#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2n h ASN 574 N 0.00 0.00 0.00 1.61 2.35 -2.01 -3.47 115.58 114.06 1k2n h ASN 574 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1k2n h ASN 574 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1k2n h ASN 574 CO 0.00 0.03 0.00 0.61 -1.65 0.00 0.00 177.43 176.42 1k2n n GLY 575 N 0.48 0.68 3.68 2.83 0.00 -1.26 -5.08 105.19 106.51 1k2n n GLY 575 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1k2n n GLY 575 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k2n s ARG 576 N -0.00 3.42 0.03 1.61 3.00 -1.26 0.41 118.95 126.16 1k2n s ARG 576 Ca 0.00 -0.36 0.00 0.00 -1.00 0.00 0.00 55.73 54.37 1k2n s ARG 576 Cb 0.00 -2.99 0.00 0.00 0.00 0.00 0.00 34.95 31.96 1k2n s ARG 576 CO 0.00 0.54 0.00 0.34 0.00 0.00 0.00 175.30 176.18 1k2n n PHE 577 N 2.68 -0.06 -4.63 5.12 -0.00 -0.86 -3.82 117.46 115.90 1k2n n PHE 577 Ca -0.18 0.01 -0.33 0.00 -0.00 0.00 0.00 57.45 56.95 1k2n n PHE 577 Cb 0.53 0.04 -0.12 0.00 -0.00 0.00 0.00 39.48 39.94 1k2n n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1k2n s LEU 578 N -6.25 3.00 -0.23 -2.13 2.96 -1.16 -0.92 118.68 113.96 1k2n s LEU 578 Ca 0.00 -0.16 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 1k2n s LEU 578 Cb 0.00 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 45.05 1k2n s LEU 578 CO 0.00 0.31 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.31 1k2n s THR 579 N -0.88 2.09 -0.37 3.68 2.01 0.46 0.12 115.64 122.75 1k2n s THR 579 Ca 0.14 -1.33 -0.09 0.00 0.31 0.00 0.00 61.69 60.72 1k2n s THR 579 Cb -0.11 -2.08 0.04 0.00 0.01 0.00 0.00 72.50 70.36 1k2n s THR 579 CO 0.04 0.20 0.17 -0.76 -0.69 0.00 0.00 174.62 173.58 1k2n s LEU 580 N 1.19 4.64 -0.39 4.42 1.02 0.57 0.18 118.68 130.31 1k2n s LEU 580 Ca -0.03 -1.17 -0.02 0.00 0.02 0.00 0.00 54.13 52.93 1k2n s LEU 580 Cb -0.17 -1.95 0.10 0.00 0.02 0.00 0.00 46.19 44.20 1k2n s LEU 580 CO -0.08 -0.39 0.16 -1.59 0.02 0.00 0.00 176.35 174.47 1k2n s LYS 581 N 1.46 1.94 -0.77 1.70 -2.85 -0.19 0.20 119.74 121.23 1k2n s LYS 581 Ca 0.01 -1.79 -0.32 0.00 -1.00 0.00 0.00 55.97 52.86 1k2n s LYS 581 Cb -0.20 -3.49 -0.18 0.00 -2.06 0.00 0.00 37.83 31.90 1k2n s LYS 581 CO 0.04 -1.02 2.52 -2.30 0.10 0.00 0.00 175.35 174.69 1k2n n PRO 582 N 4.54 0.31 -1.57 1.78 -0.02 0.12 -3.04 135.00 137.12 1k2n n PRO 582 Ca -0.02 0.03 -0.31 0.00 -2.02 0.00 0.00 63.50 61.18 1k2n n PRO 582 Cb 0.42 -1.97 0.05 0.00 -0.02 0.00 0.00 33.50 31.98 1k2n n PRO 582 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1k2n s LEU 583 N 9.01 3.15 0.53 2.45 2.34 -1.11 -1.82 118.68 133.23 1k2n s LEU 583 Ca 1.24 1.66 0.34 0.00 0.06 0.00 0.00 54.13 57.44 1k2n s LEU 583 Cb -1.05 -4.50 1.50 0.00 -0.56 0.00 0.00 46.19 41.58 1k2n s LEU 583 CO 0.47 -1.50 1.82 1.55 -1.06 0.00 0.00 176.35 177.63 1k2n h PRO 584 N -0.67 0.03 0.00 1.48 0.13 -1.89 0.83 132.00 131.91 1k2n h PRO 584 Ca -0.44 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1k2n h PRO 584 Cb 1.21 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1k2n h PRO 584 CO 0.56 0.02 0.00 -0.44 -0.23 0.00 0.00 178.00 177.91 1k2n h ASP 585 N 0.03 0.00 -3.01 1.44 3.32 -1.91 -3.42 116.42 112.87 1k2n h ASP 585 Ca 0.54 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 57.05 1k2n h ASP 585 Cb 2.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.64 1k2n h ASP 585 CO -0.03 0.00 -0.29 -0.55 -1.72 0.00 0.00 179.24 176.65 1k2n s SER 586 N -4.80 6.43 0.62 6.45 0.15 0.29 -4.80 113.70 118.03 1k2n s SER 586 Ca -0.02 0.52 0.40 0.00 0.70 0.00 0.00 55.95 57.55 1k2n s SER 586 Cb 0.10 -2.06 2.18 0.00 -1.71 0.00 0.00 66.02 64.53 1k2n s SER 586 CO 0.37 -0.05 2.23 0.16 1.20 0.00 0.00 173.24 177.15 1k2n h ILE 587 N 1.64 0.00 -3.43 6.45 3.07 -1.69 -3.38 117.51 120.18 1k2n h ILE 587 Ca -0.47 0.00 -0.66 0.00 1.55 0.00 0.00 64.86 65.27 1k2n h ILE 587 Cb 1.18 0.89 -0.29 0.00 -0.27 0.00 0.00 36.82 38.34 1k2n h ILE 587 CO 0.69 0.00 -0.72 -0.63 -1.05 0.00 0.00 178.15 176.44 1k2n s ILE 588 N -4.05 3.28 -0.93 0.16 1.01 -1.26 -5.03 121.20 114.38 1k2n s ILE 588 Ca -0.04 -0.64 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 1k2n s ILE 588 Cb 0.12 -2.54 0.31 0.00 0.01 0.00 0.00 42.46 40.35 1k2n s ILE 588 CO 0.36 0.35 1.39 0.00 0.00 0.00 0.00 174.94 177.04 1k2n n GLN 589 N 4.77 4.26 -4.54 2.79 1.13 -1.25 -3.89 117.38 120.65 1k2n n GLN 589 Ca -0.18 -4.65 -0.25 0.00 -1.94 0.00 0.00 57.00 49.98 1k2n n GLN 589 Cb 0.50 -2.42 -0.10 0.00 0.11 0.00 0.00 30.24 28.33 1k2n n GLN 589 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1k2n s GLU 590 N -3.26 1.83 -0.10 -1.09 2.02 -0.76 -4.98 118.70 112.37 1k2n s GLU 590 Ca 0.37 -2.06 0.01 0.00 0.02 0.00 0.00 54.97 53.31 1k2n s GLU 590 Cb 0.14 -1.08 0.02 0.00 0.10 0.00 0.00 34.13 33.30 1k2n s GLU 590 CO -0.01 -0.23 -0.12 -1.54 0.02 0.00 0.00 175.26 173.38 1k2n s SER 591 N -3.61 2.15 -0.07 -0.19 1.04 -1.26 0.15 113.70 111.92 1k2n s SER 591 Ca 0.30 -0.36 0.02 0.00 0.48 0.00 0.00 55.95 56.40 1k2n s SER 591 Cb 0.07 -0.94 -0.03 0.00 0.10 0.00 0.00 66.02 65.22 1k2n s SER 591 CO 0.14 -0.01 -0.11 -0.76 0.98 0.00 0.00 173.24 173.49 1k2n s LEU 592 N 1.06 2.93 -0.20 2.42 1.43 0.52 -4.93 118.68 121.91 1k2n s LEU 592 Ca -0.06 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1k2n s LEU 592 Cb -0.15 -1.62 0.04 0.00 0.03 0.00 0.00 46.19 44.49 1k2n s LEU 592 CO -0.02 0.33 -0.10 -1.61 0.23 0.00 0.00 176.35 175.18 1k2n s GLU 593 N -0.62 2.02 -0.40 1.70 8.01 -1.26 0.21 118.70 128.36 1k2n s GLU 593 Ca 0.09 -0.85 -0.28 0.00 0.01 0.00 0.00 54.97 53.93 1k2n s GLU 593 Cb -0.11 -2.42 -0.00 0.00 -4.31 0.00 0.00 34.13 27.28 1k2n s GLU 593 CO 0.01 -0.43 1.57 0.42 0.01 0.00 0.00 175.26 176.84 1k2n s ILE 594 N 1.39 3.72 -0.27 -1.63 1.01 0.32 -4.93 121.20 120.82 1k2n s ILE 594 Ca -0.01 0.72 -0.28 0.00 0.00 0.00 0.00 60.65 61.08 1k2n s ILE 594 Cb -0.16 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 1k2n s ILE 594 CO -0.08 -0.66 2.00 -1.10 0.00 0.00 0.00 174.94 175.10 1k2n s GLN 595 N 5.30 3.25 0.56 2.79 1.11 -1.26 -2.02 119.66 129.38 1k2n s GLN 595 Ca 0.68 1.73 0.44 0.00 0.01 0.00 0.00 55.36 58.22 1k2n s GLN 595 Cb -0.17 -4.28 1.62 0.00 -1.01 0.00 0.00 33.01 29.18 1k2n s GLN 595 CO 0.32 -1.96 1.65 -0.56 0.01 0.00 0.00 175.29 174.75 1k2n h GLN 596 N 13.89 0.00 0.00 2.91 -0.00 -0.31 1.31 115.11 132.91 1k2n h GLN 596 Ca -0.37 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.26 1k2n h GLN 596 Cb 1.20 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.68 1k2n h GLN 596 CO 0.99 0.00 -0.10 0.78 -0.00 0.00 0.00 178.83 180.51 1k2n h GLY 597 N 0.00 0.00 -7.76 0.06 0.00 -1.87 -3.41 103.07 90.08 1k2n h GLY 597 Ca 0.76 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.44 1k2n h GLY 597 CO -0.01 0.00 -0.54 0.14 0.00 0.00 0.00 176.54 176.14 1k2n s VAL 598 N -3.88 5.10 -0.04 4.60 1.01 0.45 -5.06 120.40 122.58 1k2n s VAL 598 Ca -0.01 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1k2n s VAL 598 Cb 0.11 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 33.07 1k2n s VAL 598 CO 0.57 0.23 0.04 0.21 0.00 0.00 0.00 175.10 176.14 1k2n s ASN 599 N 1.72 0.90 0.44 3.32 2.47 -1.26 -4.03 114.94 118.51 1k2n s ASN 599 Ca 0.07 0.03 -0.03 0.00 0.42 0.00 0.00 52.86 53.35 1k2n s ASN 599 Cb -0.16 -0.19 -0.03 0.00 -1.45 0.00 0.00 41.25 39.42 1k2n s ASN 599 CO 0.09 -0.20 0.71 -2.16 -3.72 0.00 0.00 177.10 171.82 1k2n s PRO 600 N 1.76 3.43 -0.35 0.43 0.04 -1.26 -5.03 135.00 134.01 1k2n s PRO 600 Ca 0.00 -0.06 -0.20 0.00 0.04 0.00 0.00 61.00 60.79 1k2n s PRO 600 Cb -0.12 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 31.94 1k2n s PRO 600 CO -0.03 -0.14 0.59 0.12 0.04 0.00 0.00 177.00 177.58 1k2n s PHE 601 N -2.61 3.16 -0.01 0.56 5.36 0.34 -4.91 117.98 119.89 1k2n s PHE 601 Ca 0.46 0.28 -0.16 0.00 -0.96 0.00 0.00 56.93 56.54 1k2n s PHE 601 Cb -0.10 -3.06 -0.06 0.00 -0.34 0.00 0.00 43.02 39.47 1k2n s PHE 601 CO 0.41 -0.60 0.45 -0.06 -1.46 0.00 0.00 175.22 173.97 1k2n s PHE 602 N 2.59 3.71 0.05 10.12 0.08 -1.26 0.10 117.98 133.36 1k2n s PHE 602 Ca 0.22 1.03 0.07 0.00 0.12 0.00 0.00 56.93 58.37 1k2n s PHE 602 Cb -0.15 -2.37 -0.02 0.00 -0.57 0.00 0.00 43.02 39.90 1k2n s PHE 602 CO 0.14 0.55 -0.19 0.42 -0.10 0.00 0.00 175.22 176.05 1k2n s ILE 603 N -0.78 1.49 -5.00 0.64 1.09 0.88 0.15 121.20 119.67 1k2n s ILE 603 Ca 0.25 -1.16 0.00 0.00 -1.10 0.00 0.00 60.65 58.64 1k2n s ILE 603 Cb -0.17 -1.31 0.00 0.00 -1.06 0.00 0.00 42.46 39.92 1k2n s ILE 603 CO 0.14 0.12 0.00 0.61 -0.10 0.00 0.00 174.94 175.71 1k2n n GLY 604 N 1.81 -2.13 0.11 6.18 0.00 -1.13 -2.70 105.19 107.32 1k2n n GLY 604 Ca -0.18 -1.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 1k2n n GLY 604 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1k2n h ARG 605 N 0.11 0.25 -6.56 1.61 3.08 0.24 0.33 114.38 113.44 1k2n h ARG 605 Ca 0.00 -0.07 -0.52 0.00 0.07 0.00 0.00 59.98 59.45 1k2n h ARG 605 Cb 0.00 -0.03 0.05 0.00 0.08 0.00 0.00 29.97 30.07 1k2n h ARG 605 CO 0.00 0.45 1.06 -1.12 -1.07 0.00 0.00 179.97 179.28 1k2n s SER 606 N -5.71 6.43 0.49 7.04 0.01 -0.60 -4.55 113.70 116.81 1k2n s SER 606 Ca -0.14 2.78 0.30 0.00 1.31 0.00 0.00 55.95 60.20 1k2n s SER 606 Cb 0.06 -2.58 1.64 0.00 0.21 0.00 0.00 66.02 65.35 1k2n s SER 606 CO 0.71 -0.98 1.91 -0.33 0.41 0.00 0.00 173.24 174.96 1k2n h GLU 607 N 7.85 0.00 -0.23 12.44 3.07 -1.89 -0.82 114.58 135.00 1k2n h GLU 607 Ca -0.45 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 58.46 1k2n h GLU 607 Cb 1.21 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.11 1k2n h GLU 607 CO 0.95 0.00 0.16 -0.44 -1.40 0.00 0.00 179.01 178.28 1k2n h ASP 608 N 0.00 0.08 -3.33 1.42 3.32 -1.91 -3.41 116.42 112.59 1k2n h ASP 608 Ca 0.00 -0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.52 1k2n h ASP 608 Cb 0.16 -0.02 0.03 0.00 0.22 0.00 0.00 39.33 39.72 1k2n h ASP 608 CO 0.00 0.06 0.63 0.00 -1.72 0.00 0.00 179.24 178.21 1k2n h ASN 610 N 5.70 0.00 -3.75 0.00 2.35 -0.49 -3.37 115.58 116.02 1k2n h ASN 610 Ca -0.44 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 54.63 1k2n h ASN 610 Cb 1.21 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 39.39 1k2n h ASN 610 CO 0.78 0.00 -0.72 0.00 -1.65 0.00 0.00 177.43 175.84 1k2n s LYS 612 N -1.09 2.25 -0.18 0.00 2.20 -1.26 -2.86 119.74 118.80 1k2n s LYS 612 Ca 0.14 -1.52 -0.05 0.00 -0.36 0.00 0.00 55.97 54.19 1k2n s LYS 612 Cb -0.11 -3.41 0.06 0.00 -1.51 0.00 0.00 37.83 32.86 1k2n s LYS 612 CO 0.04 -0.84 0.08 0.42 -0.36 0.00 0.00 175.35 174.69 1k2n s ILE 613 N 1.22 0.01 -0.41 5.43 -1.09 0.12 -4.94 121.20 121.54 1k2n s ILE 613 Ca 0.02 -0.24 -0.11 0.00 -2.23 0.00 0.00 60.65 58.08 1k2n s ILE 613 Cb -0.21 -0.66 0.06 0.00 -1.58 0.00 0.00 42.46 40.07 1k2n s ILE 613 CO -0.02 -0.28 0.26 -1.83 -1.23 0.00 0.00 174.94 171.84 1k2n s GLU 614 N 2.09 2.77 -0.24 2.79 -1.05 -1.26 0.11 118.70 123.91 1k2n s GLU 614 Ca 0.02 -1.28 -0.01 0.00 -0.15 0.00 0.00 54.97 53.55 1k2n s GLU 614 Cb -0.16 -3.83 0.07 0.00 -0.44 0.00 0.00 34.13 29.77 1k2n s GLU 614 CO -0.10 -0.86 0.01 0.34 0.95 0.00 0.00 175.26 175.60 1k2n s ASP 615 N 1.97 3.64 0.57 0.83 2.15 -1.26 -4.99 116.67 119.57 1k2n s ASP 615 Ca 0.03 -1.21 0.48 0.00 0.43 0.00 0.00 52.55 52.28 1k2n s ASP 615 Cb -0.22 -0.96 1.65 0.00 -0.30 0.00 0.00 42.92 43.09 1k2n s ASP 615 CO 0.05 -0.30 1.54 -0.46 -0.17 0.00 0.00 175.17 175.83 1k2n n ASN 616 N 4.80 0.00 -0.10 -0.34 6.94 -1.26 0.66 115.26 125.96 1k2n n ASN 616 Ca -0.08 0.97 -0.13 0.00 -0.02 0.00 0.00 54.58 55.31 1k2n n ASN 616 Cb 0.44 -0.47 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 1k2n n ASN 616 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 1k2n h ARG 617 N 0.00 0.81 -6.76 -3.83 -0.00 -2.02 -3.45 114.38 99.13 1k2n h ARG 617 Ca 0.89 -0.43 -0.49 0.00 -0.50 0.00 0.00 59.98 59.45 1k2n h ARG 617 Cb 3.71 0.02 0.02 0.00 0.00 0.00 0.00 29.97 33.72 1k2n h ARG 617 CO -0.01 1.07 0.00 -0.48 0.00 0.00 0.00 179.97 180.55 1k2n s LEU 618 N -8.92 3.80 0.82 3.04 0.05 0.21 -4.65 118.68 113.03 1k2n s LEU 618 Ca -0.12 0.80 -0.11 0.00 0.05 0.00 0.00 54.13 54.74 1k2n s LEU 618 Cb 0.10 -3.70 0.08 0.00 -2.05 0.00 0.00 46.19 40.62 1k2n s LEU 618 CO 0.85 -0.44 1.10 -0.55 -0.55 0.00 0.00 176.35 176.76 1k2n s SER 619 N -3.88 4.24 0.59 1.48 0.15 -1.26 -4.69 113.70 110.33 1k2n s SER 619 Ca 0.45 1.34 0.29 0.00 0.70 0.00 0.00 55.95 58.73 1k2n s SER 619 Cb -0.10 -2.06 1.51 0.00 -1.71 0.00 0.00 66.02 63.66 1k2n s SER 619 CO 0.39 -2.13 1.93 0.08 1.20 0.00 0.00 173.24 174.71 1k2n h ARG 620 N -1.20 0.00 -2.10 5.44 -0.00 -1.94 -2.10 114.38 112.47 1k2n h ARG 620 Ca -0.48 0.00 -0.55 0.00 -0.00 0.00 0.00 59.98 58.96 1k2n h ARG 620 Cb 1.27 0.00 -0.41 0.00 -0.00 0.00 0.00 29.97 30.84 1k2n h ARG 620 CO 0.58 0.00 -0.93 0.28 -0.00 0.00 0.00 179.97 179.90 1k2n n VAL 621 N -3.71 0.92 -0.28 0.08 0.31 -1.26 -0.46 118.33 113.93 1k2n n VAL 621 Ca 0.07 -4.79 0.10 0.00 -0.01 0.00 0.00 64.34 59.71 1k2n n VAL 621 Cb 0.61 -1.30 0.25 0.00 -0.91 0.00 0.00 33.84 32.48 1k2n n VAL 621 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1k2n h HIS 622 N 3.47 0.53 -2.29 3.52 2.76 -1.17 -3.37 115.15 118.60 1k2n h HIS 622 Ca 0.12 0.04 0.12 0.00 -2.20 0.00 0.00 60.37 58.45 1k2n h HIS 622 Cb 0.78 -0.10 -0.14 0.00 1.55 0.00 0.00 27.41 29.49 1k2n h HIS 622 CO 0.57 -0.03 0.49 0.00 -1.30 0.00 0.00 177.93 177.67 1k2n s PHE 624 N -3.14 0.06 -0.13 0.00 -0.71 0.37 -0.08 117.98 114.34 1k2n s PHE 624 Ca 0.06 -0.14 -0.06 0.00 -1.04 0.00 0.00 56.93 55.75 1k2n s PHE 624 Cb -0.01 -0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.70 1k2n s PHE 624 CO -0.08 -0.23 0.09 0.42 -1.34 0.00 0.00 175.22 174.09 1k2n s ILE 625 N -1.16 5.09 -0.04 -4.49 1.01 0.29 0.19 121.20 122.09 1k2n s ILE 625 Ca -0.13 0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.62 1k2n s ILE 625 Cb -0.07 -3.23 -0.00 0.00 0.01 0.00 0.00 42.46 39.17 1k2n s ILE 625 CO 0.01 0.56 -0.15 0.12 0.00 0.00 0.00 174.94 175.48 1k2n s PHE 626 N -0.55 1.56 -0.10 3.97 5.36 0.48 0.13 117.98 128.82 1k2n s PHE 626 Ca 0.11 -0.45 -0.11 0.00 -0.96 0.00 0.00 56.93 55.52 1k2n s PHE 626 Cb -0.12 -1.06 -0.05 0.00 -0.34 0.00 0.00 43.02 41.45 1k2n s PHE 626 CO 0.02 -0.16 0.25 0.21 -1.46 0.00 0.00 175.22 174.08 1k2n s LYS 627 N 0.10 3.83 0.08 10.12 2.47 -1.26 0.22 119.74 135.31 1k2n s LYS 627 Ca -0.04 0.07 0.01 0.00 -1.56 0.00 0.00 55.97 54.45 1k2n s LYS 627 Cb -0.11 -3.27 -0.04 0.00 -1.46 0.00 0.00 37.83 32.95 1k2n s LYS 627 CO 0.02 0.59 -0.06 0.21 0.16 0.00 0.00 175.35 176.27 1k2n s LYS 628 N -0.57 0.74 -0.38 4.03 2.36 0.13 -4.92 119.74 121.13 1k2n s LYS 628 Ca 0.17 -1.23 -0.29 0.00 -2.55 0.00 0.00 55.97 52.07 1k2n s LYS 628 Cb -0.13 -0.12 0.01 0.00 -1.05 0.00 0.00 37.83 36.54 1k2n s LYS 628 CO 0.06 -0.03 1.25 0.50 1.55 0.00 0.00 175.35 178.68 1k2n s ARG 629 N -3.56 3.80 -0.18 4.03 6.06 -1.26 0.19 118.95 128.03 1k2n s ARG 629 Ca 0.08 0.97 -0.27 0.00 -2.50 0.00 0.00 55.73 54.01 1k2n s ARG 629 Cb 0.04 -3.90 -0.01 0.00 0.06 0.00 0.00 34.95 31.14 1k2n s ARG 629 CO -0.05 -1.27 0.90 -1.58 -2.50 0.00 0.00 175.30 170.80 1k2n s HIS 630 N 4.55 3.41 0.08 5.12 5.65 0.80 -4.86 115.29 130.03 1k2n s HIS 630 Ca 0.54 1.34 -0.04 0.00 0.25 0.00 0.00 55.06 57.15 1k2n s HIS 630 Cb -0.13 -3.10 -0.03 0.00 -1.18 0.00 0.00 32.58 28.15 1k2n s HIS 630 CO 0.26 -0.30 0.07 0.00 -0.65 0.00 0.00 174.74 174.12 1k2n s ALA 631 N 2.40 0.26 0.35 1.58 0.00 -1.26 -0.24 121.76 124.85 1k2n s ALA 631 Ca 0.41 -1.01 0.09 0.00 0.00 0.00 0.00 51.96 51.45 1k2n s ALA 631 Cb -0.16 0.42 -0.07 0.00 0.00 0.00 0.00 23.12 23.31 1k2n s ALA 631 CO 0.12 -0.44 -0.09 0.14 0.00 0.00 0.00 175.76 175.49 1k2n s VAL 632 N -3.91 2.24 -0.46 0.00 -7.23 -1.25 -5.01 120.40 104.77 1k2n s VAL 632 Ca 0.08 -2.19 -0.17 0.00 -1.81 0.00 0.00 61.98 57.90 1k2n s VAL 632 Cb 0.07 -2.67 0.05 0.00 0.56 0.00 0.00 36.38 34.38 1k2n s VAL 632 CO -0.09 -0.19 0.46 -0.83 -0.31 0.00 0.00 175.10 174.14 1k2n s GLY 633 N -3.62 1.93 0.49 2.32 0.00 -1.26 -4.91 107.32 102.27 1k2n s GLY 633 Ca 0.33 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.23 1k2n s GLY 633 CO 0.17 1.18 0.00 1.17 0.00 0.00 0.00 173.10 175.62 1k2n n LYS 634 N 5.56 -4.15 -3.90 2.90 4.81 -1.26 -4.95 118.16 117.17 1k2n n LYS 634 Ca -0.09 3.10 -0.30 0.00 -0.87 0.00 0.00 58.31 60.15 1k2n n LYS 634 Cb 0.45 -3.53 -0.15 0.00 0.02 0.00 0.00 35.03 31.82 1k2n n LYS 634 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1k2n s SER 635 N -3.49 3.97 -0.31 3.14 1.04 -1.26 -5.02 113.70 111.76 1k2n s SER 635 Ca 0.00 -1.41 -0.17 0.00 0.48 0.00 0.00 55.95 54.86 1k2n s SER 635 Cb 0.00 -1.15 -0.02 0.00 0.10 0.00 0.00 66.02 64.96 1k2n s SER 635 CO 0.00 -0.30 0.46 -0.04 0.98 0.00 0.00 173.24 174.34 1k2n s MET 636 N 1.39 3.79 0.00 4.02 1.00 -1.26 -4.74 119.30 123.50 1k2n s MET 636 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 55.69 55.63 1k2n s MET 636 Cb -0.18 -3.74 0.00 0.00 0.00 0.00 0.00 34.83 30.90 1k2n s MET 636 CO -0.11 -0.49 0.00 0.66 0.00 0.00 0.00 175.02 175.09 1k2n n TYR 637 N 5.56 0.00 -2.64 -0.03 4.02 -1.26 -4.78 117.16 118.03 1k2n n TYR 637 Ca -0.06 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.46 1k2n n TYR 637 Cb 0.50 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.76 1k2n n TYR 637 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1k2n s GLU 638 N 0.00 4.44 -0.52 -0.72 2.12 -1.26 -5.03 118.70 117.73 1k2n s GLU 638 Ca 0.00 1.48 -0.03 0.00 0.36 0.00 0.00 54.97 56.78 1k2n s GLU 638 Cb 0.00 -2.78 0.14 0.00 0.26 0.00 0.00 34.13 31.75 1k2n s GLU 638 CO 0.00 0.11 0.33 0.45 -0.54 0.00 0.00 175.26 175.61 1k2n s SER 639 N -1.47 5.28 0.00 -1.70 0.15 -1.26 -4.75 113.70 109.95 1k2n s SER 639 Ca 0.52 -2.43 0.00 0.00 0.70 0.00 0.00 55.95 54.74 1k2n s SER 639 Cb -0.22 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 1k2n s SER 639 CO 0.28 -0.47 0.00 -2.65 1.20 0.00 0.00 173.24 171.60 1k2n n PRO 640 N 4.07 1.68 0.23 5.44 -0.02 -1.26 -4.70 135.00 140.44 1k2n n PRO 640 Ca 0.02 0.00 0.18 0.00 -2.02 0.00 0.00 63.50 61.68 1k2n n PRO 640 Cb 0.40 0.00 0.83 0.00 -0.02 0.00 0.00 33.50 34.70 1k2n n PRO 640 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k2n h ALA 641 N -2.06 1.66 0.00 3.55 0.00 -1.98 -3.45 119.26 116.99 1k2n h ALA 641 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1k2n h ALA 641 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1k2n h ALA 641 CO 0.00 -0.40 0.00 1.04 0.00 0.00 0.00 179.25 179.89 1k2n n GLN 642 N -3.37 0.00 -2.65 0.00 6.02 -1.26 -3.97 117.38 112.15 1k2n n GLN 642 Ca 0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.98 1k2n n GLN 642 Cb 0.42 0.00 0.04 0.00 1.02 0.00 0.00 30.24 31.72 1k2n n GLN 642 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1k2n n GLY 643 N 0.00 -1.97 0.00 1.08 0.00 -1.24 -3.94 105.19 99.12 1k2n n GLY 643 Ca 0.00 1.47 0.00 0.00 0.00 0.00 0.00 46.02 47.49 1k2n n GLY 643 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k2n n LEU 644 N 2.44 0.00 -4.58 0.99 4.77 0.67 -4.88 117.00 116.42 1k2n n LEU 644 Ca 0.09 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.77 1k2n n LEU 644 Cb 0.67 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.66 1k2n n LEU 644 CO -0.13 0.00 -0.41 -1.81 -1.33 0.00 0.00 177.39 173.71 1k2n s ASP 645 N 1.00 4.44 -0.02 -1.43 1.11 -1.26 0.28 116.67 120.78 1k2n s ASP 645 Ca 0.00 -0.31 0.00 0.00 0.18 0.00 0.00 52.55 52.42 1k2n s ASP 645 Cb 0.00 -0.90 0.02 0.00 1.07 0.00 0.00 42.92 43.11 1k2n s ASP 645 CO 0.00 0.21 -0.00 -1.81 1.18 0.00 0.00 175.17 174.75 1k2n s ASP 646 N -1.93 0.36 -0.18 0.27 1.11 0.50 -3.75 116.67 113.03 1k2n s ASP 646 Ca 0.20 -0.02 -0.22 0.00 0.18 0.00 0.00 52.55 52.68 1k2n s ASP 646 Cb -0.11 -0.17 -0.02 0.00 1.07 0.00 0.00 42.92 43.69 1k2n s ASP 646 CO 0.12 -0.08 0.70 0.27 1.18 0.00 0.00 175.17 177.36 1k2n s ILE 647 N 0.82 4.97 -0.03 0.77 -4.36 -1.26 0.18 121.20 122.29 1k2n s ILE 647 Ca -0.08 1.35 -0.01 0.00 -0.26 0.00 0.00 60.65 61.65 1k2n s ILE 647 Cb -0.11 -4.02 -0.04 0.00 1.25 0.00 0.00 42.46 39.54 1k2n s ILE 647 CO -0.02 0.09 0.06 0.26 0.24 0.00 0.00 174.94 175.58 1k2n s TRP 648 N 1.94 3.27 -0.29 1.37 0.52 0.60 -0.92 118.94 125.42 1k2n s TRP 648 Ca 0.32 0.21 -0.09 0.00 0.02 0.00 0.00 56.10 56.57 1k2n s TRP 648 Cb -0.16 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.39 1k2n s TRP 648 CO 0.11 0.54 0.13 -0.47 0.02 0.00 0.00 176.95 177.29 1k2n s TYR 649 N -1.12 3.16 -0.17 -1.98 6.14 0.21 0.18 117.35 123.76 1k2n s TYR 649 Ca 0.20 -0.47 -0.06 0.00 0.64 0.00 0.00 57.07 57.38 1k2n s TYR 649 Cb -0.12 -2.33 -0.04 0.00 0.42 0.00 0.00 41.96 39.90 1k2n s TYR 649 CO 0.11 -0.40 0.03 0.00 0.64 0.00 0.00 175.55 175.93 1k2n s HIS 651 N 0.35 3.04 0.00 0.00 2.46 -0.46 0.14 115.29 120.82 1k2n s HIS 651 Ca 0.01 -0.16 0.00 0.00 0.47 0.00 0.00 55.06 55.38 1k2n s HIS 651 Cb -0.13 -1.90 0.00 0.00 -0.13 0.00 0.00 32.58 30.42 1k2n s HIS 651 CO 0.01 0.11 0.56 0.25 -2.47 0.00 0.00 174.74 173.20 1k2n n THR 652 N 3.11 0.31 -2.78 0.89 -2.24 0.22 1.00 114.28 114.79 1k2n n THR 652 Ca -0.18 -0.40 -0.33 0.00 -2.27 0.00 0.00 64.05 60.87 1k2n n THR 652 Cb 0.53 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.72 1k2n n THR 652 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k2n s GLY 653 N -0.31 2.34 0.16 3.38 0.00 0.65 -4.80 107.32 108.73 1k2n s GLY 653 Ca 0.00 0.34 -0.03 0.00 0.00 0.00 0.00 44.72 45.03 1k2n s GLY 653 CO 0.00 0.61 1.41 0.00 0.00 0.00 0.00 173.10 175.12 1k2n h THR 654 N 1.76 1.36 0.00 0.90 1.03 -1.91 -3.08 112.91 112.98 1k2n h THR 654 Ca -0.49 -2.14 0.00 0.00 -0.01 0.00 0.00 66.41 63.78 1k2n h THR 654 Cb 1.18 2.11 0.00 0.00 -1.07 0.00 0.00 68.15 70.37 1k2n h THR 654 CO 0.61 0.65 0.00 0.59 -0.01 0.00 0.00 175.52 177.36 1k2n n ASN 655 N -3.85 0.00 -1.87 0.00 3.02 -1.26 -4.83 115.26 106.48 1k2n n ASN 655 Ca -0.05 -0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 1k2n n ASN 655 Cb 0.72 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.80 1k2n n ASN 655 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 1k2n n VAL 656 N -1.09 -6.78 -2.70 2.41 3.14 -1.16 -4.92 118.33 107.23 1k2n n VAL 656 Ca 0.11 2.17 -0.24 0.00 -2.96 0.00 0.00 64.34 63.42 1k2n n VAL 656 Cb 0.08 -3.22 0.02 0.00 -1.06 0.00 0.00 33.84 29.66 1k2n n VAL 656 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 1k2n s SER 657 N -1.07 5.62 -0.12 6.55 1.04 -0.43 -4.78 113.70 120.51 1k2n s SER 657 Ca 0.00 0.38 -0.00 0.00 0.48 0.00 0.00 55.95 56.81 1k2n s SER 657 Cb 0.00 -1.46 0.02 0.00 0.10 0.00 0.00 66.02 64.68 1k2n s SER 657 CO 0.00 -0.93 -0.09 -0.31 0.98 0.00 0.00 173.24 172.88 1k2n s TYR 658 N -2.76 1.67 -0.56 5.02 1.51 0.34 0.44 117.35 123.01 1k2n s TYR 658 Ca 0.52 -0.86 -0.17 0.00 -1.01 0.00 0.00 57.07 55.55 1k2n s TYR 658 Cb -0.10 -1.33 0.11 0.00 -0.11 0.00 0.00 41.96 40.53 1k2n s TYR 658 CO 0.41 -0.55 0.58 -1.17 -1.11 0.00 0.00 175.55 173.71 1k2n s LEU 659 N 1.62 5.79 0.00 -1.29 2.96 0.29 0.20 118.68 128.26 1k2n s LEU 659 Ca 0.04 -1.59 0.00 0.00 -0.22 0.00 0.00 54.13 52.37 1k2n s LEU 659 Cb -0.13 -2.25 0.00 0.00 0.50 0.00 0.00 46.19 44.31 1k2n s LEU 659 CO -0.09 -0.95 0.00 -3.20 -1.32 0.00 0.00 176.35 170.79 1k2n n ASN 660 N 5.72 0.00 0.00 3.68 2.85 -0.76 -0.47 115.26 126.27 1k2n n ASN 660 Ca -0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.35 1k2n n ASN 660 Cb 0.41 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.43 1k2n n ASN 660 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1k2n n ASN 661 N 1.48 0.38 -4.68 1.20 2.85 -1.26 -5.04 115.26 110.20 1k2n n ASN 661 Ca 0.00 -1.10 -0.34 0.00 -0.11 0.00 0.00 54.58 53.02 1k2n n ASN 661 Cb 0.00 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 40.93 1k2n n ASN 661 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 1k2n s ASN 662 N -0.10 5.21 0.25 1.20 0.01 0.38 -5.10 114.94 116.78 1k2n s ASN 662 Ca 0.00 0.11 -0.28 0.00 -0.71 0.00 0.00 52.86 51.98 1k2n s ASN 662 Cb 0.00 -1.44 -0.09 0.00 0.41 0.00 0.00 41.25 40.13 1k2n s ASN 662 CO 0.00 0.35 0.91 -0.60 -1.51 0.00 0.00 177.10 176.26 1k2n s ARG 663 N -1.06 4.74 -0.33 -0.60 3.52 -1.26 -0.55 118.95 123.40 1k2n s ARG 663 Ca 0.15 1.39 0.03 0.00 -0.13 0.00 0.00 55.73 57.17 1k2n s ARG 663 Cb -0.11 -3.15 0.09 0.00 -1.56 0.00 0.00 34.95 30.22 1k2n s ARG 663 CO 0.04 0.46 0.03 -1.64 -0.81 0.00 0.00 175.30 173.39 1k2n s MET 664 N -1.41 1.72 0.29 5.12 -1.94 0.17 -4.84 119.30 118.41 1k2n s MET 664 Ca 0.43 -1.75 -0.13 0.00 -1.71 0.00 0.00 55.69 52.53 1k2n s MET 664 Cb -0.24 -3.18 -0.08 0.00 2.01 0.00 0.00 34.83 33.34 1k2n s MET 664 CO 0.29 -0.87 0.66 0.96 -0.01 0.00 0.00 175.02 176.05 1k2n s ILE 665 N 0.98 4.79 -0.91 2.53 -4.36 -1.26 -1.31 121.20 121.65 1k2n s ILE 665 Ca 0.06 0.74 -0.24 0.00 -0.26 0.00 0.00 60.65 60.94 1k2n s ILE 665 Cb -0.20 -3.62 -0.22 0.00 1.25 0.00 0.00 42.46 39.67 1k2n s ILE 665 CO -0.07 -0.15 2.50 1.67 0.24 0.00 0.00 174.94 179.13 1k2n n GLN 666 N -0.32 0.19 0.00 0.37 7.27 -1.25 -1.63 117.38 122.02 1k2n n GLN 666 Ca 0.02 -0.06 0.00 0.00 0.07 0.00 0.00 57.00 57.03 1k2n n GLN 666 Cb 0.53 -1.82 0.00 0.00 2.41 0.00 0.00 30.24 31.36 1k2n n GLN 666 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1k2n n GLY 667 N 6.20 0.92 3.40 1.69 0.00 0.28 -4.93 105.19 112.76 1k2n n GLY 667 Ca 0.61 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.42 1k2n n GLY 667 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k2n s THR 668 N -1.49 1.82 0.04 2.61 -4.23 -0.65 0.56 115.64 114.30 1k2n s THR 668 Ca 0.00 -2.20 0.04 0.00 -1.18 0.00 0.00 61.69 58.35 1k2n s THR 668 Cb 0.00 -2.27 -0.02 0.00 1.34 0.00 0.00 72.50 71.55 1k2n s THR 668 CO 0.00 -0.43 -0.13 -0.75 -0.54 0.00 0.00 174.62 172.77 1k2n s LYS 669 N -3.66 0.83 -0.06 3.99 2.20 0.27 -1.35 119.74 121.96 1k2n s LYS 669 Ca 0.27 -0.73 -0.11 0.00 -0.36 0.00 0.00 55.97 55.04 1k2n s LYS 669 Cb 0.01 -0.80 0.02 0.00 -1.51 0.00 0.00 37.83 35.55 1k2n s LYS 669 CO 0.10 0.19 0.26 0.12 -0.36 0.00 0.00 175.35 175.67 1k2n s PHE 670 N -0.91 -0.20 0.21 4.03 5.36 -0.32 0.11 117.98 126.27 1k2n s PHE 670 Ca -0.00 0.44 -0.30 0.00 -0.96 0.00 0.00 56.93 56.10 1k2n s PHE 670 Cb -0.08 0.07 -0.09 0.00 -0.34 0.00 0.00 43.02 42.59 1k2n s PHE 670 CO 0.01 -0.25 1.32 -1.17 -1.46 0.00 0.00 175.22 173.68 1k2n s LEU 671 N -0.59 4.42 -0.48 6.12 1.98 -1.26 0.65 118.68 129.52 1k2n s LEU 671 Ca -0.07 2.44 -0.06 0.00 -2.89 0.00 0.00 54.13 53.56 1k2n s LEU 671 Cb -0.04 -3.61 0.13 0.00 0.66 0.00 0.00 46.19 43.32 1k2n s LEU 671 CO 0.02 -0.54 0.32 -0.76 -1.89 0.00 0.00 176.35 173.50 1k2n s LEU 672 N -0.24 5.49 0.21 -0.68 1.43 -0.10 -4.85 118.68 119.94 1k2n s LEU 672 Ca 0.56 -2.14 -0.24 0.00 -1.03 0.00 0.00 54.13 51.28 1k2n s LEU 672 Cb -0.37 -1.92 -0.08 0.00 0.03 0.00 0.00 46.19 43.84 1k2n s LEU 672 CO 0.39 -0.58 0.80 -1.10 0.23 0.00 0.00 176.35 176.10 1k2n s GLN 673 N 1.00 4.52 -0.40 1.70 -0.21 -1.26 -4.62 119.66 120.39 1k2n s GLN 673 Ca 0.09 1.15 -0.39 0.00 0.02 0.00 0.00 55.36 56.22 1k2n s GLN 673 Cb -0.23 -3.10 -0.15 0.00 1.00 0.00 0.00 33.01 30.53 1k2n s GLN 673 CO -0.03 0.48 2.11 -3.47 -2.12 0.00 0.00 175.29 172.26 1k2n n ASP 674 N 1.22 1.66 0.00 5.90 2.03 0.66 -1.27 116.55 126.75 1k2n n ASP 674 Ca -0.03 0.60 0.00 0.00 0.52 0.00 0.00 54.79 55.88 1k2n n ASP 674 Cb 0.49 -1.11 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 1k2n n ASP 674 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k2n n GLY 675 N 6.55 1.35 3.60 0.27 0.00 0.37 -4.86 105.19 112.47 1k2n n GLY 675 Ca 0.44 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.06 1k2n n GLY 675 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k2n s ASP 676 N -2.00 6.33 -0.44 1.61 2.15 -0.35 -4.78 116.67 119.18 1k2n s ASP 676 Ca 0.00 0.28 -0.17 0.00 0.43 0.00 0.00 52.55 53.09 1k2n s ASP 676 Cb 0.00 -2.25 0.03 0.00 -0.30 0.00 0.00 42.92 40.41 1k2n s ASP 676 CO 0.00 -0.29 0.47 -0.70 -0.17 0.00 0.00 175.17 174.48 1k2n s GLU 677 N 2.22 3.09 -0.14 4.34 -6.30 -1.26 0.12 118.70 120.77 1k2n s GLU 677 Ca 0.18 -0.84 -0.05 0.00 -2.50 0.00 0.00 54.97 51.76 1k2n s GLU 677 Cb -0.16 -4.01 -0.03 0.00 0.00 0.00 0.00 34.13 29.93 1k2n s GLU 677 CO 0.10 -0.94 0.02 0.42 0.02 0.00 0.00 175.26 174.89 1k2n s ILE 678 N 2.17 4.44 -0.33 -3.70 1.01 0.53 -1.82 121.20 123.49 1k2n s ILE 678 Ca 0.12 -0.18 -0.15 0.00 0.00 0.00 0.00 60.65 60.44 1k2n s ILE 678 Cb -0.18 -2.94 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 1k2n s ILE 678 CO 0.13 0.53 0.37 -0.54 0.00 0.00 0.00 174.94 175.43 1k2n s LYS 679 N -0.14 3.65 0.04 2.79 1.02 0.55 0.44 119.74 128.09 1k2n s LYS 679 Ca 0.05 -0.32 -0.13 0.00 0.02 0.00 0.00 55.97 55.60 1k2n s LYS 679 Cb -0.12 -3.78 -0.34 0.00 -0.52 0.00 0.00 37.83 33.07 1k2n s LYS 679 CO 0.02 -0.49 1.02 0.82 -0.92 0.00 0.00 175.35 175.80 1k2n h ILE 680 N 5.52 1.32 -2.36 2.17 2.04 0.39 0.99 117.51 127.58 1k2n h ILE 680 Ca -0.30 -2.79 -0.06 0.00 1.00 0.00 0.00 64.86 62.71 1k2n h ILE 680 Cb 1.15 3.01 -0.24 0.00 -0.74 0.00 0.00 36.82 40.00 1k2n h ILE 680 CO 0.69 0.83 -0.14 -0.51 0.00 0.00 0.00 178.15 179.03 1k2n s ILE 681 N -2.61 -0.01 -0.04 -0.67 1.10 -1.03 -4.29 121.20 113.63 1k2n s ILE 681 Ca -0.08 0.04 0.00 0.00 -0.51 0.00 0.00 60.65 60.10 1k2n s ILE 681 Cb 0.05 -0.78 0.03 0.00 0.15 0.00 0.00 42.46 41.90 1k2n s ILE 681 CO 0.93 0.02 -0.01 0.86 -2.11 0.00 0.00 174.94 174.62 1k2n s TRP 682 N 1.28 0.54 -0.16 3.50 -0.00 -1.21 0.13 118.94 123.03 1k2n s TRP 682 Ca -0.08 -0.10 -0.00 0.00 -0.00 0.00 0.00 56.10 55.92 1k2n s TRP 682 Cb -0.06 -0.59 0.03 0.00 -0.00 0.00 0.00 33.47 32.85 1k2n s TRP 682 CO -0.13 -0.20 -0.09 0.34 -0.00 0.00 0.00 176.95 176.88 1k2n s ASP 683 N 1.22 2.77 0.07 5.86 -1.08 0.36 -4.93 116.67 120.93 1k2n s ASP 683 Ca -0.07 -0.59 -0.20 0.00 -0.52 0.00 0.00 52.55 51.18 1k2n s ASP 683 Cb -0.13 -1.02 -0.11 0.00 -1.46 0.00 0.00 42.92 40.20 1k2n s ASP 683 CO -0.02 -0.13 1.48 0.11 0.52 0.00 0.00 175.17 177.13 1k2n h LYS 684 N 8.09 0.37 0.24 4.34 1.57 -1.95 0.28 116.57 129.50 1k2n h LYS 684 Ca -0.29 -0.13 -0.34 0.00 -1.87 0.00 0.00 60.65 58.02 1k2n h LYS 684 Cb 1.12 -0.03 0.03 0.00 0.08 0.00 0.00 32.23 33.43 1k2n h LYS 684 CO 0.45 0.59 -1.53 -2.95 -0.57 0.00 0.00 179.45 175.44 1k2n h ASN 685 N 0.11 0.79 0.98 0.86 7.08 -1.98 -3.30 115.58 120.11 1k2n h ASN 685 Ca 0.05 -0.93 0.00 0.00 -3.08 0.00 0.00 56.30 52.35 1k2n h ASN 685 Cb 0.44 -0.26 0.00 0.00 -2.08 0.00 0.00 38.32 36.42 1k2n h ASN 685 CO 0.01 1.72 -0.09 0.59 -2.08 0.00 0.00 177.43 177.59 1k2n n ASN 686 N -3.71 0.19 -1.53 6.14 3.02 -1.25 -4.90 115.26 113.22 1k2n n ASN 686 Ca -0.19 0.39 -0.20 0.00 -0.03 0.00 0.00 54.58 54.55 1k2n n ASN 686 Cb 1.09 -0.41 -0.09 0.00 -0.61 0.00 0.00 39.78 39.77 1k2n n ASN 686 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1k2n n LYS 687 N -1.61 -1.49 -2.70 3.52 5.02 0.96 -4.91 118.16 116.95 1k2n n LYS 687 Ca 0.07 1.20 -0.42 0.00 -2.02 0.00 0.00 58.31 57.14 1k2n n LYS 687 Cb 0.35 -5.60 -0.03 0.00 -0.02 0.00 0.00 35.03 29.73 1k2n n LYS 687 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1k2n s PHE 688 N -2.69 2.66 -0.12 2.13 2.19 -1.07 -4.83 117.98 116.24 1k2n s PHE 688 Ca 0.00 0.13 0.01 0.00 0.33 0.00 0.00 56.93 57.40 1k2n s PHE 688 Cb 0.00 -4.33 0.02 0.00 -1.31 0.00 0.00 43.02 37.40 1k2n s PHE 688 CO 0.00 -1.54 -0.13 0.54 1.83 0.00 0.00 175.22 175.91 1k2n s VAL 689 N 4.56 1.44 -0.13 3.12 0.11 -1.25 0.13 120.40 128.39 1k2n s VAL 689 Ca 0.36 -0.58 -0.00 0.00 -2.93 0.00 0.00 61.98 58.83 1k2n s VAL 689 Cb -0.10 -1.35 0.03 0.00 -1.53 0.00 0.00 36.38 33.42 1k2n s VAL 689 CO 0.21 0.43 -0.08 -0.63 -3.33 0.00 0.00 175.10 171.70 1k2n s ILE 690 N 1.30 1.11 -0.05 7.04 1.01 0.35 -2.13 121.20 129.83 1k2n s ILE 690 Ca -0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.23 1k2n s ILE 690 Cb -0.14 -1.14 0.02 0.00 0.01 0.00 0.00 42.46 41.22 1k2n s ILE 690 CO -0.06 0.35 0.13 -0.83 0.00 0.00 0.00 174.94 174.52 1k2n s GLY 691 N 1.67 -0.07 0.01 6.18 0.00 -1.26 0.10 107.32 113.94 1k2n s GLY 691 Ca 0.04 0.43 0.05 0.00 0.00 0.00 0.00 44.72 45.24 1k2n s GLY 691 CO -0.08 0.49 -0.12 -1.36 0.00 0.00 0.00 173.10 172.03 1k2n s PHE 692 N 0.38 2.74 -0.32 1.90 0.08 0.17 -2.76 117.98 120.18 1k2n s PHE 692 Ca -0.03 -0.13 -0.12 0.00 0.12 0.00 0.00 56.93 56.78 1k2n s PHE 692 Cb -0.04 -1.56 -0.02 0.00 -0.57 0.00 0.00 43.02 40.82 1k2n s PHE 692 CO -0.02 0.30 0.21 0.21 -0.10 0.00 0.00 175.22 175.82 1k2n s LYS 693 N -1.30 3.58 -0.13 0.44 2.47 -1.17 -0.35 119.74 123.28 1k2n s LYS 693 Ca 0.15 -0.58 -0.25 0.00 -1.56 0.00 0.00 55.97 53.74 1k2n s LYS 693 Cb -0.11 -3.71 -0.02 0.00 -1.46 0.00 0.00 37.83 32.53 1k2n s LYS 693 CO 0.05 -0.37 0.80 0.08 0.16 0.00 0.00 175.35 176.08 1k2n s VAL 694 N 1.71 4.93 -0.20 4.02 1.01 0.32 -1.02 120.40 131.16 1k2n s VAL 694 Ca 0.06 1.59 -0.03 0.00 0.00 0.00 0.00 61.98 63.61 1k2n s VAL 694 Cb -0.17 -4.12 0.06 0.00 0.00 0.00 0.00 36.38 32.16 1k2n s VAL 694 CO 0.10 0.10 0.04 -0.70 0.00 0.00 0.00 175.10 174.63 1k2n s GLU 695 N 1.69 0.70 -0.48 2.72 2.12 0.49 0.14 118.70 126.09 1k2n s GLU 695 Ca 0.39 -0.49 -0.28 0.00 0.36 0.00 0.00 54.97 54.95 1k2n s GLU 695 Cb -0.17 -2.12 -0.02 0.00 0.26 0.00 0.00 34.13 32.08 1k2n s GLU 695 CO 0.15 -0.67 1.77 0.42 -0.54 0.00 0.00 175.26 176.40 1k2n s ILE 696 N 1.82 3.48 -0.16 -3.70 1.01 -1.26 -0.40 121.20 121.98 1k2n s ILE 696 Ca -0.01 0.41 -0.23 0.00 0.00 0.00 0.00 60.65 60.82 1k2n s ILE 696 Cb -0.17 -3.87 -0.23 0.00 0.01 0.00 0.00 42.46 38.20 1k2n s ILE 696 CO -0.09 -0.70 0.48 0.78 0.00 0.00 0.00 174.94 175.41 1k2n h ASN 697 N 13.54 0.08 -3.75 3.58 2.35 -1.35 -3.47 115.58 126.56 1k2n h ASN 697 Ca -0.29 -0.75 -0.68 0.00 -0.55 0.00 0.00 56.30 54.03 1k2n h ASN 697 Cb 1.16 -0.02 -0.19 0.00 0.05 0.00 0.00 38.32 39.31 1k2n h ASN 697 CO 1.13 1.34 -0.72 -0.62 -1.65 0.00 0.00 177.43 176.91 1k2n s ASP 698 N -6.67 4.43 -0.39 5.81 2.15 -1.06 -5.04 116.67 115.90 1k2n s ASP 698 Ca -0.24 -0.14 -0.02 0.00 0.43 0.00 0.00 52.55 52.58 1k2n s ASP 698 Cb 0.02 -1.02 0.10 0.00 -0.30 0.00 0.00 42.92 41.73 1k2n s ASP 698 CO 0.66 0.32 0.17 0.42 -0.17 0.00 0.00 175.17 176.57 1k2n s THR 699 N -0.88 3.18 -0.46 1.71 -4.23 -1.26 -4.47 115.64 109.22 1k2n s THR 699 Ca 0.14 -1.99 -0.07 0.00 -1.18 0.00 0.00 61.69 58.59 1k2n s THR 699 Cb -0.11 -3.15 -0.07 0.00 1.34 0.00 0.00 72.50 70.52 1k2n s THR 699 CO 0.04 -0.61 1.61 0.41 -0.54 0.00 0.00 174.62 175.53 1k2n n THR 700 N 4.57 1.21 -4.05 3.99 -1.04 -1.26 -4.27 114.28 113.44 1k2n n THR 700 Ca -0.03 -0.77 -0.32 0.00 -2.04 0.00 0.00 64.05 60.89 1k2n n THR 700 Cb 0.42 -1.89 -0.00 0.00 -1.82 0.00 0.00 70.33 67.04 1k2n n THR 700 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1k2n n GLY 701 N 4.03 -0.42 2.79 3.41 0.00 -1.26 -4.88 105.19 108.85 1k2n n GLY 701 Ca 0.27 0.16 -0.14 0.00 0.00 0.00 0.00 46.02 46.31 1k2n n GLY 701 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1k2n n LEU 702 N -4.49 0.00 0.00 0.99 -0.00 -1.26 -4.63 117.00 107.60 1k2n n LEU 702 Ca -0.01 -1.76 0.00 0.00 -0.00 0.00 0.00 56.01 54.24 1k2n n LEU 702 Cb 0.54 -0.32 0.00 0.00 -0.00 0.00 0.00 43.42 43.64 1k2n n LEU 702 CO 0.80 -0.67 0.00 2.22 -0.00 0.00 0.00 177.39 179.73 1k2n n PHE 703 N -1.96 0.00 0.00 1.47 -1.74 -1.25 -4.47 117.46 109.52 1k2n n PHE 703 Ca 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.01 1k2n n PHE 703 Cb 0.43 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.43 1k2n n PHE 703 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1k2n n ASN 704 N 0.00 0.00 0.00 5.98 6.94 -1.26 -4.77 115.26 122.15 1k2n n ASN 704 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1k2n n ASN 704 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1k2n n ASN 704 CO 0.00 0.00 0.00 -1.84 -1.03 0.00 0.00 177.26 174.39 1k2n n GLU 705 N -0.78 0.00 0.00 -3.83 0.28 -1.26 -4.21 120.64 110.84 1k2n n GLU 705 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1k2n n GLU 705 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1k2n n GLU 705 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1k2n n GLY 706 N 0.00 -1.75 0.00 -1.84 0.00 -1.26 -4.55 105.19 95.79 1k2n n GLY 706 Ca 0.00 0.75 0.07 0.00 0.00 0.00 0.00 46.02 46.84 1k2n n GLY 706 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k2n n LEU 707 N 0.00 0.73 -0.01 0.99 7.99 -1.26 0.24 117.00 125.67 1k2n n LEU 707 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 56.01 55.50 1k2n n LEU 707 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1k2n n LEU 707 CO 0.00 0.18 0.00 0.61 -1.51 0.00 0.00 177.39 176.67 1k2n n GLY 708 N 1.36 1.62 3.65 -0.72 0.00 -1.26 -4.99 105.19 104.85 1k2n n GLY 708 Ca 0.03 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1k2n n GLY 708 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1k2n s MET 709 N -1.29 4.23 0.00 1.61 0.00 -1.26 -4.94 119.30 117.65 1k2n s MET 709 Ca 0.00 0.94 0.00 0.00 0.00 0.00 0.00 55.69 56.63 1k2n s MET 709 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 34.83 31.22 1k2n s MET 709 CO 0.00 -0.42 0.00 -0.11 0.00 0.00 0.00 175.02 174.49 1k2n n LEU 710 N 5.63 0.00 0.12 4.11 7.94 -1.26 -5.06 117.00 128.48 1k2n n LEU 710 Ca 0.04 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.82 1k2n n LEU 710 Cb 0.48 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.35 1k2n n LEU 710 CO 0.47 0.00 0.53 -0.61 -1.11 0.00 0.00 177.39 176.67 1k2n h GLN 711 N 0.00 -0.33 -6.76 1.96 4.15 -2.05 -3.44 115.11 108.64 1k2n h GLN 711 Ca 0.00 0.02 -0.49 0.00 0.77 0.00 0.00 58.65 58.95 1k2n h GLN 711 Cb 0.00 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 1k2n h GLN 711 CO 0.00 0.02 0.37 -1.21 -1.93 0.00 0.00 178.83 176.08 1k2n s GLU 712 N -4.40 4.82 -0.71 1.69 8.01 -1.26 -4.99 118.70 121.85 1k2n s GLU 712 Ca -0.14 1.53 -0.25 0.00 0.01 0.00 0.00 54.97 56.11 1k2n s GLU 712 Cb 0.02 -3.24 0.04 0.00 -4.31 0.00 0.00 34.13 26.64 1k2n s GLU 712 CO 0.54 0.47 1.17 -1.14 0.01 0.00 0.00 175.26 176.30 1k2n s GLN 713 N -1.26 3.17 -0.07 1.61 0.74 -1.26 -4.60 119.66 117.99 1k2n s GLN 713 Ca 0.42 -0.44 -0.06 0.00 0.05 0.00 0.00 55.36 55.33 1k2n s GLN 713 Cb -0.26 -4.19 0.01 0.00 1.10 0.00 0.00 33.01 29.66 1k2n s GLN 713 CO 0.33 -2.02 0.11 0.54 -0.55 0.00 0.00 175.29 173.69 1k2n n ARG 714 N 8.78 -0.49 -4.73 1.67 5.12 -1.26 -4.99 116.66 120.76 1k2n n ARG 714 Ca 0.01 0.77 -0.26 0.00 -1.93 0.00 0.00 57.85 56.44 1k2n n ARG 714 Cb 0.48 -1.01 -0.14 0.00 -1.16 0.00 0.00 32.46 30.62 1k2n n ARG 714 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1k2n s VAL 715 N -0.94 1.64 -0.06 1.55 -7.23 -1.26 -4.94 120.40 109.15 1k2n s VAL 715 Ca 0.06 -1.10 -0.26 0.00 -1.81 0.00 0.00 61.98 58.88 1k2n s VAL 715 Cb -0.01 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.50 1k2n s VAL 715 CO 0.14 0.27 0.80 -0.69 -0.31 0.00 0.00 175.10 175.31 1k2n s VAL 716 N -0.71 4.97 0.36 1.32 1.01 -1.26 -4.69 120.40 121.40 1k2n s VAL 716 Ca 0.07 1.65 0.05 0.00 0.00 0.00 0.00 61.98 63.75 1k2n s VAL 716 Cb -0.08 -4.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 1k2n s VAL 716 CO 0.01 0.19 0.52 -0.76 0.00 0.00 0.00 175.10 175.06 1k2n s LEU 717 N 1.05 3.90 -0.15 3.92 1.02 0.31 -4.89 118.68 123.84 1k2n s LEU 717 Ca 0.42 -0.08 -0.07 0.00 0.02 0.00 0.00 54.13 54.42 1k2n s LEU 717 Cb -0.18 -2.85 -0.04 0.00 0.02 0.00 0.00 46.19 43.14 1k2n s LEU 717 CO 0.20 -0.50 0.10 -0.75 0.02 0.00 0.00 176.35 175.42 1k2n s LYS 718 N -4.26 3.65 0.60 1.70 2.20 -1.26 0.96 119.74 123.33 1k2n s LYS 718 Ca 0.46 -0.24 -0.16 0.00 -0.36 0.00 0.00 55.97 55.67 1k2n s LYS 718 Cb -0.10 -3.18 -0.03 0.00 -1.51 0.00 0.00 37.83 33.01 1k2n s LYS 718 CO 0.33 0.55 1.07 -0.65 -0.36 0.00 0.00 175.35 176.29 1k2n s GLN 719 N -0.40 3.26 0.22 4.03 -0.21 0.19 -4.71 119.66 122.04 1k2n s GLN 719 Ca 0.11 1.26 0.01 0.00 0.02 0.00 0.00 55.36 56.75 1k2n s GLN 719 Cb -0.12 -2.02 -0.00 0.00 1.00 0.00 0.00 33.01 31.87 1k2n s GLN 719 CO 0.02 -0.87 0.04 0.25 -2.12 0.00 0.00 175.29 172.61 1k2n n THR 720 N -2.02 0.00 0.09 -0.19 -2.24 -1.26 -4.92 114.28 103.74 1k2n n THR 720 Ca 0.09 -1.15 0.16 0.00 -2.27 0.00 0.00 64.05 60.88 1k2n n THR 720 Cb 0.53 0.33 0.68 0.00 -2.10 0.00 0.00 70.33 69.77 1k2n n THR 720 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k2n h ALA 721 N 1.24 2.31 0.18 6.98 0.00 -1.98 -1.48 119.26 126.51 1k2n h ALA 721 Ca -0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1k2n h ALA 721 Cb 0.60 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1k2n h ALA 721 CO 0.28 -0.43 -0.08 0.93 0.00 0.00 0.00 179.25 179.95 1k2n h GLU 722 N 0.00 -0.23 -0.08 0.00 3.07 -1.99 0.03 114.58 115.38 1k2n h GLU 722 Ca 0.16 0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.03 1k2n h GLU 722 Cb 0.67 0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.63 1k2n h GLU 722 CO -0.00 -0.08 0.01 0.93 -1.40 0.00 0.00 179.01 178.47 1k2n h GLU 723 N -0.33 0.14 -0.55 2.33 3.07 -1.76 -2.78 114.58 114.70 1k2n h GLU 723 Ca -0.02 -0.04 0.10 0.00 -0.50 0.00 0.00 59.36 58.90 1k2n h GLU 723 Cb 0.25 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1k2n h GLU 723 CO 0.04 0.36 0.38 0.87 -1.40 0.00 0.00 179.01 179.25 1k2n h LYS 724 N -0.10 0.30 -0.40 2.33 1.79 -1.27 -0.65 116.57 118.57 1k2n h LYS 724 Ca 0.02 -0.02 -0.10 0.00 -2.18 0.00 0.00 60.65 58.38 1k2n h LYS 724 Cb 0.29 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 1k2n h LYS 724 CO 0.00 0.20 -0.15 -0.44 -1.08 0.00 0.00 179.45 177.98 1k2n h ASP 725 N 0.31 0.74 -0.60 0.86 5.19 -0.71 -1.09 116.42 121.12 1k2n h ASP 725 Ca 0.26 -0.23 0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1k2n h ASP 725 Cb 0.60 -0.20 -0.03 0.00 0.18 0.00 0.00 39.33 39.88 1k2n h ASP 725 CO -0.06 0.90 0.39 -0.07 -3.12 0.00 0.00 179.24 177.29 1k2n h LEU 726 N 0.67 0.68 -0.36 1.55 3.38 -0.90 -2.35 115.31 117.98 1k2n h LEU 726 Ca 0.11 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1k2n h LEU 726 Cb 0.63 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1k2n h LEU 726 CO 0.04 0.49 -0.52 0.58 0.09 0.00 0.00 178.44 179.13 1k2n h VAL 727 N 0.80 0.98 -0.67 1.22 2.07 -1.42 -3.21 116.25 116.02 1k2n h VAL 727 Ca 0.22 -2.11 0.13 0.00 0.82 0.00 0.00 66.70 65.75 1k2n h VAL 727 Cb -0.09 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 1k2n h VAL 727 CO -0.05 0.51 0.45 0.11 0.02 0.00 0.00 177.57 178.61 1k2n h LYS 728 N 0.00 0.38 -1.00 1.57 1.57 -0.63 0.12 116.57 118.57 1k2n h LYS 728 Ca -0.01 -0.02 -0.52 0.00 -1.87 0.00 0.00 60.65 58.23 1k2n h LYS 728 Cb 1.25 -0.09 -0.30 0.00 0.08 0.00 0.00 32.23 33.18 1k2n h LYS 728 CO 0.07 0.25 0.66 1.63 -0.57 0.00 0.00 179.45 181.49 1k2n n LYS 729 N -4.47 2.25 0.00 3.15 5.02 -1.19 -5.10 118.16 117.83 1k2n n LYS 729 Ca 0.12 -2.94 0.15 0.00 -2.02 0.00 0.00 58.31 53.62 1k2n n LYS 729 Cb 0.46 -2.15 0.67 0.00 -0.02 0.00 0.00 35.03 33.99 1k2n n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77