#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 1.92 0.00 1.61 0.23 -1.26 -4.70 115.26 113.06 1k2n n ASN 574 Ca 0.00 -2.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.05 1k2n n ASN 574 Cb 0.00 -0.24 0.00 0.00 -2.08 0.00 0.00 39.78 37.46 1k2n n ASN 574 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1k2n n GLY 575 N 1.06 0.33 3.69 4.83 0.00 -1.26 -5.12 105.19 108.73 1k2n n GLY 575 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 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 2.99 0.12 1.61 3.00 -1.26 -2.65 118.95 122.76 1k2n s ARG 576 Ca 0.00 -0.41 0.00 0.00 -1.00 0.00 0.00 55.73 54.32 1k2n s ARG 576 Cb 0.00 -2.80 0.00 0.00 0.00 0.00 0.00 34.95 32.15 1k2n s ARG 576 CO 0.00 0.70 0.00 0.34 0.00 0.00 0.00 175.30 176.34 1k2n n PHE 577 N 2.09 -0.66 -4.28 5.12 7.35 -0.95 -4.38 117.46 121.75 1k2n n PHE 577 Ca -0.18 0.12 -0.34 0.00 -0.76 0.00 0.00 57.45 56.28 1k2n n PHE 577 Cb 0.54 0.20 -0.09 0.00 0.35 0.00 0.00 39.48 40.48 1k2n n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1k2n s LEU 578 N -6.43 3.65 -0.20 -2.13 0.20 -0.89 -0.82 118.68 112.07 1k2n s LEU 578 Ca 0.00 0.12 0.01 0.00 0.69 0.00 0.00 54.13 54.95 1k2n s LEU 578 Cb 0.00 -1.96 0.04 0.00 -0.43 0.00 0.00 46.19 43.84 1k2n s LEU 578 CO 0.00 0.33 -0.10 -0.89 -0.29 0.00 0.00 176.35 175.41 1k2n s THR 579 N -1.00 1.61 -0.40 3.68 2.01 0.60 0.15 115.64 122.30 1k2n s THR 579 Ca 0.17 -0.99 -0.11 0.00 0.31 0.00 0.00 61.69 61.06 1k2n s THR 579 Cb -0.12 -1.70 0.04 0.00 0.01 0.00 0.00 72.50 70.74 1k2n s THR 579 CO 0.07 0.16 0.24 -0.76 -0.69 0.00 0.00 174.62 173.64 1k2n s LEU 580 N 1.41 4.94 -0.37 4.42 1.02 0.54 0.16 118.68 130.79 1k2n s LEU 580 Ca -0.01 -1.14 0.01 0.00 0.02 0.00 0.00 54.13 53.01 1k2n s LEU 580 Cb -0.16 -2.04 0.10 0.00 0.02 0.00 0.00 46.19 44.11 1k2n s LEU 580 CO -0.08 -0.45 0.11 -1.59 0.02 0.00 0.00 176.35 174.36 1k2n s LYS 581 N 1.54 1.72 -0.66 1.70 0.00 0.06 0.24 119.74 124.35 1k2n s LYS 581 Ca 0.02 -1.84 -0.34 0.00 0.00 0.00 0.00 55.97 53.81 1k2n s LYS 581 Cb -0.21 -3.37 -0.17 0.00 0.00 0.00 0.00 37.83 34.09 1k2n s LYS 581 CO 0.06 -0.99 2.41 -2.30 0.00 0.00 0.00 175.35 174.53 1k2n n PRO 582 N 4.40 0.40 -1.83 1.78 -0.02 0.14 -2.47 135.00 137.40 1k2n n PRO 582 Ca 0.01 0.07 -0.32 0.00 -2.02 0.00 0.00 63.50 61.24 1k2n n PRO 582 Cb 0.42 -2.01 0.03 0.00 -0.02 0.00 0.00 33.50 31.92 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 8.38 3.34 0.50 2.45 2.34 -0.91 -1.66 118.68 133.12 1k2n s LEU 583 Ca 1.21 1.74 0.30 0.00 0.06 0.00 0.00 54.13 57.43 1k2n s LEU 583 Cb -1.07 -4.52 1.40 0.00 -0.56 0.00 0.00 46.19 41.45 1k2n s LEU 583 CO 0.50 -1.31 1.84 -0.65 -1.06 0.00 0.00 176.35 175.67 1k2n h PRO 584 N -0.08 0.11 0.00 1.48 0.11 -1.89 0.48 132.00 132.21 1k2n h PRO 584 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1k2n h PRO 584 Cb 1.22 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1k2n h PRO 584 CO 0.57 0.07 -0.03 -0.44 -0.21 0.00 0.00 178.00 177.96 1k2n h ASP 585 N 0.11 0.00 -2.94 -2.05 5.19 -1.92 -3.43 116.42 111.39 1k2n h ASP 585 Ca 0.50 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 56.36 1k2n h ASP 585 Cb 1.79 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 41.28 1k2n h ASP 585 CO -0.07 0.03 -0.33 -0.94 -3.12 0.00 0.00 179.24 174.81 1k2n s SER 586 N -5.60 6.41 0.63 6.45 1.04 0.17 -4.95 113.70 117.85 1k2n s SER 586 Ca -0.03 0.45 0.27 0.00 0.48 0.00 0.00 55.95 57.12 1k2n s SER 586 Cb 0.12 -2.03 1.45 0.00 0.10 0.00 0.00 66.02 65.65 1k2n s SER 586 CO 0.50 -0.02 1.80 -0.29 0.98 0.00 0.00 173.24 176.21 1k2n h ILE 587 N 1.68 0.00 -3.49 -1.02 2.10 -0.33 -3.36 117.51 113.09 1k2n h ILE 587 Ca -0.47 0.00 -0.66 0.00 1.08 0.00 0.00 64.86 64.81 1k2n h ILE 587 Cb 1.18 0.59 -0.27 0.00 -1.09 0.00 0.00 36.82 37.23 1k2n h ILE 587 CO 0.69 0.00 -0.69 -0.63 -1.08 0.00 0.00 178.15 176.44 1k2n s ILE 588 N -4.01 3.59 -0.82 2.19 1.01 -1.26 -5.02 121.20 116.88 1k2n s ILE 588 Ca -0.03 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.11 1k2n s ILE 588 Cb 0.08 -2.70 0.33 0.00 0.01 0.00 0.00 42.46 40.17 1k2n s ILE 588 CO 0.24 0.32 1.38 0.00 0.00 0.00 0.00 174.94 176.88 1k2n n GLN 589 N 4.82 4.32 -4.53 2.79 1.13 -1.25 -3.49 117.38 121.17 1k2n n GLN 589 Ca -0.17 -4.75 -0.25 0.00 -1.94 0.00 0.00 57.00 49.89 1k2n n GLN 589 Cb 0.50 -2.36 -0.10 0.00 0.11 0.00 0.00 30.24 28.39 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 -3.82 1.82 -0.08 -1.09 2.02 -0.66 -4.95 118.70 111.94 1k2n s GLU 590 Ca 0.43 -2.05 0.02 0.00 0.02 0.00 0.00 54.97 53.39 1k2n s GLU 590 Cb 0.22 -1.10 0.01 0.00 0.10 0.00 0.00 34.13 33.37 1k2n s GLU 590 CO -0.12 -0.21 -0.13 -1.54 0.02 0.00 0.00 175.26 173.28 1k2n s SER 591 N -3.60 2.09 -0.08 -0.19 1.04 -1.26 0.28 113.70 111.98 1k2n s SER 591 Ca 0.31 -0.35 0.02 0.00 0.48 0.00 0.00 55.95 56.41 1k2n s SER 591 Cb 0.08 -0.94 -0.03 0.00 0.10 0.00 0.00 66.02 65.23 1k2n s SER 591 CO 0.15 0.02 -0.11 -0.76 0.98 0.00 0.00 173.24 173.52 1k2n s LEU 592 N 0.84 2.91 -0.16 2.42 1.43 0.66 -4.93 118.68 121.86 1k2n s LEU 592 Ca -0.11 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1k2n s LEU 592 Cb -0.15 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.47 1k2n s LEU 592 CO 0.01 0.31 -0.14 -1.61 0.23 0.00 0.00 176.35 175.15 1k2n s GLU 593 N -0.51 2.33 -0.47 1.70 8.01 -1.26 0.20 118.70 128.70 1k2n s GLU 593 Ca 0.07 -0.60 -0.24 0.00 0.01 0.00 0.00 54.97 54.20 1k2n s GLU 593 Cb -0.12 -2.17 0.03 0.00 -4.31 0.00 0.00 34.13 27.56 1k2n s GLU 593 CO 0.02 -0.25 0.87 0.42 0.01 0.00 0.00 175.26 176.33 1k2n s ILE 594 N 1.46 4.53 -0.03 -1.63 1.01 0.39 -4.97 121.20 121.96 1k2n s ILE 594 Ca 0.04 0.54 -0.30 0.00 0.00 0.00 0.00 60.65 60.93 1k2n s ILE 594 Cb -0.13 -4.41 -0.05 0.00 0.01 0.00 0.00 42.46 37.88 1k2n s ILE 594 CO -0.11 -0.83 1.52 -1.10 0.00 0.00 0.00 174.94 174.42 1k2n s GLN 595 N 3.59 4.22 0.55 2.79 1.11 -1.26 -2.09 119.66 128.58 1k2n s GLN 595 Ca 0.33 2.06 0.38 0.00 0.01 0.00 0.00 55.36 58.15 1k2n s GLN 595 Cb -0.11 -3.76 1.56 0.00 -1.01 0.00 0.00 33.01 29.68 1k2n s GLN 595 CO 0.24 -0.72 1.75 -0.56 0.01 0.00 0.00 175.29 176.01 1k2n h GLN 596 N 8.60 0.00 0.00 2.91 -0.00 -1.77 0.84 115.11 125.69 1k2n h GLN 596 Ca -0.38 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.23 1k2n h GLN 596 Cb 1.17 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.65 1k2n h GLN 596 CO 0.93 0.00 -0.20 0.78 -0.00 0.00 0.00 178.83 180.35 1k2n h GLY 597 N 0.00 0.00 -7.74 0.06 0.00 -1.89 -3.41 103.07 90.08 1k2n h GLY 597 Ca 0.61 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 47.28 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 -3.98 5.12 -0.04 4.60 1.01 0.29 -5.05 120.40 122.35 1k2n s VAL 598 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1k2n s VAL 598 Cb 0.12 -3.51 0.03 0.00 0.00 0.00 0.00 36.38 33.02 1k2n s VAL 598 CO 0.62 0.16 0.05 0.21 0.00 0.00 0.00 175.10 176.15 1k2n s ASN 599 N 1.72 0.85 0.42 3.32 2.47 -1.26 -3.99 114.94 118.47 1k2n s ASN 599 Ca 0.06 0.08 -0.03 0.00 0.42 0.00 0.00 52.86 53.39 1k2n s ASN 599 Cb -0.16 -0.11 -0.04 0.00 -1.45 0.00 0.00 41.25 39.49 1k2n s ASN 599 CO 0.10 -0.22 0.69 -2.16 -3.72 0.00 0.00 177.10 171.79 1k2n s PRO 600 N 1.89 3.53 -0.32 0.43 0.04 -1.26 -5.04 135.00 134.27 1k2n s PRO 600 Ca 0.01 0.01 -0.19 0.00 0.04 0.00 0.00 61.00 60.87 1k2n s PRO 600 Cb -0.12 -2.49 -0.01 0.00 0.04 0.00 0.00 34.50 31.92 1k2n s PRO 600 CO -0.03 -0.06 0.57 0.12 0.04 0.00 0.00 177.00 177.63 1k2n s PHE 601 N -2.56 3.20 -0.02 0.56 2.19 0.14 -4.93 117.98 116.57 1k2n s PHE 601 Ca 0.45 0.43 -0.16 0.00 0.33 0.00 0.00 56.93 57.98 1k2n s PHE 601 Cb -0.10 -2.93 -0.06 0.00 -1.31 0.00 0.00 43.02 38.63 1k2n s PHE 601 CO 0.41 -0.47 0.43 -0.06 1.83 0.00 0.00 175.22 177.36 1k2n s PHE 602 N 2.49 3.70 0.03 10.12 0.08 -1.26 0.26 117.98 133.39 1k2n s PHE 602 Ca 0.22 0.99 0.06 0.00 0.12 0.00 0.00 56.93 58.32 1k2n s PHE 602 Cb -0.15 -2.35 -0.02 0.00 -0.57 0.00 0.00 43.02 39.93 1k2n s PHE 602 CO 0.12 0.55 -0.16 0.42 -0.10 0.00 0.00 175.22 176.05 1k2n s ILE 603 N -0.78 1.29 -3.84 0.64 1.09 0.50 0.17 121.20 120.28 1k2n s ILE 603 Ca 0.24 -1.00 0.00 0.00 -1.10 0.00 0.00 60.65 58.79 1k2n s ILE 603 Cb -0.17 -1.14 0.00 0.00 -1.06 0.00 0.00 42.46 40.09 1k2n s ILE 603 CO 0.13 0.12 0.00 0.61 -0.10 0.00 0.00 174.94 175.70 1k2n n GLY 604 N 2.02 -1.73 0.21 6.18 0.00 -1.15 -2.23 105.19 108.49 1k2n n GLY 604 Ca -0.17 -1.17 0.14 0.00 0.00 0.00 0.00 46.02 44.82 1k2n n GLY 604 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1k2n h ARG 605 N 0.00 0.00 -5.89 1.61 2.43 -0.49 0.01 114.38 112.06 1k2n h ARG 605 Ca 0.00 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.60 1k2n h ARG 605 Cb 0.00 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.48 1k2n h ARG 605 CO 0.00 0.00 -0.02 -1.12 -1.51 0.00 0.00 179.97 177.32 1k2n s SER 606 N -5.51 6.84 0.63 -3.80 0.01 -1.13 -4.71 113.70 106.03 1k2n s SER 606 Ca 0.06 1.00 0.31 0.00 1.31 0.00 0.00 55.95 58.63 1k2n s SER 606 Cb 0.08 -2.35 1.73 0.00 0.21 0.00 0.00 66.02 65.69 1k2n s SER 606 CO 0.58 -0.06 2.05 -0.08 0.41 0.00 0.00 173.24 176.14 1k2n h GLU 607 N 6.74 0.00 -0.51 12.44 4.81 -1.89 -0.04 114.58 136.13 1k2n h GLU 607 Ca -0.41 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 58.96 1k2n h GLU 607 Cb 1.19 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1k2n h GLU 607 CO 0.75 0.00 0.37 -0.44 -0.73 0.00 0.00 179.01 178.96 1k2n h ASP 608 N 0.00 0.04 -3.10 1.04 3.32 -1.92 -3.40 116.42 112.40 1k2n h ASP 608 Ca 0.07 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.58 1k2n h ASP 608 Cb 0.59 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.13 1k2n h ASP 608 CO -0.00 0.02 0.66 0.00 -1.72 0.00 0.00 179.24 178.19 1k2n h ASN 610 N 7.14 0.20 -3.09 0.00 4.21 -0.14 -3.37 115.58 120.53 1k2n h ASN 610 Ca -0.39 0.08 -0.66 0.00 1.21 0.00 0.00 56.30 56.53 1k2n h ASN 610 Cb 1.19 0.06 -0.11 0.00 -1.12 0.00 0.00 38.32 38.35 1k2n h ASN 610 CO 0.85 -0.06 -0.57 0.00 -1.29 0.00 0.00 177.43 176.35 1k2n s LYS 612 N -1.39 2.51 -0.19 0.00 2.36 -1.26 -2.93 119.74 118.86 1k2n s LYS 612 Ca 0.19 -1.16 -0.04 0.00 -2.55 0.00 0.00 55.97 52.41 1k2n s LYS 612 Cb -0.12 -2.79 0.06 0.00 -1.05 0.00 0.00 37.83 33.94 1k2n s LYS 612 CO 0.09 -0.44 0.07 0.42 1.55 0.00 0.00 175.35 177.04 1k2n s ILE 613 N 1.17 0.14 -0.49 5.43 -1.09 -0.01 -4.95 121.20 121.40 1k2n s ILE 613 Ca -0.04 -0.34 -0.17 0.00 -2.23 0.00 0.00 60.65 57.86 1k2n s ILE 613 Cb -0.18 -0.77 0.07 0.00 -1.58 0.00 0.00 42.46 40.00 1k2n s ILE 613 CO -0.08 -0.28 0.51 -1.83 -1.23 0.00 0.00 174.94 172.03 1k2n s GLU 614 N 2.03 3.05 -0.09 2.79 -1.05 -1.26 -1.91 118.70 122.25 1k2n s GLU 614 Ca 0.01 -1.14 0.00 0.00 -0.15 0.00 0.00 54.97 53.69 1k2n s GLU 614 Cb -0.16 -4.12 0.02 0.00 -0.44 0.00 0.00 34.13 29.43 1k2n s GLU 614 CO -0.10 -1.13 -0.06 0.34 0.95 0.00 0.00 175.26 175.26 1k2n s ASP 615 N 2.66 1.80 0.55 0.83 2.15 -1.26 -5.00 116.67 118.40 1k2n s ASP 615 Ca 0.09 -0.23 0.36 0.00 0.43 0.00 0.00 52.55 53.20 1k2n s ASP 615 Cb -0.22 -0.69 1.52 0.00 -0.30 0.00 0.00 42.92 43.23 1k2n s ASP 615 CO 0.09 -0.10 1.77 -0.55 -0.17 0.00 0.00 175.17 176.21 1k2n h ASN 616 N 7.87 0.00 0.17 -0.34 -1.07 -2.02 0.69 115.58 120.88 1k2n h ASN 616 Ca -0.29 0.00 -0.29 0.00 0.07 0.00 0.00 56.30 55.79 1k2n h ASN 616 Cb 1.14 0.00 0.03 0.00 -2.07 0.00 0.00 38.32 37.42 1k2n h ASN 616 CO 0.40 0.00 -1.23 0.03 0.07 0.00 0.00 177.43 176.70 1k2n h ARG 617 N 0.00 0.60 -7.28 4.14 -0.00 -2.00 -3.46 114.38 106.38 1k2n h ARG 617 Ca 0.54 -0.79 -0.52 0.00 -0.50 0.00 0.00 59.98 58.72 1k2n h ARG 617 Cb 2.28 0.26 0.15 0.00 0.00 0.00 0.00 29.97 32.66 1k2n h ARG 617 CO -0.01 1.35 0.29 -0.51 0.00 0.00 0.00 179.97 181.10 1k2n s LEU 618 N -7.82 3.01 0.45 3.04 1.02 0.24 -4.69 118.68 113.92 1k2n s LEU 618 Ca -0.09 2.01 0.07 0.00 0.02 0.00 0.00 54.13 56.14 1k2n s LEU 618 Cb 0.06 -4.54 -0.02 0.00 0.02 0.00 0.00 46.19 41.70 1k2n s LEU 618 CO 0.93 -2.41 0.30 -0.44 0.02 0.00 0.00 176.35 174.74 1k2n s SER 619 N -2.98 4.69 0.23 2.29 0.01 -1.26 -4.75 113.70 111.92 1k2n s SER 619 Ca 0.65 -1.01 -0.09 0.00 1.31 0.00 0.00 55.95 56.81 1k2n s SER 619 Cb -0.20 -0.29 0.37 0.00 0.21 0.00 0.00 66.02 66.11 1k2n s SER 619 CO 0.55 -0.71 1.65 0.03 0.41 0.00 0.00 173.24 175.16 1k2n h ARG 620 N 1.13 0.11 -2.01 12.44 3.08 -1.93 -0.92 114.38 126.28 1k2n h ARG 620 Ca -0.41 -0.01 -0.58 0.00 0.07 0.00 0.00 59.98 59.05 1k2n h ARG 620 Cb 1.27 -0.03 -0.42 0.00 0.08 0.00 0.00 29.97 30.88 1k2n h ARG 620 CO 0.63 0.08 -0.71 0.28 -1.07 0.00 0.00 179.97 179.17 1k2n n VAL 621 N -5.31 2.66 -0.30 2.04 0.31 -1.26 -2.85 118.33 113.62 1k2n n VAL 621 Ca 0.11 -5.28 0.08 0.00 -0.01 0.00 0.00 64.34 59.24 1k2n n VAL 621 Cb 0.42 -1.26 0.20 0.00 -0.91 0.00 0.00 33.84 32.29 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 2.86 -0.11 -1.84 3.52 2.76 -1.13 -3.38 115.15 117.82 1k2n h HIS 622 Ca 0.17 0.07 0.04 0.00 -2.20 0.00 0.00 60.37 58.45 1k2n h HIS 622 Cb 0.67 0.19 -0.20 0.00 1.55 0.00 0.00 27.41 29.61 1k2n h HIS 622 CO 0.81 -0.33 0.42 0.00 -1.30 0.00 0.00 177.93 177.53 1k2n s PHE 624 N -1.49 0.03 -0.21 0.00 -0.71 0.19 -0.37 117.98 115.42 1k2n s PHE 624 Ca -0.04 -0.08 -0.09 0.00 -1.04 0.00 0.00 56.93 55.69 1k2n s PHE 624 Cb -0.00 -0.05 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 1k2n s PHE 624 CO 0.02 -0.20 0.11 0.42 -1.34 0.00 0.00 175.22 174.23 1k2n s ILE 625 N -0.96 5.08 -0.06 -4.49 1.09 0.14 0.18 121.20 122.18 1k2n s ILE 625 Ca -0.10 0.08 0.06 0.00 -1.10 0.00 0.00 60.65 59.58 1k2n s ILE 625 Cb -0.06 -3.33 -0.01 0.00 -1.06 0.00 0.00 42.46 38.01 1k2n s ILE 625 CO 0.01 0.42 -0.24 0.12 -0.10 0.00 0.00 174.94 175.14 1k2n s PHE 626 N 0.64 2.41 -0.11 3.97 5.36 0.44 0.26 117.98 130.94 1k2n s PHE 626 Ca 0.06 -0.77 -0.10 0.00 -0.96 0.00 0.00 56.93 55.15 1k2n s PHE 626 Cb -0.12 -1.59 -0.05 0.00 -0.34 0.00 0.00 43.02 40.92 1k2n s PHE 626 CO 0.01 -0.25 0.23 0.21 -1.46 0.00 0.00 175.22 173.95 1k2n s LYS 627 N -0.06 3.82 0.09 10.12 2.20 -1.26 0.15 119.74 134.80 1k2n s LYS 627 Ca -0.06 0.02 0.02 0.00 -0.36 0.00 0.00 55.97 55.58 1k2n s LYS 627 Cb -0.14 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.86 1k2n s LYS 627 CO 0.05 0.58 -0.07 0.21 -0.36 0.00 0.00 175.35 175.76 1k2n s LYS 628 N -0.53 0.80 -0.35 4.03 2.36 0.21 -4.93 119.74 121.33 1k2n s LYS 628 Ca 0.16 -1.24 -0.29 0.00 -2.55 0.00 0.00 55.97 52.05 1k2n s LYS 628 Cb -0.13 -0.24 0.01 0.00 -1.05 0.00 0.00 37.83 36.42 1k2n s LYS 628 CO 0.05 -0.00 1.23 0.50 1.55 0.00 0.00 175.35 178.68 1k2n s ARG 629 N -3.45 3.88 0.12 4.03 6.06 -1.26 0.18 118.95 128.51 1k2n s ARG 629 Ca 0.08 1.06 -0.31 0.00 -2.50 0.00 0.00 55.73 54.07 1k2n s ARG 629 Cb 0.03 -3.87 -0.07 0.00 0.06 0.00 0.00 34.95 31.09 1k2n s ARG 629 CO -0.04 -1.16 1.31 -1.58 -2.50 0.00 0.00 175.30 171.33 1k2n s HIS 630 N 4.34 3.31 -0.03 5.12 5.65 0.53 -4.88 115.29 129.34 1k2n s HIS 630 Ca 0.53 1.13 -0.31 0.00 0.25 0.00 0.00 55.06 56.66 1k2n s HIS 630 Cb -0.14 -3.58 0.12 0.00 -1.18 0.00 0.00 32.58 27.80 1k2n s HIS 630 CO 0.24 -1.91 1.25 0.00 -0.65 0.00 0.00 174.74 173.66 1k2n s ALA 631 N 0.85 -2.16 0.08 1.58 0.00 -1.26 -2.24 121.76 118.61 1k2n s ALA 631 Ca 0.61 0.79 -0.09 0.00 0.00 0.00 0.00 51.96 53.27 1k2n s ALA 631 Cb -0.34 0.31 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 1k2n s ALA 631 CO 0.32 -0.98 0.19 0.54 0.00 0.00 0.00 175.76 175.83 1k2n s VAL 632 N -2.50 0.14 -0.40 0.00 0.11 -1.26 -5.12 120.40 111.37 1k2n s VAL 632 Ca 0.13 -1.15 -0.29 0.00 -2.93 0.00 0.00 61.98 57.74 1k2n s VAL 632 Cb 0.03 -1.30 0.01 0.00 -1.53 0.00 0.00 36.38 33.59 1k2n s VAL 632 CO -0.04 -0.63 1.40 -0.83 -3.33 0.00 0.00 175.10 171.67 1k2n s GLY 633 N -2.80 1.13 0.49 6.54 0.00 -1.26 -4.73 107.32 106.69 1k2n s GLY 633 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 44.72 44.64 1k2n s GLY 633 CO -0.10 2.75 0.00 0.28 0.00 0.00 0.00 173.10 176.02 1k2n n LYS 634 N 7.98 -4.04 -2.31 2.90 5.02 -1.26 -4.83 118.16 121.63 1k2n n LYS 634 Ca 0.16 3.04 -0.28 0.00 -2.02 0.00 0.00 58.31 59.21 1k2n n LYS 634 Cb 0.48 -3.51 0.01 0.00 -0.02 0.00 0.00 35.03 31.99 1k2n n LYS 634 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1k2n n SER 635 N -1.29 5.16 -4.68 4.39 7.64 -1.26 -5.05 113.62 118.53 1k2n n SER 635 Ca 0.00 -3.74 -0.43 0.00 1.01 0.00 0.00 58.87 55.71 1k2n n SER 635 Cb 0.11 -0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 62.75 1k2n n SER 635 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1k2n n MET 636 N -0.54 2.76 0.00 1.43 0.00 -1.26 -3.78 117.12 115.73 1k2n n MET 636 Ca 0.42 1.01 0.00 0.00 0.00 0.00 0.00 57.70 59.13 1k2n n MET 636 Cb 0.66 -2.91 0.00 0.00 0.00 0.00 0.00 33.22 30.97 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 6.20 0.00 -2.60 1.12 9.36 -1.26 -4.79 117.16 125.19 1k2n n TYR 637 Ca 0.19 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.99 1k2n n TYR 637 Cb 0.37 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.06 1k2n n TYR 637 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1k2n s GLU 638 N 0.00 4.45 -0.44 2.98 -6.30 -1.25 -5.02 118.70 113.13 1k2n s GLU 638 Ca 0.00 1.53 -0.05 0.00 -2.50 0.00 0.00 54.97 53.95 1k2n s GLU 638 Cb 0.00 -3.48 0.12 0.00 0.00 0.00 0.00 34.13 30.76 1k2n s GLU 638 CO 0.00 -0.24 0.26 0.45 0.02 0.00 0.00 175.26 175.75 1k2n s SER 639 N 1.14 5.41 0.00 -1.70 0.15 -1.26 -4.54 113.70 112.90 1k2n s SER 639 Ca 0.53 -2.02 0.00 0.00 0.70 0.00 0.00 55.95 55.16 1k2n s SER 639 Cb -0.22 -1.89 0.00 0.00 -1.71 0.00 0.00 66.02 62.19 1k2n s SER 639 CO 0.24 -0.59 0.00 -2.65 1.20 0.00 0.00 173.24 171.44 1k2n n PRO 640 N 4.66 2.25 -0.18 5.44 -0.02 -1.26 -4.86 135.00 141.03 1k2n n PRO 640 Ca -0.04 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.50 1k2n n PRO 640 Cb 0.41 0.00 0.16 0.00 -0.02 0.00 0.00 33.50 34.05 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 2.45 0.00 3.55 0.00 -1.26 -4.96 120.51 117.28 1k2n n ALA 641 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.83 1k2n n ALA 641 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 0.52 0.00 -2.71 0.00 6.02 -1.26 -4.47 117.38 115.47 1k2n n GLN 642 Ca 0.12 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.13 1k2n n GLN 642 Cb 0.29 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.56 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 -1.54 0.00 1.08 0.00 -1.26 -4.71 107.32 100.89 1k2n s GLY 643 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 44.72 46.31 1k2n s GLY 643 CO 0.00 4.43 0.00 1.04 0.00 0.00 0.00 173.10 178.57 1k2n n LEU 644 N 3.67 0.00 -4.32 0.66 4.32 -0.95 -4.90 117.00 115.47 1k2n n LEU 644 Ca 0.05 0.00 -0.28 0.00 -0.02 0.00 0.00 56.01 55.76 1k2n n LEU 644 Cb 0.64 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.30 1k2n n LEU 644 CO -0.15 0.00 -0.55 -1.81 -1.22 0.00 0.00 177.39 173.66 1k2n s ASP 645 N 1.00 2.91 0.15 -1.43 1.01 -1.19 0.20 116.67 119.32 1k2n s ASP 645 Ca 0.00 -0.62 0.04 0.00 0.71 0.00 0.00 52.55 52.68 1k2n s ASP 645 Cb 0.00 -0.23 -0.04 0.00 1.01 0.00 0.00 42.92 43.66 1k2n s ASP 645 CO 0.00 0.19 -0.09 -1.81 0.21 0.00 0.00 175.17 173.67 1k2n s ASP 646 N -1.48 1.70 -0.22 0.27 1.01 0.47 -3.17 116.67 115.24 1k2n s ASP 646 Ca 0.10 -1.03 -0.06 0.00 0.71 0.00 0.00 52.55 52.27 1k2n s ASP 646 Cb -0.10 0.01 -0.02 0.00 1.01 0.00 0.00 42.92 43.82 1k2n s ASP 646 CO 0.03 -0.37 0.03 0.27 0.21 0.00 0.00 175.17 175.34 1k2n s ILE 647 N -3.38 4.04 -0.21 0.77 -4.36 -1.26 0.65 121.20 117.44 1k2n s ILE 647 Ca 0.17 -0.27 -0.07 0.00 -0.26 0.00 0.00 60.65 60.22 1k2n s ILE 647 Cb 0.03 -2.86 -0.03 0.00 1.25 0.00 0.00 42.46 40.85 1k2n s ILE 647 CO 0.01 0.39 0.05 0.26 0.24 0.00 0.00 174.94 175.88 1k2n s TRP 648 N 1.34 3.12 -0.31 1.37 0.52 0.40 0.40 118.94 125.77 1k2n s TRP 648 Ca 0.04 -0.26 -0.20 0.00 0.02 0.00 0.00 56.10 55.70 1k2n s TRP 648 Cb -0.15 -2.14 -0.01 0.00 -1.15 0.00 0.00 33.47 30.03 1k2n s TRP 648 CO 0.02 -0.15 0.63 -0.47 0.02 0.00 0.00 176.95 176.99 1k2n s TYR 649 N 1.03 3.20 -0.04 -1.98 6.14 0.38 0.16 117.35 126.25 1k2n s TYR 649 Ca 0.03 0.54 -0.03 0.00 0.64 0.00 0.00 57.07 58.26 1k2n s TYR 649 Cb -0.14 -3.02 -0.04 0.00 0.42 0.00 0.00 41.96 39.18 1k2n s TYR 649 CO 0.03 -0.50 0.12 0.00 0.64 0.00 0.00 175.55 175.84 1k2n s HIS 651 N -1.18 1.23 0.00 0.00 5.04 -0.26 0.53 115.29 120.64 1k2n s HIS 651 Ca 0.22 -0.51 0.00 0.00 -1.54 0.00 0.00 55.06 53.23 1k2n s HIS 651 Cb -0.12 -1.03 0.00 0.00 0.04 0.00 0.00 32.58 31.47 1k2n s HIS 651 CO 0.13 -0.37 0.81 0.25 -2.34 0.00 0.00 174.74 173.21 1k2n n THR 652 N 4.52 0.63 -2.62 0.89 -2.24 0.57 0.10 114.28 116.13 1k2n n THR 652 Ca -0.17 -0.79 -0.35 0.00 -2.27 0.00 0.00 64.05 60.48 1k2n n THR 652 Cb 0.51 0.70 -0.05 0.00 -2.10 0.00 0.00 70.33 69.39 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 -0.63 2.59 0.24 3.38 0.00 0.41 -4.78 107.32 108.53 1k2n s GLY 653 Ca 0.00 0.59 0.01 0.00 0.00 0.00 0.00 44.72 45.32 1k2n s GLY 653 CO 0.00 0.95 1.60 0.00 0.00 0.00 0.00 173.10 175.66 1k2n h THR 654 N 1.94 1.31 0.00 0.90 1.03 -1.88 -2.92 112.91 113.30 1k2n h THR 654 Ca -0.49 -1.63 0.00 0.00 -0.01 0.00 0.00 66.41 64.28 1k2n h THR 654 Cb 1.21 1.66 0.00 0.00 -1.07 0.00 0.00 68.15 69.95 1k2n h THR 654 CO 0.61 0.50 0.00 0.59 -0.01 0.00 0.00 175.52 177.21 1k2n n ASN 655 N -4.00 0.00 -1.62 0.00 3.02 -1.26 -4.90 115.26 106.50 1k2n n ASN 655 Ca -0.02 -0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.26 1k2n n ASN 655 Cb 0.53 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 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 -1.13 -3.16 -3.61 2.41 3.14 -1.10 -4.86 118.33 110.03 1k2n n VAL 656 Ca 0.10 1.46 -0.20 0.00 -2.96 0.00 0.00 64.34 62.75 1k2n n VAL 656 Cb 0.09 -1.93 -0.02 0.00 -1.06 0.00 0.00 33.84 30.92 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 -2.21 5.62 -0.14 6.55 1.04 -0.93 -4.62 113.70 119.01 1k2n s SER 657 Ca 0.00 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1k2n s SER 657 Cb 0.00 -1.06 0.02 0.00 0.10 0.00 0.00 66.02 65.08 1k2n s SER 657 CO 0.00 -0.42 -0.13 -0.31 0.98 0.00 0.00 173.24 173.36 1k2n s TYR 658 N -2.25 2.03 -0.51 5.02 2.02 0.50 0.11 117.35 124.26 1k2n s TYR 658 Ca 0.44 -1.11 -0.15 0.00 -0.37 0.00 0.00 57.07 55.87 1k2n s TYR 658 Cb -0.08 -1.52 0.11 0.00 -0.40 0.00 0.00 41.96 40.08 1k2n s TYR 658 CO 0.29 -0.63 0.45 -1.17 -1.57 0.00 0.00 175.55 172.92 1k2n s LEU 659 N 1.51 5.99 0.00 -1.29 2.96 0.51 0.17 118.68 128.53 1k2n s LEU 659 Ca 0.04 -1.69 0.00 0.00 -0.22 0.00 0.00 54.13 52.27 1k2n s LEU 659 Cb -0.13 -2.18 0.00 0.00 0.50 0.00 0.00 46.19 44.38 1k2n s LEU 659 CO -0.10 -0.79 0.00 -3.20 -1.32 0.00 0.00 176.35 170.95 1k2n n ASN 660 N 5.20 0.00 0.00 3.68 2.85 -0.95 -0.43 115.26 125.60 1k2n n ASN 660 Ca -0.13 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.34 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 0.93 0.25 -4.75 1.20 5.15 -1.26 -5.06 115.26 111.73 1k2n n ASN 661 Ca 0.00 -0.82 -0.35 0.00 -0.60 0.00 0.00 54.58 52.82 1k2n n ASN 661 Cb 0.00 0.07 -0.08 0.00 -0.53 0.00 0.00 39.78 39.24 1k2n n ASN 661 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1k2n s ASN 662 N -0.07 5.56 0.23 1.20 3.84 0.43 -5.09 114.94 121.03 1k2n s ASN 662 Ca 0.00 0.20 -0.27 0.00 0.21 0.00 0.00 52.86 53.01 1k2n s ASN 662 Cb 0.00 -1.62 -0.09 0.00 -0.55 0.00 0.00 41.25 38.99 1k2n s ASN 662 CO 0.00 0.36 0.87 -0.13 -2.79 0.00 0.00 177.10 175.40 1k2n s ARG 663 N -1.13 4.66 -0.45 0.43 0.52 -1.26 -0.36 118.95 121.35 1k2n s ARG 663 Ca 0.16 1.29 -0.07 0.00 -0.52 0.00 0.00 55.73 56.60 1k2n s ARG 663 Cb -0.12 -3.15 0.12 0.00 0.52 0.00 0.00 34.95 32.32 1k2n s ARG 663 CO 0.06 0.48 0.29 -1.64 0.02 0.00 0.00 175.30 174.51 1k2n s MET 664 N -1.40 2.30 0.02 3.54 -1.94 0.31 -4.88 119.30 117.24 1k2n s MET 664 Ca 0.41 -1.78 -0.22 0.00 -1.71 0.00 0.00 55.69 52.39 1k2n s MET 664 Cb -0.23 -3.79 -0.05 0.00 2.01 0.00 0.00 34.83 32.76 1k2n s MET 664 CO 0.28 -1.14 0.67 0.96 -0.01 0.00 0.00 175.02 175.77 1k2n s ILE 665 N 1.28 4.83 -0.92 2.53 -4.36 -1.26 -2.20 121.20 121.09 1k2n s ILE 665 Ca 0.07 1.41 -0.25 0.00 -0.26 0.00 0.00 60.65 61.61 1k2n s ILE 665 Cb -0.25 -4.01 -0.22 0.00 1.25 0.00 0.00 42.46 39.23 1k2n s ILE 665 CO -0.02 0.40 2.40 1.67 0.24 0.00 0.00 174.94 179.63 1k2n n GLN 666 N 2.74 0.00 0.00 0.37 7.27 -1.26 -1.82 117.38 124.68 1k2n n GLN 666 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.02 1k2n n GLN 666 Cb 0.51 -1.30 0.00 0.00 2.41 0.00 0.00 30.24 31.86 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 5.84 1.26 3.09 1.69 0.00 0.28 -4.92 105.19 112.43 1k2n n GLY 667 Ca 0.61 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.55 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 0.29 0.22 2.61 -4.23 -0.76 -2.13 115.64 109.64 1k2n s THR 668 Ca 0.00 -1.69 0.10 0.00 -1.18 0.00 0.00 61.69 58.92 1k2n s THR 668 Cb 0.00 -1.35 -0.05 0.00 1.34 0.00 0.00 72.50 72.44 1k2n s THR 668 CO 0.00 -0.90 -0.18 -1.59 -0.54 0.00 0.00 174.62 171.42 1k2n s LYS 669 N -3.51 1.44 -0.02 3.99 -2.85 -0.23 -1.10 119.74 117.45 1k2n s LYS 669 Ca 0.04 -1.59 -0.07 0.00 -1.00 0.00 0.00 55.97 53.35 1k2n s LYS 669 Cb 0.05 -1.44 0.01 0.00 -2.06 0.00 0.00 37.83 34.39 1k2n s LYS 669 CO -0.08 0.27 0.16 0.12 0.10 0.00 0.00 175.35 175.93 1k2n s PHE 670 N -2.47 -0.06 0.15 1.78 5.36 0.95 -1.54 117.98 122.16 1k2n s PHE 670 Ca 0.23 0.11 -0.31 0.00 -0.96 0.00 0.00 56.93 56.00 1k2n s PHE 670 Cb -0.04 0.00 -0.09 0.00 -0.34 0.00 0.00 43.02 42.55 1k2n s PHE 670 CO 0.09 -0.22 1.45 -1.17 -1.46 0.00 0.00 175.22 173.92 1k2n s LEU 671 N -0.84 4.38 -0.25 6.12 1.98 -1.26 0.14 118.68 128.95 1k2n s LEU 671 Ca -0.09 2.48 -0.05 0.00 -2.89 0.00 0.00 54.13 53.57 1k2n s LEU 671 Cb -0.05 -3.60 -0.01 0.00 0.66 0.00 0.00 46.19 43.20 1k2n s LEU 671 CO 0.01 -0.71 0.01 -0.76 -1.89 0.00 0.00 176.35 173.01 1k2n s LEU 672 N 0.85 3.26 -0.09 -0.68 1.43 0.16 -4.85 118.68 118.76 1k2n s LEU 672 Ca 0.65 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1k2n s LEU 672 Cb -0.40 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 1k2n s LEU 672 CO 0.33 -0.07 -0.03 -1.10 0.23 0.00 0.00 176.35 175.71 1k2n s GLN 673 N 1.51 3.01 -0.47 1.70 -0.21 -1.26 -4.44 119.66 119.51 1k2n s GLN 673 Ca 0.05 -0.48 -0.43 0.00 0.02 0.00 0.00 55.36 54.52 1k2n s GLN 673 Cb -0.15 -2.74 -0.19 0.00 1.00 0.00 0.00 33.01 30.93 1k2n s GLN 673 CO -0.00 0.61 1.67 -3.47 -2.12 0.00 0.00 175.29 171.97 1k2n n ASP 674 N 2.40 1.01 -0.08 5.90 -0.08 1.11 -1.14 116.55 125.67 1k2n n ASP 674 Ca -0.18 0.98 0.00 0.00 -1.51 0.00 0.00 54.79 54.07 1k2n n ASP 674 Cb 0.53 -0.84 0.00 0.00 2.34 0.00 0.00 41.12 43.16 1k2n n ASP 674 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k2n n GLY 675 N 4.78 1.23 3.56 0.27 0.00 0.46 -4.72 105.19 110.77 1k2n n GLY 675 Ca 0.36 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1k2n n GLY 675 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k2n s ASP 676 N -2.31 6.37 -0.45 1.61 1.11 -0.30 -4.76 116.67 117.95 1k2n s ASP 676 Ca 0.00 0.06 -0.18 0.00 0.18 0.00 0.00 52.55 52.61 1k2n s ASP 676 Cb 0.00 -2.29 0.04 0.00 1.07 0.00 0.00 42.92 41.73 1k2n s ASP 676 CO 0.00 -0.53 0.50 -1.61 1.18 0.00 0.00 175.17 174.72 1k2n s GLU 677 N 2.53 3.11 -0.15 8.23 2.02 -1.26 0.14 118.70 133.33 1k2n s GLU 677 Ca 0.21 -0.80 -0.04 0.00 0.02 0.00 0.00 54.97 54.36 1k2n s GLU 677 Cb -0.15 -4.01 -0.03 0.00 0.10 0.00 0.00 34.13 30.04 1k2n s GLU 677 CO 0.14 -0.97 -0.02 0.42 0.02 0.00 0.00 175.26 174.85 1k2n s ILE 678 N 2.29 4.10 -0.34 -1.63 1.01 0.28 -2.25 121.20 124.66 1k2n s ILE 678 Ca 0.13 -0.29 -0.16 0.00 0.00 0.00 0.00 60.65 60.33 1k2n s ILE 678 Cb -0.18 -2.79 -0.01 0.00 0.01 0.00 0.00 42.46 39.49 1k2n s ILE 678 CO 0.13 0.51 0.40 -0.75 0.00 0.00 0.00 174.94 175.23 1k2n s LYS 679 N 0.13 3.62 0.09 2.79 2.20 0.46 -0.29 119.74 128.75 1k2n s LYS 679 Ca 0.00 -0.31 -0.06 0.00 -0.36 0.00 0.00 55.97 55.24 1k2n s LYS 679 Cb -0.13 -3.79 -0.21 0.00 -1.51 0.00 0.00 37.83 32.19 1k2n s LYS 679 CO 0.02 -0.53 1.20 0.82 -0.36 0.00 0.00 175.35 176.50 1k2n h ILE 680 N 5.54 1.42 -2.38 5.43 2.04 -1.19 1.45 117.51 129.83 1k2n h ILE 680 Ca -0.29 -2.72 -0.06 0.00 1.00 0.00 0.00 64.86 62.78 1k2n h ILE 680 Cb 1.14 2.70 -0.24 0.00 -0.74 0.00 0.00 36.82 39.68 1k2n h ILE 680 CO 0.71 0.80 -0.15 -0.51 0.00 0.00 0.00 178.15 179.01 1k2n s ILE 681 N -2.95 -0.01 -0.05 -0.67 2.07 -1.20 -3.99 121.20 114.40 1k2n s ILE 681 Ca -0.06 0.04 -0.00 0.00 -1.41 0.00 0.00 60.65 59.23 1k2n s ILE 681 Cb 0.07 -0.77 0.03 0.00 0.13 0.00 0.00 42.46 41.92 1k2n s ILE 681 CO 0.88 0.02 -0.01 0.86 -1.91 0.00 0.00 174.94 174.79 1k2n s TRP 682 N 1.27 0.54 -0.16 3.50 -0.00 -1.23 0.15 118.94 123.01 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 -0.62 0.03 0.00 -0.00 0.00 0.00 33.47 32.82 1k2n s TRP 682 CO -0.13 -0.22 -0.09 0.34 -0.00 0.00 0.00 176.95 176.86 1k2n s ASP 683 N 1.39 2.82 0.06 5.86 -1.08 0.25 -4.95 116.67 121.02 1k2n s ASP 683 Ca -0.04 -0.62 -0.20 0.00 -0.52 0.00 0.00 52.55 51.17 1k2n s ASP 683 Cb -0.13 -1.03 -0.11 0.00 -1.46 0.00 0.00 42.92 40.19 1k2n s ASP 683 CO -0.02 -0.14 1.46 0.50 0.52 0.00 0.00 175.17 177.49 1k2n h LYS 684 N 8.08 0.36 -0.09 4.34 3.64 -1.94 0.86 116.57 131.82 1k2n h LYS 684 Ca -0.29 -0.13 -0.24 0.00 -1.27 0.00 0.00 60.65 58.72 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 0.45 0.61 -0.87 -0.91 -2.27 0.00 0.00 179.45 176.46 1k2n h ASN 685 N 0.08 0.92 0.79 4.20 4.21 -1.98 -3.22 115.58 120.58 1k2n h ASN 685 Ca 0.05 -0.67 0.00 0.00 1.21 0.00 0.00 56.30 56.88 1k2n h ASN 685 Cb 0.47 -0.27 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 1k2n h ASN 685 CO 0.02 1.45 -0.41 -3.20 -1.29 0.00 0.00 177.43 174.01 1k2n n ASN 686 N -3.93 0.49 -1.03 5.81 5.15 -1.23 -4.92 115.26 115.60 1k2n n ASN 686 Ca -0.09 0.08 -0.13 0.00 -0.60 0.00 0.00 54.58 53.84 1k2n n ASN 686 Cb 0.79 -0.01 -0.06 0.00 -0.53 0.00 0.00 39.78 39.98 1k2n n ASN 686 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1k2n n LYS 687 N -1.76 -1.49 -2.67 1.20 4.76 0.29 -4.91 118.16 113.58 1k2n n LYS 687 Ca 0.05 0.96 -0.42 0.00 -2.87 0.00 0.00 58.31 56.03 1k2n n LYS 687 Cb 0.38 -5.30 -0.03 0.00 -1.84 0.00 0.00 35.03 28.24 1k2n n LYS 687 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1k2n s PHE 688 N -2.22 2.65 -0.13 2.13 2.19 -0.99 -4.82 117.98 116.80 1k2n s PHE 688 Ca 0.00 0.22 0.01 0.00 0.33 0.00 0.00 56.93 57.49 1k2n s PHE 688 Cb 0.00 -4.37 0.02 0.00 -1.31 0.00 0.00 43.02 37.36 1k2n s PHE 688 CO 0.00 -1.54 -0.13 0.54 1.83 0.00 0.00 175.22 175.92 1k2n s VAL 689 N 4.66 1.42 -0.10 3.12 0.11 -1.25 0.86 120.40 129.21 1k2n s VAL 689 Ca 0.38 -0.55 0.03 0.00 -2.93 0.00 0.00 61.98 58.90 1k2n s VAL 689 Cb -0.09 -1.34 -0.01 0.00 -1.53 0.00 0.00 36.38 33.41 1k2n s VAL 689 CO 0.22 0.43 -0.20 -0.63 -3.33 0.00 0.00 175.10 171.59 1k2n s ILE 690 N 1.37 2.44 -0.21 7.04 1.01 0.39 0.39 121.20 133.63 1k2n s ILE 690 Ca 0.01 -0.89 -0.12 0.00 0.00 0.00 0.00 60.65 59.65 1k2n s ILE 690 Cb -0.13 -1.97 0.07 0.00 0.01 0.00 0.00 42.46 40.44 1k2n s ILE 690 CO -0.07 0.55 0.52 -0.83 0.00 0.00 0.00 174.94 175.11 1k2n s GLY 691 N 0.26 -0.45 0.01 6.18 0.00 -1.26 -0.72 107.32 111.34 1k2n s GLY 691 Ca -0.14 1.86 0.05 0.00 0.00 0.00 0.00 44.72 46.49 1k2n s GLY 691 CO 0.07 1.92 -0.12 -1.36 0.00 0.00 0.00 173.10 173.61 1k2n s PHE 692 N 1.39 2.74 -0.31 1.90 0.08 0.61 -2.14 117.98 122.26 1k2n s PHE 692 Ca -0.09 -0.14 -0.11 0.00 0.12 0.00 0.00 56.93 56.71 1k2n s PHE 692 Cb -0.07 -1.56 -0.03 0.00 -0.57 0.00 0.00 43.02 40.80 1k2n s PHE 692 CO -0.14 0.30 0.19 0.21 -0.10 0.00 0.00 175.22 175.68 1k2n s LYS 693 N -1.32 3.62 -0.05 0.44 2.36 -1.03 -0.56 119.74 123.21 1k2n s LYS 693 Ca 0.15 -0.54 -0.30 0.00 -2.55 0.00 0.00 55.97 52.74 1k2n s LYS 693 Cb -0.11 -3.66 -0.02 0.00 -1.05 0.00 0.00 37.83 32.99 1k2n s LYS 693 CO 0.06 -0.33 0.99 0.08 1.55 0.00 0.00 175.35 177.70 1k2n s VAL 694 N 1.70 4.83 -0.20 4.02 1.01 0.38 -0.76 120.40 131.38 1k2n s VAL 694 Ca 0.06 2.05 -0.02 0.00 0.00 0.00 0.00 61.98 64.07 1k2n s VAL 694 Cb -0.17 -4.32 0.06 0.00 0.00 0.00 0.00 36.38 31.96 1k2n s VAL 694 CO 0.09 0.09 0.03 -1.61 0.00 0.00 0.00 175.10 173.70 1k2n s GLU 695 N 1.46 0.77 -0.59 2.72 0.41 0.42 0.17 118.70 124.08 1k2n s GLU 695 Ca 0.50 -0.52 -0.26 0.00 -0.41 0.00 0.00 54.97 54.28 1k2n s GLU 695 Cb -0.20 -2.16 0.04 0.00 -1.78 0.00 0.00 34.13 30.02 1k2n s GLU 695 CO 0.23 -0.65 1.08 0.42 -0.49 0.00 0.00 175.26 175.85 1k2n s ILE 696 N 1.79 4.17 -0.11 -1.63 1.01 -1.26 -0.29 121.20 124.88 1k2n s ILE 696 Ca -0.01 0.52 -0.22 0.00 0.00 0.00 0.00 60.65 60.94 1k2n s ILE 696 Cb -0.17 -4.66 -0.27 0.00 0.01 0.00 0.00 42.46 37.37 1k2n s ILE 696 CO -0.09 -1.29 0.65 0.78 0.00 0.00 0.00 174.94 174.99 1k2n h ASN 697 N 9.49 0.24 -3.71 3.58 -0.26 -1.32 -3.46 115.58 120.13 1k2n h ASN 697 Ca -0.26 -0.87 -0.68 0.00 -0.56 0.00 0.00 56.30 53.93 1k2n h ASN 697 Cb 1.06 -0.08 -0.19 0.00 -1.06 0.00 0.00 38.32 38.05 1k2n h ASN 697 CO 1.15 1.37 -0.71 -0.62 -1.06 0.00 0.00 177.43 177.57 1k2n s ASP 698 N -6.77 4.55 -0.41 5.81 -1.08 -1.19 -4.95 116.67 112.63 1k2n s ASP 698 Ca -0.19 -0.07 -0.02 0.00 -0.52 0.00 0.00 52.55 51.75 1k2n s ASP 698 Cb 0.02 -1.10 0.11 0.00 -1.46 0.00 0.00 42.92 40.48 1k2n s ASP 698 CO 0.74 0.35 0.19 0.42 0.52 0.00 0.00 175.17 177.39 1k2n s THR 699 N -0.83 3.14 -1.25 1.71 -4.23 -1.26 -4.75 115.64 108.17 1k2n s THR 699 Ca 0.13 -2.16 -0.15 0.00 -1.18 0.00 0.00 61.69 58.33 1k2n s THR 699 Cb -0.11 -3.17 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 1k2n s THR 699 CO 0.02 -0.69 2.24 0.41 -0.54 0.00 0.00 174.62 176.06 1k2n n THR 700 N 4.47 3.04 -3.23 3.99 -1.04 -1.26 -4.29 114.28 115.97 1k2n n THR 700 Ca -0.01 -2.45 -0.15 0.00 -2.04 0.00 0.00 64.05 59.41 1k2n n THR 700 Cb 0.41 -2.50 0.07 0.00 -1.82 0.00 0.00 70.33 66.50 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 4.12 -0.72 3.77 3.41 0.00 -1.26 -4.75 105.19 109.76 1k2n n GLY 701 Ca 0.54 0.33 -0.39 0.00 0.00 0.00 0.00 46.02 46.50 1k2n n GLY 701 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1k2n s LEU 702 N -5.61 4.54 0.47 0.99 2.96 -1.26 -3.17 118.68 117.60 1k2n s LEU 702 Ca 0.24 1.80 0.32 0.00 -0.22 0.00 0.00 54.13 56.28 1k2n s LEU 702 Cb -0.03 -3.63 1.44 0.00 0.50 0.00 0.00 46.19 44.47 1k2n s LEU 702 CO 0.69 0.11 1.68 2.19 -1.32 0.00 0.00 176.35 179.70 1k2n h PHE 703 N 3.90 0.36 0.00 5.38 -0.00 -1.85 -3.33 116.94 121.39 1k2n h PHE 703 Ca -0.46 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.52 1k2n h PHE 703 Cb 1.20 -0.09 0.00 0.00 -0.00 0.00 0.00 35.95 37.05 1k2n h PHE 703 CO 0.62 -0.08 0.00 -1.71 -0.00 0.00 0.00 178.31 177.14 1k2n n ASN 704 N -4.45 0.00 0.00 -0.68 5.15 -1.26 -4.75 115.26 109.26 1k2n n ASN 704 Ca 0.34 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.32 1k2n n ASN 704 Cb 1.38 0.01 0.00 0.00 -0.53 0.00 0.00 39.78 40.63 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 -2.22 0.00 0.00 1.20 0.28 -1.25 -4.77 120.64 113.88 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 1.84 0.14 -1.84 0.00 -1.26 -4.43 105.19 99.63 1k2n n GLY 706 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1k2n n GLY 706 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1k2n n LEU 707 N 0.00 0.42 -2.92 0.99 -0.00 -1.26 0.36 117.00 114.58 1k2n n LEU 707 Ca 0.00 -0.16 -0.01 0.00 -0.00 0.00 0.00 56.01 55.84 1k2n n LEU 707 Cb 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 43.42 43.40 1k2n n LEU 707 CO 0.00 0.08 -0.39 0.61 -0.00 0.00 0.00 177.39 177.69 1k2n n GLY 708 N 0.97 -2.13 3.69 -3.96 0.00 -1.26 -4.81 105.19 97.69 1k2n n GLY 708 Ca 0.19 0.54 -0.43 0.00 0.00 0.00 0.00 46.02 46.32 1k2n n GLY 708 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1k2n n MET 709 N 1.67 2.13 0.00 1.61 0.00 -1.26 -4.67 117.12 116.60 1k2n n MET 709 Ca -0.10 0.75 0.00 0.00 0.00 0.00 0.00 57.70 58.35 1k2n n MET 709 Cb 0.29 -2.37 0.00 0.00 0.00 0.00 0.00 33.22 31.14 1k2n n MET 709 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1k2n n LEU 710 N 1.29 0.00 0.00 3.17 7.99 -1.26 -4.34 117.00 123.85 1k2n n LEU 710 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.07 1k2n n LEU 710 Cb 0.35 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.66 1k2n n LEU 710 CO 0.62 -0.87 0.00 0.00 -1.51 0.00 0.00 177.39 175.63 1k2n n GLN 711 N -0.98 0.00 -3.84 3.23 10.64 -1.26 -4.76 117.38 120.41 1k2n n GLN 711 Ca 0.00 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.82 1k2n n GLN 711 Cb 0.00 0.00 -0.12 0.00 -0.86 0.00 0.00 30.24 29.26 1k2n n GLN 711 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.06 173.40 1k2n s GLU 712 N 0.00 1.92 -0.36 2.61 -1.05 -1.26 -4.97 118.70 115.59 1k2n s GLU 712 Ca 0.00 -1.92 -0.00 0.00 -0.15 0.00 0.00 54.97 52.90 1k2n s GLU 712 Cb 0.00 -3.50 0.09 0.00 -0.44 0.00 0.00 34.13 30.28 1k2n s GLU 712 CO 0.00 -1.05 0.10 -0.65 0.95 0.00 0.00 175.26 174.60 1k2n s GLN 713 N 0.94 1.93 0.00 -4.83 -0.21 -1.26 -5.02 119.66 111.20 1k2n s GLN 713 Ca 0.10 -1.70 0.00 0.00 0.02 0.00 0.00 55.36 53.77 1k2n s GLN 713 Cb -0.22 -3.34 0.00 0.00 1.00 0.00 0.00 33.01 30.45 1k2n s GLN 713 CO -0.05 -0.91 0.00 2.89 -2.12 0.00 0.00 175.29 175.10 1k2n n ARG 714 N 4.48 0.00 -4.62 2.91 -4.01 -1.26 -4.90 116.66 109.26 1k2n n ARG 714 Ca -0.03 0.00 -0.27 0.00 -1.04 0.00 0.00 57.85 56.51 1k2n n ARG 714 Cb 0.42 0.00 -0.14 0.00 -3.04 0.00 0.00 32.46 29.70 1k2n n ARG 714 CO 0.00 0.00 0.00 0.14 -3.04 0.00 0.00 177.63 174.73 1k2n s VAL 715 N -0.04 1.89 0.03 8.89 -7.23 -1.26 -5.00 120.40 117.68 1k2n s VAL 715 Ca 0.00 -1.39 -0.30 0.00 -1.81 0.00 0.00 61.98 58.48 1k2n s VAL 715 Cb 0.00 -1.65 -0.04 0.00 0.56 0.00 0.00 36.38 35.25 1k2n s VAL 715 CO 0.00 0.19 1.09 0.54 -0.31 0.00 0.00 175.10 176.61 1k2n s VAL 716 N -0.90 4.44 0.45 1.32 0.11 -1.26 -4.65 120.40 119.92 1k2n s VAL 716 Ca 0.09 1.76 0.07 0.00 -2.93 0.00 0.00 61.98 60.98 1k2n s VAL 716 Cb -0.09 -4.13 -0.01 0.00 -1.53 0.00 0.00 36.38 30.62 1k2n s VAL 716 CO 0.03 0.14 0.35 -0.76 -3.33 0.00 0.00 175.10 171.53 1k2n s LEU 717 N 0.99 3.14 0.30 2.54 1.02 -0.59 -4.96 118.68 121.12 1k2n s LEU 717 Ca 0.55 -0.95 -0.00 0.00 0.02 0.00 0.00 54.13 53.75 1k2n s LEU 717 Cb -0.25 -1.68 -0.04 0.00 0.02 0.00 0.00 46.19 44.24 1k2n s LEU 717 CO 0.29 -0.76 0.49 -0.54 0.02 0.00 0.00 176.35 175.85 1k2n s LYS 718 N -4.13 3.51 0.32 1.70 1.02 -1.26 -1.07 119.74 119.83 1k2n s LYS 718 Ca 0.43 -0.33 0.02 0.00 0.02 0.00 0.00 55.97 56.10 1k2n s LYS 718 Cb -0.01 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 34.54 1k2n s LYS 718 CO 0.25 0.24 0.50 -0.65 -0.92 0.00 0.00 175.35 174.78 1k2n s GLN 719 N -3.96 3.45 0.23 1.68 -0.21 -0.91 -4.71 119.66 115.24 1k2n s GLN 719 Ca 0.39 -0.46 0.00 0.00 0.02 0.00 0.00 55.36 55.31 1k2n s GLN 719 Cb -0.10 -2.72 -0.00 0.00 1.00 0.00 0.00 33.01 31.19 1k2n s GLN 719 CO 0.33 0.20 0.00 0.25 -2.12 0.00 0.00 175.29 173.95 1k2n n THR 720 N -1.70 0.00 -0.16 -0.19 -2.24 -1.26 -4.98 114.28 103.75 1k2n n THR 720 Ca -0.06 -1.11 0.16 0.00 -2.27 0.00 0.00 64.05 60.78 1k2n n THR 720 Cb 0.56 0.23 0.52 0.00 -2.10 0.00 0.00 70.33 69.54 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 1.12 2.16 -0.18 6.98 0.00 -2.00 -1.06 119.26 126.29 1k2n h ALA 721 Ca -0.19 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1k2n h ALA 721 Cb 0.59 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1k2n h ALA 721 CO 0.32 -0.37 0.11 1.49 0.00 0.00 0.00 179.25 180.80 1k2n h GLU 722 N 0.38 0.24 -0.09 0.00 4.81 -2.00 -1.79 114.58 116.13 1k2n h GLU 722 Ca 0.37 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 1k2n h GLU 722 Cb 0.90 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 1k2n h GLU 722 CO -0.11 0.20 0.03 1.49 -0.73 0.00 0.00 179.01 179.88 1k2n h GLU 723 N 0.21 0.13 -0.80 1.92 4.22 -1.61 -2.69 114.58 115.97 1k2n h GLU 723 Ca 0.06 -0.03 0.18 0.00 0.08 0.00 0.00 59.36 59.66 1k2n h GLU 723 Cb 0.02 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1k2n h GLU 723 CO -0.01 0.30 0.54 -0.22 -2.18 0.00 0.00 179.01 177.44 1k2n h LYS 724 N -0.05 0.30 -0.34 1.92 3.64 -1.21 0.11 116.57 120.94 1k2n h LYS 724 Ca 0.03 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 1k2n h LYS 724 Cb 0.22 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1k2n h LYS 724 CO -0.00 0.20 -0.28 0.22 -2.27 0.00 0.00 179.45 177.32 1k2n h ASP 725 N 0.31 0.72 -0.65 4.20 1.82 -1.00 -1.60 116.42 120.22 1k2n h ASP 725 Ca 0.40 -0.27 0.06 0.00 -0.39 0.00 0.00 57.03 56.83 1k2n h ASP 725 Cb 1.09 -0.20 -0.05 0.00 0.68 0.00 0.00 39.33 40.85 1k2n h ASP 725 CO -0.11 0.96 0.35 -0.07 -1.61 0.00 0.00 179.24 178.76 1k2n h LEU 726 N 0.60 0.51 0.00 2.28 3.38 -0.56 -1.51 115.31 120.02 1k2n h LEU 726 Ca 0.08 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1k2n h LEU 726 Cb 0.78 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1k2n h LEU 726 CO 0.06 0.33 -0.21 1.62 0.09 0.00 0.00 178.44 180.34 1k2n h VAL 727 N 0.65 0.21 -0.47 1.22 3.04 -1.44 -3.24 116.25 116.21 1k2n h VAL 727 Ca 0.29 -1.30 -0.12 0.00 -1.01 0.00 0.00 66.70 64.56 1k2n h VAL 727 Cb 0.19 2.06 -0.01 0.00 -2.01 0.00 0.00 31.29 31.52 1k2n h VAL 727 CO -0.19 0.12 -0.19 0.11 -1.01 0.00 0.00 177.57 176.41 1k2n h LYS 728 N 0.00 0.94 0.00 4.17 1.57 -0.30 -2.59 116.57 120.36 1k2n h LYS 728 Ca -0.00 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1k2n h LYS 728 Cb 1.10 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1k2n h LYS 728 CO 0.02 1.05 0.00 1.63 -0.57 0.00 0.00 179.45 181.57 1k2n n LYS 729 N -4.12 0.09 0.00 3.15 5.02 -0.80 -5.09 118.16 116.41 1k2n n LYS 729 Ca 0.00 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1k2n n LYS 729 Cb 0.44 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 1k2n n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77