25 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 2.20 0.03 2.61 -4.23 -0.53 0.05 115.64 113.77 1k2m s THR 668 Ca 0.00 -2.29 0.02 0.00 -1.18 0.00 0.00 61.69 58.24 1k2m s THR 668 Cb 0.00 -2.37 -0.02 0.00 1.34 0.00 0.00 72.50 71.45 1k2m s THR 668 CO 0.00 -0.37 -0.08 -0.75 -0.54 0.00 0.00 174.62 172.89 1k2m s LYS 669 N -3.58 0.53 -0.06 3.99 2.20 0.29 -1.95 119.74 121.16 1k2m s LYS 669 Ca 0.29 -0.65 -0.11 0.00 -0.36 0.00 0.00 55.97 55.15 1k2m s LYS 669 Cb -0.01 -0.35 0.02 0.00 -1.51 0.00 0.00 37.83 35.98 1k2m s LYS 669 CO 0.14 0.07 0.27 0.12 -0.36 0.00 0.00 175.35 175.58 1k2m s PHE 670 N -1.11 -0.21 0.21 4.03 5.36 -0.56 0.77 117.98 126.48 1k2m s PHE 670 Ca -0.07 0.44 -0.30 0.00 -0.96 0.00 0.00 56.93 56.04 1k2m s PHE 670 Cb -0.08 0.08 -0.09 0.00 -0.34 0.00 0.00 43.02 42.58 1k2m s PHE 670 CO 0.00 -0.25 1.32 -1.17 -1.46 0.00 0.00 175.22 173.66 1k2m s LEU 671 N -0.59 4.41 -0.37 6.12 1.98 -1.26 0.37 118.68 129.34 1k2m s LEU 671 Ca -0.07 2.44 -0.07 0.00 -2.89 0.00 0.00 54.13 53.54 1k2m s LEU 671 Cb -0.04 -3.61 0.05 0.00 0.66 0.00 0.00 46.19 43.25 1k2m s LEU 671 CO 0.02 -0.54 0.16 -0.76 -1.89 0.00 0.00 176.35 173.33 1k2m s LEU 672 N -0.22 4.62 0.27 -0.68 1.43 0.96 -4.86 118.68 120.20 1k2m s LEU 672 Ca 0.56 -1.29 -0.00 0.00 -1.03 0.00 0.00 54.13 52.38 1k2m s LEU 672 Cb -0.37 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1k2m s LEU 672 CO 0.39 -0.40 0.46 -1.10 0.23 0.00 0.00 176.35 175.94 1k2m s GLN 673 N 1.40 3.51 -0.03 1.70 -0.21 -1.26 -4.48 119.66 120.28 1k2m s GLN 673 Ca 0.00 -0.35 -0.36 0.00 0.02 0.00 0.00 55.36 54.67 1k2m s GLN 673 Cb -0.21 -2.76 -0.14 0.00 1.00 0.00 0.00 33.01 30.91 1k2m s GLN 673 CO 0.02 0.29 1.67 -0.40 -2.12 0.00 0.00 175.29 174.76 1k2m n ASP 674 N -1.21 2.80 -0.38 5.90 5.75 0.49 -1.82 116.55 128.09 1k2m n ASP 674 Ca -0.05 1.05 0.00 0.00 -0.01 0.00 0.00 54.79 55.78 1k2m n ASP 674 Cb 0.55 -1.30 0.00 0.00 -1.03 0.00 0.00 41.12 39.34 1k2m n ASP 674 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1k2m n GLY 675 N 3.75 0.96 3.55 6.12 0.00 0.28 -4.92 105.19 114.94 1k2m n GLY 675 Ca 0.21 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1k2m n GLY 675 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k2m s ASP 676 N -2.78 6.41 -0.44 1.61 1.11 -0.55 -4.72 116.67 117.30 1k2m s ASP 676 Ca 0.00 -0.02 -0.18 0.00 0.18 0.00 0.00 52.55 52.53 1k2m s ASP 676 Cb 0.00 -2.35 0.03 0.00 1.07 0.00 0.00 42.92 41.68 1k2m s ASP 676 CO 0.00 -0.73 0.50 -1.61 1.18 0.00 0.00 175.17 174.50 1k2m s GLU 677 N 2.92 3.12 -0.16 8.23 2.02 -1.26 0.15 118.70 133.71 1k2m s GLU 677 Ca 0.26 -0.78 -0.03 0.00 0.02 0.00 0.00 54.97 54.44 1k2m s GLU 677 Cb -0.14 -4.00 -0.02 0.00 0.10 0.00 0.00 34.13 30.07 1k2m s GLU 677 CO 0.18 -0.96 -0.04 0.42 0.02 0.00 0.00 175.26 174.88 1k2m s ILE 678 N 2.29 3.78 -0.33 -1.63 1.01 0.25 -2.35 121.20 124.22 1k2m s ILE 678 Ca 0.13 -0.39 -0.21 0.00 0.00 0.00 0.00 60.65 60.19 1k2m s ILE 678 Cb -0.18 -2.66 -0.00 0.00 0.01 0.00 0.00 42.46 39.63 1k2m s ILE 678 CO 0.13 0.49 0.64 -0.54 0.00 0.00 0.00 174.94 175.66 1k2m s LYS 679 N 0.49 3.78 0.09 2.79 3.01 0.75 -0.62 119.74 130.03 1k2m s LYS 679 Ca -0.04 0.18 -0.09 0.00 -1.01 0.00 0.00 55.97 55.01 1k2m s LYS 679 Cb -0.14 -3.77 -0.20 0.00 -1.01 0.00 0.00 37.83 32.70 1k2m s LYS 679 CO 0.03 -0.67 1.20 0.82 0.51 0.00 0.00 175.35 177.24 1k2m h ILE 680 N 5.62 1.36 -2.36 2.17 2.04 -1.80 1.71 117.51 126.25 1k2m h ILE 680 Ca -0.26 -2.50 -0.06 0.00 1.00 0.00 0.00 64.86 63.04 1k2m h ILE 680 Cb 1.11 2.56 -0.24 0.00 -0.74 0.00 0.00 36.82 39.52 1k2m h ILE 680 CO 0.83 0.75 -0.14 -0.63 0.00 0.00 0.00 178.15 178.96 1k2m s ILE 681 N -3.11 -0.01 -0.07 -0.67 1.01 -1.26 -4.09 121.20 113.01 1k2m s ILE 681 Ca -0.07 0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.61 1k2m s ILE 681 Cb 0.07 -0.78 0.03 0.00 0.01 0.00 0.00 42.46 41.79 1k2m s ILE 681 CO 0.90 0.02 0.00 0.86 0.00 0.00 0.00 174.94 176.72 1k2m s TRP 682 N 1.29 0.61 -0.18 3.97 -0.00 -1.22 0.54 118.94 123.95 1k2m s TRP 682 Ca -0.08 -0.13 0.01 0.00 -0.00 0.00 0.00 56.10 55.90 1k2m s TRP 682 Cb -0.06 -0.75 0.03 0.00 -0.00 0.00 0.00 33.47 32.69 1k2m s TRP 682 CO -0.13 -0.30 -0.13 -0.51 -0.00 0.00 0.00 176.95 175.88 1k2m s ASP 683 N 1.87 3.12 0.07 5.86 1.01 0.29 -4.94 116.67 123.95 1k2m s ASP 683 Ca 0.03 -0.72 -0.20 0.00 0.71 0.00 0.00 52.55 52.38 1k2m s ASP 683 Cb -0.12 -1.26 -0.11 0.00 1.01 0.00 0.00 42.92 42.44 1k2m s ASP 683 CO -0.05 -0.09 1.48 0.11 0.21 0.00 0.00 175.17 176.84 1k2m h LYS 684 N 7.99 0.35 0.21 8.23 1.57 -1.95 0.18 116.57 133.15 1k2m h LYS 684 Ca -0.34 -0.12 -0.34 0.00 -1.87 0.00 0.00 60.65 57.97 1k2m h LYS 684 Cb 1.12 -0.03 0.02 0.00 0.08 0.00 0.00 32.23 33.42 1k2m h LYS 684 CO 0.52 0.58 -1.62 -0.91 -0.57 0.00 0.00 179.45 177.45 1k2m h ASN 685 N 0.09 0.70 0.95 0.86 2.35 -1.98 -3.30 115.58 115.26 1k2m h ASN 685 Ca 0.05 -0.93 0.00 0.00 -0.55 0.00 0.00 56.30 54.87 1k2m h ASN 685 Cb 0.43 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1k2m h ASN 685 CO 0.01 1.75 0.00 -3.20 -1.65 0.00 0.00 177.43 174.34 1k2m n ASN 686 N -3.67 0.21 -1.62 5.81 5.15 -1.25 -4.88 115.26 115.02 1k2m n ASN 686 Ca -0.22 0.53 -0.20 0.00 -0.60 0.00 0.00 54.58 54.10 1k2m n ASN 686 Cb 1.08 -0.58 -0.08 0.00 -0.53 0.00 0.00 39.78 39.66 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 -1.71 -1.45 -2.77 1.20 0.00 0.59 -4.90 118.16 109.12 1k2m n LYS 687 Ca 0.05 1.15 -0.43 0.00 0.00 0.00 0.00 58.31 59.09 1k2m n LYS 687 Cb 0.31 -5.54 -0.04 0.00 0.00 0.00 0.00 35.03 29.76 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 -2.69 2.71 -0.17 5.64 2.19 -1.06 -4.86 117.98 119.74 1k2m s PHE 688 Ca 0.00 0.01 0.01 0.00 0.33 0.00 0.00 56.93 57.28 1k2m s PHE 688 Cb 0.00 -4.23 0.02 0.00 -1.31 0.00 0.00 43.02 37.50 1k2m s PHE 688 CO 0.00 -1.48 -0.20 0.54 1.83 0.00 0.00 175.22 175.91 1k2m s VAL 689 N 4.29 2.14 0.08 3.12 0.11 -1.26 0.11 120.40 129.00 1k2m s VAL 689 Ca 0.32 -0.92 0.06 0.00 -2.93 0.00 0.00 61.98 58.51 1k2m s VAL 689 Cb -0.12 -1.89 -0.03 0.00 -1.53 0.00 0.00 36.38 32.81 1k2m s VAL 689 CO 0.19 0.54 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.70 1k2m s ILE 690 N 1.17 1.35 -0.30 7.04 -1.09 0.19 0.76 121.20 130.32 1k2m s ILE 690 Ca 0.02 -1.41 -0.17 0.00 -2.23 0.00 0.00 60.65 56.86 1k2m s ILE 690 Cb -0.14 -1.27 0.21 0.00 -1.58 0.00 0.00 42.46 39.68 1k2m s ILE 690 CO -0.09 -0.17 1.26 -0.83 -1.23 0.00 0.00 174.94 173.88 1k2m s GLY 691 N -1.82 0.54 0.04 6.18 0.00 -1.26 -3.23 107.32 107.77 1k2m s GLY 691 Ca 0.02 3.79 0.05 0.00 0.00 0.00 0.00 44.72 48.58 1k2m s GLY 691 CO 0.03 2.92 -0.12 -1.36 0.00 0.00 0.00 173.10 174.57 1k2m s PHE 692 N 1.30 2.73 -0.30 1.90 0.08 0.21 -2.57 117.98 121.32 1k2m s PHE 692 Ca -0.06 -0.15 -0.11 0.00 0.12 0.00 0.00 56.93 56.74 1k2m s PHE 692 Cb -0.02 -1.52 -0.03 0.00 -0.57 0.00 0.00 43.02 40.89 1k2m s PHE 692 CO -0.11 0.34 0.18 0.21 -0.10 0.00 0.00 175.22 175.73 1k2m s LYS 693 N -1.59 3.66 -0.17 0.44 2.20 -1.01 -0.58 119.74 122.69 1k2m s LYS 693 Ca 0.17 -0.51 -0.29 0.00 -0.36 0.00 0.00 55.97 54.98 1k2m s LYS 693 Cb -0.11 -3.62 -0.00 0.00 -1.51 0.00 0.00 37.83 32.59 1k2m s LYS 693 CO 0.08 -0.29 1.05 0.08 -0.36 0.00 0.00 175.35 175.91 1k2m s VAL 694 N 1.70 4.67 -0.23 4.02 1.01 0.39 -0.66 120.40 131.31 1k2m s VAL 694 Ca 0.06 1.98 -0.01 0.00 0.00 0.00 0.00 61.98 64.01 1k2m s VAL 694 Cb -0.16 -4.27 0.07 0.00 0.00 0.00 0.00 36.38 32.01 1k2m s VAL 694 CO 0.09 -0.10 0.02 -0.70 0.00 0.00 0.00 175.10 174.41 1k2m s GLU 695 N 2.72 0.97 -0.55 2.72 2.12 0.48 0.10 118.70 127.27 1k2m s GLU 695 Ca 0.47 -0.71 -0.28 0.00 0.36 0.00 0.00 54.97 54.81 1k2m s GLU 695 Cb -0.17 -2.26 0.01 0.00 0.26 0.00 0.00 34.13 31.98 1k2m s GLU 695 CO 0.12 -0.68 1.40 0.42 -0.54 0.00 0.00 175.26 175.98 1k2m s ILE 696 N 1.67 3.81 -0.14 -3.70 1.01 -1.26 -0.18 121.20 122.41 1k2m s ILE 696 Ca -0.01 0.71 -0.18 0.00 0.00 0.00 0.00 60.65 61.17 1k2m s ILE 696 Cb -0.18 -4.43 -0.24 0.00 0.01 0.00 0.00 42.46 37.62 1k2m s ILE 696 CO -0.10 -1.14 0.44 0.78 0.00 0.00 0.00 174.94 174.92 1k2m h ASN 697 N 10.96 0.21 -3.68 3.58 2.35 -1.00 -3.47 115.58 124.54 1k2m h ASN 697 Ca -0.27 -0.76 -0.68 0.00 -0.55 0.00 0.00 56.30 54.04 1k2m h ASN 697 Cb 1.09 -0.07 -0.20 0.00 0.05 0.00 0.00 38.32 39.20 1k2m h ASN 697 CO 1.17 1.54 -0.70 -0.62 -1.65 0.00 0.00 177.43 177.16 1k2m s ASP 698 N -6.89 4.59 -0.38 5.81 2.15 -1.02 -5.02 116.67 115.91 1k2m s ASP 698 Ca -0.23 -0.05 -0.00 0.00 0.43 0.00 0.00 52.55 52.70 1k2m s ASP 698 Cb 0.04 -1.17 0.11 0.00 -0.30 0.00 0.00 42.92 41.60 1k2m s ASP 698 CO 0.70 0.35 0.15 0.42 -0.17 0.00 0.00 175.17 176.62 1k2m s THR 699 N -0.73 2.91 -1.49 1.71 -4.23 -1.26 -4.53 115.64 108.01 1k2m s THR 699 Ca 0.11 -2.17 -0.13 0.00 -1.18 0.00 0.00 61.69 58.32 1k2m s THR 699 Cb -0.11 -3.04 0.02 0.00 1.34 0.00 0.00 72.50 70.70 1k2m s THR 699 CO 0.01 -0.66 2.35 1.07 -0.54 0.00 0.00 174.62 176.86 1k2m n THR 700 N 4.46 3.60 -2.27 3.99 5.66 -1.26 -4.22 114.28 124.24 1k2m n THR 700 Ca 0.00 -2.95 -0.13 0.00 -3.05 0.00 0.00 64.05 57.92 1k2m n THR 700 Cb 0.42 -2.61 -0.00 0.00 -1.55 0.00 0.00 70.33 66.58 1k2m n THR 700 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1k2m n GLY 701 N 4.00 -0.16 3.73 1.09 0.00 -1.26 -4.79 105.19 107.80 1k2m n GLY 701 Ca 0.56 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.77 4.41 0.27 0.99 1.43 -1.26 -4.05 118.68 116.70 1k2m s LEU 702 Ca 0.01 2.31 -0.07 0.00 -1.03 0.00 0.00 54.13 55.35 1k2m s LEU 702 Cb -0.00 -3.60 0.45 0.00 0.03 0.00 0.00 46.19 43.06 1k2m s LEU 702 CO 0.01 -0.52 1.49 2.22 0.23 0.00 0.00 176.35 179.79 1k2m n PHE 703 N 3.04 0.35 -2.01 0.29 -1.74 -1.26 -3.70 117.46 112.44 1k2m n PHE 703 Ca 0.07 1.17 -0.00 0.00 -0.56 0.00 0.00 57.45 58.13 1k2m n PHE 703 Cb 0.43 -1.06 -0.00 0.00 1.52 0.00 0.00 39.48 40.37 1k2m n PHE 703 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1k2m n ASN 704 N -5.56 -0.06 0.00 5.98 2.04 -1.26 -4.76 115.26 111.64 1k2m n ASN 704 Ca 0.15 -1.19 0.00 0.00 -0.44 0.00 0.00 54.58 53.10 1k2m n ASN 704 Cb 0.48 -0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.73 1k2m n ASN 704 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 1k2m n GLU 705 N 0.01 0.00 0.00 -3.83 0.28 -1.24 -3.93 120.64 111.93 1k2m n GLU 705 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1k2m n GLU 705 Cb 0.54 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.41 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 -1.58 0.04 -1.84 0.00 -1.26 -4.42 105.19 96.12 1k2m n GLY 706 Ca 0.00 0.76 0.08 0.00 0.00 0.00 0.00 46.02 46.86 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 0.86 0.00 0.99 7.99 -1.25 0.18 117.00 125.77 1k2m n LEU 707 Ca 0.00 -0.53 0.00 0.00 -0.01 0.00 0.00 56.01 55.47 1k2m n LEU 707 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1k2m n LEU 707 CO 0.00 0.20 0.00 0.61 -1.51 0.00 0.00 177.39 176.69 1k2m n GLY 708 N 1.36 3.01 7.00 -0.72 0.00 -1.26 -5.00 105.19 109.58 1k2m n GLY 708 Ca 0.03 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 0.00 0.00 0.00 1.61 0.00 -1.26 -4.87 117.12 112.60 1k2m n MET 709 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1k2m n MET 709 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1k2m n MET 709 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 175.97 177.44 1k2m n LEU 710 N 0.00 0.00 0.00 4.03 -0.00 -1.26 -4.96 117.00 114.81 1k2m n LEU 710 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1k2m n LEU 710 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1k2m n LEU 710 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.39 177.39 1k2m n GLN 711 N 0.00 0.00 -3.53 1.47 6.02 -1.26 -4.56 117.38 115.51 1k2m n GLN 711 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.58 1k2m n GLN 711 Cb 0.00 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.18 1k2m n GLN 711 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1k2m s GLU 712 N 0.00 2.60 -0.72 -1.09 2.02 -1.26 -5.03 118.70 115.22 1k2m s GLU 712 Ca 0.00 -1.89 -0.26 0.00 0.02 0.00 0.00 54.97 52.84 1k2m s GLU 712 Cb 0.00 -3.97 0.04 0.00 0.10 0.00 0.00 34.13 30.29 1k2m s GLU 712 CO 0.00 -1.21 1.21 -1.14 0.02 0.00 0.00 175.26 174.14 1k2m s GLN 713 N 1.16 3.19 0.00 1.61 -0.44 -1.26 -4.62 119.66 119.30 1k2m s GLN 713 Ca 0.07 -0.34 0.00 0.00 -2.50 0.00 0.00 55.36 52.60 1k2m s GLN 713 Cb -0.25 -4.18 0.00 0.00 -1.64 0.00 0.00 33.01 26.94 1k2m s GLN 713 CO -0.01 -2.06 0.00 0.54 0.50 0.00 0.00 175.29 174.26 1k2m n ARG 714 N 8.99 -0.25 -4.84 1.67 5.12 -1.26 -4.99 116.66 121.11 1k2m n ARG 714 Ca 0.02 0.59 -0.26 0.00 -1.93 0.00 0.00 57.85 56.27 1k2m n ARG 714 Cb 0.48 -0.71 -0.15 0.00 -1.16 0.00 0.00 32.46 30.92 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 -0.69 1.64 -0.06 1.55 -7.23 -1.26 -5.01 120.40 109.34 1k2m s VAL 715 Ca 0.00 -1.02 -0.23 0.00 -1.81 0.00 0.00 61.98 58.91 1k2m s VAL 715 Cb 0.00 -1.39 -0.04 0.00 0.56 0.00 0.00 36.38 35.51 1k2m s VAL 715 CO 0.00 0.34 0.69 -0.69 -0.31 0.00 0.00 175.10 175.13 1k2m s VAL 716 N -0.63 5.04 0.37 1.32 1.01 -1.26 -4.59 120.40 121.66 1k2m s VAL 716 Ca 0.08 1.42 0.07 0.00 0.00 0.00 0.00 61.98 63.56 1k2m s VAL 716 Cb -0.08 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 1k2m s VAL 716 CO 0.00 0.26 0.38 -0.76 0.00 0.00 0.00 175.10 174.98 1k2m s LEU 717 N 0.73 3.59 0.05 3.92 1.43 0.23 -4.93 118.68 123.70 1k2m s LEU 717 Ca 0.37 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 1k2m s LEU 717 Cb -0.18 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.71 1k2m s LEU 717 CO 0.18 -0.51 0.13 -0.54 0.23 0.00 0.00 176.35 175.84 1k2m s LYS 718 N -4.10 3.13 0.36 1.70 3.01 -1.26 0.11 119.74 122.69 1k2m s LYS 718 Ca 0.45 -0.54 -0.15 0.00 -1.01 0.00 0.00 55.97 54.73 1k2m s LYS 718 Cb -0.06 -2.88 -0.09 0.00 -1.01 0.00 0.00 37.83 33.79 1k2m s LYS 718 CO 0.28 0.61 0.78 -0.65 0.51 0.00 0.00 175.35 176.89 1k2m s GLN 719 N -2.22 3.98 0.37 1.68 -0.21 0.11 -4.61 119.66 118.75 1k2m s GLN 719 Ca 0.29 0.70 0.02 0.00 0.02 0.00 0.00 55.36 56.39 1k2m s GLN 719 Cb -0.12 -2.37 -0.01 0.00 1.00 0.00 0.00 33.01 31.51 1k2m s GLN 719 CO 0.21 0.07 0.07 0.25 -2.12 0.00 0.00 175.29 173.77 1k2m n THR 720 N -0.65 0.00 -0.04 -0.19 -2.24 -1.26 -4.92 114.28 104.97 1k2m n THR 720 Ca 0.04 -1.94 0.21 0.00 -2.27 0.00 0.00 64.05 60.08 1k2m n THR 720 Cb 0.53 0.57 0.67 0.00 -2.10 0.00 0.00 70.33 70.00 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 1.41 2.49 0.13 6.98 0.00 -1.98 -1.40 119.26 126.89 1k2m h ALA 721 Ca -0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1k2m h ALA 721 Cb 1.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1k2m h ALA 721 CO 0.48 -0.66 -0.11 1.49 0.00 0.00 0.00 179.25 180.44 1k2m h GLU 722 N 0.05 -0.24 -0.19 0.00 4.81 -1.99 1.00 114.58 118.01 1k2m h GLU 722 Ca 0.29 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.49 1k2m h GLU 722 Cb 1.07 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1k2m h GLU 722 CO -0.02 -0.16 -0.05 0.93 -0.73 0.00 0.00 179.01 178.98 1k2m h GLU 723 N -0.25 0.37 -0.54 1.92 3.07 -1.70 -2.88 114.58 114.56 1k2m h GLU 723 Ca -0.00 -0.14 0.10 0.00 -0.50 0.00 0.00 59.36 58.81 1k2m h GLU 723 Cb 0.23 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.09 1k2m h GLU 723 CO -0.02 0.63 0.36 -0.22 -1.40 0.00 0.00 179.01 178.37 1k2m h LYS 724 N 0.08 0.31 -0.43 2.33 3.64 -1.18 -0.79 116.57 120.54 1k2m h LYS 724 Ca 0.05 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.29 1k2m h LYS 724 Cb 0.50 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1k2m h LYS 724 CO 0.02 0.21 -0.21 0.22 -2.27 0.00 0.00 179.45 177.42 1k2m h ASP 725 N 0.32 0.88 -0.65 4.20 1.82 -0.60 -2.21 116.42 120.19 1k2m h ASP 725 Ca 0.25 -0.32 0.06 0.00 -0.39 0.00 0.00 57.03 56.63 1k2m h ASP 725 Cb 0.55 -0.24 -0.06 0.00 0.68 0.00 0.00 39.33 40.26 1k2m h ASP 725 CO -0.06 1.06 0.35 -0.07 -1.61 0.00 0.00 179.24 178.91 1k2m h LEU 726 N 0.75 0.50 -0.80 2.28 3.38 -0.96 -1.09 115.31 119.38 1k2m h LEU 726 Ca 0.10 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 1k2m h LEU 726 Cb 0.74 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1k2m h LEU 726 CO 0.06 0.32 -0.43 1.62 0.09 0.00 0.00 178.44 180.10 1k2m h VAL 727 N 0.64 0.96 -0.65 1.22 3.04 -1.43 -3.08 116.25 116.96 1k2m h VAL 727 Ca 0.29 -1.71 0.10 0.00 -1.01 0.00 0.00 66.70 64.37 1k2m h VAL 727 Cb 0.20 2.03 -0.04 0.00 -2.01 0.00 0.00 31.29 31.47 1k2m h VAL 727 CO -0.19 0.42 0.43 0.50 -1.01 0.00 0.00 177.57 177.72 1k2m h LYS 728 N 0.00 0.48 -0.97 4.17 3.64 -0.55 0.89 116.57 124.22 1k2m h LYS 728 Ca -0.00 -0.03 -0.45 0.00 -1.27 0.00 0.00 60.65 58.90 1k2m h LYS 728 Cb 0.99 -0.11 -0.27 0.00 -0.41 0.00 0.00 32.23 32.44 1k2m h LYS 728 CO 0.06 0.31 0.57 1.63 -2.27 0.00 0.00 179.45 179.75 1k2m n LYS 729 N -4.48 2.35 0.00 1.90 5.02 -1.15 -5.11 118.16 116.69 1k2m n LYS 729 Ca 0.11 -2.82 0.15 0.00 -2.02 0.00 0.00 58.31 53.73 1k2m n LYS 729 Cb 0.36 -2.11 0.81 0.00 -0.02 0.00 0.00 35.03 34.07 1k2m n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77