#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 4.21 -1.99 -3.48 115.58 115.93 1k2n h ASN 574 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1k2n h ASN 574 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1k2n h ASN 574 CO 0.00 0.23 0.00 0.61 -1.29 0.00 0.00 177.43 176.98 1k2n n GLY 575 N 1.26 2.62 3.52 2.83 0.00 -1.26 -5.13 105.19 109.03 1k2n n GLY 575 Ca -0.04 -0.31 -0.32 0.00 0.00 0.00 0.00 46.02 45.35 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 2.36 0.09 1.61 3.52 -1.26 -3.01 118.95 122.26 1k2n s ARG 576 Ca 0.00 -0.81 0.00 0.00 -0.13 0.00 0.00 55.73 54.79 1k2n s ARG 576 Cb 0.00 -2.36 0.00 0.00 -1.56 0.00 0.00 34.95 31.03 1k2n s ARG 576 CO 0.00 0.58 0.00 0.34 -0.81 0.00 0.00 175.30 175.41 1k2n n PHE 577 N 1.71 -0.23 -4.55 5.12 -0.00 -1.05 -3.76 117.46 114.70 1k2n n PHE 577 Ca -0.16 0.04 -0.33 0.00 -0.00 0.00 0.00 57.45 57.00 1k2n n PHE 577 Cb 0.52 0.07 -0.11 0.00 -0.00 0.00 0.00 39.48 39.96 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 -6.67 3.13 -0.22 -2.13 2.96 -1.08 -0.86 118.68 113.81 1k2n s LEU 578 Ca 0.00 -0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.82 1k2n s LEU 578 Cb 0.00 -1.75 0.04 0.00 0.50 0.00 0.00 46.19 44.99 1k2n s LEU 578 CO 0.00 0.32 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.32 1k2n s THR 579 N -0.91 1.99 -0.40 3.68 2.01 0.10 0.12 115.64 122.23 1k2n s THR 579 Ca 0.15 -1.25 -0.12 0.00 0.31 0.00 0.00 61.69 60.78 1k2n s THR 579 Cb -0.11 -2.00 0.04 0.00 0.01 0.00 0.00 72.50 70.45 1k2n s THR 579 CO 0.05 0.20 0.26 -0.76 -0.69 0.00 0.00 174.62 173.68 1k2n s LEU 580 N 1.24 5.01 -0.41 4.42 1.43 0.45 0.16 118.68 130.99 1k2n s LEU 580 Ca -0.03 -1.12 -0.02 0.00 -1.03 0.00 0.00 54.13 51.93 1k2n s LEU 580 Cb -0.17 -2.07 0.11 0.00 0.03 0.00 0.00 46.19 44.10 1k2n s LEU 580 CO -0.08 -0.47 0.20 -0.54 0.23 0.00 0.00 176.35 175.69 1k2n s LYS 581 N 1.57 1.97 -0.78 1.70 1.02 0.16 0.27 119.74 125.64 1k2n s LYS 581 Ca 0.03 -1.84 -0.30 0.00 0.02 0.00 0.00 55.97 53.88 1k2n s LYS 581 Cb -0.21 -3.55 -0.16 0.00 -0.52 0.00 0.00 37.83 33.38 1k2n s LYS 581 CO 0.06 -1.06 2.56 -2.30 -0.92 0.00 0.00 175.35 173.69 1k2n n PRO 582 N 4.54 0.39 -1.82 -1.68 -0.02 0.75 -2.28 135.00 134.89 1k2n n PRO 582 Ca -0.01 0.01 -0.32 0.00 -2.02 0.00 0.00 63.50 61.16 1k2n n PRO 582 Cb 0.41 -2.18 0.03 0.00 -0.02 0.00 0.00 33.50 31.74 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 9.85 3.32 0.59 2.45 2.34 -1.08 -1.96 118.68 134.19 1k2n s LEU 583 Ca 1.22 1.72 0.29 0.00 0.06 0.00 0.00 54.13 57.42 1k2n s LEU 583 Cb -0.90 -4.51 1.45 0.00 -0.56 0.00 0.00 46.19 41.67 1k2n s LEU 583 CO 0.42 -1.30 1.86 1.55 -1.06 0.00 0.00 176.35 177.82 1k2n h PRO 584 N -0.12 0.00 0.00 1.48 0.13 -1.90 0.45 132.00 132.05 1k2n h PRO 584 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1k2n h PRO 584 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1k2n h PRO 584 CO 0.57 0.00 -0.07 0.22 -0.23 0.00 0.00 178.00 178.49 1k2n h ASP 585 N 0.00 0.00 -2.95 1.44 1.82 -1.92 -3.42 116.42 111.40 1k2n h ASP 585 Ca 0.24 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.34 1k2n h ASP 585 Cb 1.30 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.29 1k2n h ASP 585 CO -0.00 0.07 -0.29 -0.55 -1.61 0.00 0.00 179.24 176.86 1k2n s SER 586 N -6.58 6.41 0.10 2.28 0.15 0.16 -4.82 113.70 111.40 1k2n s SER 586 Ca -0.04 0.49 0.05 0.00 0.70 0.00 0.00 55.95 57.15 1k2n s SER 586 Cb 0.15 -2.05 0.29 0.00 -1.71 0.00 0.00 66.02 62.70 1k2n s SER 586 CO 0.62 -0.07 1.08 2.30 1.20 0.00 0.00 173.24 178.37 1k2n n ILE 587 N -0.65 1.36 -4.14 6.45 -5.35 -0.73 -4.38 119.36 111.93 1k2n n ILE 587 Ca -0.04 0.57 -0.35 0.00 -0.27 0.00 0.00 62.75 62.67 1k2n n ILE 587 Cb 0.54 -1.57 -0.13 0.00 -1.74 0.00 0.00 39.64 36.73 1k2n n ILE 587 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1k2n s ILE 588 N -2.99 3.78 -0.70 7.28 1.01 -1.26 -5.02 121.20 123.29 1k2n s ILE 588 Ca -0.01 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.29 1k2n s ILE 588 Cb 0.02 -2.70 0.35 0.00 0.01 0.00 0.00 42.46 40.14 1k2n s ILE 588 CO 0.05 0.44 1.33 0.00 0.00 0.00 0.00 174.94 176.76 1k2n n GLN 589 N 4.20 3.82 -4.54 2.79 3.00 -1.25 -3.51 117.38 121.89 1k2n n GLN 589 Ca -0.17 -4.60 -0.25 0.00 -0.01 0.00 0.00 57.00 51.96 1k2n n GLN 589 Cb 0.52 -2.31 -0.10 0.00 0.00 0.00 0.00 30.24 28.35 1k2n n GLN 589 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1k2n s GLU 590 N -3.79 1.83 -0.08 -1.09 2.12 -0.83 -4.99 118.70 111.88 1k2n s GLU 590 Ca 0.46 -2.05 0.02 0.00 0.36 0.00 0.00 54.97 53.77 1k2n s GLU 590 Cb 0.30 -1.16 0.01 0.00 0.26 0.00 0.00 34.13 33.54 1k2n s GLU 590 CO -0.18 -0.19 -0.13 -1.12 -0.54 0.00 0.00 175.26 173.10 1k2n s SER 591 N -3.61 1.99 -0.04 -1.70 0.01 -1.26 -0.18 113.70 108.91 1k2n s SER 591 Ca 0.32 -0.34 0.02 0.00 1.31 0.00 0.00 55.95 57.27 1k2n s SER 591 Cb 0.08 -0.91 -0.03 0.00 0.21 0.00 0.00 66.02 65.37 1k2n s SER 591 CO 0.15 0.03 -0.10 -0.76 0.41 0.00 0.00 173.24 172.98 1k2n s LEU 592 N 0.74 3.01 -0.19 2.44 1.43 0.76 -4.93 118.68 121.93 1k2n s LEU 592 Ca -0.13 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1k2n s LEU 592 Cb -0.16 -1.66 0.04 0.00 0.03 0.00 0.00 46.19 44.44 1k2n s LEU 592 CO 0.03 0.34 -0.12 -1.61 0.23 0.00 0.00 176.35 175.22 1k2n s GLU 593 N -0.93 2.15 -0.50 1.70 8.01 -1.26 0.17 118.70 128.05 1k2n s GLU 593 Ca 0.13 -0.80 -0.27 0.00 0.01 0.00 0.00 54.97 54.04 1k2n s GLU 593 Cb -0.11 -2.38 0.03 0.00 -4.31 0.00 0.00 34.13 27.37 1k2n s GLU 593 CO 0.02 -0.38 1.05 0.42 0.01 0.00 0.00 175.26 176.38 1k2n s ILE 594 N 1.40 4.29 -0.10 -1.63 1.01 0.33 -4.97 121.20 121.53 1k2n s ILE 594 Ca 0.00 0.89 -0.29 0.00 0.00 0.00 0.00 60.65 61.25 1k2n s ILE 594 Cb -0.15 -4.56 -0.05 0.00 0.01 0.00 0.00 42.46 37.71 1k2n s ILE 594 CO -0.09 -1.01 1.69 -1.58 0.00 0.00 0.00 174.94 173.95 1k2n s GLN 595 N 4.22 4.03 0.57 2.79 2.00 -1.26 -2.52 119.66 129.48 1k2n s GLN 595 Ca 0.41 2.07 0.36 0.00 -2.00 0.00 0.00 55.36 56.20 1k2n s GLN 595 Cb -0.09 -4.03 1.47 0.00 0.80 0.00 0.00 33.01 31.16 1k2n s GLN 595 CO 0.27 -1.03 1.71 -0.56 -0.50 0.00 0.00 175.29 175.18 1k2n h GLN 596 N 10.18 0.00 0.00 1.67 -0.00 -1.82 0.96 115.11 126.11 1k2n h GLN 596 Ca -0.38 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.24 1k2n h GLN 596 Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.65 1k2n h GLN 596 CO 0.97 0.00 -0.13 0.78 -0.00 0.00 0.00 178.83 180.44 1k2n h GLY 597 N 0.00 0.00 -7.76 0.06 0.00 -1.88 -3.41 103.07 90.07 1k2n h GLY 597 Ca 0.55 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.22 1k2n h GLY 597 CO -0.01 0.00 -0.52 0.14 0.00 0.00 0.00 176.54 176.15 1k2n s VAL 598 N -3.85 5.14 -0.04 4.60 1.01 0.33 -5.06 120.40 122.53 1k2n s VAL 598 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 1k2n s VAL 598 Cb 0.11 -3.51 0.03 0.00 0.00 0.00 0.00 36.38 33.01 1k2n s VAL 598 CO 0.59 0.18 0.05 0.21 0.00 0.00 0.00 175.10 176.12 1k2n s ASN 599 N 1.72 0.92 0.42 3.32 2.47 -1.26 -3.99 114.94 118.54 1k2n s ASN 599 Ca 0.07 0.05 -0.03 0.00 0.42 0.00 0.00 52.86 53.37 1k2n s ASN 599 Cb -0.16 -0.16 -0.04 0.00 -1.45 0.00 0.00 41.25 39.45 1k2n s ASN 599 CO 0.10 -0.21 0.68 -2.16 -3.72 0.00 0.00 177.10 171.78 1k2n s PRO 600 N 1.87 3.52 -0.34 0.43 0.04 -1.26 -5.04 135.00 134.21 1k2n s PRO 600 Ca 0.01 -0.04 -0.19 0.00 0.04 0.00 0.00 61.00 60.82 1k2n s PRO 600 Cb -0.12 -2.50 -0.00 0.00 0.04 0.00 0.00 34.50 31.91 1k2n s PRO 600 CO -0.03 -0.04 0.58 0.12 0.04 0.00 0.00 177.00 177.67 1k2n s PHE 601 N -2.55 3.17 -0.01 0.56 2.19 0.26 -4.91 117.98 116.70 1k2n s PHE 601 Ca 0.44 0.32 -0.16 0.00 0.33 0.00 0.00 56.93 57.86 1k2n s PHE 601 Cb -0.10 -3.02 -0.06 0.00 -1.31 0.00 0.00 43.02 38.53 1k2n s PHE 601 CO 0.41 -0.56 0.45 -0.06 1.83 0.00 0.00 175.22 177.29 1k2n s PHE 602 N 2.56 3.70 0.05 10.12 0.08 -1.26 0.62 117.98 133.85 1k2n s PHE 602 Ca 0.22 1.02 0.07 0.00 0.12 0.00 0.00 56.93 58.37 1k2n s PHE 602 Cb -0.15 -2.38 -0.03 0.00 -0.57 0.00 0.00 43.02 39.90 1k2n s PHE 602 CO 0.14 0.54 -0.21 0.42 -0.10 0.00 0.00 175.22 176.01 1k2n s ILE 603 N -0.75 1.67 -5.00 0.64 1.09 0.45 0.17 121.20 119.47 1k2n s ILE 603 Ca 0.25 -1.25 0.00 0.00 -1.10 0.00 0.00 60.65 58.55 1k2n s ILE 603 Cb -0.17 -1.46 0.00 0.00 -1.06 0.00 0.00 42.46 39.77 1k2n s ILE 603 CO 0.14 0.17 0.00 0.61 -0.10 0.00 0.00 174.94 175.75 1k2n n GLY 604 N 1.74 -1.61 0.12 6.18 0.00 -1.14 -2.69 105.19 107.79 1k2n n GLY 604 Ca -0.18 -1.28 -0.13 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 0.34 -0.18 -6.55 1.61 3.08 0.32 0.50 114.38 113.51 1k2n h ARG 605 Ca 0.00 0.01 -0.52 0.00 0.07 0.00 0.00 59.98 59.54 1k2n h ARG 605 Cb 0.00 0.04 0.04 0.00 0.08 0.00 0.00 29.97 30.13 1k2n h ARG 605 CO 0.00 0.21 1.10 -1.12 -1.07 0.00 0.00 179.97 179.08 1k2n s SER 606 N -5.40 6.40 0.66 7.04 0.01 -1.08 -4.54 113.70 116.80 1k2n s SER 606 Ca -0.15 2.80 0.29 0.00 1.31 0.00 0.00 55.95 60.20 1k2n s SER 606 Cb 0.02 -2.57 1.56 0.00 0.21 0.00 0.00 66.02 65.23 1k2n s SER 606 CO 0.60 -1.00 1.88 -0.08 0.41 0.00 0.00 173.24 175.04 1k2n h GLU 607 N 8.22 0.00 -0.61 12.44 4.81 -1.90 0.50 114.58 138.05 1k2n h GLU 607 Ca -0.45 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 58.92 1k2n h GLU 607 Cb 1.21 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1k2n h GLU 607 CO 0.95 0.00 0.42 -0.44 -0.73 0.00 0.00 179.01 179.21 1k2n h ASP 608 N 0.00 0.18 -3.08 1.04 5.19 -1.91 -3.41 116.42 114.44 1k2n h ASP 608 Ca 0.00 0.01 -0.53 0.00 -0.62 0.00 0.00 57.03 55.89 1k2n h ASP 608 Cb 0.74 -0.03 0.02 0.00 0.18 0.00 0.00 39.33 40.24 1k2n h ASP 608 CO -0.00 0.10 0.67 0.00 -3.12 0.00 0.00 179.24 176.89 1k2n h ASN 610 N 6.74 0.13 -3.34 0.00 4.21 0.28 -3.37 115.58 120.24 1k2n h ASN 610 Ca -0.42 0.05 -0.67 0.00 1.21 0.00 0.00 56.30 56.47 1k2n h ASN 610 Cb 1.21 0.04 -0.14 0.00 -1.12 0.00 0.00 38.32 38.31 1k2n h ASN 610 CO 0.84 -0.04 -0.63 0.00 -1.29 0.00 0.00 177.43 176.31 1k2n s LYS 612 N -1.21 2.31 -0.17 0.00 2.36 -1.26 -2.87 119.74 118.89 1k2n s LYS 612 Ca 0.16 -1.54 -0.05 0.00 -2.55 0.00 0.00 55.97 52.00 1k2n s LYS 612 Cb -0.11 -3.52 0.06 0.00 -1.05 0.00 0.00 37.83 33.21 1k2n s LYS 612 CO 0.06 -0.89 0.09 0.42 1.55 0.00 0.00 175.35 176.57 1k2n s ILE 613 N 1.26 -0.04 -0.42 5.43 -1.09 0.17 -4.94 121.20 121.57 1k2n s ILE 613 Ca 0.03 -0.20 -0.12 0.00 -2.23 0.00 0.00 60.65 58.13 1k2n s ILE 613 Cb -0.22 -0.61 0.06 0.00 -1.58 0.00 0.00 42.46 40.11 1k2n s ILE 613 CO -0.01 -0.28 0.28 -1.61 -1.23 0.00 0.00 174.94 172.09 1k2n s GLU 614 N 2.12 2.80 -0.24 2.79 2.02 -1.26 -0.07 118.70 126.86 1k2n s GLU 614 Ca 0.02 -1.28 -0.00 0.00 0.02 0.00 0.00 54.97 53.73 1k2n s GLU 614 Cb -0.16 -3.88 0.07 0.00 0.10 0.00 0.00 34.13 30.26 1k2n s GLU 614 CO -0.09 -0.88 0.01 0.34 0.02 0.00 0.00 175.26 174.66 1k2n s ASP 615 N 2.03 3.66 0.57 -0.19 2.15 -1.26 -4.99 116.67 118.64 1k2n s ASP 615 Ca 0.03 -1.22 0.43 0.00 0.43 0.00 0.00 52.55 52.22 1k2n s ASP 615 Cb -0.22 -0.97 1.50 0.00 -0.30 0.00 0.00 42.92 42.93 1k2n s ASP 615 CO 0.05 -0.30 1.50 0.78 -0.17 0.00 0.00 175.17 177.04 1k2n h ASN 616 N 8.04 0.00 -0.36 -0.34 2.35 -1.98 0.54 115.58 123.84 1k2n h ASN 616 Ca -0.16 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.46 1k2n h ASN 616 Cb 1.07 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 1k2n h ASN 616 CO 0.41 0.00 -0.31 0.03 -1.65 0.00 0.00 177.43 175.91 1k2n h ARG 617 N 0.00 0.84 -6.79 0.81 -0.00 -2.02 -3.45 114.38 103.77 1k2n h ARG 617 Ca 0.80 -0.42 -0.49 0.00 -0.50 0.00 0.00 59.98 59.36 1k2n h ARG 617 Cb 3.48 0.01 0.02 0.00 0.00 0.00 0.00 29.97 33.48 1k2n h ARG 617 CO -0.01 1.06 0.02 -0.48 0.00 0.00 0.00 179.97 180.57 1k2n s LEU 618 N -8.97 3.77 0.91 3.04 0.05 0.19 -4.64 118.68 113.03 1k2n s LEU 618 Ca -0.12 0.82 -0.14 0.00 0.05 0.00 0.00 54.13 54.74 1k2n s LEU 618 Cb 0.10 -3.74 0.15 0.00 -2.05 0.00 0.00 46.19 40.65 1k2n s LEU 618 CO 0.85 -0.47 1.21 -0.94 -0.55 0.00 0.00 176.35 176.46 1k2n s SER 619 N -3.93 3.56 0.19 1.48 1.04 -1.26 -4.72 113.70 110.05 1k2n s SER 619 Ca 0.46 0.63 -0.18 0.00 0.48 0.00 0.00 55.95 57.34 1k2n s SER 619 Cb -0.10 -0.97 0.16 0.00 0.10 0.00 0.00 66.02 65.21 1k2n s SER 619 CO 0.40 -2.49 1.60 0.03 0.98 0.00 0.00 173.24 173.77 1k2n h ARG 620 N -1.46 -0.11 -2.42 4.02 -0.00 -1.95 -2.62 114.38 109.84 1k2n h ARG 620 Ca -0.46 0.01 -0.66 0.00 -0.50 0.00 0.00 59.98 58.37 1k2n h ARG 620 Cb 1.30 0.03 -0.38 0.00 0.00 0.00 0.00 29.97 30.91 1k2n h ARG 620 CO 0.53 -0.07 -0.21 0.28 0.00 0.00 0.00 179.97 180.50 1k2n n VAL 621 N -5.44 3.18 -0.28 2.04 0.31 -1.26 -0.00 118.33 116.87 1k2n n VAL 621 Ca 0.05 -5.41 0.10 0.00 -0.01 0.00 0.00 64.34 59.07 1k2n n VAL 621 Cb 0.35 -2.10 0.25 0.00 -0.91 0.00 0.00 33.84 31.43 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 4.57 0.45 -2.26 3.52 2.76 -1.24 -3.37 115.15 119.57 1k2n h HIS 622 Ca 0.20 0.04 0.10 0.00 -2.20 0.00 0.00 60.37 58.51 1k2n h HIS 622 Cb 0.65 -0.07 -0.16 0.00 1.55 0.00 0.00 27.41 29.39 1k2n h HIS 622 CO 0.80 -0.09 0.48 0.00 -1.30 0.00 0.00 177.93 177.82 1k2n s PHE 624 N -2.98 0.10 -0.15 0.00 -0.71 0.35 -0.41 117.98 114.18 1k2n s PHE 624 Ca 0.04 -0.23 -0.07 0.00 -1.04 0.00 0.00 56.93 55.63 1k2n s PHE 624 Cb -0.01 -0.09 -0.04 0.00 -1.21 0.00 0.00 43.02 41.67 1k2n s PHE 624 CO -0.08 -0.25 0.09 0.42 -1.34 0.00 0.00 175.22 174.07 1k2n s ILE 625 N -1.33 5.10 -0.04 -4.49 1.01 0.20 0.27 121.20 121.92 1k2n s ILE 625 Ca -0.14 0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.60 1k2n s ILE 625 Cb -0.08 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.14 1k2n s ILE 625 CO 0.01 0.54 -0.13 0.12 0.00 0.00 0.00 174.94 175.47 1k2n s PHE 626 N -0.34 1.40 -0.12 3.97 5.36 0.39 0.92 117.98 129.56 1k2n s PHE 626 Ca 0.10 -0.41 -0.10 0.00 -0.96 0.00 0.00 56.93 55.56 1k2n s PHE 626 Cb -0.12 -0.97 -0.05 0.00 -0.34 0.00 0.00 43.02 41.54 1k2n s PHE 626 CO 0.01 -0.16 0.21 0.21 -1.46 0.00 0.00 175.22 174.03 1k2n s LYS 627 N 0.21 3.79 0.08 10.12 2.20 -1.26 0.18 119.74 135.06 1k2n s LYS 627 Ca -0.06 -0.02 0.02 0.00 -0.36 0.00 0.00 55.97 55.55 1k2n s LYS 627 Cb -0.11 -3.27 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 1k2n s LYS 627 CO 0.02 0.59 -0.07 0.21 -0.36 0.00 0.00 175.35 175.74 1k2n s LYS 628 N -0.54 0.76 -0.34 4.03 2.20 0.10 -4.93 119.74 121.02 1k2n s LYS 628 Ca 0.15 -1.20 -0.29 0.00 -0.36 0.00 0.00 55.97 54.28 1k2n s LYS 628 Cb -0.13 -0.22 0.01 0.00 -1.51 0.00 0.00 37.83 35.98 1k2n s LYS 628 CO 0.04 -0.00 1.19 0.50 -0.36 0.00 0.00 175.35 176.73 1k2n s ARG 629 N -3.30 3.94 -0.04 4.03 6.06 -1.26 0.19 118.95 128.57 1k2n s ARG 629 Ca 0.07 1.08 -0.30 0.00 -2.50 0.00 0.00 55.73 54.07 1k2n s ARG 629 Cb 0.02 -3.83 -0.04 0.00 0.06 0.00 0.00 34.95 31.16 1k2n s ARG 629 CO -0.04 -1.08 1.27 -1.58 -2.50 0.00 0.00 175.30 171.37 1k2n s HIS 630 N 4.13 3.07 -0.03 5.12 5.65 0.45 -4.86 115.29 128.82 1k2n s HIS 630 Ca 0.51 1.08 -0.00 0.00 0.25 0.00 0.00 55.06 56.90 1k2n s HIS 630 Cb -0.13 -3.50 0.03 0.00 -1.18 0.00 0.00 32.58 27.79 1k2n s HIS 630 CO 0.22 -1.70 0.02 0.00 -0.65 0.00 0.00 174.74 172.63 1k2n s ALA 631 N 2.31 0.23 0.95 1.58 0.00 -1.26 -2.53 121.76 123.04 1k2n s ALA 631 Ca 0.58 0.21 -0.15 0.00 0.00 0.00 0.00 51.96 52.60 1k2n s ALA 631 Cb -0.27 -0.35 0.18 0.00 0.00 0.00 0.00 23.12 22.68 1k2n s ALA 631 CO 0.23 -0.16 1.28 0.14 0.00 0.00 0.00 175.76 177.24 1k2n s VAL 632 N 1.25 1.97 -0.06 0.00 -7.23 -1.26 -5.03 120.40 110.04 1k2n s VAL 632 Ca -0.07 0.00 -0.17 0.00 -1.81 0.00 0.00 61.98 59.93 1k2n s VAL 632 Cb -0.13 -2.95 -0.12 0.00 0.56 0.00 0.00 36.38 33.74 1k2n s VAL 632 CO -0.03 0.00 0.68 1.23 -0.31 0.00 0.00 175.10 176.67 1k2n h GLY 633 N -1.61 -0.29 -3.69 2.32 0.00 -2.04 -3.48 103.07 94.29 1k2n h GLY 633 Ca -0.45 0.11 -0.10 0.00 0.00 0.00 0.00 47.33 46.89 1k2n h GLY 633 CO 0.43 -0.11 -0.39 1.25 0.00 0.00 0.00 176.54 177.73 1k2n s LYS 634 N -3.09 0.74 -0.40 4.80 2.47 -1.26 -5.09 119.74 117.91 1k2n s LYS 634 Ca -0.10 -0.74 0.10 0.00 -1.56 0.00 0.00 55.97 53.67 1k2n s LYS 634 Cb 0.00 0.30 0.37 0.00 -1.46 0.00 0.00 37.83 37.04 1k2n s LYS 634 CO 0.35 -0.22 1.04 -1.13 0.16 0.00 0.00 175.35 175.55 1k2n n SER 635 N 0.45 -0.73 -2.17 1.43 3.41 -1.26 -4.95 113.62 109.80 1k2n n SER 635 Ca -0.18 -3.07 -0.24 0.00 -0.26 0.00 0.00 58.87 55.13 1k2n n SER 635 Cb 0.60 0.61 0.16 0.00 -0.26 0.00 0.00 64.21 65.32 1k2n n SER 635 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1k2n n MET 636 N 0.05 2.23 0.03 4.33 0.00 -1.26 -4.67 117.12 117.82 1k2n n MET 636 Ca 0.10 -2.86 0.00 0.00 0.00 0.00 0.00 57.70 54.94 1k2n n MET 636 Cb 0.74 -2.12 0.00 0.00 0.00 0.00 0.00 33.22 31.84 1k2n n MET 636 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 1k2n n TYR 637 N -1.01 -1.59 -2.57 1.12 4.19 -1.26 -5.13 117.16 110.91 1k2n n TYR 637 Ca 0.57 0.18 -0.37 0.00 3.31 0.00 0.00 57.90 61.58 1k2n n TYR 637 Cb 1.48 0.66 -0.04 0.00 0.49 0.00 0.00 39.34 41.92 1k2n n TYR 637 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 1k2n s GLU 638 N -1.32 4.33 -0.50 2.98 2.12 -1.26 -5.02 118.70 120.02 1k2n s GLU 638 Ca 0.00 1.54 -0.14 0.00 0.36 0.00 0.00 54.97 56.73 1k2n s GLU 638 Cb 0.00 -2.72 0.11 0.00 0.26 0.00 0.00 34.13 31.78 1k2n s GLU 638 CO 0.00 0.00 0.43 -1.12 -0.54 0.00 0.00 175.26 174.03 1k2n s SER 639 N -1.43 6.03 0.00 -1.70 0.01 -1.26 -4.74 113.70 110.60 1k2n s SER 639 Ca 0.54 -1.71 0.00 0.00 1.31 0.00 0.00 55.95 56.09 1k2n s SER 639 Cb -0.24 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 63.85 1k2n s SER 639 CO 0.30 -0.76 0.00 -2.65 0.41 0.00 0.00 173.24 170.54 1k2n n PRO 640 N 5.14 1.88 -0.75 12.44 -0.02 -1.26 -4.93 135.00 147.50 1k2n n PRO 640 Ca -0.12 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.32 1k2n n PRO 640 Cb 0.41 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 34.12 1k2n n PRO 640 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k2n n ALA 641 N -3.00 4.02 -1.41 3.55 0.00 -1.26 -5.04 120.51 117.36 1k2n n ALA 641 Ca 0.00 -1.68 0.19 0.00 0.00 0.00 0.00 53.44 51.95 1k2n n ALA 641 Cb 0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 1k2n n ALA 641 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1k2n n GLN 642 N -0.01 -2.91 -2.99 0.00 6.02 -1.26 -4.38 117.38 111.85 1k2n n GLN 642 Ca 0.30 2.00 -0.44 0.00 -0.01 0.00 0.00 57.00 58.84 1k2n n GLN 642 Cb 1.11 -3.52 -0.01 0.00 1.02 0.00 0.00 30.24 28.83 1k2n n GLN 642 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1k2n s GLY 643 N -7.08 2.31 0.00 1.08 0.00 -1.26 -4.80 107.32 97.57 1k2n s GLY 643 Ca 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 44.72 41.55 1k2n s GLY 643 CO 0.00 1.93 0.00 1.04 0.00 0.00 0.00 173.10 176.07 1k2n n LEU 644 N 5.65 0.00 -4.57 0.66 4.77 -1.05 -4.79 117.00 117.67 1k2n n LEU 644 Ca 0.29 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.97 1k2n n LEU 644 Cb 0.45 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 1k2n n LEU 644 CO 0.55 0.00 -0.42 -1.81 -1.33 0.00 0.00 177.39 174.37 1k2n s ASP 645 N -0.64 4.37 -0.04 -1.43 1.01 -1.26 0.17 116.67 118.85 1k2n s ASP 645 Ca 0.00 -0.36 0.01 0.00 0.71 0.00 0.00 52.55 52.91 1k2n s ASP 645 Cb 0.00 -0.85 0.02 0.00 1.01 0.00 0.00 42.92 43.11 1k2n s ASP 645 CO 0.00 0.20 -0.03 -1.81 0.21 0.00 0.00 175.17 173.73 1k2n s ASP 646 N -2.06 0.83 -0.20 0.27 1.01 0.50 -4.02 116.67 113.01 1k2n s ASP 646 Ca 0.20 -0.10 -0.23 0.00 0.71 0.00 0.00 52.55 53.13 1k2n s ASP 646 Cb -0.11 -0.40 -0.02 0.00 1.01 0.00 0.00 42.92 43.41 1k2n s ASP 646 CO 0.12 -0.07 0.72 0.27 0.21 0.00 0.00 175.17 176.43 1k2n s ILE 647 N 0.94 4.95 0.06 0.77 -4.36 -1.26 0.01 121.20 122.32 1k2n s ILE 647 Ca -0.11 1.37 0.03 0.00 -0.26 0.00 0.00 60.65 61.68 1k2n s ILE 647 Cb -0.14 -4.03 -0.04 0.00 1.25 0.00 0.00 42.46 39.50 1k2n s ILE 647 CO -0.00 0.06 0.07 0.26 0.24 0.00 0.00 174.94 175.56 1k2n s TRP 648 N 2.14 3.17 -0.28 1.37 0.52 0.48 -0.27 118.94 126.08 1k2n s TRP 648 Ca 0.32 0.08 -0.07 0.00 0.02 0.00 0.00 56.10 56.46 1k2n s TRP 648 Cb -0.16 -1.63 -0.00 0.00 -1.15 0.00 0.00 33.47 30.53 1k2n s TRP 648 CO 0.10 0.52 0.07 -0.47 0.02 0.00 0.00 176.95 177.19 1k2n s TYR 649 N -1.33 3.11 -0.13 -1.98 5.04 0.52 0.15 117.35 122.73 1k2n s TYR 649 Ca 0.27 -0.84 -0.06 0.00 -2.44 0.00 0.00 57.07 54.00 1k2n s TYR 649 Cb -0.12 -2.24 -0.04 0.00 0.35 0.00 0.00 41.96 39.91 1k2n s TYR 649 CO 0.20 -0.52 0.10 0.00 -1.34 0.00 0.00 175.55 173.98 1k2n s HIS 651 N -0.67 2.60 0.00 0.00 2.46 -0.53 0.13 115.29 119.28 1k2n s HIS 651 Ca 0.12 -0.85 0.00 0.00 0.47 0.00 0.00 55.06 54.80 1k2n s HIS 651 Cb -0.12 -1.71 0.00 0.00 -0.13 0.00 0.00 32.58 30.62 1k2n s HIS 651 CO 0.02 -0.30 0.56 0.25 -2.47 0.00 0.00 174.74 172.81 1k2n n THR 652 N 3.34 0.32 -2.72 0.89 -2.24 0.07 0.81 114.28 114.75 1k2n n THR 652 Ca -0.18 -0.43 -0.33 0.00 -2.27 0.00 0.00 64.05 60.84 1k2n n THR 652 Cb 0.53 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.73 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 -0.32 2.26 -0.01 3.38 0.00 0.58 -4.83 107.32 108.39 1k2n s GLY 653 Ca 0.00 0.27 -0.20 0.00 0.00 0.00 0.00 44.72 44.79 1k2n s GLY 653 CO 0.00 0.54 1.05 0.00 0.00 0.00 0.00 173.10 174.69 1k2n h THR 654 N 1.57 1.45 0.00 0.90 1.03 -1.91 -3.23 112.91 112.72 1k2n h THR 654 Ca -0.48 -2.18 0.00 0.00 -0.01 0.00 0.00 66.41 63.74 1k2n h THR 654 Cb 1.18 2.73 0.00 0.00 -1.07 0.00 0.00 68.15 71.00 1k2n h THR 654 CO 0.62 0.63 0.05 0.78 -0.01 0.00 0.00 175.52 177.59 1k2n h ASN 655 N -0.17 0.00 -4.00 0.00 2.35 -1.93 -3.46 115.58 108.37 1k2n h ASN 655 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1k2n h ASN 655 Cb 1.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.76 1k2n h ASN 655 CO 0.13 0.00 -0.07 0.52 -1.65 0.00 0.00 177.43 176.35 1k2n n VAL 656 N -2.74 -1.09 -4.28 2.81 0.31 -1.22 -4.92 118.33 107.20 1k2n n VAL 656 Ca -0.02 0.17 -0.28 0.00 -0.01 0.00 0.00 64.34 64.20 1k2n n VAL 656 Cb 0.11 -0.25 -0.10 0.00 -0.91 0.00 0.00 33.84 32.69 1k2n n VAL 656 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1k2n s SER 657 N -2.35 4.19 -0.15 4.52 1.04 -0.58 -4.49 113.70 115.88 1k2n s SER 657 Ca 0.00 -0.53 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1k2n s SER 657 Cb 0.00 -0.70 0.02 0.00 0.10 0.00 0.00 66.02 65.44 1k2n s SER 657 CO 0.00 0.14 -0.14 -0.31 0.98 0.00 0.00 173.24 173.91 1k2n s TYR 658 N -1.45 2.19 -0.59 5.02 2.02 0.42 -0.29 117.35 124.67 1k2n s TYR 658 Ca 0.22 -1.24 -0.19 0.00 -0.37 0.00 0.00 57.07 55.49 1k2n s TYR 658 Cb -0.10 -1.60 0.11 0.00 -0.40 0.00 0.00 41.96 39.96 1k2n s TYR 658 CO 0.14 -0.68 0.70 -1.17 -1.57 0.00 0.00 175.55 172.97 1k2n s LEU 659 N 1.48 5.43 0.00 -1.29 2.96 -0.23 0.19 118.68 127.22 1k2n s LEU 659 Ca 0.05 -1.47 0.00 0.00 -0.22 0.00 0.00 54.13 52.49 1k2n s LEU 659 Cb -0.13 -2.30 0.00 0.00 0.50 0.00 0.00 46.19 44.26 1k2n s LEU 659 CO -0.11 -1.10 0.00 -3.20 -1.32 0.00 0.00 176.35 170.62 1k2n n ASN 660 N 6.28 0.00 0.00 3.68 2.85 -0.89 -0.48 115.26 126.70 1k2n n ASN 660 Ca -0.09 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.38 1k2n n ASN 660 Cb 0.42 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.44 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 1.17 0.21 -4.78 1.20 5.15 -1.26 -5.05 115.26 111.90 1k2n n ASN 661 Ca 0.00 -0.96 -0.36 0.00 -0.60 0.00 0.00 54.58 52.66 1k2n n ASN 661 Cb 0.00 0.01 -0.07 0.00 -0.53 0.00 0.00 39.78 39.19 1k2n n ASN 661 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1k2n s ASN 662 N -0.01 6.15 0.30 1.20 -0.87 0.37 -5.08 114.94 116.99 1k2n s ASN 662 Ca 0.00 0.32 -0.28 0.00 -1.57 0.00 0.00 52.86 51.32 1k2n s ASN 662 Cb 0.00 -2.02 -0.09 0.00 -0.02 0.00 0.00 41.25 39.12 1k2n s ASN 662 CO 0.00 0.30 1.06 -0.60 -2.57 0.00 0.00 177.10 175.29 1k2n s ARG 663 N -0.38 4.59 -0.40 -0.60 3.52 -1.26 -1.07 118.95 123.35 1k2n s ARG 663 Ca 0.11 1.69 0.02 0.00 -0.13 0.00 0.00 55.73 57.42 1k2n s ARG 663 Cb -0.12 -3.08 0.12 0.00 -1.56 0.00 0.00 34.95 30.31 1k2n s ARG 663 CO 0.01 0.20 0.17 -1.64 -0.81 0.00 0.00 175.30 173.23 1k2n s MET 664 N -1.60 1.32 0.51 5.12 -1.94 0.61 -4.86 119.30 118.46 1k2n s MET 664 Ca 0.46 -1.86 -0.05 0.00 -1.71 0.00 0.00 55.69 52.53 1k2n s MET 664 Cb -0.29 -2.62 -0.02 0.00 2.01 0.00 0.00 34.83 33.91 1k2n s MET 664 CO 0.37 -1.06 0.81 0.96 -0.01 0.00 0.00 175.02 176.08 1k2n s ILE 665 N 0.66 4.44 -0.37 2.53 -4.36 -1.26 -1.53 121.20 121.31 1k2n s ILE 665 Ca 0.14 0.06 -0.37 0.00 -0.26 0.00 0.00 60.65 60.22 1k2n s ILE 665 Cb -0.22 -3.70 -0.13 0.00 1.25 0.00 0.00 42.46 39.66 1k2n s ILE 665 CO -0.08 -0.68 2.14 1.67 0.24 0.00 0.00 174.94 178.24 1k2n n GLN 666 N -2.33 0.90 0.00 0.37 7.27 -1.24 -1.28 117.38 121.06 1k2n n GLN 666 Ca 0.02 0.25 0.00 0.00 0.07 0.00 0.00 57.00 57.34 1k2n n GLN 666 Cb 0.56 -2.26 0.00 0.00 2.41 0.00 0.00 30.24 30.95 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 6.51 1.92 3.68 1.69 0.00 0.24 -4.95 105.19 114.28 1k2n n GLY 667 Ca 0.42 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.00 3.23 -0.06 2.61 -4.23 -0.40 0.12 115.64 114.90 1k2n s THR 668 Ca 0.00 -1.84 -0.04 0.00 -1.18 0.00 0.00 61.69 58.63 1k2n s THR 668 Cb 0.00 -2.89 0.03 0.00 1.34 0.00 0.00 72.50 70.98 1k2n s THR 668 CO 0.00 -0.29 0.15 -0.75 -0.54 0.00 0.00 174.62 173.19 1k2n s LYS 669 N -3.74 0.13 0.01 3.99 2.20 0.30 -1.45 119.74 121.17 1k2n s LYS 669 Ca 0.34 0.31 0.00 0.00 -0.36 0.00 0.00 55.97 56.26 1k2n s LYS 669 Cb -0.04 -0.08 -0.01 0.00 -1.51 0.00 0.00 37.83 36.19 1k2n s LYS 669 CO 0.21 -0.11 -0.01 0.12 -0.36 0.00 0.00 175.35 175.20 1k2n s PHE 670 N 0.75 0.10 0.33 4.03 5.36 -0.07 0.91 117.98 129.39 1k2n s PHE 670 Ca -0.06 -0.19 -0.28 0.00 -0.96 0.00 0.00 56.93 55.44 1k2n s PHE 670 Cb -0.07 -0.07 -0.10 0.00 -0.34 0.00 0.00 43.02 42.43 1k2n s PHE 670 CO -0.04 -0.07 1.22 -0.51 -1.46 0.00 0.00 175.22 174.37 1k2n s LEU 671 N -0.51 4.43 -0.19 6.12 1.43 -1.26 0.20 118.68 128.90 1k2n s LEU 671 Ca -0.05 2.52 -0.04 0.00 -1.03 0.00 0.00 54.13 55.52 1k2n s LEU 671 Cb -0.04 -3.69 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 1k2n s LEU 671 CO -0.00 -0.44 -0.02 -0.76 0.23 0.00 0.00 176.35 175.36 1k2n s LEU 672 N -1.79 3.18 0.04 1.79 1.43 0.63 -4.82 118.68 119.14 1k2n s LEU 672 Ca 0.49 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 1k2n s LEU 672 Cb -0.36 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 1k2n s LEU 672 CO 0.47 0.09 0.01 -1.10 0.23 0.00 0.00 176.35 176.06 1k2n s GLN 673 N 0.83 2.73 -0.63 1.70 -0.21 -0.12 -4.15 119.66 119.81 1k2n s GLN 673 Ca -0.00 -0.69 -0.32 0.00 0.02 0.00 0.00 55.36 54.37 1k2n s GLN 673 Cb -0.14 -2.64 -0.15 0.00 1.00 0.00 0.00 33.01 31.08 1k2n s GLN 673 CO 0.02 0.59 2.43 -3.47 -2.12 0.00 0.00 175.29 172.74 1k2n n ASP 674 N 0.99 1.40 0.00 5.90 2.03 -1.26 -0.22 116.55 125.39 1k2n n ASP 674 Ca -0.12 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1k2n n ASP 674 Cb 0.52 -1.20 0.00 0.00 -0.72 0.00 0.00 41.12 39.73 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 6.47 1.64 3.61 0.27 0.00 0.52 -4.87 105.19 112.83 1k2n n GLY 675 Ca 0.50 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.12 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 6.50 -0.40 1.61 2.15 0.69 -4.79 116.67 120.43 1k2n s ASP 676 Ca 0.00 0.52 -0.17 0.00 0.43 0.00 0.00 52.55 53.33 1k2n s ASP 676 Cb 0.00 -2.32 0.01 0.00 -0.30 0.00 0.00 42.92 40.32 1k2n s ASP 676 CO 0.00 -0.39 0.44 -1.61 -0.17 0.00 0.00 175.17 173.44 1k2n s GLU 677 N 2.49 3.25 -0.11 4.34 2.02 -1.26 0.15 118.70 129.57 1k2n s GLU 677 Ca 0.24 -0.61 -0.04 0.00 0.02 0.00 0.00 54.97 54.58 1k2n s GLU 677 Cb -0.15 -3.92 -0.03 0.00 0.10 0.00 0.00 34.13 30.12 1k2n s GLU 677 CO 0.10 -0.78 0.03 0.96 0.02 0.00 0.00 175.26 175.58 1k2n s ILE 678 N 2.19 4.50 -0.32 -1.63 -4.36 -0.08 -2.09 121.20 119.40 1k2n s ILE 678 Ca 0.13 -0.16 -0.14 0.00 -0.26 0.00 0.00 60.65 60.22 1k2n s ILE 678 Cb -0.17 -2.93 -0.02 0.00 1.25 0.00 0.00 42.46 40.59 1k2n s ILE 678 CO 0.14 0.57 0.29 -0.54 0.24 0.00 0.00 174.94 175.64 1k2n s LYS 679 N -0.58 3.65 -0.03 0.37 3.01 0.50 -0.82 119.74 125.84 1k2n s LYS 679 Ca 0.10 -0.43 -0.08 0.00 -1.01 0.00 0.00 55.97 54.55 1k2n s LYS 679 Cb -0.12 -3.77 -0.30 0.00 -1.01 0.00 0.00 37.83 32.64 1k2n s LYS 679 CO 0.02 -0.42 0.75 0.82 0.51 0.00 0.00 175.35 177.03 1k2n h ILE 680 N 5.48 1.02 -2.37 2.17 2.04 -1.76 1.21 117.51 125.30 1k2n h ILE 680 Ca -0.31 -2.63 -0.06 0.00 1.00 0.00 0.00 64.86 62.86 1k2n h ILE 680 Cb 1.16 2.76 -0.24 0.00 -0.74 0.00 0.00 36.82 39.76 1k2n h ILE 680 CO 0.65 0.84 -0.15 -0.51 0.00 0.00 0.00 178.15 178.97 1k2n s ILE 681 N -2.59 -0.01 -0.05 -0.67 1.10 -1.23 -4.28 121.20 113.47 1k2n s ILE 681 Ca -0.13 0.05 -0.00 0.00 -0.51 0.00 0.00 60.65 60.05 1k2n s ILE 681 Cb 0.06 -0.78 0.03 0.00 0.15 0.00 0.00 42.46 41.92 1k2n s ILE 681 CO 0.86 0.02 0.00 0.86 -2.11 0.00 0.00 174.94 174.57 1k2n s TRP 682 N 1.34 0.46 -0.16 3.50 -0.00 -1.23 0.38 118.94 123.23 1k2n s TRP 682 Ca -0.08 -0.05 -0.00 0.00 -0.00 0.00 0.00 56.10 55.97 1k2n s TRP 682 Cb -0.07 -0.59 0.04 0.00 -0.00 0.00 0.00 33.47 32.85 1k2n s TRP 682 CO -0.14 -0.22 -0.08 0.34 -0.00 0.00 0.00 176.95 176.85 1k2n s ASP 683 N 1.51 2.83 0.06 5.86 -1.08 0.31 -4.95 116.67 121.21 1k2n s ASP 683 Ca -0.03 -0.63 -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 -0.03 -0.14 1.45 0.50 0.52 0.00 0.00 175.17 177.47 1k2n h LYS 684 N 8.08 0.36 -0.08 4.34 3.64 -1.94 0.52 116.57 131.48 1k2n h LYS 684 Ca -0.28 -0.14 -0.23 0.00 -1.27 0.00 0.00 60.65 58.73 1k2n h LYS 684 Cb 1.12 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.93 1k2n h LYS 684 CO 0.44 0.62 -0.85 -0.91 -2.27 0.00 0.00 179.45 176.47 1k2n h ASN 685 N 0.07 0.90 0.44 4.20 2.35 -1.98 -3.21 115.58 118.34 1k2n h ASN 685 Ca 0.05 -0.68 0.00 0.00 -0.55 0.00 0.00 56.30 55.12 1k2n h ASN 685 Cb 0.48 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1k2n h ASN 685 CO 0.02 1.44 -0.27 -3.20 -1.65 0.00 0.00 177.43 173.77 1k2n n ASN 686 N -3.94 0.60 -1.30 5.81 5.15 -1.24 -4.91 115.26 115.43 1k2n n ASN 686 Ca -0.09 -0.45 -0.16 0.00 -0.60 0.00 0.00 54.58 53.27 1k2n n ASN 686 Cb 0.79 0.05 -0.07 0.00 -0.53 0.00 0.00 39.78 40.02 1k2n n ASN 686 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1k2n n LYS 687 N -1.10 -1.54 -2.45 1.20 4.81 0.18 -4.89 118.16 114.36 1k2n n LYS 687 Ca 0.10 1.06 -0.42 0.00 -0.87 0.00 0.00 58.31 58.18 1k2n n LYS 687 Cb 0.32 -5.44 -0.03 0.00 0.02 0.00 0.00 35.03 29.91 1k2n n LYS 687 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1k2n s PHE 688 N -2.39 2.37 -0.14 5.64 2.19 -0.89 -4.83 117.98 119.94 1k2n s PHE 688 Ca 0.00 0.42 0.01 0.00 0.33 0.00 0.00 56.93 57.69 1k2n s PHE 688 Cb 0.00 -4.44 0.02 0.00 -1.31 0.00 0.00 43.02 37.29 1k2n s PHE 688 CO 0.00 -1.88 -0.15 0.54 1.83 0.00 0.00 175.22 175.56 1k2n s VAL 689 N 5.75 1.61 0.08 3.12 0.11 -1.26 0.11 120.40 129.93 1k2n s VAL 689 Ca 0.49 -0.68 0.06 0.00 -2.93 0.00 0.00 61.98 58.92 1k2n s VAL 689 Cb -0.10 -1.50 -0.03 0.00 -1.53 0.00 0.00 36.38 33.23 1k2n s VAL 689 CO 0.24 0.47 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.69 1k2n s ILE 690 N 1.31 1.32 -0.30 7.04 1.01 0.16 -1.77 121.20 129.97 1k2n s ILE 690 Ca 0.01 -1.41 -0.24 0.00 0.00 0.00 0.00 60.65 59.01 1k2n s ILE 690 Cb -0.13 -1.26 0.20 0.00 0.01 0.00 0.00 42.46 41.28 1k2n s ILE 690 CO -0.08 -0.19 1.46 -0.83 0.00 0.00 0.00 174.94 175.30 1k2n s GLY 691 N -1.85 0.45 0.09 6.18 0.00 -1.26 -2.47 107.32 108.46 1k2n s GLY 691 Ca 0.01 3.66 0.07 0.00 0.00 0.00 0.00 44.72 48.46 1k2n s GLY 691 CO 0.03 2.07 -0.12 -1.36 0.00 0.00 0.00 173.10 173.72 1k2n s PHE 692 N 0.14 2.71 -0.31 1.90 0.08 0.00 -2.64 117.98 119.86 1k2n s PHE 692 Ca 0.06 -0.17 -0.11 0.00 0.12 0.00 0.00 56.93 56.83 1k2n s PHE 692 Cb -0.05 -1.45 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 1k2n s PHE 692 CO -0.16 0.40 0.20 0.21 -0.10 0.00 0.00 175.22 175.77 1k2n s LYS 693 N -2.02 3.59 -0.17 0.44 2.20 -0.97 -0.90 119.74 121.92 1k2n s LYS 693 Ca 0.20 -0.56 -0.28 0.00 -0.36 0.00 0.00 55.97 54.96 1k2n s LYS 693 Cb -0.11 -3.69 -0.01 0.00 -1.51 0.00 0.00 37.83 32.52 1k2n s LYS 693 CO 0.12 -0.35 0.96 0.08 -0.36 0.00 0.00 175.35 175.79 1k2n s VAL 694 N 1.70 4.79 -0.21 4.02 1.01 0.39 -0.66 120.40 131.43 1k2n s VAL 694 Ca 0.06 1.89 -0.02 0.00 0.00 0.00 0.00 61.98 63.91 1k2n s VAL 694 Cb -0.17 -4.25 0.06 0.00 0.00 0.00 0.00 36.38 32.02 1k2n s VAL 694 CO 0.09 -0.04 0.03 -0.70 0.00 0.00 0.00 175.10 174.48 1k2n s GLU 695 N 2.43 0.78 -0.58 2.72 2.12 0.42 0.20 118.70 126.80 1k2n s GLU 695 Ca 0.43 -0.53 -0.28 0.00 0.36 0.00 0.00 54.97 54.95 1k2n s GLU 695 Cb -0.17 -2.17 0.02 0.00 0.26 0.00 0.00 34.13 32.08 1k2n s GLU 695 CO 0.12 -0.66 1.29 0.42 -0.54 0.00 0.00 175.26 175.90 1k2n s ILE 696 N 1.79 3.91 -0.13 -3.70 1.01 -1.26 0.01 121.20 122.82 1k2n s ILE 696 Ca -0.01 0.79 -0.24 0.00 0.00 0.00 0.00 60.65 61.19 1k2n s ILE 696 Cb -0.17 -4.61 -0.26 0.00 0.01 0.00 0.00 42.46 37.43 1k2n s ILE 696 CO -0.09 -1.28 0.63 0.78 0.00 0.00 0.00 174.94 174.98 1k2n h ASN 697 N 10.20 0.15 -3.74 3.58 -0.26 -1.32 -3.46 115.58 120.74 1k2n h ASN 697 Ca -0.26 -0.86 -0.69 0.00 -0.56 0.00 0.00 56.30 53.93 1k2n h ASN 697 Cb 1.07 -0.05 -0.20 0.00 -1.06 0.00 0.00 38.32 38.08 1k2n h ASN 697 CO 1.19 1.28 -0.71 -0.62 -1.06 0.00 0.00 177.43 177.51 1k2n s ASP 698 N -6.63 4.52 -0.38 5.81 2.15 -1.12 -5.04 116.67 115.98 1k2n s ASP 698 Ca -0.20 -0.06 -0.00 0.00 0.43 0.00 0.00 52.55 52.71 1k2n s ASP 698 Cb 0.01 -1.11 0.10 0.00 -0.30 0.00 0.00 42.92 41.62 1k2n s ASP 698 CO 0.71 0.36 0.14 0.42 -0.17 0.00 0.00 175.17 176.62 1k2n s THR 699 N -0.77 2.91 -0.60 1.71 -4.23 -1.26 -4.48 115.64 108.91 1k2n s THR 699 Ca 0.12 -2.13 -0.25 0.00 -1.18 0.00 0.00 61.69 58.25 1k2n s THR 699 Cb -0.11 -3.03 -0.22 0.00 1.34 0.00 0.00 72.50 70.49 1k2n s THR 699 CO 0.01 -0.63 1.84 1.07 -0.54 0.00 0.00 174.62 176.37 1k2n n THR 700 N 4.47 1.27 -3.64 3.99 5.66 -1.26 -4.04 114.28 120.74 1k2n n THR 700 Ca -0.01 -1.14 -0.23 0.00 -3.05 0.00 0.00 64.05 59.63 1k2n n THR 700 Cb 0.42 -2.21 0.04 0.00 -1.55 0.00 0.00 70.33 67.03 1k2n n THR 700 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1k2n n GLY 701 N 4.81 -0.56 3.90 1.09 0.00 -1.26 -4.82 105.19 108.35 1k2n n GLY 701 Ca 0.48 0.26 -0.29 0.00 0.00 0.00 0.00 46.02 46.47 1k2n n GLY 701 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k2n s LEU 702 N -6.46 4.12 0.60 0.99 1.02 -1.26 -4.24 118.68 113.45 1k2n s LEU 702 Ca 0.17 0.68 0.29 0.00 0.02 0.00 0.00 54.13 55.29 1k2n s LEU 702 Cb -0.05 -3.47 1.63 0.00 0.02 0.00 0.00 46.19 44.31 1k2n s LEU 702 CO 0.81 -0.13 2.02 2.19 0.02 0.00 0.00 176.35 181.27 1k2n h PHE 703 N 1.95 0.00 0.00 0.29 -0.00 -1.82 -3.41 116.94 113.96 1k2n h PHE 703 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.50 1k2n h PHE 703 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.13 1k2n h PHE 703 CO 0.58 0.00 0.00 -1.71 -0.00 0.00 0.00 178.31 177.18 1k2n n ASN 704 N -3.64 -2.32 0.00 -0.68 5.15 -1.26 -4.93 115.26 107.57 1k2n n ASN 704 Ca 0.03 0.60 0.00 0.00 -0.60 0.00 0.00 54.58 54.61 1k2n n ASN 704 Cb 0.43 2.34 0.00 0.00 -0.53 0.00 0.00 39.78 42.02 1k2n n ASN 704 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1k2n n GLU 705 N -3.08 0.00 0.00 1.20 0.28 -1.26 -4.99 120.64 112.79 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 0.00 1.09 -1.84 0.00 -1.26 -4.47 105.19 98.71 1k2n n GLY 706 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 3.22 0.00 0.99 4.32 -1.26 -0.94 117.00 123.32 1k2n n LEU 707 Ca 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 56.01 54.50 1k2n n LEU 707 Cb 0.00 -0.31 0.00 0.00 -1.62 0.00 0.00 43.42 41.49 1k2n n LEU 707 CO 0.00 0.74 0.00 0.61 -1.22 0.00 0.00 177.39 177.52 1k2n n GLY 708 N 1.47 1.45 2.57 -0.72 0.00 -1.26 -4.90 105.19 103.79 1k2n n GLY 708 Ca 0.20 0.12 -0.01 0.00 0.00 0.00 0.00 46.02 46.33 1k2n n GLY 708 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1k2n n MET 709 N 0.00 -1.05 -0.06 1.61 2.81 -1.26 -5.06 117.12 114.10 1k2n n MET 709 Ca 0.00 1.28 0.00 0.00 -1.81 0.00 0.00 57.70 57.17 1k2n n MET 709 Cb 0.00 -4.48 0.00 0.00 -0.71 0.00 0.00 33.22 28.03 1k2n n MET 709 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 1k2n n LEU 710 N -1.34 0.00 0.00 4.03 -0.00 -1.26 -5.08 117.00 113.35 1k2n n LEU 710 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.02 1k2n n LEU 710 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.89 1k2n n LEU 710 CO 0.37 0.00 0.45 0.00 -0.00 0.00 0.00 177.39 178.21 1k2n n GLN 711 N 0.00 0.00 -2.59 1.47 1.13 -1.26 -4.50 117.38 111.63 1k2n n GLN 711 Ca 0.00 0.73 -0.40 0.00 -1.94 0.00 0.00 57.00 55.39 1k2n n GLN 711 Cb 0.00 -1.41 -0.05 0.00 0.11 0.00 0.00 30.24 28.90 1k2n n GLN 711 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1k2n s GLU 712 N -2.62 4.72 -0.64 -1.09 0.41 -1.26 -4.99 118.70 113.23 1k2n s GLU 712 Ca 0.00 1.67 -0.22 0.00 -0.41 0.00 0.00 54.97 56.00 1k2n s GLU 712 Cb 0.00 -3.24 0.07 0.00 -1.78 0.00 0.00 34.13 29.18 1k2n s GLU 712 CO 0.00 0.30 0.92 -0.65 -0.49 0.00 0.00 175.26 175.35 1k2n s GLN 713 N -1.14 3.12 -0.39 1.61 -0.21 -1.26 -4.58 119.66 116.81 1k2n s GLN 713 Ca 0.44 -0.83 -0.26 0.00 0.02 0.00 0.00 55.36 54.73 1k2n s GLN 713 Cb -0.29 -4.21 0.04 0.00 1.00 0.00 0.00 33.01 29.55 1k2n s GLN 713 CO 0.36 -1.73 0.54 0.54 -2.12 0.00 0.00 175.29 172.88 1k2n n ARG 714 N 7.48 -2.01 -4.79 2.91 5.12 -1.26 -5.01 116.66 119.10 1k2n n ARG 714 Ca -0.04 1.67 -0.26 0.00 -1.93 0.00 0.00 57.85 57.29 1k2n n ARG 714 Cb 0.45 -3.31 -0.15 0.00 -1.16 0.00 0.00 32.46 28.30 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 -1.79 1.62 -0.36 1.55 -7.23 -1.26 -4.96 120.40 107.97 1k2n s VAL 715 Ca 0.28 -1.05 -0.25 0.00 -1.81 0.00 0.00 61.98 59.15 1k2n s VAL 715 Cb -0.04 -1.39 0.01 0.00 0.56 0.00 0.00 36.38 35.52 1k2n s VAL 715 CO 0.75 0.31 0.90 0.54 -0.31 0.00 0.00 175.10 177.29 1k2n s VAL 716 N -0.66 4.63 0.69 1.32 0.11 -1.26 -4.68 120.40 120.55 1k2n s VAL 716 Ca 0.07 1.18 -0.04 0.00 -2.93 0.00 0.00 61.98 60.26 1k2n s VAL 716 Cb -0.08 -4.30 0.08 0.00 -1.53 0.00 0.00 36.38 30.55 1k2n s VAL 716 CO 0.01 -0.49 0.97 -0.76 -3.33 0.00 0.00 175.10 171.50 1k2n s LEU 717 N 3.37 2.96 0.07 2.54 1.02 0.26 -4.86 118.68 124.04 1k2n s LEU 717 Ca 0.37 0.15 0.01 0.00 0.02 0.00 0.00 54.13 54.68 1k2n s LEU 717 Cb -0.12 -2.75 -0.04 0.00 0.02 0.00 0.00 46.19 43.29 1k2n s LEU 717 CO 0.17 -1.63 0.20 -0.54 0.02 0.00 0.00 176.35 174.58 1k2n s LYS 718 N -5.15 3.38 0.55 1.70 1.02 -1.26 0.11 119.74 120.08 1k2n s LYS 718 Ca 0.62 -0.49 -0.17 0.00 0.02 0.00 0.00 55.97 55.95 1k2n s LYS 718 Cb -0.09 -3.00 -0.06 0.00 -0.52 0.00 0.00 37.83 34.17 1k2n s LYS 718 CO 0.44 0.60 1.04 -0.65 -0.92 0.00 0.00 175.35 175.85 1k2n s GLN 719 N -2.57 3.55 0.49 1.68 -0.21 0.32 -4.59 119.66 118.33 1k2n s GLN 719 Ca 0.34 1.22 0.00 0.00 0.02 0.00 0.00 55.36 56.94 1k2n s GLN 719 Cb -0.13 -2.07 0.00 0.00 1.00 0.00 0.00 33.01 31.82 1k2n s GLN 719 CO 0.27 -0.62 0.02 0.25 -2.12 0.00 0.00 175.29 173.10 1k2n n THR 720 N -1.64 0.00 0.04 -0.19 -2.24 -1.26 -4.94 114.28 104.05 1k2n n THR 720 Ca 0.09 -2.28 0.19 0.00 -2.27 0.00 0.00 64.05 59.78 1k2n n THR 720 Cb 0.53 0.43 0.70 0.00 -2.10 0.00 0.00 70.33 69.88 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 1.21 2.39 0.02 6.98 0.00 -1.98 -1.33 119.26 126.55 1k2n h ALA 721 Ca -0.40 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1k2n h ALA 721 Cb 1.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1k2n h ALA 721 CO 0.66 -0.57 -0.01 0.93 0.00 0.00 0.00 179.25 180.26 1k2n h GLU 722 N 0.00 -0.03 0.09 0.00 5.08 -1.99 -1.44 114.58 116.29 1k2n h GLU 722 Ca 0.21 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1k2n h GLU 722 Cb 0.88 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1k2n h GLU 722 CO -0.00 0.27 -0.04 0.93 -1.00 0.00 0.00 179.01 179.17 1k2n h GLU 723 N -0.32 -0.11 -0.57 2.33 3.07 -1.70 -2.75 114.58 114.52 1k2n h GLU 723 Ca -0.00 0.01 0.11 0.00 -0.50 0.00 0.00 59.36 58.97 1k2n h GLU 723 Cb 0.31 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 1k2n h GLU 723 CO 0.00 0.10 0.39 -0.22 -1.40 0.00 0.00 179.01 177.88 1k2n h LYS 724 N -0.31 0.30 -0.40 2.33 3.64 -1.33 -0.53 116.57 120.27 1k2n h LYS 724 Ca -0.01 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1k2n h LYS 724 Cb 0.26 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1k2n h LYS 724 CO 0.02 0.20 -0.14 0.22 -2.27 0.00 0.00 179.45 177.48 1k2n h ASP 725 N 0.31 0.72 -0.57 4.20 3.58 -0.98 -0.71 116.42 122.97 1k2n h ASP 725 Ca 0.27 -0.22 -0.00 0.00 0.42 0.00 0.00 57.03 57.50 1k2n h ASP 725 Cb 0.64 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.46 1k2n h ASP 725 CO -0.06 0.87 0.35 -0.07 -2.88 0.00 0.00 179.24 177.45 1k2n h LEU 726 N 0.65 0.67 -0.39 2.28 3.38 -0.82 -2.46 115.31 118.63 1k2n h LEU 726 Ca 0.11 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1k2n h LEU 726 Cb 0.61 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1k2n h LEU 726 CO 0.04 0.52 -0.63 1.62 0.09 0.00 0.00 178.44 180.08 1k2n h VAL 727 N 0.77 1.21 -0.78 1.22 3.04 -1.40 -3.21 116.25 117.08 1k2n h VAL 727 Ca 0.21 -2.34 0.11 0.00 -1.01 0.00 0.00 66.70 63.66 1k2n h VAL 727 Cb -0.04 2.36 -0.05 0.00 -2.01 0.00 0.00 31.29 31.54 1k2n h VAL 727 CO -0.04 0.61 0.51 0.50 -1.01 0.00 0.00 177.57 178.15 1k2n h LYS 728 N 0.00 0.62 -0.97 4.17 1.63 -0.64 -0.11 116.57 121.28 1k2n h LYS 728 Ca -0.01 -0.04 -0.57 0.00 -0.85 0.00 0.00 60.65 59.19 1k2n h LYS 728 Cb 1.31 -0.14 -0.30 0.00 -0.60 0.00 0.00 32.23 32.50 1k2n h LYS 728 CO 0.08 0.41 0.69 1.63 -3.45 0.00 0.00 179.45 178.81 1k2n n LYS 729 N -4.51 2.42 0.00 1.90 5.02 -1.16 -5.10 118.16 116.74 1k2n n LYS 729 Ca 0.14 -3.14 0.15 0.00 -2.02 0.00 0.00 58.31 53.44 1k2n n LYS 729 Cb 0.39 -2.21 0.79 0.00 -0.02 0.00 0.00 35.03 33.98 1k2n n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77