#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2n n ASN 574 N 0.00 0.30 0.00 1.61 3.02 -1.26 -4.85 115.26 114.08 1k2n n ASN 574 Ca 0.00 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1k2n n ASN 574 Cb 0.00 -0.27 0.00 0.00 -0.61 0.00 0.00 39.78 38.90 1k2n n ASN 574 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k2n n GLY 575 N 1.46 0.25 3.70 7.41 0.00 -1.26 -5.09 105.19 111.67 1k2n n GLY 575 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 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 2.97 0.00 1.61 3.00 -1.26 -0.27 118.95 125.00 1k2n s ARG 576 Ca 0.00 -0.44 0.00 0.00 -1.00 0.00 0.00 55.73 54.29 1k2n s ARG 576 Cb 0.00 -2.79 0.00 0.00 0.00 0.00 0.00 34.95 32.16 1k2n s ARG 576 CO 0.00 0.69 0.00 0.34 0.00 0.00 0.00 175.30 176.33 1k2n n PHE 577 N 1.93 0.00 -4.97 5.12 -0.00 -0.95 -4.24 117.46 114.35 1k2n n PHE 577 Ca -0.18 0.00 -0.31 0.00 -0.00 0.00 0.00 57.45 56.97 1k2n n PHE 577 Cb 0.53 0.18 -0.14 0.00 -0.00 0.00 0.00 39.48 40.06 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 -5.48 2.32 -0.23 -2.13 2.96 -1.10 -1.46 118.68 113.56 1k2n s LEU 578 Ca 0.00 -0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 53.44 1k2n s LEU 578 Cb 0.00 -1.40 0.02 0.00 0.50 0.00 0.00 46.19 45.31 1k2n s LEU 578 CO 0.00 0.29 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.34 1k2n s THR 579 N -0.76 2.76 -0.38 3.68 2.01 0.12 0.15 115.64 123.22 1k2n s THR 579 Ca 0.12 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 61.11 1k2n s THR 579 Cb -0.10 -2.33 0.04 0.00 0.01 0.00 0.00 72.50 70.12 1k2n s THR 579 CO 0.02 0.32 0.20 -0.76 -0.69 0.00 0.00 174.62 173.71 1k2n s LEU 580 N 1.34 4.75 -0.37 4.42 1.43 0.43 0.13 118.68 130.80 1k2n s LEU 580 Ca 0.02 -1.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.02 1k2n s LEU 580 Cb -0.15 -2.00 0.11 0.00 0.03 0.00 0.00 46.19 44.18 1k2n s LEU 580 CO -0.06 -0.41 0.11 -1.59 0.23 0.00 0.00 176.35 174.63 1k2n s LYS 581 N 1.51 1.67 -0.84 1.70 -2.85 -0.39 0.17 119.74 120.71 1k2n s LYS 581 Ca 0.01 -1.89 -0.30 0.00 -1.00 0.00 0.00 55.97 52.79 1k2n s LYS 581 Cb -0.20 -3.34 -0.17 0.00 -2.06 0.00 0.00 37.83 32.06 1k2n s LYS 581 CO 0.05 -0.99 2.61 -2.30 0.10 0.00 0.00 175.35 174.82 1k2n n PRO 582 N 4.31 0.32 -1.78 1.78 -0.02 0.86 -2.60 135.00 137.87 1k2n n PRO 582 Ca 0.02 -0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.18 1k2n n PRO 582 Cb 0.41 -2.09 0.03 0.00 -0.02 0.00 0.00 33.50 31.84 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 9.97 3.29 0.60 2.45 2.34 -1.09 -2.01 118.68 134.23 1k2n s LEU 583 Ca 1.24 1.69 0.28 0.00 0.06 0.00 0.00 54.13 57.40 1k2n s LEU 583 Cb -0.93 -4.51 1.33 0.00 -0.56 0.00 0.00 46.19 41.52 1k2n s LEU 583 CO 0.42 -1.31 1.74 -0.65 -1.06 0.00 0.00 176.35 175.50 1k2n h PRO 584 N -0.22 0.00 0.00 1.48 0.11 -1.89 0.58 132.00 132.06 1k2n h PRO 584 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 1k2n h PRO 584 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1k2n h PRO 584 CO 0.57 0.00 -0.06 0.22 -0.21 0.00 0.00 178.00 178.52 1k2n h ASP 585 N 0.00 0.00 -2.97 -2.05 1.82 -1.91 -3.41 116.42 107.90 1k2n h ASP 585 Ca 0.25 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 56.35 1k2n h ASP 585 Cb 1.54 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.53 1k2n h ASP 585 CO -0.00 0.06 -0.28 -0.55 -1.61 0.00 0.00 179.24 176.85 1k2n s SER 586 N -6.57 6.41 0.21 2.28 0.15 0.20 -4.76 113.70 111.63 1k2n s SER 586 Ca -0.04 0.50 0.12 0.00 0.70 0.00 0.00 55.95 57.22 1k2n s SER 586 Cb 0.15 -2.05 0.64 0.00 -1.71 0.00 0.00 66.02 63.05 1k2n s SER 586 CO 0.62 -0.07 1.30 2.30 1.20 0.00 0.00 173.24 178.59 1k2n n ILE 587 N -0.63 1.13 -4.34 6.45 -5.35 -0.70 -4.41 119.36 111.50 1k2n n ILE 587 Ca -0.04 0.66 -0.34 0.00 -0.27 0.00 0.00 62.75 62.76 1k2n n ILE 587 Cb 0.54 -1.66 -0.11 0.00 -1.74 0.00 0.00 39.64 36.66 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 -3.24 4.06 -0.64 7.28 1.01 -1.26 -5.03 121.20 123.38 1k2n s ILE 588 Ca -0.01 -0.30 0.04 0.00 0.00 0.00 0.00 60.65 60.38 1k2n s ILE 588 Cb 0.03 -2.78 0.34 0.00 0.01 0.00 0.00 42.46 40.06 1k2n s ILE 588 CO 0.11 0.50 1.07 0.00 0.00 0.00 0.00 174.94 176.61 1k2n n GLN 589 N 3.40 3.54 -4.51 2.79 3.00 -1.25 -3.78 117.38 120.57 1k2n n GLN 589 Ca -0.17 -4.84 -0.24 0.00 -0.01 0.00 0.00 57.00 51.74 1k2n n GLN 589 Cb 0.52 -2.27 -0.11 0.00 0.00 0.00 0.00 30.24 28.39 1k2n n GLN 589 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1k2n s GLU 590 N -3.58 1.76 -0.10 -1.09 2.02 -0.85 -4.99 118.70 111.86 1k2n s GLU 590 Ca 0.48 -1.98 -0.00 0.00 0.02 0.00 0.00 54.97 53.49 1k2n s GLU 590 Cb 0.27 -1.18 0.02 0.00 0.10 0.00 0.00 34.13 33.34 1k2n s GLU 590 CO -0.14 -0.12 -0.07 -1.54 0.02 0.00 0.00 175.26 173.42 1k2n s SER 591 N -3.57 1.99 0.10 -0.19 1.04 -1.26 -0.10 113.70 111.71 1k2n s SER 591 Ca 0.35 -0.26 0.07 0.00 0.48 0.00 0.00 55.95 56.59 1k2n s SER 591 Cb 0.09 -0.76 -0.04 0.00 0.10 0.00 0.00 66.02 65.41 1k2n s SER 591 CO 0.16 -0.11 -0.10 -0.76 0.98 0.00 0.00 173.24 173.41 1k2n s LEU 592 N 1.60 3.03 -0.16 2.42 2.01 0.44 -4.94 118.68 123.09 1k2n s LEU 592 Ca 0.02 -0.37 0.00 0.00 0.01 0.00 0.00 54.13 53.79 1k2n s LEU 592 Cb -0.13 -1.82 0.03 0.00 0.01 0.00 0.00 46.19 44.28 1k2n s LEU 592 CO -0.06 0.19 -0.13 -1.61 1.01 0.00 0.00 176.35 175.75 1k2n s GLU 593 N -2.13 2.16 -0.42 1.70 2.02 -1.26 0.16 118.70 120.93 1k2n s GLU 593 Ca 0.21 -0.60 -0.29 0.00 0.02 0.00 0.00 54.97 54.32 1k2n s GLU 593 Cb -0.11 -2.13 0.01 0.00 0.10 0.00 0.00 34.13 31.99 1k2n s GLU 593 CO 0.13 -0.29 1.48 0.42 0.02 0.00 0.00 175.26 177.02 1k2n s ILE 594 N 1.49 3.81 -0.19 -1.63 1.01 0.41 -4.94 121.20 121.16 1k2n s ILE 594 Ca 0.04 0.81 -0.29 0.00 0.00 0.00 0.00 60.65 61.21 1k2n s ILE 594 Cb -0.14 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 1k2n s ILE 594 CO -0.10 -0.76 1.91 -1.10 0.00 0.00 0.00 174.94 174.89 1k2n s GLN 595 N 5.16 3.57 0.53 2.79 1.11 -1.26 -2.24 119.66 129.32 1k2n s GLN 595 Ca 0.63 1.92 0.38 0.00 0.01 0.00 0.00 55.36 58.30 1k2n s GLN 595 Cb -0.15 -4.19 1.55 0.00 -1.01 0.00 0.00 33.01 29.21 1k2n s GLN 595 CO 0.32 -1.58 1.75 -0.56 0.01 0.00 0.00 175.29 175.22 1k2n h GLN 596 N 12.44 0.04 0.00 2.91 -0.00 -0.88 1.43 115.11 131.04 1k2n h GLN 596 Ca -0.39 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.25 1k2n h GLN 596 Cb 1.20 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.48 28.67 1k2n h GLN 596 CO 0.98 0.02 -0.02 0.78 -0.00 0.00 0.00 178.83 180.60 1k2n h GLY 597 N 0.04 0.00 -7.83 0.06 0.00 -1.87 -3.41 103.07 90.05 1k2n h GLY 597 Ca 0.66 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.34 1k2n h GLY 597 CO -0.06 0.00 -0.50 0.14 0.00 0.00 0.00 176.54 176.13 1k2n s VAL 598 N -3.76 5.30 -0.04 4.60 1.01 0.49 -5.06 120.40 122.94 1k2n s VAL 598 Ca 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 1k2n s VAL 598 Cb 0.10 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.92 1k2n s VAL 598 CO 0.53 0.17 0.05 0.21 0.00 0.00 0.00 175.10 176.06 1k2n s ASN 599 N 1.75 0.99 0.43 3.32 2.47 -1.26 -3.97 114.94 118.66 1k2n s ASN 599 Ca 0.07 0.06 -0.03 0.00 0.42 0.00 0.00 52.86 53.38 1k2n s ASN 599 Cb -0.16 -0.16 -0.03 0.00 -1.45 0.00 0.00 41.25 39.44 1k2n s ASN 599 CO 0.11 -0.22 0.69 -2.16 -3.72 0.00 0.00 177.10 171.80 1k2n s PRO 600 N 1.95 3.50 -0.35 0.43 0.04 -1.26 -5.03 135.00 134.27 1k2n s PRO 600 Ca 0.02 -0.03 -0.20 0.00 0.04 0.00 0.00 61.00 60.84 1k2n s PRO 600 Cb -0.12 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.93 1k2n s PRO 600 CO -0.03 -0.07 0.62 0.12 0.04 0.00 0.00 177.00 177.67 1k2n s PHE 601 N -2.57 3.16 -0.00 0.56 5.36 0.29 -4.90 117.98 119.87 1k2n s PHE 601 Ca 0.44 0.33 -0.17 0.00 -0.96 0.00 0.00 56.93 56.57 1k2n s PHE 601 Cb -0.10 -3.10 -0.06 0.00 -0.34 0.00 0.00 43.02 39.42 1k2n s PHE 601 CO 0.41 -0.61 0.47 -0.06 -1.46 0.00 0.00 175.22 173.97 1k2n s PHE 602 N 2.66 3.71 0.03 10.12 0.08 -1.26 0.75 117.98 134.06 1k2n s PHE 602 Ca 0.23 1.05 0.07 0.00 0.12 0.00 0.00 56.93 58.40 1k2n s PHE 602 Cb -0.15 -2.40 -0.02 0.00 -0.57 0.00 0.00 43.02 39.88 1k2n s PHE 602 CO 0.14 0.54 -0.20 0.42 -0.10 0.00 0.00 175.22 176.03 1k2n s ILE 603 N -0.76 1.56 -4.41 0.64 1.09 0.71 0.17 121.20 120.21 1k2n s ILE 603 Ca 0.26 -1.06 0.00 0.00 -1.10 0.00 0.00 60.65 58.74 1k2n s ILE 603 Cb -0.17 -1.34 0.00 0.00 -1.06 0.00 0.00 42.46 39.88 1k2n s ILE 603 CO 0.14 0.25 0.00 0.61 -0.10 0.00 0.00 174.94 175.85 1k2n n GLY 604 N 2.08 -0.81 0.07 6.18 0.00 -1.14 -2.65 105.19 108.92 1k2n n GLY 604 Ca -0.17 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.63 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 0.00 -0.02 -6.57 1.61 3.08 0.84 0.84 114.38 114.16 1k2n h ARG 605 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 1k2n h ARG 605 Cb 0.00 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.10 1k2n h ARG 605 CO 0.00 0.74 1.07 0.45 -1.07 0.00 0.00 179.97 181.17 1k2n s SER 606 N -5.99 6.41 0.65 7.04 0.15 -1.10 -4.55 113.70 116.31 1k2n s SER 606 Ca -0.16 2.80 0.31 0.00 0.70 0.00 0.00 55.95 59.59 1k2n s SER 606 Cb -0.01 -2.58 1.66 0.00 -1.71 0.00 0.00 66.02 63.38 1k2n s SER 606 CO 0.62 -0.99 1.93 -0.33 1.20 0.00 0.00 173.24 175.67 1k2n h GLU 607 N 7.93 0.00 -0.43 5.44 5.08 -1.90 0.45 114.58 131.15 1k2n h GLU 607 Ca -0.45 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.03 1k2n h GLU 607 Cb 1.21 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1k2n h GLU 607 CO 0.95 0.00 0.30 -0.44 -1.00 0.00 0.00 179.01 178.83 1k2n h ASP 608 N 0.00 0.03 -3.20 1.42 5.19 -1.92 -3.41 116.42 114.54 1k2n h ASP 608 Ca 0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 1k2n h ASP 608 Cb 0.60 -0.01 0.02 0.00 0.18 0.00 0.00 39.33 40.13 1k2n h ASP 608 CO 0.00 0.02 0.65 0.00 -3.12 0.00 0.00 179.24 176.79 1k2n h ASN 610 N 6.23 0.00 -3.59 0.00 2.35 -0.61 -3.36 115.58 116.60 1k2n h ASN 610 Ca -0.43 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 54.65 1k2n h ASN 610 Cb 1.21 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.38 1k2n h ASN 610 CO 0.82 0.00 -0.70 0.00 -1.65 0.00 0.00 177.43 175.89 1k2n s LYS 612 N -0.46 2.52 -0.17 0.00 2.36 -1.26 -2.89 119.74 119.84 1k2n s LYS 612 Ca 0.07 -1.48 -0.05 0.00 -2.55 0.00 0.00 55.97 51.96 1k2n s LYS 612 Cb -0.12 -3.70 0.06 0.00 -1.05 0.00 0.00 37.83 33.02 1k2n s LYS 612 CO 0.02 -0.94 0.09 0.42 1.55 0.00 0.00 175.35 176.49 1k2n s ILE 613 N 1.38 -0.04 -0.41 5.43 -1.09 0.29 -4.96 121.20 121.81 1k2n s ILE 613 Ca 0.03 -0.21 -0.11 0.00 -2.23 0.00 0.00 60.65 58.14 1k2n s ILE 613 Cb -0.23 -0.62 0.06 0.00 -1.58 0.00 0.00 42.46 40.09 1k2n s ILE 613 CO 0.01 -0.28 0.25 -1.61 -1.23 0.00 0.00 174.94 172.08 1k2n s GLU 614 N 2.11 2.74 -0.24 2.79 2.02 -1.26 -0.90 118.70 125.96 1k2n s GLU 614 Ca 0.02 -1.29 -0.00 0.00 0.02 0.00 0.00 54.97 53.72 1k2n s GLU 614 Cb -0.16 -3.80 0.07 0.00 0.10 0.00 0.00 34.13 30.34 1k2n s GLU 614 CO -0.09 -0.85 0.01 0.34 0.02 0.00 0.00 175.26 174.68 1k2n s ASP 615 N 1.93 3.67 0.58 -0.19 2.15 -1.26 -5.00 116.67 118.55 1k2n s ASP 615 Ca 0.02 -1.23 0.38 0.00 0.43 0.00 0.00 52.55 52.16 1k2n s ASP 615 Cb -0.22 -0.97 1.30 0.00 -0.30 0.00 0.00 42.92 42.74 1k2n s ASP 615 CO 0.05 -0.30 1.42 -0.46 -0.17 0.00 0.00 175.17 175.70 1k2n n ASN 616 N 4.79 0.00 -0.02 -0.34 6.94 -1.26 0.52 115.26 125.90 1k2n n ASN 616 Ca -0.08 0.87 -0.17 0.00 -0.02 0.00 0.00 54.58 55.18 1k2n n ASN 616 Cb 0.44 -0.37 -0.07 0.00 -2.36 0.00 0.00 39.78 37.42 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 0.79 -6.81 -3.83 3.08 -2.02 -3.45 114.38 102.14 1k2n h ARG 617 Ca 0.71 -0.65 -0.49 0.00 0.07 0.00 0.00 59.98 59.62 1k2n h ARG 617 Cb 3.34 0.14 0.02 0.00 0.08 0.00 0.00 29.97 33.55 1k2n h ARG 617 CO -0.01 1.25 0.04 -0.48 -1.07 0.00 0.00 179.97 179.70 1k2n s LEU 618 N -8.40 3.76 0.85 3.04 0.05 0.19 -4.58 118.68 113.60 1k2n s LEU 618 Ca -0.10 0.86 -0.12 0.00 0.05 0.00 0.00 54.13 54.82 1k2n s LEU 618 Cb 0.09 -3.77 0.10 0.00 -2.05 0.00 0.00 46.19 40.56 1k2n s LEU 618 CO 0.91 -0.47 1.14 -0.44 -0.55 0.00 0.00 176.35 176.94 1k2n s SER 619 N -3.87 4.04 0.41 1.48 0.01 -1.26 -4.72 113.70 109.80 1k2n s SER 619 Ca 0.46 0.96 0.18 0.00 1.31 0.00 0.00 55.95 58.86 1k2n s SER 619 Cb -0.10 -1.54 1.09 0.00 0.21 0.00 0.00 66.02 65.68 1k2n s SER 619 CO 0.40 -2.21 1.83 0.03 0.41 0.00 0.00 173.24 173.70 1k2n h ARG 620 N -1.27 0.39 -2.15 12.44 -0.00 -1.95 -2.37 114.38 119.47 1k2n h ARG 620 Ca -0.48 -0.02 -0.56 0.00 -0.50 0.00 0.00 59.98 58.41 1k2n h ARG 620 Cb 1.32 -0.09 -0.41 0.00 0.00 0.00 0.00 29.97 30.79 1k2n h ARG 620 CO 0.63 0.26 -0.83 0.28 0.00 0.00 0.00 179.97 180.31 1k2n n VAL 621 N -4.53 1.59 -0.34 2.04 0.31 -1.26 -0.94 118.33 115.19 1k2n n VAL 621 Ca 0.21 -5.03 0.18 0.00 -0.01 0.00 0.00 64.34 59.69 1k2n n VAL 621 Cb 0.75 -1.39 0.39 0.00 -0.91 0.00 0.00 33.84 32.69 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 3.43 0.95 -1.95 3.52 2.76 -1.20 -3.35 115.15 119.31 1k2n h HIS 622 Ca 0.13 0.04 0.12 0.00 -2.20 0.00 0.00 60.37 58.46 1k2n h HIS 622 Cb 0.71 -0.26 -0.18 0.00 1.55 0.00 0.00 27.41 29.22 1k2n h HIS 622 CO 0.65 0.01 0.55 0.00 -1.30 0.00 0.00 177.93 177.84 1k2n s PHE 624 N -2.37 0.07 -0.15 0.00 -0.12 0.36 -0.21 117.98 115.56 1k2n s PHE 624 Ca 0.03 -0.16 -0.07 0.00 -0.05 0.00 0.00 56.93 56.68 1k2n s PHE 624 Cb -0.01 -0.07 -0.04 0.00 -0.63 0.00 0.00 43.02 42.27 1k2n s PHE 624 CO -0.05 -0.23 0.09 0.42 -0.05 0.00 0.00 175.22 175.40 1k2n s ILE 625 N -1.19 5.10 -0.05 -4.49 1.01 0.23 0.20 121.20 122.00 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 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1k2n s ILE 625 CO 0.01 0.54 -0.16 0.12 0.00 0.00 0.00 174.94 175.45 1k2n s PHE 626 N -0.35 1.62 -0.13 3.97 5.36 0.54 0.10 117.98 129.10 1k2n s PHE 626 Ca 0.10 -0.50 -0.11 0.00 -0.96 0.00 0.00 56.93 55.47 1k2n s PHE 626 Cb -0.12 -1.11 -0.05 0.00 -0.34 0.00 0.00 43.02 41.40 1k2n s PHE 626 CO 0.01 -0.19 0.21 0.21 -1.46 0.00 0.00 175.22 174.01 1k2n s LYS 627 N 0.18 3.90 0.09 10.12 2.20 -1.26 0.19 119.74 135.17 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 -0.12 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.85 1k2n s LYS 627 CO 0.03 0.51 -0.07 0.21 -0.36 0.00 0.00 175.35 175.67 1k2n s LYS 628 N -0.31 0.79 -0.30 4.03 2.36 0.20 -4.93 119.74 121.58 1k2n s LYS 628 Ca 0.15 -1.24 -0.29 0.00 -2.55 0.00 0.00 55.97 52.04 1k2n s LYS 628 Cb -0.13 -0.23 0.01 0.00 -1.05 0.00 0.00 37.83 36.43 1k2n s LYS 628 CO 0.04 -0.00 1.21 0.50 1.55 0.00 0.00 175.35 178.65 1k2n s ARG 629 N -3.44 4.00 0.02 4.03 6.06 -1.26 0.16 118.95 128.52 1k2n s ARG 629 Ca 0.08 1.21 -0.30 0.00 -2.50 0.00 0.00 55.73 54.22 1k2n s ARG 629 Cb 0.03 -3.82 -0.05 0.00 0.06 0.00 0.00 34.95 31.17 1k2n s ARG 629 CO -0.04 -1.00 1.20 -1.58 -2.50 0.00 0.00 175.30 171.38 1k2n s HIS 630 N 4.02 3.33 0.06 5.12 5.65 0.44 -4.86 115.29 129.06 1k2n s HIS 630 Ca 0.52 1.26 0.02 0.00 0.25 0.00 0.00 55.06 57.11 1k2n s HIS 630 Cb -0.15 -3.42 -0.03 0.00 -1.18 0.00 0.00 32.58 27.80 1k2n s HIS 630 CO 0.20 -1.30 -0.08 0.00 -0.65 0.00 0.00 174.74 172.91 1k2n s ALA 631 N 1.51 0.73 0.19 1.58 0.00 -1.26 -2.58 121.76 121.93 1k2n s ALA 631 Ca 0.58 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.63 1k2n s ALA 631 Cb -0.28 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.88 1k2n s ALA 631 CO 0.27 -0.09 -0.13 0.54 0.00 0.00 0.00 175.76 176.34 1k2n s VAL 632 N -2.14 1.60 0.00 0.00 0.11 -1.26 -5.09 120.40 113.62 1k2n s VAL 632 Ca -0.02 -2.18 0.00 0.00 -2.93 0.00 0.00 61.98 56.85 1k2n s VAL 632 Cb -0.05 -2.00 0.00 0.00 -1.53 0.00 0.00 36.38 32.80 1k2n s VAL 632 CO -0.01 -0.63 0.92 0.61 -3.33 0.00 0.00 175.10 172.65 1k2n n GLY 633 N -0.34 -2.65 3.11 6.54 0.00 -1.26 -4.86 105.19 105.74 1k2n n GLY 633 Ca -0.08 0.11 0.05 0.00 0.00 0.00 0.00 46.02 46.09 1k2n n GLY 633 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k2n s LYS 634 N -2.66 0.27 0.67 1.61 1.02 -1.26 -5.16 119.74 114.22 1k2n s LYS 634 Ca 0.00 0.19 -0.16 0.00 0.02 0.00 0.00 55.97 56.02 1k2n s LYS 634 Cb 0.00 0.10 0.01 0.00 -0.52 0.00 0.00 37.83 37.42 1k2n s LYS 634 CO 0.00 -0.48 1.15 -1.12 -0.92 0.00 0.00 175.35 173.98 1k2n s SER 635 N 2.77 4.87 0.01 2.83 0.01 -1.26 -5.05 113.70 117.88 1k2n s SER 635 Ca 0.22 2.16 0.03 0.00 1.31 0.00 0.00 55.95 59.66 1k2n s SER 635 Cb -0.03 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 1k2n s SER 635 CO -0.22 -1.80 -0.09 -0.04 0.41 0.00 0.00 173.24 171.50 1k2n s MET 636 N -3.91 0.65 0.00 12.44 1.00 -1.26 -4.91 119.30 123.31 1k2n s MET 636 Ca 0.71 -0.45 0.00 0.00 0.00 0.00 0.00 55.69 55.95 1k2n s MET 636 Cb -0.24 -0.60 0.00 0.00 0.00 0.00 0.00 34.83 33.99 1k2n s MET 636 CO 0.41 0.15 0.00 0.98 0.00 0.00 0.00 175.02 176.56 1k2n n TYR 637 N 2.45 0.00 -2.93 -0.03 9.36 -1.26 -4.83 117.16 119.92 1k2n n TYR 637 Ca -0.16 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.68 1k2n n TYR 637 Cb 0.56 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 39.21 1k2n n TYR 637 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1k2n s GLU 638 N 0.00 4.54 -0.44 2.98 2.02 -1.26 -5.04 118.70 121.49 1k2n s GLU 638 Ca 0.00 1.18 -0.13 0.00 0.02 0.00 0.00 54.97 56.04 1k2n s GLU 638 Cb 0.00 -3.05 0.07 0.00 0.10 0.00 0.00 34.13 31.25 1k2n s GLU 638 CO 0.00 0.45 0.33 -1.12 0.02 0.00 0.00 175.26 174.93 1k2n s SER 639 N -1.40 5.93 0.10 -0.19 0.01 -1.26 -4.88 113.70 112.02 1k2n s SER 639 Ca 0.42 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 56.34 1k2n s SER 639 Cb -0.21 -2.10 0.00 0.00 0.21 0.00 0.00 66.02 63.92 1k2n s SER 639 CO 0.25 -0.58 0.00 -0.81 0.41 0.00 0.00 173.24 172.51 1k2n n PRO 640 N 5.08 1.18 0.00 12.44 -0.04 -1.26 -4.93 135.00 147.48 1k2n n PRO 640 Ca -0.11 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.46 1k2n n PRO 640 Cb 0.44 0.00 0.61 0.00 -0.04 0.00 0.00 33.50 34.51 1k2n n PRO 640 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k2n n ALA 641 N -3.00 2.23 0.00 0.55 0.00 -1.26 -4.91 120.51 114.12 1k2n n ALA 641 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1k2n n ALA 641 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.08 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 -1.20 0.00 -2.80 0.00 6.02 -1.26 -4.23 117.38 113.91 1k2n n GLN 642 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 1k2n n GLN 642 Cb 0.15 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.42 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 0.00 -1.58 0.00 1.08 0.00 -1.26 -4.33 107.32 101.23 1k2n s GLY 643 Ca 0.00 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.61 1k2n s GLY 643 CO 0.00 4.19 0.00 1.04 0.00 0.00 0.00 173.10 178.33 1k2n n LEU 644 N 3.48 0.00 -4.46 0.66 4.77 -1.06 -4.81 117.00 115.57 1k2n n LEU 644 Ca 0.08 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.76 1k2n n LEU 644 Cb 0.62 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.59 1k2n n LEU 644 CO -0.09 0.00 -0.50 -1.81 -1.33 0.00 0.00 177.39 173.66 1k2n s ASP 645 N -0.63 3.80 0.04 -1.43 1.01 -1.25 0.17 116.67 118.37 1k2n s ASP 645 Ca 0.00 -0.50 0.03 0.00 0.71 0.00 0.00 52.55 52.79 1k2n s ASP 645 Cb 0.00 -0.56 -0.02 0.00 1.01 0.00 0.00 42.92 43.35 1k2n s ASP 645 CO 0.00 0.22 -0.10 -1.81 0.21 0.00 0.00 175.17 173.69 1k2n s ASP 646 N -1.76 1.17 -0.20 0.27 1.11 0.43 -3.93 116.67 113.76 1k2n s ASP 646 Ca 0.16 -0.45 -0.13 0.00 0.18 0.00 0.00 52.55 52.30 1k2n s ASP 646 Cb -0.10 -0.04 -0.04 0.00 1.07 0.00 0.00 42.92 43.80 1k2n s ASP 646 CO 0.07 -0.07 0.29 0.27 1.18 0.00 0.00 175.17 176.91 1k2n s ILE 647 N -0.99 5.29 -0.13 0.77 -4.36 -1.26 0.59 121.20 121.10 1k2n s ILE 647 Ca -0.03 0.49 -0.02 0.00 -0.26 0.00 0.00 60.65 60.83 1k2n s ILE 647 Cb -0.08 -3.62 -0.02 0.00 1.25 0.00 0.00 42.46 39.98 1k2n s ILE 647 CO 0.01 0.33 -0.07 0.26 0.24 0.00 0.00 174.94 175.71 1k2n s TRP 648 N 0.94 2.95 -0.30 1.37 0.52 0.51 -1.41 118.94 123.51 1k2n s TRP 648 Ca 0.15 -0.34 -0.18 0.00 0.02 0.00 0.00 56.10 55.74 1k2n s TRP 648 Cb -0.14 -1.88 -0.02 0.00 -1.15 0.00 0.00 33.47 30.28 1k2n s TRP 648 CO 0.05 -0.02 0.53 -0.47 0.02 0.00 0.00 176.95 177.07 1k2n s TYR 649 N 0.16 3.22 -0.12 -1.98 6.14 0.39 0.20 117.35 125.36 1k2n s TYR 649 Ca -0.03 0.46 -0.05 0.00 0.64 0.00 0.00 57.07 58.09 1k2n s TYR 649 Cb -0.14 -2.85 -0.04 0.00 0.42 0.00 0.00 41.96 39.35 1k2n s TYR 649 CO 0.03 -0.41 0.05 0.00 0.64 0.00 0.00 175.55 175.86 1k2n s HIS 651 N -0.57 2.72 -0.03 0.00 2.46 -0.39 0.13 115.29 119.61 1k2n s HIS 651 Ca 0.11 -0.70 0.04 0.00 0.47 0.00 0.00 55.06 54.98 1k2n s HIS 651 Cb -0.12 -1.78 0.07 0.00 -0.13 0.00 0.00 32.58 30.62 1k2n s HIS 651 CO 0.02 -0.22 0.91 0.25 -2.47 0.00 0.00 174.74 173.23 1k2n n THR 652 N 3.37 0.62 -2.89 0.89 -2.24 0.85 0.50 114.28 115.37 1k2n n THR 652 Ca -0.18 -0.70 -0.31 0.00 -2.27 0.00 0.00 64.05 60.58 1k2n n THR 652 Cb 0.53 0.45 -0.04 0.00 -2.10 0.00 0.00 70.33 69.17 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 -1.19 2.06 0.21 3.38 0.00 0.77 -4.68 107.32 107.88 1k2n s GLY 653 Ca 0.07 -0.10 0.14 0.00 0.00 0.00 0.00 44.72 44.84 1k2n s GLY 653 CO 0.01 0.10 1.29 -0.84 0.00 0.00 0.00 173.10 173.66 1k2n h THR 654 N 1.32 0.89 -0.02 0.90 2.02 -1.89 -3.21 112.91 112.92 1k2n h THR 654 Ca -0.47 -2.32 0.00 0.00 0.77 0.00 0.00 66.41 64.38 1k2n h THR 654 Cb 1.18 2.40 0.00 0.00 -1.74 0.00 0.00 68.15 69.99 1k2n h THR 654 CO 0.64 0.51 0.00 0.59 0.37 0.00 0.00 175.52 177.63 1k2n n ASN 655 N -3.17 0.30 -1.59 4.18 3.02 -1.26 -4.89 115.26 111.85 1k2n n ASN 655 Ca -0.01 -1.40 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 1k2n n ASN 655 Cb 0.78 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.94 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 -0.62 -3.34 -3.74 2.41 3.14 -1.22 -4.85 118.33 110.10 1k2n n VAL 656 Ca 0.16 1.54 -0.21 0.00 -2.96 0.00 0.00 64.34 62.87 1k2n n VAL 656 Cb 0.12 -2.05 -0.03 0.00 -1.06 0.00 0.00 33.84 30.81 1k2n n VAL 656 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1k2n s SER 657 N -2.44 5.24 -0.12 6.55 0.01 0.21 -4.62 113.70 118.52 1k2n s SER 657 Ca 0.00 -0.55 -0.00 0.00 1.31 0.00 0.00 55.95 56.71 1k2n s SER 657 Cb 0.00 -0.88 0.02 0.00 0.21 0.00 0.00 66.02 65.38 1k2n s SER 657 CO 0.00 -0.43 -0.10 -0.31 0.41 0.00 0.00 173.24 172.81 1k2n s TYR 658 N -2.34 1.72 -0.53 2.43 1.51 0.49 0.15 117.35 120.78 1k2n s TYR 658 Ca 0.43 -0.90 -0.14 0.00 -1.01 0.00 0.00 57.07 55.45 1k2n s TYR 658 Cb -0.05 -1.36 0.13 0.00 -0.11 0.00 0.00 41.96 40.57 1k2n s TYR 658 CO 0.27 -0.56 0.47 -1.17 -1.11 0.00 0.00 175.55 173.44 1k2n s LEU 659 N 1.60 6.06 0.00 -1.29 2.96 0.58 0.25 118.68 128.84 1k2n s LEU 659 Ca 0.04 -1.87 0.00 0.00 -0.22 0.00 0.00 54.13 52.08 1k2n s LEU 659 Cb -0.13 -2.15 0.00 0.00 0.50 0.00 0.00 46.19 44.41 1k2n s LEU 659 CO -0.09 -0.80 0.00 0.59 -1.32 0.00 0.00 176.35 174.74 1k2n n ASN 660 N 5.09 0.00 0.00 3.68 4.13 -1.00 -0.06 115.26 127.09 1k2n n ASN 660 Ca -0.11 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.15 1k2n n ASN 660 Cb 0.40 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.64 1k2n n ASN 660 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1k2n n ASN 661 N 1.37 0.60 -4.60 6.41 5.15 -1.26 -5.06 115.26 117.87 1k2n n ASN 661 Ca 0.00 -1.14 -0.34 0.00 -0.60 0.00 0.00 54.58 52.49 1k2n n ASN 661 Cb 0.00 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.14 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 -0.14 4.86 0.30 1.20 0.01 0.91 -5.10 114.94 116.97 1k2n s ASN 662 Ca 0.00 0.01 -0.28 0.00 -0.71 0.00 0.00 52.86 51.88 1k2n s ASN 662 Cb 0.00 -1.38 -0.09 0.00 0.41 0.00 0.00 41.25 40.18 1k2n s ASN 662 CO 0.00 0.33 1.06 -0.60 -1.51 0.00 0.00 177.10 176.38 1k2n s ARG 663 N -0.60 4.59 -0.56 -0.60 3.52 -1.26 -0.31 118.95 123.72 1k2n s ARG 663 Ca 0.09 1.67 0.04 0.00 -0.13 0.00 0.00 55.73 57.41 1k2n s ARG 663 Cb -0.12 -3.07 0.14 0.00 -1.56 0.00 0.00 34.95 30.35 1k2n s ARG 663 CO 0.02 0.20 0.32 -1.64 -0.81 0.00 0.00 175.30 173.39 1k2n s MET 664 N -1.62 2.10 0.41 5.12 -1.94 0.39 -4.85 119.30 118.90 1k2n s MET 664 Ca 0.47 -2.79 -0.08 0.00 -1.71 0.00 0.00 55.69 51.58 1k2n s MET 664 Cb -0.28 -3.35 -0.05 0.00 2.01 0.00 0.00 34.83 33.15 1k2n s MET 664 CO 0.36 -1.15 0.74 0.96 -0.01 0.00 0.00 175.02 175.92 1k2n s ILE 665 N -0.55 4.86 -0.85 2.53 -4.36 -1.26 0.63 121.20 122.19 1k2n s ILE 665 Ca 0.19 0.42 -0.21 0.00 -0.26 0.00 0.00 60.65 60.78 1k2n s ILE 665 Cb -0.21 -3.77 -0.21 0.00 1.25 0.00 0.00 42.46 39.52 1k2n s ILE 665 CO -0.04 -0.57 2.39 1.67 0.24 0.00 0.00 174.94 178.63 1k2n n GLN 666 N -1.49 0.33 0.00 0.37 7.27 -1.21 -1.64 117.38 121.02 1k2n n GLN 666 Ca 0.01 -0.23 0.00 0.00 0.07 0.00 0.00 57.00 56.85 1k2n n GLN 666 Cb 0.54 -2.27 0.00 0.00 2.41 0.00 0.00 30.24 30.92 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 6.17 0.98 3.35 1.69 0.00 0.18 -4.93 105.19 112.63 1k2n n GLY 667 Ca 0.56 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.40 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 -1.69 1.51 0.00 2.61 -4.23 -0.65 -0.44 115.64 112.74 1k2n s THR 668 Ca 0.00 -2.14 0.01 0.00 -1.18 0.00 0.00 61.69 58.38 1k2n s THR 668 Cb 0.00 -2.17 -0.01 0.00 1.34 0.00 0.00 72.50 71.67 1k2n s THR 668 CO 0.00 -0.50 -0.03 -0.75 -0.54 0.00 0.00 174.62 172.80 1k2n s LYS 669 N -3.72 0.27 -0.05 3.99 2.20 0.35 -1.26 119.74 121.51 1k2n s LYS 669 Ca 0.24 -0.20 -0.11 0.00 -0.36 0.00 0.00 55.97 55.54 1k2n s LYS 669 Cb 0.02 -0.21 0.02 0.00 -1.51 0.00 0.00 37.83 36.15 1k2n s LYS 669 CO 0.07 0.05 0.26 0.12 -0.36 0.00 0.00 175.35 175.49 1k2n s PHE 670 N -0.30 -0.20 0.34 4.03 5.36 -0.00 0.10 117.98 127.31 1k2n s PHE 670 Ca -0.01 0.42 -0.28 0.00 -0.96 0.00 0.00 56.93 56.09 1k2n s PHE 670 Cb -0.03 0.07 -0.10 0.00 -0.34 0.00 0.00 43.02 42.63 1k2n s PHE 670 CO -0.00 -0.25 1.25 -1.17 -1.46 0.00 0.00 175.22 173.60 1k2n s LEU 671 N -0.60 4.41 -0.19 6.12 1.98 -1.26 0.15 118.68 129.29 1k2n s LEU 671 Ca -0.07 2.57 -0.03 0.00 -2.89 0.00 0.00 54.13 53.72 1k2n s LEU 671 Cb -0.04 -3.71 -0.01 0.00 0.66 0.00 0.00 46.19 43.09 1k2n s LEU 671 CO 0.02 -0.50 -0.07 -0.76 -1.89 0.00 0.00 176.35 173.15 1k2n s LEU 672 N -1.86 2.89 0.29 -0.68 1.43 -0.50 -4.82 118.68 115.44 1k2n s LEU 672 Ca 0.50 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 53.34 1k2n s LEU 672 Cb -0.37 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 1k2n s LEU 672 CO 0.49 0.06 0.12 -1.10 0.23 0.00 0.00 176.35 176.14 1k2n s GLN 673 N 1.02 2.53 -0.51 1.70 -0.21 -0.32 -4.20 119.66 119.66 1k2n s GLN 673 Ca 0.00 -1.34 -0.26 0.00 0.02 0.00 0.00 55.36 53.78 1k2n s GLN 673 Cb -0.15 -2.31 -0.08 0.00 1.00 0.00 0.00 33.01 31.48 1k2n s GLN 673 CO -0.00 0.28 2.43 -3.47 -2.12 0.00 0.00 175.29 172.41 1k2n n ASP 674 N -1.09 2.24 0.00 5.90 2.03 -1.26 -0.82 116.55 123.55 1k2n n ASP 674 Ca -0.05 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.76 1k2n n ASP 674 Cb 0.59 -1.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.43 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 6.03 1.97 3.59 0.27 0.00 0.49 -4.86 105.19 112.69 1k2n n GLY 675 Ca 0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 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 6.58 -0.45 1.61 2.15 0.00 -4.73 116.67 119.84 1k2n s ASP 676 Ca 0.00 0.40 -0.18 0.00 0.43 0.00 0.00 52.55 53.20 1k2n s ASP 676 Cb 0.00 -2.41 0.03 0.00 -0.30 0.00 0.00 42.92 40.24 1k2n s ASP 676 CO 0.00 -0.77 0.49 -1.61 -0.17 0.00 0.00 175.17 173.11 1k2n s GLU 677 N 3.21 3.10 -0.24 4.34 8.01 -1.26 0.10 118.70 135.96 1k2n s GLU 677 Ca 0.33 -0.81 -0.07 0.00 0.01 0.00 0.00 54.97 54.43 1k2n s GLU 677 Cb -0.13 -4.01 -0.03 0.00 -4.31 0.00 0.00 34.13 25.65 1k2n s GLU 677 CO 0.18 -0.96 0.07 0.42 0.01 0.00 0.00 175.26 174.98 1k2n s ILE 678 N 2.25 4.39 -0.34 -1.63 1.01 0.08 -2.38 121.20 124.58 1k2n s ILE 678 Ca 0.13 -0.15 -0.27 0.00 0.00 0.00 0.00 60.65 60.36 1k2n s ILE 678 Cb -0.18 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 39.25 1k2n s ILE 678 CO 0.13 0.34 0.99 -0.54 0.00 0.00 0.00 174.94 175.86 1k2n s LYS 679 N 1.51 3.96 0.09 2.79 1.02 0.69 -0.98 119.74 128.82 1k2n s LYS 679 Ca 0.06 0.81 -0.12 0.00 0.02 0.00 0.00 55.97 56.75 1k2n s LYS 679 Cb -0.15 -3.77 -0.19 0.00 -0.52 0.00 0.00 37.83 33.21 1k2n s LYS 679 CO 0.04 -0.91 1.24 0.82 -0.92 0.00 0.00 175.35 175.61 1k2n h ILE 680 N 5.77 1.30 -2.33 2.17 2.04 -1.78 1.44 117.51 126.12 1k2n h ILE 680 Ca -0.22 -2.23 -0.05 0.00 1.00 0.00 0.00 64.86 63.35 1k2n h ILE 680 Cb 1.07 2.31 -0.24 0.00 -0.74 0.00 0.00 36.82 39.23 1k2n h ILE 680 CO 1.00 0.69 -0.13 -0.51 0.00 0.00 0.00 178.15 179.20 1k2n s ILE 681 N -3.39 -0.01 -0.06 -0.67 2.07 -1.25 -4.01 121.20 113.88 1k2n s ILE 681 Ca -0.09 0.04 -0.01 0.00 -1.41 0.00 0.00 60.65 59.18 1k2n s ILE 681 Cb 0.08 -0.80 0.03 0.00 0.13 0.00 0.00 42.46 41.89 1k2n s ILE 681 CO 0.91 0.02 0.01 0.86 -1.91 0.00 0.00 174.94 174.82 1k2n s TRP 682 N 1.34 0.52 -0.16 3.50 -0.00 -1.24 0.77 118.94 123.66 1k2n s TRP 682 Ca -0.08 -0.07 -0.00 0.00 -0.00 0.00 0.00 56.10 55.95 1k2n s TRP 682 Cb -0.06 -0.69 0.04 0.00 -0.00 0.00 0.00 33.47 32.75 1k2n s TRP 682 CO -0.14 -0.27 -0.09 0.34 -0.00 0.00 0.00 176.95 176.79 1k2n s ASP 683 N 1.87 2.83 0.06 5.86 2.15 0.18 -4.97 116.67 124.65 1k2n s ASP 683 Ca 0.03 -0.62 -0.20 0.00 0.43 0.00 0.00 52.55 52.19 1k2n s ASP 683 Cb -0.12 -1.03 -0.11 0.00 -0.30 0.00 0.00 42.92 41.35 1k2n s ASP 683 CO -0.04 -0.14 1.45 0.11 -0.17 0.00 0.00 175.17 176.38 1k2n h LYS 684 N 8.08 0.36 -0.60 4.34 1.57 -1.94 0.93 116.57 129.31 1k2n h LYS 684 Ca -0.29 -0.14 -0.09 0.00 -1.87 0.00 0.00 60.65 58.26 1k2n h LYS 684 Cb 1.12 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1k2n h LYS 684 CO 0.44 0.62 0.02 -0.91 -0.57 0.00 0.00 179.45 179.05 1k2n h ASN 685 N 0.08 1.03 0.26 0.86 4.21 -1.98 -3.01 115.58 117.03 1k2n h ASN 685 Ca 0.05 -0.30 0.00 0.00 1.21 0.00 0.00 56.30 57.26 1k2n h ASN 685 Cb 0.49 -0.28 0.00 0.00 -1.12 0.00 0.00 38.32 37.41 1k2n h ASN 685 CO 0.02 1.08 -0.59 0.59 -1.29 0.00 0.00 177.43 177.24 1k2n n ASN 686 N -4.21 0.91 -0.94 5.81 4.13 -1.22 -4.94 115.26 114.80 1k2n n ASN 686 Ca 0.03 -0.72 -0.12 0.00 1.68 0.00 0.00 54.58 55.45 1k2n n ASN 686 Cb 0.34 0.46 -0.05 0.00 -1.54 0.00 0.00 39.78 38.98 1k2n n ASN 686 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1k2n n LYS 687 N -1.17 -1.48 -2.43 3.52 5.02 0.32 -4.90 118.16 117.03 1k2n n LYS 687 Ca 0.07 0.92 -0.42 0.00 -2.02 0.00 0.00 58.31 56.86 1k2n n LYS 687 Cb 0.35 -5.23 -0.03 0.00 -0.02 0.00 0.00 35.03 30.10 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 -2.14 2.35 -0.15 2.13 5.36 -0.78 -4.84 117.98 119.92 1k2n s PHE 688 Ca 0.00 0.46 0.02 0.00 -0.96 0.00 0.00 56.93 56.45 1k2n s PHE 688 Cb 0.00 -4.42 0.01 0.00 -0.34 0.00 0.00 43.02 38.27 1k2n s PHE 688 CO 0.00 -1.90 -0.21 0.54 -1.46 0.00 0.00 175.22 172.19 1k2n s VAL 689 N 5.80 2.13 0.14 3.12 0.11 -1.26 0.50 120.40 130.94 1k2n s VAL 689 Ca 0.51 -0.95 0.07 0.00 -2.93 0.00 0.00 61.98 58.67 1k2n s VAL 689 Cb -0.10 -1.86 -0.04 0.00 -1.53 0.00 0.00 36.38 32.85 1k2n s VAL 689 CO 0.25 0.54 -0.15 -0.63 -3.33 0.00 0.00 175.10 171.79 1k2n s ILE 690 N 0.86 1.48 0.00 7.04 -1.09 0.23 -1.72 121.20 127.99 1k2n s ILE 690 Ca -0.06 -1.79 0.00 0.00 -2.23 0.00 0.00 60.65 56.57 1k2n s ILE 690 Cb -0.15 -1.64 0.00 0.00 -1.58 0.00 0.00 42.46 39.09 1k2n s ILE 690 CO -0.03 -0.39 0.00 0.61 -1.23 0.00 0.00 174.94 173.90 1k2n n GLY 691 N 0.44 1.78 3.56 6.18 0.00 -1.26 -2.97 105.19 112.92 1k2n n GLY 691 Ca -0.15 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1k2n n GLY 691 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k2n s PHE 692 N -0.42 2.75 -0.32 1.61 0.08 -0.16 -2.68 117.98 118.85 1k2n s PHE 692 Ca 0.00 -0.14 -0.11 0.00 0.12 0.00 0.00 56.93 56.80 1k2n s PHE 692 Cb 0.00 -1.49 -0.02 0.00 -0.57 0.00 0.00 43.02 40.94 1k2n s PHE 692 CO 0.00 0.38 0.20 0.21 -0.10 0.00 0.00 175.22 175.91 1k2n s LYS 693 N -1.82 3.55 -0.02 0.44 2.36 -1.07 -0.74 119.74 122.44 1k2n s LYS 693 Ca 0.19 -0.59 -0.29 0.00 -2.55 0.00 0.00 55.97 52.72 1k2n s LYS 693 Cb -0.11 -3.70 -0.03 0.00 -1.05 0.00 0.00 37.83 32.94 1k2n s LYS 693 CO 0.10 -0.38 0.95 0.08 1.55 0.00 0.00 175.35 177.65 1k2n s VAL 694 N 1.70 4.89 -0.21 4.02 1.01 0.28 -1.26 120.40 130.83 1k2n s VAL 694 Ca 0.06 1.98 -0.02 0.00 0.00 0.00 0.00 61.98 63.99 1k2n s VAL 694 Cb -0.17 -4.28 0.06 0.00 0.00 0.00 0.00 36.38 31.99 1k2n s VAL 694 CO 0.09 0.16 0.03 -0.70 0.00 0.00 0.00 175.10 174.68 1k2n s GLU 695 N 1.05 0.76 -0.57 2.72 2.12 0.34 0.19 118.70 125.31 1k2n s GLU 695 Ca 0.50 -0.52 -0.28 0.00 0.36 0.00 0.00 54.97 55.03 1k2n s GLU 695 Cb -0.20 -2.16 0.02 0.00 0.26 0.00 0.00 34.13 32.05 1k2n s GLU 695 CO 0.26 -0.66 1.30 0.42 -0.54 0.00 0.00 175.26 176.04 1k2n s ILE 696 N 1.80 3.90 -0.20 -3.70 1.01 -1.26 0.14 121.20 122.88 1k2n s ILE 696 Ca -0.01 0.79 -0.13 0.00 0.00 0.00 0.00 60.65 61.30 1k2n s ILE 696 Cb -0.17 -4.59 -0.19 0.00 0.01 0.00 0.00 42.46 37.52 1k2n s ILE 696 CO -0.09 -1.26 0.09 0.59 0.00 0.00 0.00 174.94 174.27 1k2n n ASN 697 N 8.97 1.97 -4.57 3.58 5.03 -0.53 -4.92 115.26 124.79 1k2n n ASN 697 Ca 0.10 0.28 -0.34 0.00 0.87 0.00 0.00 54.58 55.49 1k2n n ASN 697 Cb 0.49 -0.84 -0.11 0.00 -1.02 0.00 0.00 39.78 38.30 1k2n n ASN 697 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1k2n s ASP 698 N -7.00 4.59 -0.38 6.41 -1.08 -1.06 -5.06 116.67 113.09 1k2n s ASP 698 Ca -0.30 -0.04 -0.00 0.00 -0.52 0.00 0.00 52.55 51.69 1k2n s ASP 698 Cb 0.08 -1.15 0.10 0.00 -1.46 0.00 0.00 42.92 40.50 1k2n s ASP 698 CO 0.62 0.36 0.14 0.42 0.52 0.00 0.00 175.17 177.23 1k2n s THR 699 N -0.79 2.90 -0.66 1.71 -4.23 -1.26 -4.59 115.64 108.73 1k2n s THR 699 Ca 0.12 -2.13 -0.22 0.00 -1.18 0.00 0.00 61.69 58.29 1k2n s THR 699 Cb -0.11 -3.02 -0.18 0.00 1.34 0.00 0.00 72.50 70.53 1k2n s THR 699 CO 0.01 -0.63 1.88 0.41 -0.54 0.00 0.00 174.62 175.76 1k2n n THR 700 N 4.47 1.58 -3.53 3.99 -1.04 -1.26 -4.07 114.28 114.43 1k2n n THR 700 Ca -0.01 -1.34 -0.19 0.00 -2.04 0.00 0.00 64.05 60.47 1k2n n THR 700 Cb 0.42 -2.25 0.06 0.00 -1.82 0.00 0.00 70.33 66.74 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 4.53 -0.45 3.90 3.41 0.00 -1.26 -4.78 105.19 110.54 1k2n n GLY 701 Ca 0.48 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 46.39 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 -6.37 4.14 0.62 0.99 1.43 -1.26 -3.82 118.68 114.41 1k2n s LEU 702 Ca 0.07 0.67 0.33 0.00 -1.03 0.00 0.00 54.13 54.17 1k2n s LEU 702 Cb -0.01 -3.45 1.84 0.00 0.03 0.00 0.00 46.19 44.60 1k2n s LEU 702 CO 0.77 -0.11 2.13 2.19 0.23 0.00 0.00 176.35 181.57 1k2n h PHE 703 N 2.07 0.00 0.00 0.29 -0.00 -1.89 -3.41 116.94 114.01 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 -3.45 -1.42 0.00 -0.68 5.15 -1.26 -4.86 115.26 108.74 1k2n n ASN 704 Ca -0.00 0.35 0.00 0.00 -0.60 0.00 0.00 54.58 54.33 1k2n n ASN 704 Cb 0.27 1.58 0.00 0.00 -0.53 0.00 0.00 39.78 41.10 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 -2.79 0.00 0.00 1.20 0.28 -1.26 -4.97 120.64 113.09 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 0.21 -1.84 0.00 -1.26 -4.49 105.19 97.81 1k2n n GLY 706 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 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 0.60 0.00 0.99 7.99 -1.26 -1.18 117.00 124.14 1k2n n LEU 707 Ca 0.00 -0.28 0.00 0.00 -0.01 0.00 0.00 56.01 55.72 1k2n n LEU 707 Cb 0.00 -0.06 0.00 0.00 -0.11 0.00 0.00 43.42 43.25 1k2n n LEU 707 CO 0.00 0.14 0.00 0.61 -1.51 0.00 0.00 177.39 176.63 1k2n n GLY 708 N 0.78 0.54 3.25 -0.72 0.00 -1.26 -4.95 105.19 102.83 1k2n n GLY 708 Ca 0.09 -1.25 0.03 0.00 0.00 0.00 0.00 46.02 44.89 1k2n n GLY 708 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1k2n s MET 709 N 0.00 0.05 1.00 1.61 0.23 -1.26 -5.07 119.30 115.85 1k2n s MET 709 Ca 0.00 0.12 -0.19 0.00 -1.03 0.00 0.00 55.69 54.59 1k2n s MET 709 Cb 0.00 0.07 -0.16 0.00 -1.53 0.00 0.00 34.83 33.21 1k2n s MET 709 CO 0.00 -0.02 -0.96 1.47 -2.03 0.00 0.00 175.02 173.48 1k2n n LEU 710 N 4.39 -5.40 0.00 0.18 -0.00 -1.26 -2.50 117.00 112.41 1k2n n LEU 710 Ca -0.08 0.14 0.00 0.00 -0.00 0.00 0.00 56.01 56.07 1k2n n LEU 710 Cb 0.56 -0.70 0.00 0.00 -0.00 0.00 0.00 43.42 43.27 1k2n n LEU 710 CO -0.03 -5.30 0.00 1.67 -0.00 0.00 0.00 177.39 173.72 1k2n n GLN 711 N 2.49 0.00 -2.74 1.47 7.27 -1.26 -4.79 117.38 119.82 1k2n n GLN 711 Ca -0.02 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.63 1k2n n GLN 711 Cb 0.60 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.21 1k2n n GLN 711 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 1k2n s GLU 712 N 0.00 3.29 -0.70 3.69 2.02 -1.04 -4.98 118.70 120.97 1k2n s GLU 712 Ca 0.00 -0.30 -0.26 0.00 0.02 0.00 0.00 54.97 54.44 1k2n s GLU 712 Cb 0.00 -4.11 0.04 0.00 0.10 0.00 0.00 34.13 30.16 1k2n s GLU 712 CO 0.00 -1.72 1.17 -0.65 0.02 0.00 0.00 175.26 174.08 1k2n s GLN 713 N 4.49 3.19 -0.07 1.61 -0.21 -1.26 -4.31 119.66 123.09 1k2n s GLN 713 Ca 0.32 -0.39 -0.07 0.00 0.02 0.00 0.00 55.36 55.24 1k2n s GLN 713 Cb -0.12 -4.18 0.01 0.00 1.00 0.00 0.00 33.01 29.72 1k2n s GLN 713 CO 0.17 -2.00 0.11 0.54 -2.12 0.00 0.00 175.29 171.99 1k2n n ARG 714 N 8.77 -0.51 -4.86 2.91 5.12 -1.26 -4.99 116.66 121.84 1k2n n ARG 714 Ca 0.01 0.83 -0.26 0.00 -1.93 0.00 0.00 57.85 56.50 1k2n n ARG 714 Cb 0.48 -1.08 -0.15 0.00 -1.16 0.00 0.00 32.46 30.54 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 -1.02 1.62 -0.29 1.55 -7.23 -1.26 -5.00 120.40 108.77 1k2n s VAL 715 Ca 0.06 -0.99 -0.15 0.00 -1.81 0.00 0.00 61.98 59.10 1k2n s VAL 715 Cb -0.01 -1.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.53 1k2n s VAL 715 CO 0.14 0.36 0.38 0.54 -0.31 0.00 0.00 175.10 176.21 1k2n s VAL 716 N -0.59 5.16 0.64 1.32 0.11 -1.26 -4.57 120.40 121.21 1k2n s VAL 716 Ca 0.08 0.44 -0.01 0.00 -2.93 0.00 0.00 61.98 59.55 1k2n s VAL 716 Cb -0.08 -3.74 0.07 0.00 -1.53 0.00 0.00 36.38 31.10 1k2n s VAL 716 CO 0.00 0.08 0.90 -0.76 -3.33 0.00 0.00 175.10 171.99 1k2n s LEU 717 N 2.08 3.08 0.20 2.54 1.02 0.28 -4.87 118.68 123.01 1k2n s LEU 717 Ca 0.14 -0.02 0.05 0.00 0.02 0.00 0.00 54.13 54.32 1k2n s LEU 717 Cb -0.16 -2.64 -0.03 0.00 0.02 0.00 0.00 46.19 43.38 1k2n s LEU 717 CO 0.11 -1.48 0.25 -0.75 0.02 0.00 0.00 176.35 174.50 1k2n s LYS 718 N -4.99 3.21 0.39 1.70 2.20 -1.26 0.13 119.74 121.11 1k2n s LYS 718 Ca 0.61 -0.80 -0.09 0.00 -0.36 0.00 0.00 55.97 55.33 1k2n s LYS 718 Cb -0.09 -2.79 -0.06 0.00 -1.51 0.00 0.00 37.83 33.39 1k2n s LYS 718 CO 0.42 0.46 0.73 -0.65 -0.36 0.00 0.00 175.35 175.95 1k2n s GLN 719 N -3.53 3.73 0.25 4.03 -0.21 0.42 -4.53 119.66 119.81 1k2n s GLN 719 Ca 0.33 0.37 0.01 0.00 0.02 0.00 0.00 55.36 56.09 1k2n s GLN 719 Cb -0.10 -2.43 -0.00 0.00 1.00 0.00 0.00 33.01 31.48 1k2n s GLN 719 CO 0.27 -0.01 0.05 0.25 -2.12 0.00 0.00 175.29 173.73 1k2n n THR 720 N -1.32 0.00 0.07 -0.19 -2.24 -1.26 -4.91 114.28 104.43 1k2n n THR 720 Ca 0.02 -1.31 0.14 0.00 -2.27 0.00 0.00 64.05 60.63 1k2n n THR 720 Cb 0.54 0.38 0.63 0.00 -2.10 0.00 0.00 70.33 69.79 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 1.28 2.23 0.20 6.98 0.00 -1.99 -1.30 119.26 126.66 1k2n h ALA 721 Ca -0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1k2n h ALA 721 Cb 0.68 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1k2n h ALA 721 CO 0.32 -0.33 -0.10 0.93 0.00 0.00 0.00 179.25 180.08 1k2n h GLU 722 N 0.09 -0.26 -0.25 0.00 5.08 -1.99 -0.44 114.58 116.80 1k2n h GLU 722 Ca 0.17 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1k2n h GLU 722 Cb 0.57 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1k2n h GLU 722 CO -0.02 -0.15 0.00 0.93 -1.00 0.00 0.00 179.01 178.77 1k2n h GLU 723 N -0.30 0.44 -0.64 2.33 3.07 -1.78 -2.77 114.58 114.92 1k2n h GLU 723 Ca -0.03 -0.14 0.12 0.00 -0.50 0.00 0.00 59.36 58.81 1k2n h GLU 723 Cb 0.23 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.06 1k2n h GLU 723 CO 0.05 0.61 0.43 0.87 -1.40 0.00 0.00 179.01 179.56 1k2n h LYS 724 N 0.21 0.38 -0.34 2.33 1.57 -1.18 -0.26 116.57 119.28 1k2n h LYS 724 Ca 0.07 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 1k2n h LYS 724 Cb 0.41 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1k2n h LYS 724 CO 0.01 0.25 -0.28 0.22 -0.57 0.00 0.00 179.45 179.09 1k2n h ASP 725 N 0.39 0.72 -0.63 0.86 3.58 -0.80 -1.30 116.42 119.24 1k2n h ASP 725 Ca 0.30 -0.27 0.05 0.00 0.42 0.00 0.00 57.03 57.53 1k2n h ASP 725 Cb 0.65 -0.20 -0.05 0.00 1.72 0.00 0.00 39.33 41.45 1k2n h ASP 725 CO -0.09 0.96 0.35 -0.07 -2.88 0.00 0.00 179.24 177.51 1k2n h LEU 726 N 0.60 0.51 0.00 2.28 3.38 -0.83 -1.68 115.31 119.58 1k2n h LEU 726 Ca 0.08 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1k2n h LEU 726 Cb 0.78 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1k2n h LEU 726 CO 0.06 0.34 -0.26 1.62 0.09 0.00 0.00 178.44 180.29 1k2n h VAL 727 N 0.65 0.37 -0.76 1.22 3.04 -1.44 -3.28 116.25 116.05 1k2n h VAL 727 Ca 0.28 -1.53 0.02 0.00 -1.01 0.00 0.00 66.70 64.46 1k2n h VAL 727 Cb 0.17 2.17 -0.04 0.00 -2.01 0.00 0.00 31.29 31.57 1k2n h VAL 727 CO -0.17 0.21 0.51 0.50 -1.01 0.00 0.00 177.57 177.60 1k2n h LYS 728 N 0.00 0.98 0.00 4.17 3.64 -0.27 -1.02 116.57 124.07 1k2n h LYS 728 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1k2n h LYS 728 Cb 1.17 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1k2n h LYS 728 CO 0.03 0.65 0.00 0.87 -2.27 0.00 0.00 179.45 178.72 1k2n h LYS 729 N 1.01 0.00 0.00 1.90 1.57 -1.57 -3.51 116.57 115.97 1k2n h LYS 729 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1k2n h LYS 729 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1k2n h LYS 729 CO -0.07 0.00 0.00 -0.11 -0.57 0.00 0.00 179.45 178.70