#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2m h ASN 574 N 0.00 0.00 0.00 1.61 4.21 -2.03 -3.47 115.58 115.90 1k2m h ASN 574 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1k2m h ASN 574 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1k2m h ASN 574 CO 0.00 0.23 0.00 0.61 -1.29 0.00 0.00 177.43 176.98 1k2m n GLY 575 N 1.19 2.08 3.61 2.83 0.00 -1.26 -5.12 105.19 108.52 1k2m n GLY 575 Ca 0.01 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1k2m n GLY 575 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k2m s ARG 576 N 0.00 2.64 0.00 1.61 3.52 -1.26 -1.17 118.95 124.28 1k2m s ARG 576 Ca 0.00 -0.66 0.00 0.00 -0.13 0.00 0.00 55.73 54.94 1k2m s ARG 576 Cb 0.00 -2.55 0.00 0.00 -1.56 0.00 0.00 34.95 30.84 1k2m s ARG 576 CO 0.00 0.62 0.00 0.34 -0.81 0.00 0.00 175.30 175.45 1k2m n PHE 577 N 1.68 0.00 -4.68 5.12 -0.00 -0.92 -3.99 117.46 114.68 1k2m n PHE 577 Ca -0.16 0.00 -0.24 0.00 -0.00 0.00 0.00 57.45 57.05 1k2m n PHE 577 Cb 0.53 0.00 -0.15 0.00 -0.00 0.00 0.00 39.48 39.86 1k2m n PHE 577 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1k2m s LEU 578 N -4.74 2.09 -0.20 -2.13 2.96 -1.14 -1.92 118.68 113.59 1k2m s LEU 578 Ca 0.00 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 1k2m s LEU 578 Cb 0.00 -0.85 0.04 0.00 0.50 0.00 0.00 46.19 45.89 1k2m s LEU 578 CO 0.00 0.16 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.21 1k2m s THR 579 N -0.58 1.58 -0.37 3.68 2.01 0.41 0.60 115.64 122.96 1k2m s THR 579 Ca 0.06 -1.00 -0.09 0.00 0.31 0.00 0.00 61.69 60.97 1k2m s THR 579 Cb -0.07 -1.68 0.04 0.00 0.01 0.00 0.00 72.50 70.80 1k2m s THR 579 CO 0.00 0.14 0.18 -0.76 -0.69 0.00 0.00 174.62 173.49 1k2m s LEU 580 N 1.42 4.66 -0.41 4.42 1.02 0.39 0.20 118.68 130.38 1k2m s LEU 580 Ca -0.02 -1.16 -0.04 0.00 0.02 0.00 0.00 54.13 52.94 1k2m s LEU 580 Cb -0.16 -1.96 0.11 0.00 0.02 0.00 0.00 46.19 44.20 1k2m s LEU 580 CO -0.08 -0.40 0.21 -1.59 0.02 0.00 0.00 176.35 174.51 1k2m s LYS 581 N 1.47 2.07 -0.75 1.70 0.00 0.13 0.20 119.74 124.57 1k2m s LYS 581 Ca 0.01 -1.79 -0.33 0.00 0.00 0.00 0.00 55.97 53.86 1k2m s LYS 581 Cb -0.20 -3.60 -0.18 0.00 0.00 0.00 0.00 37.83 33.85 1k2m s LYS 581 CO 0.04 -1.06 2.49 -2.30 0.00 0.00 0.00 175.35 174.52 1k2m n PRO 582 N 4.63 0.30 -1.73 1.78 -0.02 0.95 -2.44 135.00 138.46 1k2m n PRO 582 Ca -0.03 0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.17 1k2m n PRO 582 Cb 0.41 -1.93 0.04 0.00 -0.02 0.00 0.00 33.50 32.00 1k2m n PRO 582 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1k2m s LEU 583 N 8.76 3.26 0.62 2.45 2.34 -0.88 -2.12 118.68 133.11 1k2m s LEU 583 Ca 1.24 1.68 0.27 0.00 0.06 0.00 0.00 54.13 57.37 1k2m s LEU 583 Cb -1.08 -4.51 1.32 0.00 -0.56 0.00 0.00 46.19 41.36 1k2m s LEU 583 CO 0.48 -1.34 1.74 1.55 -1.06 0.00 0.00 176.35 177.72 1k2m h PRO 584 N -0.32 0.00 0.00 1.48 0.13 -1.89 0.23 132.00 131.62 1k2m h PRO 584 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1k2m h PRO 584 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1k2m h PRO 584 CO 0.57 0.00 -0.01 -0.44 -0.23 0.00 0.00 178.00 177.89 1k2m h ASP 585 N 0.00 0.00 -2.96 1.44 5.19 -1.91 -3.41 116.42 114.76 1k2m h ASP 585 Ca 0.19 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 56.06 1k2m h ASP 585 Cb 1.40 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.88 1k2m h ASP 585 CO -0.00 0.01 -0.31 -0.55 -3.12 0.00 0.00 179.24 175.27 1k2m s SER 586 N -6.36 6.42 0.32 6.45 0.15 0.82 -4.82 113.70 116.67 1k2m s SER 586 Ca -0.05 0.48 0.16 0.00 0.70 0.00 0.00 55.95 57.25 1k2m s SER 586 Cb 0.15 -2.04 0.88 0.00 -1.71 0.00 0.00 66.02 63.30 1k2m s SER 586 CO 0.58 -0.04 1.43 2.30 1.20 0.00 0.00 173.24 178.71 1k2m n ILE 587 N -0.52 0.78 -4.70 6.45 -5.35 -1.16 -4.41 119.36 110.46 1k2m n ILE 587 Ca -0.04 0.74 -0.33 0.00 -0.27 0.00 0.00 62.75 62.85 1k2m n ILE 587 Cb 0.53 -1.74 -0.13 0.00 -1.74 0.00 0.00 39.64 36.56 1k2m n ILE 587 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 1k2m s ILE 588 N -3.40 3.29 -0.78 7.28 2.07 -1.26 -5.05 121.20 123.35 1k2m s ILE 588 Ca -0.02 -0.59 0.03 0.00 -1.41 0.00 0.00 60.65 58.66 1k2m s ILE 588 Cb 0.05 -2.39 0.27 0.00 0.13 0.00 0.00 42.46 40.52 1k2m s ILE 588 CO 0.15 0.53 1.00 0.00 -1.91 0.00 0.00 174.94 174.70 1k2m n GLN 589 N 3.28 3.20 -4.52 3.50 3.00 -1.26 -4.13 117.38 120.45 1k2m n GLN 589 Ca -0.18 -4.65 -0.24 0.00 -0.01 0.00 0.00 57.00 51.92 1k2m n GLN 589 Cb 0.53 -2.34 -0.10 0.00 0.00 0.00 0.00 30.24 28.32 1k2m n GLN 589 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1k2m s GLU 590 N -2.65 1.78 -0.07 -1.09 2.02 -0.90 -5.01 118.70 112.79 1k2m s GLU 590 Ca 0.38 -2.01 0.02 0.00 0.02 0.00 0.00 54.97 53.38 1k2m s GLU 590 Cb 0.12 -1.11 0.01 0.00 0.10 0.00 0.00 34.13 33.25 1k2m s GLU 590 CO 0.02 -0.17 -0.13 -1.54 0.02 0.00 0.00 175.26 173.46 1k2m s SER 591 N -3.58 1.86 -0.08 -0.19 1.04 -1.26 -0.03 113.70 111.45 1k2m s SER 591 Ca 0.34 -0.31 0.01 0.00 0.48 0.00 0.00 55.95 56.47 1k2m s SER 591 Cb 0.09 -0.85 -0.02 0.00 0.10 0.00 0.00 66.02 65.33 1k2m s SER 591 CO 0.16 0.04 -0.11 -0.76 0.98 0.00 0.00 173.24 173.55 1k2m s LEU 592 N 0.63 2.90 -0.24 2.42 1.43 0.55 -4.92 118.68 121.44 1k2m s LEU 592 Ca -0.15 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1k2m s LEU 592 Cb -0.16 -1.63 0.06 0.00 0.03 0.00 0.00 46.19 44.49 1k2m s LEU 592 CO 0.04 0.29 -0.08 -1.61 0.23 0.00 0.00 176.35 175.22 1k2m s GLU 593 N -0.38 1.85 -0.47 1.70 2.02 -1.26 0.15 118.70 122.30 1k2m s GLU 593 Ca 0.05 -1.06 -0.29 0.00 0.02 0.00 0.00 54.97 53.68 1k2m s GLU 593 Cb -0.12 -2.64 0.02 0.00 0.10 0.00 0.00 34.13 31.49 1k2m s GLU 593 CO 0.02 -0.56 1.21 0.42 0.02 0.00 0.00 175.26 176.37 1k2m s ILE 594 N 1.32 4.11 -0.19 -1.63 1.01 0.20 -4.97 121.20 121.05 1k2m s ILE 594 Ca -0.06 1.13 -0.29 0.00 0.00 0.00 0.00 60.65 61.43 1k2m s ILE 594 Cb -0.19 -4.51 -0.04 0.00 0.01 0.00 0.00 42.46 37.73 1k2m s ILE 594 CO -0.06 -0.97 1.70 -1.10 0.00 0.00 0.00 174.94 174.51 1k2m s GLN 595 N 4.62 3.79 0.56 2.79 1.11 -1.26 -2.16 119.66 129.12 1k2m s GLN 595 Ca 0.51 1.81 0.39 0.00 0.01 0.00 0.00 55.36 58.09 1k2m s GLN 595 Cb -0.09 -4.07 1.53 0.00 -1.01 0.00 0.00 33.01 29.36 1k2m s GLN 595 CO 0.32 -1.31 1.67 -0.56 0.01 0.00 0.00 175.29 175.42 1k2m h GLN 596 N 11.03 0.00 0.00 2.91 -0.00 -1.41 1.02 115.11 128.67 1k2m h GLN 596 Ca -0.36 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.27 1k2m h GLN 596 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.65 1k2m h GLN 596 CO 0.99 0.00 -0.09 0.78 -0.00 0.00 0.00 178.83 180.51 1k2m h GLY 597 N 0.00 0.00 -7.75 0.06 0.00 -1.88 -3.41 103.07 90.08 1k2m h GLY 597 Ca 0.65 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 47.33 1k2m h GLY 597 CO -0.01 0.00 -0.54 0.14 0.00 0.00 0.00 176.54 176.13 1k2m s VAL 598 N -3.86 5.07 -0.04 4.60 1.01 0.35 -5.06 120.40 122.46 1k2m s VAL 598 Ca -0.01 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1k2m s VAL 598 Cb 0.11 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 33.09 1k2m s VAL 598 CO 0.56 0.24 0.04 0.21 0.00 0.00 0.00 175.10 176.15 1k2m s ASN 599 N 1.72 1.01 0.43 3.32 2.47 -1.26 -4.01 114.94 118.62 1k2m s ASN 599 Ca 0.07 0.03 -0.03 0.00 0.42 0.00 0.00 52.86 53.35 1k2m s ASN 599 Cb -0.16 -0.20 -0.03 0.00 -1.45 0.00 0.00 41.25 39.41 1k2m s ASN 599 CO 0.09 -0.21 0.69 -2.16 -3.72 0.00 0.00 177.10 171.80 1k2m s PRO 600 N 1.86 3.45 -0.27 0.43 0.04 -1.26 -5.03 135.00 134.22 1k2m s PRO 600 Ca 0.01 -0.06 -0.18 0.00 0.04 0.00 0.00 61.00 60.81 1k2m s PRO 600 Cb -0.12 -2.49 -0.02 0.00 0.04 0.00 0.00 34.50 31.90 1k2m s PRO 600 CO -0.03 -0.10 0.54 0.12 0.04 0.00 0.00 177.00 177.56 1k2m s PHE 601 N -2.58 3.26 -0.02 0.56 2.19 0.33 -4.88 117.98 116.83 1k2m s PHE 601 Ca 0.45 0.64 -0.15 0.00 0.33 0.00 0.00 56.93 58.19 1k2m s PHE 601 Cb -0.10 -2.77 -0.06 0.00 -1.31 0.00 0.00 43.02 38.79 1k2m s PHE 601 CO 0.41 -0.31 0.42 -0.06 1.83 0.00 0.00 175.22 177.51 1k2m s PHE 602 N 2.36 3.70 -0.00 10.12 0.08 -1.26 0.16 117.98 133.14 1k2m s PHE 602 Ca 0.22 0.98 0.04 0.00 0.12 0.00 0.00 56.93 58.30 1k2m s PHE 602 Cb -0.16 -2.34 -0.01 0.00 -0.57 0.00 0.00 43.02 39.94 1k2m s PHE 602 CO 0.09 0.57 -0.14 0.42 -0.10 0.00 0.00 175.22 176.06 1k2m s ILE 603 N -0.81 1.08 -4.00 0.64 1.09 0.46 0.16 121.20 119.82 1k2m s ILE 603 Ca 0.24 -0.66 0.00 0.00 -1.10 0.00 0.00 60.65 59.13 1k2m s ILE 603 Cb -0.17 -0.91 0.00 0.00 -1.06 0.00 0.00 42.46 40.32 1k2m s ILE 603 CO 0.13 0.24 0.00 0.61 -0.10 0.00 0.00 174.94 175.82 1k2m n GLY 604 N 2.58 -1.10 0.46 6.18 0.00 -1.16 -0.74 105.19 111.40 1k2m n GLY 604 Ca -0.15 -1.10 0.07 0.00 0.00 0.00 0.00 46.02 44.84 1k2m n GLY 604 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1k2m n ARG 605 N 0.00 1.59 -3.74 1.61 0.63 -0.09 -1.51 116.66 115.14 1k2m n ARG 605 Ca 0.00 -0.90 -0.36 0.00 -0.92 0.00 0.00 57.85 55.67 1k2m n ARG 605 Cb 0.00 -1.29 -0.10 0.00 0.45 0.00 0.00 32.46 31.52 1k2m n ARG 605 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1k2m s SER 606 N -1.30 5.93 0.63 6.15 0.15 -0.95 -4.79 113.70 119.51 1k2m s SER 606 Ca 0.25 0.08 0.33 0.00 0.70 0.00 0.00 55.95 57.31 1k2m s SER 606 Cb 0.13 -2.06 1.83 0.00 -1.71 0.00 0.00 66.02 64.21 1k2m s SER 606 CO 0.19 0.08 2.11 -0.33 1.20 0.00 0.00 173.24 176.50 1k2m h GLU 607 N 7.38 0.00 0.00 5.44 5.08 -1.89 0.25 114.58 130.83 1k2m h GLU 607 Ca -0.38 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.95 1k2m h GLU 607 Cb 1.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1k2m h GLU 607 CO 0.66 0.00 -0.15 -0.44 -1.00 0.00 0.00 179.01 178.08 1k2m h ASP 608 N 0.00 0.00 -3.08 1.42 5.19 -1.93 -3.42 116.42 114.60 1k2m h ASP 608 Ca 0.05 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 55.92 1k2m h ASP 608 Cb 0.44 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 1k2m h ASP 608 CO -0.00 0.15 0.68 0.00 -3.12 0.00 0.00 179.24 176.96 1k2m h ASN 610 N 7.30 0.17 -3.31 0.00 -0.26 -1.31 -3.36 115.58 114.81 1k2m h ASN 610 Ca -0.38 0.08 -0.66 0.00 -0.56 0.00 0.00 56.30 54.78 1k2m h ASN 610 Cb 1.18 0.07 -0.17 0.00 -1.06 0.00 0.00 38.32 38.35 1k2m h ASN 610 CO 0.86 -0.09 -0.62 0.00 -1.06 0.00 0.00 177.43 176.52 1k2m s LYS 612 N -0.41 2.75 -0.18 0.00 1.02 -1.26 -2.99 119.74 118.67 1k2m s LYS 612 Ca 0.08 -1.01 -0.04 0.00 0.02 0.00 0.00 55.97 55.01 1k2m s LYS 612 Cb -0.12 -2.84 0.06 0.00 -0.52 0.00 0.00 37.83 34.41 1k2m s LYS 612 CO 0.02 -0.38 0.07 0.42 -0.92 0.00 0.00 175.35 174.56 1k2m s ILE 613 N 1.26 0.17 -0.62 2.17 -1.09 -0.57 -4.98 121.20 117.54 1k2m s ILE 613 Ca -0.00 -0.34 -0.25 0.00 -2.23 0.00 0.00 60.65 57.82 1k2m s ILE 613 Cb -0.16 -0.77 0.04 0.00 -1.58 0.00 0.00 42.46 39.99 1k2m s ILE 613 CO -0.07 -0.26 1.08 -1.61 -1.23 0.00 0.00 174.94 172.85 1k2m s GLU 614 N 2.02 3.29 -0.17 2.79 2.02 -1.26 -3.31 118.70 124.08 1k2m s GLU 614 Ca 0.01 -0.27 -0.02 0.00 0.02 0.00 0.00 54.97 54.71 1k2m s GLU 614 Cb -0.16 -4.11 0.05 0.00 0.10 0.00 0.00 34.13 30.00 1k2m s GLU 614 CO -0.09 -1.75 -0.01 -0.51 0.02 0.00 0.00 175.26 172.93 1k2m s ASP 615 N 3.25 2.80 0.30 -0.19 1.11 -1.26 -5.03 116.67 117.65 1k2m s ASP 615 Ca 0.32 -0.71 0.01 0.00 0.18 0.00 0.00 52.55 52.35 1k2m s ASP 615 Cb -0.11 -0.73 0.72 0.00 1.07 0.00 0.00 42.92 43.86 1k2m s ASP 615 CO 0.18 -0.25 1.60 0.78 1.18 0.00 0.00 175.17 178.66 1k2m h ASN 616 N 8.19 -0.31 0.36 0.27 2.35 -2.02 0.90 115.58 125.32 1k2m h ASN 616 Ca -0.19 0.25 -0.10 0.00 -0.55 0.00 0.00 56.30 55.70 1k2m h ASN 616 Cb 1.11 0.40 -0.01 0.00 0.05 0.00 0.00 38.32 39.87 1k2m h ASN 616 CO 0.35 -0.28 -0.44 0.03 -1.65 0.00 0.00 177.43 175.45 1k2m h ARG 617 N 0.07 0.09 -7.28 0.81 -0.00 -2.00 -3.44 114.38 102.63 1k2m h ARG 617 Ca 0.57 -0.04 -0.52 0.00 -0.50 0.00 0.00 59.98 59.48 1k2m h ARG 617 Cb 1.16 -0.00 0.16 0.00 0.00 0.00 0.00 29.97 31.29 1k2m h ARG 617 CO -0.81 0.51 0.29 -0.51 0.00 0.00 0.00 179.97 179.46 1k2m s LEU 618 N -8.10 3.01 0.37 3.04 1.02 0.31 -4.79 118.68 113.54 1k2m s LEU 618 Ca -0.03 2.04 0.08 0.00 0.02 0.00 0.00 54.13 56.24 1k2m s LEU 618 Cb 0.14 -4.55 -0.05 0.00 0.02 0.00 0.00 46.19 41.75 1k2m s LEU 618 CO 0.75 -2.47 0.11 -0.94 0.02 0.00 0.00 176.35 173.83 1k2m s SER 619 N -2.91 4.38 0.10 2.29 1.04 -1.26 -4.77 113.70 112.57 1k2m s SER 619 Ca 0.65 -1.00 -0.25 0.00 0.48 0.00 0.00 55.95 55.84 1k2m s SER 619 Cb -0.21 -0.55 -0.08 0.00 0.10 0.00 0.00 66.02 65.29 1k2m s SER 619 CO 0.55 -0.39 1.41 0.08 0.98 0.00 0.00 173.24 175.87 1k2m h ARG 620 N 1.58 -0.22 -2.18 4.02 0.11 -1.93 0.03 114.38 115.79 1k2m h ARG 620 Ca -0.43 0.02 -0.74 0.00 0.10 0.00 0.00 59.98 58.93 1k2m h ARG 620 Cb 1.25 0.05 -0.32 0.00 1.11 0.00 0.00 29.97 32.07 1k2m h ARG 620 CO 0.68 -0.15 0.53 0.28 0.10 0.00 0.00 179.97 181.41 1k2m n VAL 621 N -4.72 4.81 -0.22 0.08 0.31 -1.26 -2.24 118.33 115.08 1k2m n VAL 621 Ca -0.02 -5.59 0.00 0.00 -0.01 0.00 0.00 64.34 58.72 1k2m n VAL 621 Cb 0.24 -1.45 0.08 0.00 -0.91 0.00 0.00 33.84 31.80 1k2m n VAL 621 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1k2m h HIS 622 N 3.64 -0.30 -2.46 3.52 2.76 -0.87 -3.38 115.15 118.06 1k2m h HIS 622 Ca 0.43 0.06 0.02 0.00 -2.20 0.00 0.00 60.37 58.68 1k2m h HIS 622 Cb 0.36 0.23 -0.15 0.00 1.55 0.00 0.00 27.41 29.40 1k2m h HIS 622 CO 1.16 -0.27 0.32 0.00 -1.30 0.00 0.00 177.93 177.85 1k2m s PHE 624 N -2.83 0.02 -0.18 0.00 -0.71 0.14 0.18 117.98 114.60 1k2m s PHE 624 Ca -0.00 -0.06 -0.08 0.00 -1.04 0.00 0.00 56.93 55.75 1k2m s PHE 624 Cb -0.01 -0.04 -0.04 0.00 -1.21 0.00 0.00 43.02 41.71 1k2m s PHE 624 CO -0.06 -0.20 0.10 0.42 -1.34 0.00 0.00 175.22 174.13 1k2m s ILE 625 N -0.96 5.13 -0.05 -4.49 1.01 0.42 0.19 121.20 122.46 1k2m s ILE 625 Ca -0.11 0.09 0.05 0.00 0.00 0.00 0.00 60.65 60.68 1k2m s ILE 625 Cb -0.06 -3.31 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 1k2m s ILE 625 CO 0.01 0.48 -0.20 0.12 0.00 0.00 0.00 174.94 175.34 1k2m s PHE 626 N 0.15 1.96 -0.13 3.97 5.36 0.54 0.12 117.98 129.95 1k2m s PHE 626 Ca 0.07 -0.57 -0.11 0.00 -0.96 0.00 0.00 56.93 55.36 1k2m s PHE 626 Cb -0.12 -1.31 -0.05 0.00 -0.34 0.00 0.00 43.02 41.21 1k2m s PHE 626 CO -0.00 -0.18 0.24 0.21 -1.46 0.00 0.00 175.22 174.03 1k2m s LYS 627 N -0.05 3.99 0.08 10.12 2.47 -1.26 0.19 119.74 135.28 1k2m s LYS 627 Ca -0.03 0.02 0.01 0.00 -1.56 0.00 0.00 55.97 54.41 1k2m s LYS 627 Cb -0.12 -3.33 -0.04 0.00 -1.46 0.00 0.00 37.83 32.87 1k2m s LYS 627 CO 0.03 0.46 -0.06 0.21 0.16 0.00 0.00 175.35 176.14 1k2m s LYS 628 N -0.16 0.76 -0.37 4.03 2.36 0.14 -4.93 119.74 121.57 1k2m s LYS 628 Ca 0.15 -1.28 -0.29 0.00 -2.55 0.00 0.00 55.97 52.01 1k2m s LYS 628 Cb -0.13 -0.11 0.01 0.00 -1.05 0.00 0.00 37.83 36.56 1k2m s LYS 628 CO 0.04 -0.04 1.29 0.50 1.55 0.00 0.00 175.35 178.69 1k2m s ARG 629 N -3.74 3.77 0.00 4.03 6.06 -1.26 0.15 118.95 127.95 1k2m s ARG 629 Ca 0.10 0.99 -0.30 0.00 -2.50 0.00 0.00 55.73 54.02 1k2m s ARG 629 Cb 0.05 -3.92 -0.03 0.00 0.06 0.00 0.00 34.95 31.11 1k2m s ARG 629 CO -0.06 -1.31 0.99 -1.58 -2.50 0.00 0.00 175.30 170.84 1k2m s HIS 630 N 4.70 3.65 -0.01 5.12 5.65 0.79 -4.87 115.29 130.33 1k2m s HIS 630 Ca 0.56 1.68 -0.03 0.00 0.25 0.00 0.00 55.06 57.51 1k2m s HIS 630 Cb -0.13 -3.13 -0.00 0.00 -1.18 0.00 0.00 32.58 28.13 1k2m s HIS 630 CO 0.27 -0.07 0.07 0.00 -0.65 0.00 0.00 174.74 174.36 1k2m s ALA 631 N 1.03 -0.15 -0.12 1.58 0.00 -1.26 -1.10 121.76 121.75 1k2m s ALA 631 Ca 0.52 -0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.41 1k2m s ALA 631 Cb -0.21 -0.01 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1k2m s ALA 631 CO 0.28 -0.11 -0.05 0.14 0.00 0.00 0.00 175.76 176.02 1k2m s VAL 632 N -0.65 3.83 -0.02 0.00 -7.23 -1.22 -5.01 120.40 110.10 1k2m s VAL 632 Ca -0.07 -0.40 -0.03 0.00 -1.81 0.00 0.00 61.98 59.67 1k2m s VAL 632 Cb -0.04 -2.63 -0.27 0.00 0.56 0.00 0.00 36.38 33.99 1k2m s VAL 632 CO 0.00 0.54 0.77 1.23 -0.31 0.00 0.00 175.10 177.33 1k2m h GLY 633 N 6.06 0.27 -7.48 2.32 0.00 -2.01 -3.44 103.07 98.78 1k2m h GLY 633 Ca -0.39 -0.70 -0.65 0.00 0.00 0.00 0.00 47.33 45.59 1k2m h GLY 633 CO 0.58 0.61 -0.59 1.25 0.00 0.00 0.00 176.54 178.39 1k2m s LYS 634 N -2.61 3.65 -0.14 4.80 2.20 -1.26 -5.07 119.74 121.31 1k2m s LYS 634 Ca -0.11 -0.49 -0.07 0.00 -0.36 0.00 0.00 55.97 54.94 1k2m s LYS 634 Cb 0.07 -3.43 0.06 0.00 -1.51 0.00 0.00 37.83 33.01 1k2m s LYS 634 CO 0.84 -0.23 0.33 -1.54 -0.36 0.00 0.00 175.35 174.39 1k2m s SER 635 N 1.64 -0.26 -0.80 1.43 1.04 -1.26 -5.06 113.70 110.44 1k2m s SER 635 Ca 0.06 0.72 -0.21 0.00 0.48 0.00 0.00 55.95 57.00 1k2m s SER 635 Cb -0.16 0.69 -0.15 0.00 0.10 0.00 0.00 66.02 66.50 1k2m s SER 635 CO 0.06 -0.19 1.94 1.15 0.98 0.00 0.00 173.24 177.17 1k2m n MET 636 N 4.54 1.56 0.00 4.02 0.00 -1.26 -4.72 117.12 121.27 1k2m n MET 636 Ca -0.20 -1.87 0.00 0.00 0.00 0.00 0.00 57.70 55.64 1k2m n MET 636 Cb 0.53 -2.92 0.00 0.00 0.00 0.00 0.00 33.22 30.83 1k2m n MET 636 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1k2m n TYR 637 N 7.37 0.00 -3.39 3.17 4.01 -1.26 -4.50 117.16 122.56 1k2m n TYR 637 Ca 0.50 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.79 1k2m n TYR 637 Cb 0.40 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.35 1k2m n TYR 637 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1k2m s GLU 638 N 0.00 2.97 0.06 -0.72 2.02 -1.26 -5.05 118.70 116.72 1k2m s GLU 638 Ca 0.00 -1.34 0.03 0.00 0.02 0.00 0.00 54.97 53.68 1k2m s GLU 638 Cb 0.00 -4.12 -0.03 0.00 0.10 0.00 0.00 34.13 30.08 1k2m s GLU 638 CO 0.00 -1.01 -0.09 0.45 0.02 0.00 0.00 175.26 174.62 1k2m s SER 639 N 2.55 1.18 1.08 -0.19 0.15 -1.26 -5.12 113.70 112.08 1k2m s SER 639 Ca 0.04 -0.66 -0.17 0.00 0.70 0.00 0.00 55.95 55.86 1k2m s SER 639 Cb -0.24 0.02 0.23 0.00 -1.71 0.00 0.00 66.02 64.32 1k2m s SER 639 CO 0.07 -0.22 1.17 -2.16 1.20 0.00 0.00 173.24 173.30 1k2m s PRO 640 N -2.09 -0.25 0.00 5.44 0.04 -1.26 -4.23 135.00 132.66 1k2m s PRO 640 Ca -0.03 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 60.95 1k2m s PRO 640 Cb -0.07 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.76 1k2m s PRO 640 CO 0.00 -3.07 0.00 0.00 0.04 0.00 0.00 177.00 173.97 1k2m n ALA 641 N -4.31 0.00 -0.59 8.56 0.00 -1.26 -4.83 120.51 118.08 1k2m n ALA 641 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1k2m n ALA 641 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1k2m n ALA 641 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1k2m n GLN 642 N 0.00 0.00 -2.75 0.00 1.13 -1.26 -3.66 117.38 110.84 1k2m n GLN 642 Ca 0.00 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 55.02 1k2m n GLN 642 Cb 0.00 0.00 0.02 0.00 0.11 0.00 0.00 30.24 30.37 1k2m n GLN 642 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1k2m n GLY 643 N 0.00 -0.63 0.00 1.08 0.00 -1.26 -3.41 105.19 100.97 1k2m n GLY 643 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1k2m n GLY 643 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k2m n LEU 644 N 2.71 0.00 -4.52 0.99 4.77 -0.26 -4.87 117.00 115.82 1k2m n LEU 644 Ca 0.16 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.84 1k2m n LEU 644 Cb 0.58 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.56 1k2m n LEU 644 CO -0.02 0.00 -0.46 -1.81 -1.33 0.00 0.00 177.39 173.77 1k2m s ASP 645 N 0.39 4.11 0.02 -1.43 1.01 -1.26 0.28 116.67 119.79 1k2m s ASP 645 Ca 0.00 -0.43 0.02 0.00 0.71 0.00 0.00 52.55 52.85 1k2m s ASP 645 Cb 0.00 -0.71 -0.02 0.00 1.01 0.00 0.00 42.92 43.21 1k2m s ASP 645 CO 0.00 0.20 -0.07 -1.81 0.21 0.00 0.00 175.17 173.70 1k2m s ASP 646 N -1.95 0.80 -0.24 0.27 1.01 0.39 -3.51 116.67 113.44 1k2m s ASP 646 Ca 0.18 -0.37 -0.15 0.00 0.71 0.00 0.00 52.55 52.92 1k2m s ASP 646 Cb -0.11 -0.01 -0.04 0.00 1.01 0.00 0.00 42.92 43.77 1k2m s ASP 646 CO 0.10 -0.09 0.37 0.27 0.21 0.00 0.00 175.17 176.03 1k2m s ILE 647 N -0.88 5.19 -0.17 0.77 -4.36 -1.26 0.28 121.20 120.77 1k2m s ILE 647 Ca -0.05 0.61 -0.06 0.00 -0.26 0.00 0.00 60.65 60.89 1k2m s ILE 647 Cb -0.07 -3.70 -0.04 0.00 1.25 0.00 0.00 42.46 39.90 1k2m s ILE 647 CO 0.00 0.21 0.03 0.26 0.24 0.00 0.00 174.94 175.68 1k2m s TRP 648 N 1.68 3.18 -0.32 1.37 0.52 0.50 -1.04 118.94 124.84 1k2m s TRP 648 Ca 0.16 -0.04 -0.20 0.00 0.02 0.00 0.00 56.10 56.04 1k2m s TRP 648 Cb -0.15 -2.04 -0.01 0.00 -1.15 0.00 0.00 33.47 30.12 1k2m s TRP 648 CO 0.09 0.10 0.62 -0.47 0.02 0.00 0.00 176.95 177.30 1k2m s TYR 649 N 0.37 3.20 -0.06 -1.98 6.14 0.18 0.20 117.35 125.39 1k2m s TYR 649 Ca 0.01 0.52 -0.04 0.00 0.64 0.00 0.00 57.07 58.20 1k2m s TYR 649 Cb -0.13 -3.01 -0.04 0.00 0.42 0.00 0.00 41.96 39.21 1k2m s TYR 649 CO 0.01 -0.50 0.11 0.00 0.64 0.00 0.00 175.55 175.81 1k2m s HIS 651 N -1.10 2.25 0.00 0.00 2.46 -0.14 0.28 115.29 119.03 1k2m s HIS 651 Ca 0.19 -1.01 0.00 0.00 0.47 0.00 0.00 55.06 54.71 1k2m s HIS 651 Cb -0.12 -1.56 0.00 0.00 -0.13 0.00 0.00 32.58 30.77 1k2m s HIS 651 CO 0.09 -0.46 0.42 0.25 -2.47 0.00 0.00 174.74 172.56 1k2m n THR 652 N 3.90 0.02 -2.75 0.89 -2.24 -0.37 0.14 114.28 113.87 1k2m n THR 652 Ca -0.20 -0.42 -0.35 0.00 -2.27 0.00 0.00 64.05 60.82 1k2m n THR 652 Cb 0.52 1.17 -0.06 0.00 -2.10 0.00 0.00 70.33 69.86 1k2m n THR 652 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k2m s GLY 653 N -0.02 2.56 0.41 3.38 0.00 0.52 -4.79 107.32 109.39 1k2m s GLY 653 Ca 0.00 0.49 0.21 0.00 0.00 0.00 0.00 44.72 45.42 1k2m s GLY 653 CO 0.00 0.84 1.82 0.00 0.00 0.00 0.00 173.10 175.76 1k2m h THR 654 N 2.11 0.81 0.00 0.90 1.03 -1.93 -2.84 112.91 113.00 1k2m h THR 654 Ca -0.48 -1.25 0.00 0.00 -0.01 0.00 0.00 66.41 64.67 1k2m h THR 654 Cb 1.19 1.77 0.00 0.00 -1.07 0.00 0.00 68.15 70.04 1k2m h THR 654 CO 0.62 0.30 0.00 0.59 -0.01 0.00 0.00 175.52 177.02 1k2m n ASN 655 N -3.59 0.00 -1.91 0.00 4.13 -1.26 -4.90 115.26 107.73 1k2m n ASN 655 Ca -0.01 0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.31 1k2m n ASN 655 Cb 0.44 -0.26 0.00 0.00 -1.54 0.00 0.00 39.78 38.41 1k2m n ASN 655 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09 1k2m n VAL 656 N -1.26 -8.03 -2.95 2.41 3.14 -1.07 -4.81 118.33 105.76 1k2m n VAL 656 Ca 0.06 2.38 -0.22 0.00 -2.96 0.00 0.00 64.34 63.60 1k2m n VAL 656 Cb 0.10 -3.64 0.02 0.00 -1.06 0.00 0.00 33.84 29.26 1k2m n VAL 656 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1k2m s SER 657 N -0.90 5.72 -0.07 6.55 0.15 -0.57 -4.57 113.70 120.01 1k2m s SER 657 Ca 0.00 0.17 -0.01 0.00 0.70 0.00 0.00 55.95 56.80 1k2m s SER 657 Cb 0.00 -1.34 0.03 0.00 -1.71 0.00 0.00 66.02 63.00 1k2m s SER 657 CO 0.00 -0.78 0.00 -0.31 1.20 0.00 0.00 173.24 173.35 1k2m s TYR 658 N -2.57 0.64 -0.60 3.44 1.51 0.30 0.14 117.35 120.21 1k2m s TYR 658 Ca 0.50 -0.15 -0.19 0.00 -1.01 0.00 0.00 57.07 56.22 1k2m s TYR 658 Cb -0.10 -0.77 0.11 0.00 -0.11 0.00 0.00 41.96 41.08 1k2m s TYR 658 CO 0.37 -0.31 0.72 -1.17 -1.11 0.00 0.00 175.55 174.05 1k2m s LEU 659 N 1.90 5.40 0.00 -1.29 1.98 0.63 -0.65 118.68 126.65 1k2m s LEU 659 Ca 0.04 -1.47 0.00 0.00 -2.89 0.00 0.00 54.13 49.81 1k2m s LEU 659 Cb -0.12 -2.30 0.00 0.00 0.66 0.00 0.00 46.19 44.42 1k2m s LEU 659 CO -0.05 -1.11 0.00 -3.20 -1.89 0.00 0.00 176.35 170.10 1k2m n ASN 660 N 6.32 0.00 0.00 3.68 2.85 -1.00 -0.75 115.26 126.36 1k2m n ASN 660 Ca -0.08 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.39 1k2m n ASN 660 Cb 0.43 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.45 1k2m n ASN 660 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1k2m n ASN 661 N 1.39 0.18 -4.76 1.20 5.15 -1.26 -5.03 115.26 112.13 1k2m n ASN 661 Ca 0.00 -0.57 -0.36 0.00 -0.60 0.00 0.00 54.58 53.05 1k2m n ASN 661 Cb 0.00 0.21 -0.07 0.00 -0.53 0.00 0.00 39.78 39.39 1k2m n ASN 661 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1k2m s ASN 662 N -0.21 6.38 0.31 1.20 -0.87 0.07 -5.07 114.94 116.76 1k2m s ASN 662 Ca 0.00 0.45 -0.28 0.00 -1.57 0.00 0.00 52.86 51.46 1k2m s ASN 662 Cb 0.00 -2.14 -0.09 0.00 -0.02 0.00 0.00 41.25 38.99 1k2m s ASN 662 CO 0.00 0.18 1.07 -0.13 -2.57 0.00 0.00 177.10 175.65 1k2m s ARG 663 N 0.12 4.53 -0.26 -0.60 0.52 -1.26 -0.27 118.95 121.73 1k2m s ARG 663 Ca 0.14 1.69 0.02 0.00 -0.52 0.00 0.00 55.73 57.06 1k2m s ARG 663 Cb -0.12 -3.02 0.06 0.00 0.52 0.00 0.00 34.95 32.39 1k2m s ARG 663 CO 0.03 0.15 -0.10 -1.64 0.02 0.00 0.00 175.30 173.76 1k2m s MET 664 N -1.71 2.30 0.25 3.54 -1.94 0.36 -4.87 119.30 117.24 1k2m s MET 664 Ca 0.48 -1.31 -0.14 0.00 -1.71 0.00 0.00 55.69 53.00 1k2m s MET 664 Cb -0.28 -2.91 -0.08 0.00 2.01 0.00 0.00 34.83 33.56 1k2m s MET 664 CO 0.36 -0.56 0.65 0.96 -0.01 0.00 0.00 175.02 176.42 1k2m s ILE 665 N 1.13 4.76 -0.83 2.53 -4.36 -1.26 -1.51 121.20 121.66 1k2m s ILE 665 Ca -0.08 0.85 -0.25 0.00 -0.26 0.00 0.00 60.65 60.91 1k2m s ILE 665 Cb -0.20 -3.67 -0.19 0.00 1.25 0.00 0.00 42.46 39.65 1k2m s ILE 665 CO -0.05 -0.02 2.50 1.67 0.24 0.00 0.00 174.94 179.28 1k2m n GLN 666 N 0.07 0.36 0.00 0.37 7.27 -1.26 -1.91 117.38 122.28 1k2m n GLN 666 Ca 0.00 -0.10 0.00 0.00 0.07 0.00 0.00 57.00 56.97 1k2m n GLN 666 Cb 0.52 -2.22 0.00 0.00 2.41 0.00 0.00 30.24 30.95 1k2m n GLN 666 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1k2m n GLY 667 N 6.23 1.00 3.13 1.69 0.00 0.37 -4.92 105.19 112.69 1k2m n GLY 667 Ca 0.56 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.49 1k2m n GLY 667 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k2m s THR 668 N -1.99 0.26 0.16 2.61 -4.23 -0.80 -3.08 115.64 108.57 1k2m s THR 668 Ca 0.00 -1.87 0.06 0.00 -1.18 0.00 0.00 61.69 58.70 1k2m s THR 668 Cb 0.00 -1.76 -0.04 0.00 1.34 0.00 0.00 72.50 72.04 1k2m s THR 668 CO 0.00 -0.77 -0.13 -1.59 -0.54 0.00 0.00 174.62 171.59 1k2m s LYS 669 N -3.95 1.14 -0.04 3.99 -2.85 0.32 -0.97 119.74 117.38 1k2m s LYS 669 Ca 0.14 -1.43 -0.10 0.00 -1.00 0.00 0.00 55.97 53.58 1k2m s LYS 669 Cb 0.07 -0.90 0.02 0.00 -2.06 0.00 0.00 37.83 34.96 1k2m s LYS 669 CO -0.04 0.15 0.24 0.12 0.10 0.00 0.00 175.35 175.91 1k2m s PHE 670 N -2.78 -0.14 0.17 1.78 2.19 -0.07 0.55 117.98 119.68 1k2m s PHE 670 Ca 0.16 0.27 -0.31 0.00 0.33 0.00 0.00 56.93 57.38 1k2m s PHE 670 Cb -0.01 0.05 -0.09 0.00 -1.31 0.00 0.00 43.02 41.66 1k2m s PHE 670 CO 0.04 -0.27 1.42 -1.17 1.83 0.00 0.00 175.22 177.06 1k2m s LEU 671 N -0.87 4.38 -0.19 6.12 1.98 -1.26 0.47 118.68 129.31 1k2m s LEU 671 Ca -0.10 2.47 -0.06 0.00 -2.89 0.00 0.00 54.13 53.55 1k2m s LEU 671 Cb -0.05 -3.60 -0.03 0.00 0.66 0.00 0.00 46.19 43.17 1k2m s LEU 671 CO 0.02 -0.68 0.04 -0.76 -1.89 0.00 0.00 176.35 173.08 1k2m s LEU 672 N 0.61 3.59 0.24 -0.68 1.43 -0.20 -4.87 118.68 118.80 1k2m s LEU 672 Ca 0.63 -0.03 0.11 0.00 -1.03 0.00 0.00 54.13 53.81 1k2m s LEU 672 Cb -0.39 -1.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.87 1k2m s LEU 672 CO 0.34 0.13 -0.14 -1.10 0.23 0.00 0.00 176.35 175.82 1k2m s GLN 673 N 0.59 1.88 -0.58 1.70 -0.21 -0.75 -4.25 119.66 118.05 1k2m s GLN 673 Ca 0.02 -1.53 -0.27 0.00 0.02 0.00 0.00 55.36 53.60 1k2m s GLN 673 Cb -0.13 -1.96 -0.10 0.00 1.00 0.00 0.00 33.01 31.82 1k2m s GLN 673 CO 0.02 0.37 2.46 -3.47 -2.12 0.00 0.00 175.29 172.55 1k2m n ASP 674 N -0.38 1.99 0.00 5.90 -0.08 -1.26 -0.52 116.55 122.20 1k2m n ASP 674 Ca -0.08 -0.47 0.00 0.00 -1.51 0.00 0.00 54.79 52.73 1k2m n ASP 674 Cb 0.58 -1.50 0.00 0.00 2.34 0.00 0.00 41.12 42.54 1k2m n ASP 674 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k2m n GLY 675 N 6.11 1.97 3.59 0.27 0.00 0.60 -4.85 105.19 112.88 1k2m n GLY 675 Ca 0.42 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.01 1k2m n GLY 675 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k2m s ASP 676 N -2.00 6.60 -0.46 1.61 2.15 0.32 -4.73 116.67 120.17 1k2m s ASP 676 Ca 0.00 0.44 -0.18 0.00 0.43 0.00 0.00 52.55 53.24 1k2m s ASP 676 Cb 0.00 -2.42 0.04 0.00 -0.30 0.00 0.00 42.92 40.24 1k2m s ASP 676 CO 0.00 -0.77 0.53 -0.70 -0.17 0.00 0.00 175.17 174.06 1k2m s GLU 677 N 3.21 3.12 -0.16 4.34 2.12 -1.26 0.10 118.70 130.18 1k2m s GLU 677 Ca 0.34 -0.80 -0.03 0.00 0.36 0.00 0.00 54.97 54.84 1k2m s GLU 677 Cb -0.13 -4.02 -0.02 0.00 0.26 0.00 0.00 34.13 30.22 1k2m s GLU 677 CO 0.17 -1.02 -0.06 0.42 -0.54 0.00 0.00 175.26 174.24 1k2m s ILE 678 N 2.36 3.63 -0.32 -3.70 1.01 -0.31 -2.39 121.20 121.48 1k2m s ILE 678 Ca 0.14 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.23 1k2m s ILE 678 Cb -0.18 -2.59 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1k2m s ILE 678 CO 0.13 0.49 0.19 -0.54 0.00 0.00 0.00 174.94 175.21 1k2m s LYS 679 N 0.52 3.45 0.16 2.79 1.02 0.17 -1.42 119.74 126.43 1k2m s LYS 679 Ca -0.04 -0.66 0.24 0.00 0.02 0.00 0.00 55.97 55.53 1k2m s LYS 679 Cb -0.15 -3.68 0.30 0.00 -0.52 0.00 0.00 37.83 33.78 1k2m s LYS 679 CO 0.03 -0.41 1.30 -0.84 -0.92 0.00 0.00 175.35 174.51 1k2m h ILE 680 N 5.56 0.00 -2.39 2.17 3.07 -1.79 0.86 117.51 124.99 1k2m h ILE 680 Ca -0.32 -0.62 -0.06 0.00 1.55 0.00 0.00 64.86 65.41 1k2m h ILE 680 Cb 1.15 1.23 -0.24 0.00 -0.27 0.00 0.00 36.82 38.69 1k2m h ILE 680 CO 0.62 0.00 -0.17 -0.63 -1.05 0.00 0.00 178.15 176.92 1k2m s ILE 681 N -3.21 -0.02 -0.02 0.16 1.01 -1.24 -4.05 121.20 113.83 1k2m s ILE 681 Ca 0.05 0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.76 1k2m s ILE 681 Cb 0.12 -0.76 0.02 0.00 0.01 0.00 0.00 42.46 41.85 1k2m s ILE 681 CO 0.73 0.02 -0.01 0.86 0.00 0.00 0.00 174.94 176.54 1k2m s TRP 682 N 1.47 0.34 -0.23 3.97 -0.00 -1.26 0.09 118.94 123.32 1k2m s TRP 682 Ca -0.10 -0.03 -0.00 0.00 -0.00 0.00 0.00 56.10 55.98 1k2m s TRP 682 Cb -0.07 -0.38 0.03 0.00 -0.00 0.00 0.00 33.47 33.05 1k2m s TRP 682 CO -0.15 -0.11 -0.12 0.34 -0.00 0.00 0.00 176.95 176.92 1k2m s ASP 683 N 0.77 3.94 0.04 5.86 -1.08 0.15 -4.98 116.67 121.36 1k2m s ASP 683 Ca -0.08 -0.86 -0.21 0.00 -0.52 0.00 0.00 52.55 50.88 1k2m s ASP 683 Cb -0.11 -1.59 -0.14 0.00 -1.46 0.00 0.00 42.92 39.62 1k2m s ASP 683 CO -0.01 -0.09 1.40 0.11 0.52 0.00 0.00 175.17 177.10 1k2m h LYS 684 N 7.95 0.26 0.20 4.34 1.57 -1.95 -0.64 116.57 128.30 1k2m h LYS 684 Ca -0.35 -0.11 -0.33 0.00 -1.87 0.00 0.00 60.65 57.99 1k2m h LYS 684 Cb 1.11 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.43 1k2m h LYS 684 CO 0.58 0.58 -1.57 -0.91 -0.57 0.00 0.00 179.45 177.56 1k2m h ASN 685 N -0.07 0.66 1.44 0.86 2.35 -1.98 -3.32 115.58 115.52 1k2m h ASN 685 Ca 0.03 -0.93 0.00 0.00 -0.55 0.00 0.00 56.30 54.85 1k2m h ASN 685 Cb 0.50 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1k2m h ASN 685 CO 0.02 1.72 0.00 -1.13 -1.65 0.00 0.00 177.43 176.39 1k2m h ASN 686 N 0.04 0.00 -0.01 5.81 -1.24 -1.99 -3.46 115.58 114.73 1k2m h ASN 686 Ca -0.30 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.71 1k2m h ASN 686 Cb 2.06 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 41.11 1k2m h ASN 686 CO 0.20 0.00 -0.00 0.29 -1.29 0.00 0.00 177.43 176.62 1k2m n LYS 687 N -2.97 -1.39 -2.85 6.67 4.01 -0.25 -4.93 118.16 116.45 1k2m n LYS 687 Ca 0.02 0.36 -0.43 0.00 -0.51 0.00 0.00 58.31 57.75 1k2m n LYS 687 Cb 0.40 -4.41 -0.04 0.00 -0.51 0.00 0.00 35.03 30.47 1k2m n LYS 687 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 1k2m s PHE 688 N -1.32 2.78 -0.05 2.13 5.36 -1.22 -4.87 117.98 120.80 1k2m s PHE 688 Ca 0.00 -0.11 0.06 0.00 -0.96 0.00 0.00 56.93 55.92 1k2m s PHE 688 Cb 0.00 -4.09 -0.01 0.00 -0.34 0.00 0.00 43.02 38.59 1k2m s PHE 688 CO 0.00 -1.39 -0.23 0.54 -1.46 0.00 0.00 175.22 172.69 1k2m s VAL 689 N 3.93 1.86 -0.09 3.12 0.11 -1.26 -0.68 120.40 127.39 1k2m s VAL 689 Ca 0.29 -0.96 0.04 0.00 -2.93 0.00 0.00 61.98 58.42 1k2m s VAL 689 Cb -0.13 -1.58 -0.00 0.00 -1.53 0.00 0.00 36.38 33.14 1k2m s VAL 689 CO 0.18 0.52 -0.23 -0.51 -3.33 0.00 0.00 175.10 171.72 1k2m s ILE 690 N -0.10 2.15 -0.25 7.04 1.10 0.11 -2.98 121.20 128.27 1k2m s ILE 690 Ca -0.04 -1.00 -0.18 0.00 -0.51 0.00 0.00 60.65 58.92 1k2m s ILE 690 Cb -0.13 -1.81 0.07 0.00 0.15 0.00 0.00 42.46 40.74 1k2m s ILE 690 CO 0.03 0.56 0.63 -0.83 -2.11 0.00 0.00 174.94 173.22 1k2m s GLY 691 N 0.18 -0.52 0.08 1.50 0.00 -1.26 -2.78 107.32 104.52 1k2m s GLY 691 Ca -0.13 1.99 0.07 0.00 0.00 0.00 0.00 44.72 46.65 1k2m s GLY 691 CO 0.07 1.88 -0.13 -1.36 0.00 0.00 0.00 173.10 173.56 1k2m s PHE 692 N 0.95 2.67 -0.32 1.90 0.08 -0.51 -2.07 117.98 120.69 1k2m s PHE 692 Ca -0.05 -0.19 -0.12 0.00 0.12 0.00 0.00 56.93 56.69 1k2m s PHE 692 Cb -0.05 -1.44 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 1k2m s PHE 692 CO -0.09 0.37 0.21 0.21 -0.10 0.00 0.00 175.22 175.82 1k2m s LYS 693 N -1.92 3.58 0.03 0.44 2.20 -1.02 -1.17 119.74 121.88 1k2m s LYS 693 Ca 0.18 -0.57 -0.30 0.00 -0.36 0.00 0.00 55.97 54.92 1k2m s LYS 693 Cb -0.11 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.46 1k2m s LYS 693 CO 0.10 -0.37 0.97 0.08 -0.36 0.00 0.00 175.35 175.78 1k2m s VAL 694 N 1.71 4.77 -0.21 4.02 1.01 0.29 -0.70 120.40 131.29 1k2m s VAL 694 Ca 0.06 2.06 -0.03 0.00 0.00 0.00 0.00 61.98 64.07 1k2m s VAL 694 Cb -0.17 -4.32 0.07 0.00 0.00 0.00 0.00 36.38 31.96 1k2m s VAL 694 CO 0.10 0.20 0.05 -0.70 0.00 0.00 0.00 175.10 174.75 1k2m s GLU 695 N 0.74 0.61 -0.58 2.72 2.12 0.53 0.22 118.70 125.06 1k2m s GLU 695 Ca 0.51 -0.47 -0.28 0.00 0.36 0.00 0.00 54.97 55.08 1k2m s GLU 695 Cb -0.22 -2.05 0.02 0.00 0.26 0.00 0.00 34.13 32.14 1k2m s GLU 695 CO 0.28 -0.69 1.36 0.42 -0.54 0.00 0.00 175.26 176.09 1k2m s ILE 696 N 1.86 3.83 -0.18 -3.70 1.01 -1.26 -0.45 121.20 122.32 1k2m s ILE 696 Ca 0.01 0.71 -0.17 0.00 0.00 0.00 0.00 60.65 61.19 1k2m s ILE 696 Cb -0.17 -4.53 -0.22 0.00 0.01 0.00 0.00 42.46 37.56 1k2m s ILE 696 CO -0.11 -1.25 0.28 0.78 0.00 0.00 0.00 174.94 174.64 1k2m h ASN 697 N 10.67 0.14 -3.75 3.58 -0.26 -1.71 -3.47 115.58 120.78 1k2m h ASN 697 Ca -0.26 -0.66 -0.69 0.00 -0.56 0.00 0.00 56.30 54.13 1k2m h ASN 697 Cb 1.08 -0.05 -0.20 0.00 -1.06 0.00 0.00 38.32 38.10 1k2m h ASN 697 CO 1.19 1.60 -0.71 -0.62 -1.06 0.00 0.00 177.43 177.83 1k2m s ASP 698 N -6.92 4.49 -0.38 5.81 -1.08 -1.19 -5.05 116.67 112.35 1k2m s ASP 698 Ca -0.26 -0.07 -0.01 0.00 -0.52 0.00 0.00 52.55 51.68 1k2m s ASP 698 Cb 0.06 -1.08 0.10 0.00 -1.46 0.00 0.00 42.92 40.54 1k2m s ASP 698 CO 0.65 0.35 0.14 0.28 0.52 0.00 0.00 175.17 177.12 1k2m s THR 699 N -0.81 2.96 -0.41 1.71 -1.32 -1.26 -4.54 115.64 111.96 1k2m s THR 699 Ca 0.13 -2.10 -0.18 0.00 -1.21 0.00 0.00 61.69 58.32 1k2m s THR 699 Cb -0.11 -3.05 -0.18 0.00 -1.51 0.00 0.00 72.50 67.66 1k2m s THR 699 CO 0.02 -0.63 1.68 1.07 -2.21 0.00 0.00 174.62 174.55 1k2m n THR 700 N 4.49 1.02 -3.94 5.08 5.66 -1.26 -4.18 114.28 121.16 1k2m n THR 700 Ca -0.01 -0.77 -0.26 0.00 -3.05 0.00 0.00 64.05 59.95 1k2m n THR 700 Cb 0.42 -2.04 -0.01 0.00 -1.55 0.00 0.00 70.33 67.15 1k2m n THR 700 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1k2m n GLY 701 N 4.44 -0.29 3.85 1.09 0.00 -1.26 -4.92 105.19 108.10 1k2m n GLY 701 Ca 0.39 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 46.24 1k2m n GLY 701 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1k2m s LEU 702 N -6.98 2.37 -0.27 0.99 2.34 -1.26 -4.60 118.68 111.26 1k2m s LEU 702 Ca 0.17 -1.53 -0.29 0.00 0.06 0.00 0.00 54.13 52.54 1k2m s LEU 702 Cb -0.09 -0.87 -0.02 0.00 -0.56 0.00 0.00 46.19 44.65 1k2m s LEU 702 CO 0.87 -1.04 1.60 0.72 -1.06 0.00 0.00 176.35 177.44 1k2m s PHE 703 N -2.87 2.13 0.00 3.48 -0.12 -1.23 -4.52 117.98 114.85 1k2m s PHE 703 Ca 0.14 0.60 0.00 0.00 -0.05 0.00 0.00 56.93 57.62 1k2m s PHE 703 Cb -0.01 -4.04 0.00 0.00 -0.63 0.00 0.00 43.02 38.34 1k2m s PHE 703 CO 0.09 -2.73 0.00 -1.71 -0.05 0.00 0.00 175.22 170.82 1k2m n ASN 704 N 8.77 0.00 0.00 1.98 5.15 -1.26 -2.94 115.26 126.96 1k2m n ASN 704 Ca 0.19 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.17 1k2m n ASN 704 Cb 0.46 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.71 1k2m n ASN 704 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1k2m n GLU 705 N 0.00 0.00 0.00 1.20 0.28 -1.26 -4.86 120.64 116.00 1k2m n GLU 705 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1k2m n GLU 705 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1k2m n GLU 705 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1k2m n GLY 706 N 0.00 0.00 0.07 -1.84 0.00 -1.15 -4.56 105.19 97.71 1k2m n GLY 706 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 1k2m n GLY 706 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k2m n LEU 707 N 0.00 0.25 -3.28 0.99 4.32 -1.26 -1.80 117.00 116.21 1k2m n LEU 707 Ca 0.00 0.02 -0.22 0.00 -0.02 0.00 0.00 56.01 55.79 1k2m n LEU 707 Cb 0.00 -0.11 0.02 0.00 -1.62 0.00 0.00 43.42 41.71 1k2m n LEU 707 CO 0.00 0.04 -0.31 0.61 -1.22 0.00 0.00 177.39 176.52 1k2m n GLY 708 N 1.15 -0.38 3.00 -0.72 0.00 -1.26 -4.95 105.19 102.03 1k2m n GLY 708 Ca 0.19 0.82 -0.31 0.00 0.00 0.00 0.00 46.02 46.72 1k2m n GLY 708 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1k2m s MET 709 N -2.03 1.62 0.00 1.61 0.23 -1.26 -4.69 119.30 114.79 1k2m s MET 709 Ca 0.24 -1.61 0.00 0.00 -1.03 0.00 0.00 55.69 53.29 1k2m s MET 709 Cb -0.03 -2.98 0.00 0.00 -1.53 0.00 0.00 34.83 30.29 1k2m s MET 709 CO 0.62 -0.82 0.00 1.47 -2.03 0.00 0.00 175.02 174.26 1k2m n LEU 710 N 4.38 0.00 -0.21 0.18 -0.00 -1.26 -5.04 117.00 115.04 1k2m n LEU 710 Ca -0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 55.98 1k2m n LEU 710 Cb 0.42 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 43.95 1k2m n LEU 710 CO 0.21 0.00 1.02 1.56 -0.00 0.00 0.00 177.39 180.18 1k2m h GLN 711 N 0.00 0.48 -6.13 1.47 4.20 -1.98 -3.40 115.11 109.75 1k2m h GLN 711 Ca 0.00 -0.03 -0.56 0.00 0.06 0.00 0.00 58.65 58.12 1k2m h GLN 711 Cb 0.00 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.62 1k2m h GLN 711 CO 0.00 0.32 0.36 -1.21 -0.67 0.00 0.00 178.83 177.63 1k2m s GLU 712 N -6.09 4.41 -0.68 1.46 0.41 -1.26 -5.00 118.70 111.95 1k2m s GLU 712 Ca -0.13 1.16 -0.25 0.00 -0.41 0.00 0.00 54.97 55.34 1k2m s GLU 712 Cb 0.17 -3.51 0.05 0.00 -1.78 0.00 0.00 34.13 29.05 1k2m s GLU 712 CO 0.75 -0.18 1.10 -0.65 -0.49 0.00 0.00 175.26 175.79 1k2m s GLN 713 N 1.58 3.17 -0.38 1.61 -0.21 -1.26 -4.51 119.66 119.66 1k2m s GLN 713 Ca 0.43 -0.51 -0.26 0.00 0.02 0.00 0.00 55.36 55.05 1k2m s GLN 713 Cb -0.18 -4.19 0.04 0.00 1.00 0.00 0.00 33.01 29.68 1k2m s GLN 713 CO 0.18 -1.93 0.52 0.54 -2.12 0.00 0.00 175.29 172.48 1k2m n ARG 714 N 8.41 -1.93 -4.78 2.91 5.12 -1.26 -5.01 116.66 120.13 1k2m n ARG 714 Ca -0.00 1.61 -0.26 0.00 -1.93 0.00 0.00 57.85 57.27 1k2m n ARG 714 Cb 0.47 -3.04 -0.15 0.00 -1.16 0.00 0.00 32.46 28.59 1k2m n ARG 714 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1k2m s VAL 715 N -1.70 1.63 -0.15 1.55 -7.23 -1.26 -4.96 120.40 108.27 1k2m s VAL 715 Ca 0.28 -1.06 -0.28 0.00 -1.81 0.00 0.00 61.98 59.11 1k2m s VAL 715 Cb -0.04 -1.39 -0.01 0.00 0.56 0.00 0.00 36.38 35.50 1k2m s VAL 715 CO 0.73 0.30 0.96 0.54 -0.31 0.00 0.00 175.10 177.32 1k2m s VAL 716 N -0.66 4.79 0.42 1.32 0.11 -1.26 -4.63 120.40 120.49 1k2m s VAL 716 Ca 0.07 1.91 0.00 0.00 -2.93 0.00 0.00 61.98 61.04 1k2m s VAL 716 Cb -0.08 -4.26 -0.01 0.00 -1.53 0.00 0.00 36.38 30.50 1k2m s VAL 716 CO 0.01 -0.03 0.64 -0.76 -3.33 0.00 0.00 175.10 171.63 1k2m s LEU 717 N 2.31 3.75 0.05 2.54 1.02 0.19 -4.92 118.68 123.62 1k2m s LEU 717 Ca 0.44 0.34 0.01 0.00 0.02 0.00 0.00 54.13 54.94 1k2m s LEU 717 Cb -0.17 -3.22 -0.04 0.00 0.02 0.00 0.00 46.19 42.78 1k2m s LEU 717 CO 0.14 -0.59 0.12 -0.75 0.02 0.00 0.00 176.35 175.29 1k2m s LYS 718 N -4.49 3.11 0.29 1.70 2.20 -1.26 0.12 119.74 121.41 1k2m s LYS 718 Ca 0.46 -0.55 0.02 0.00 -0.36 0.00 0.00 55.97 55.54 1k2m s LYS 718 Cb -0.10 -2.87 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 1k2m s LYS 718 CO 0.37 0.60 0.46 1.14 -0.36 0.00 0.00 175.35 177.57 1k2m s GLN 719 N -2.26 3.47 0.17 4.03 -2.07 -1.18 -4.70 119.66 117.13 1k2m s GLN 719 Ca 0.29 -0.52 0.00 0.00 -1.82 0.00 0.00 55.36 53.31 1k2m s GLN 719 Cb -0.12 -2.77 -0.00 0.00 -1.09 0.00 0.00 33.01 29.03 1k2m s GLN 719 CO 0.22 0.28 0.00 0.25 -1.32 0.00 0.00 175.29 174.72 1k2m n THR 720 N -1.57 0.00 -0.05 3.63 -2.24 -1.26 -4.91 114.28 107.88 1k2m n THR 720 Ca -0.07 -0.81 0.23 0.00 -2.27 0.00 0.00 64.05 61.13 1k2m n THR 720 Cb 0.56 0.17 0.72 0.00 -2.10 0.00 0.00 70.33 69.68 1k2m n THR 720 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k2m h ALA 721 N 1.09 2.54 -0.14 6.98 0.00 -2.00 -0.35 119.26 127.38 1k2m h ALA 721 Ca -0.14 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1k2m h ALA 721 Cb 0.43 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1k2m h ALA 721 CO 0.24 -0.83 -0.01 1.49 0.00 0.00 0.00 179.25 180.14 1k2m h GLU 722 N 0.00 0.04 -0.12 0.00 4.81 -1.99 0.34 114.58 117.66 1k2m h GLU 722 Ca 0.30 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.51 1k2m h GLU 722 Cb 1.30 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 1k2m h GLU 722 CO -0.00 0.03 -0.03 0.93 -0.73 0.00 0.00 179.01 179.21 1k2m h GLU 723 N 0.04 0.23 -0.56 1.92 3.07 -1.47 -2.79 114.58 115.02 1k2m h GLU 723 Ca 0.07 -0.09 0.11 0.00 -0.50 0.00 0.00 59.36 58.95 1k2m h GLU 723 Cb 0.08 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 27.95 1k2m h GLU 723 CO -0.12 0.53 0.39 -0.22 -1.40 0.00 0.00 179.01 178.18 1k2m h LYS 724 N -0.08 0.27 -0.38 2.33 1.63 -1.14 0.30 116.57 119.50 1k2m h LYS 724 Ca 0.03 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.72 1k2m h LYS 724 Cb 0.44 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.99 1k2m h LYS 724 CO 0.01 0.18 -0.16 0.22 -3.45 0.00 0.00 179.45 176.25 1k2m h ASP 725 N 0.28 0.70 -0.56 4.20 1.82 -0.07 -2.45 116.42 120.35 1k2m h ASP 725 Ca 0.27 -0.22 0.03 0.00 -0.39 0.00 0.00 57.03 56.72 1k2m h ASP 725 Cb 0.67 -0.19 -0.04 0.00 0.68 0.00 0.00 39.33 40.45 1k2m h ASP 725 CO -0.06 0.87 0.32 -0.07 -1.61 0.00 0.00 179.24 178.70 1k2m h LEU 726 N 0.63 0.50 -1.11 2.28 3.38 -0.71 -1.33 115.31 118.96 1k2m h LEU 726 Ca 0.10 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1k2m h LEU 726 Cb 0.63 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1k2m h LEU 726 CO 0.04 0.35 -0.25 1.62 0.09 0.00 0.00 178.44 180.29 1k2m h VAL 727 N 0.63 0.63 -0.38 1.22 3.04 -1.42 -2.92 116.25 117.05 1k2m h VAL 727 Ca 0.23 -1.18 0.05 0.00 -1.01 0.00 0.00 66.70 64.79 1k2m h VAL 727 Cb 0.07 1.78 -0.02 0.00 -2.01 0.00 0.00 31.29 31.11 1k2m h VAL 727 CO -0.12 0.25 0.26 0.50 -1.01 0.00 0.00 177.57 177.44 1k2m h LYS 728 N 0.00 0.30 -0.31 4.17 3.64 -0.75 -1.29 116.57 122.33 1k2m h LYS 728 Ca -0.00 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.23 1k2m h LYS 728 Cb 0.76 -0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 32.43 1k2m h LYS 728 CO 0.03 0.20 -0.06 1.63 -2.27 0.00 0.00 179.45 178.98 1k2m n LYS 729 N -4.48 2.05 0.00 1.90 5.02 -1.11 -5.11 118.16 116.42 1k2m n LYS 729 Ca 0.04 -3.08 0.04 0.00 -2.02 0.00 0.00 58.31 53.28 1k2m n LYS 729 Cb 0.22 -1.81 0.21 0.00 -0.02 0.00 0.00 35.03 33.64 1k2m n LYS 729 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77