#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bak n SER 553 N 0.00 -7.17 -2.67 1.61 7.64 -1.26 -5.00 113.62 106.77 1bak n SER 553 Ca 0.00 1.08 -0.05 0.00 1.01 0.00 0.00 58.87 60.92 1bak n SER 553 Cb 0.00 -3.98 0.06 0.00 -1.01 0.00 0.00 64.21 59.28 1bak n SER 553 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1bak n HIS 554 N 1.37 -0.82 -3.66 1.43 8.25 -1.26 -5.08 115.22 115.46 1bak n HIS 554 Ca 0.00 -0.77 -0.15 0.00 -0.26 0.00 0.00 57.72 56.53 1bak n HIS 554 Cb 0.00 1.13 -0.08 0.00 1.12 0.00 0.00 29.99 32.16 1bak n HIS 554 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1bak s MET 555 N 0.34 0.83 0.00 -0.41 1.00 -1.26 -5.17 119.30 114.63 1bak s MET 555 Ca 0.26 0.01 0.00 0.00 0.00 0.00 0.00 55.69 55.96 1bak s MET 555 Cb 0.19 0.38 0.00 0.00 0.00 0.00 0.00 34.83 35.40 1bak s MET 555 CO -0.10 -0.24 0.00 0.41 0.00 0.00 0.00 175.02 175.09 1bak n GLY 556 N 1.16 2.36 2.55 -0.03 0.00 -1.26 -5.08 105.19 104.89 1bak n GLY 556 Ca -0.20 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.67 1bak n GLY 556 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bak n LYS 557 N -0.96 0.74 -3.26 1.61 0.00 -1.26 -5.03 118.16 110.00 1bak n LYS 557 Ca 0.00 -2.29 -0.03 0.00 0.00 0.00 0.00 58.31 55.99 1bak n LYS 557 Cb 0.00 -1.38 -0.05 0.00 0.00 0.00 0.00 35.03 33.60 1bak n LYS 557 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1bak s ASP 558 N -1.41 -0.47 0.35 3.14 -4.77 -1.26 -5.14 116.67 107.11 1bak s ASP 558 Ca 0.33 0.41 -0.27 0.00 -3.30 0.00 0.00 52.55 49.71 1bak s ASP 558 Cb 0.20 1.57 -0.09 0.00 -1.09 0.00 0.00 42.92 43.50 1bak s ASP 558 CO -0.19 -0.29 1.23 0.00 0.70 0.00 0.00 175.17 176.61 1bak h ILE 560 N 2.75 0.83 -4.28 0.00 2.04 0.10 -3.48 117.51 115.48 1bak h ILE 560 Ca -0.49 -1.77 -0.14 0.00 1.00 0.00 0.00 64.86 63.47 1bak h ILE 560 Cb 1.23 1.72 -0.15 0.00 -0.74 0.00 0.00 36.82 38.88 1bak h ILE 560 CO 0.64 0.28 -0.64 -0.32 0.00 0.00 0.00 178.15 178.12 1bak s MET 561 N -2.12 0.77 0.32 2.37 1.75 -0.80 -5.00 119.30 116.59 1bak s MET 561 Ca -0.17 -1.29 -0.14 0.00 -1.25 0.00 0.00 55.69 52.84 1bak s MET 561 Cb 0.01 0.24 0.02 0.00 2.84 0.00 0.00 34.83 37.94 1bak s MET 561 CO 0.43 -0.19 0.64 -3.38 -0.65 0.00 0.00 175.02 171.87 1bak s HIS 562 N -3.97 0.29 -3.09 4.11 -3.43 -1.26 -0.11 115.29 107.83 1bak s HIS 562 Ca 0.14 -0.76 0.00 0.00 -0.80 0.00 0.00 55.06 53.64 1bak s HIS 562 Cb 0.07 0.48 0.00 0.00 -1.43 0.00 0.00 32.58 31.71 1bak s HIS 562 CO -0.05 -1.28 0.00 0.41 -2.00 0.00 0.00 174.74 171.82 1bak n GLY 563 N -0.49 0.80 3.70 -1.38 0.00 -1.20 -5.00 105.19 101.61 1bak n GLY 563 Ca -0.04 -2.04 -0.38 0.00 0.00 0.00 0.00 46.02 43.55 1bak n GLY 563 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bak s TYR 564 N -1.76 3.46 -0.06 1.61 6.14 -1.26 -2.03 117.35 123.44 1bak s TYR 564 Ca 0.00 0.86 -0.03 0.00 0.64 0.00 0.00 57.07 58.54 1bak s TYR 564 Cb 0.00 -2.61 0.04 0.00 0.42 0.00 0.00 41.96 39.80 1bak s TYR 564 CO 0.00 0.05 0.15 -1.64 0.64 0.00 0.00 175.55 174.75 1bak s MET 565 N 1.05 0.11 -0.09 4.97 -1.94 0.74 -4.87 119.30 119.26 1bak s MET 565 Ca 0.26 0.35 -0.03 0.00 -1.71 0.00 0.00 55.69 54.56 1bak s MET 565 Cb -0.15 -0.14 -0.03 0.00 2.01 0.00 0.00 34.83 36.51 1bak s MET 565 CO 0.10 -0.14 0.02 -1.54 -0.01 0.00 0.00 175.02 173.45 1bak s SER 566 N 1.01 5.43 0.09 3.03 1.04 -0.70 -2.83 113.70 120.77 1bak s SER 566 Ca -0.08 0.20 -0.25 0.00 0.48 0.00 0.00 55.95 56.30 1bak s SER 566 Cb -0.10 -1.57 0.07 0.00 0.10 0.00 0.00 66.02 64.52 1bak s SER 566 CO -0.05 0.38 0.65 -0.75 0.98 0.00 0.00 173.24 174.45 1bak s LYS 567 N -0.91 1.18 -0.08 4.02 2.36 -1.20 0.15 119.74 125.26 1bak s LYS 567 Ca 0.14 -0.28 -0.31 0.00 -2.55 0.00 0.00 55.97 52.96 1bak s LYS 567 Cb -0.11 0.55 0.12 0.00 -1.05 0.00 0.00 37.83 37.33 1bak s LYS 567 CO 0.03 -0.49 1.38 0.00 1.55 0.00 0.00 175.35 177.82 1bak s MET 568 N -3.07 0.09 -0.30 4.03 0.23 -0.97 -4.66 119.30 114.66 1bak s MET 568 Ca -0.02 -0.06 -0.17 0.00 -1.03 0.00 0.00 55.69 54.42 1bak s MET 568 Cb -0.01 0.03 0.18 0.00 -1.53 0.00 0.00 34.83 33.50 1bak s MET 568 CO -0.07 -0.04 1.15 0.20 -2.03 0.00 0.00 175.02 174.22 1bak s GLY 569 N -3.54 0.08 0.23 3.16 0.00 -1.26 -2.36 107.32 103.64 1bak s GLY 569 Ca 0.25 3.39 -0.21 0.00 0.00 0.00 0.00 44.72 48.14 1bak s GLY 569 CO -0.04 3.27 0.95 -1.31 0.00 0.00 0.00 173.10 175.97 1bak s ASN 570 N 2.16 -0.05 0.00 1.64 0.01 -1.26 -5.00 114.94 112.44 1bak s ASN 570 Ca -0.01 -0.71 0.00 0.00 -0.71 0.00 0.00 52.86 51.43 1bak s ASN 570 Cb -0.03 0.59 0.00 0.00 0.41 0.00 0.00 41.25 42.22 1bak s ASN 570 CO -0.16 -1.15 0.46 -0.81 -1.51 0.00 0.00 177.10 173.93 1bak n PRO 571 N -0.59 0.76 -3.37 -0.60 -0.04 -1.26 -4.18 135.00 125.71 1bak n PRO 571 Ca -0.05 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.18 1bak n PRO 571 Cb 0.60 -1.32 -0.09 0.00 -0.04 0.00 0.00 33.50 32.64 1bak n PRO 571 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1bak s PHE 572 N -0.72 0.38 -1.08 0.54 0.08 -1.26 -5.06 117.98 110.85 1bak s PHE 572 Ca 0.00 -1.51 -0.18 0.00 0.12 0.00 0.00 56.93 55.36 1bak s PHE 572 Cb 0.00 -0.69 0.12 0.00 -0.57 0.00 0.00 43.02 41.88 1bak s PHE 572 CO 0.00 -0.90 1.36 -1.17 -0.10 0.00 0.00 175.22 174.41 1bak s LEU 573 N 0.90 4.59 0.00 -0.37 1.98 -1.26 -3.99 118.68 120.53 1bak s LEU 573 Ca 0.22 -2.26 0.00 0.00 -2.89 0.00 0.00 54.13 49.21 1bak s LEU 573 Cb -0.13 -2.46 0.00 0.00 0.66 0.00 0.00 46.19 44.27 1bak s LEU 573 CO -0.06 -1.07 0.00 1.07 -1.89 0.00 0.00 176.35 174.40 1bak n THR 574 N 5.63 0.00 -2.50 3.68 5.66 -1.26 -5.13 114.28 120.36 1bak n THR 574 Ca 0.33 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 61.07 1bak n THR 574 Cb 0.47 0.00 0.03 0.00 -1.55 0.00 0.00 70.33 69.28 1bak n THR 574 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1bak s GLN 575 N -0.78 2.89 -0.10 1.09 -2.07 -1.26 -5.10 119.66 114.33 1bak s GLN 575 Ca 0.00 -0.14 -0.05 0.00 -1.82 0.00 0.00 55.36 53.35 1bak s GLN 575 Cb 0.00 -2.33 0.05 0.00 -1.09 0.00 0.00 33.01 29.64 1bak s GLN 575 CO 0.00 -0.65 0.23 -1.58 -1.32 0.00 0.00 175.29 171.97 1bak s TRP 576 N -2.92 -0.31 -0.23 9.60 0.51 -1.26 -5.06 118.94 119.27 1bak s TRP 576 Ca 0.53 0.76 0.02 0.00 -2.12 0.00 0.00 56.10 55.29 1bak s TRP 576 Cb -0.10 0.02 0.04 0.00 -0.81 0.00 0.00 33.47 32.62 1bak s TRP 576 CO 0.43 -0.23 -0.13 1.14 -0.51 0.00 0.00 176.95 177.65 1bak s GLN 577 N 1.32 2.55 -0.37 4.98 -2.07 -1.26 -5.09 119.66 119.72 1bak s GLN 577 Ca -0.09 -1.14 -0.18 0.00 -1.82 0.00 0.00 55.36 52.13 1bak s GLN 577 Cb -0.11 -2.80 0.00 0.00 -1.09 0.00 0.00 33.01 29.02 1bak s GLN 577 CO -0.08 -0.44 0.50 0.50 -1.32 0.00 0.00 175.29 174.45 1bak s ARG 578 N 1.19 3.51 0.18 9.60 6.06 -1.26 -3.27 118.95 134.95 1bak s ARG 578 Ca -0.03 -0.29 0.01 0.00 -2.50 0.00 0.00 55.73 52.92 1bak s ARG 578 Cb -0.17 -3.84 -0.05 0.00 0.06 0.00 0.00 34.95 30.95 1bak s ARG 578 CO -0.08 -0.70 0.01 1.03 -2.50 0.00 0.00 175.30 173.07 1bak s ARG 579 N 2.37 1.12 -0.10 5.12 0.52 -1.13 -4.95 118.95 121.89 1bak s ARG 579 Ca 0.17 -1.54 -0.21 0.00 -0.52 0.00 0.00 55.73 53.63 1bak s ARG 579 Cb -0.16 -0.22 -0.04 0.00 0.52 0.00 0.00 34.95 35.06 1bak s ARG 579 CO 0.14 -0.16 0.60 -0.47 0.02 0.00 0.00 175.30 175.43 1bak s TYR 580 N -3.70 3.53 0.48 -0.53 6.14 0.29 -0.19 117.35 123.37 1bak s TYR 580 Ca 0.25 1.06 0.04 0.00 0.64 0.00 0.00 57.07 59.06 1bak s TYR 580 Cb 0.06 -2.70 -0.03 0.00 0.42 0.00 0.00 41.96 39.72 1bak s TYR 580 CO 0.04 0.09 0.07 -0.06 0.64 0.00 0.00 175.55 176.34 1bak s PHE 581 N 0.84 2.08 -0.20 4.97 0.40 -0.86 0.10 117.98 125.30 1bak s PHE 581 Ca 0.32 -0.83 -0.08 0.00 -0.60 0.00 0.00 56.93 55.74 1bak s PHE 581 Cb -0.16 -1.73 0.09 0.00 0.51 0.00 0.00 43.02 41.73 1bak s PHE 581 CO 0.14 0.20 0.44 0.71 0.70 0.00 0.00 175.22 177.41 1bak s TYR 582 N -2.79 -0.80 -0.35 0.36 2.02 0.17 -3.28 117.35 112.67 1bak s TYR 582 Ca 0.20 1.55 -0.19 0.00 -0.37 0.00 0.00 57.07 58.26 1bak s TYR 582 Cb 0.03 0.34 -0.00 0.00 -0.40 0.00 0.00 41.96 41.94 1bak s TYR 582 CO 0.11 -0.47 0.56 -1.17 -1.57 0.00 0.00 175.55 173.01 1bak s LEU 583 N 2.34 4.32 0.46 -1.29 2.96 0.85 -1.82 118.68 126.50 1bak s LEU 583 Ca -0.04 0.02 0.07 0.00 -0.22 0.00 0.00 54.13 53.97 1bak s LEU 583 Cb -0.11 -2.66 0.00 0.00 0.50 0.00 0.00 46.19 43.92 1bak s LEU 583 CO -0.13 -0.53 0.43 -0.36 -1.32 0.00 0.00 176.35 174.43 1bak s PHE 584 N 2.52 2.36 -2.00 5.38 0.08 -1.06 0.79 117.98 126.05 1bak s PHE 584 Ca 0.21 -0.58 0.03 0.00 0.12 0.00 0.00 56.93 56.70 1bak s PHE 584 Cb -0.15 -2.13 0.17 0.00 -0.57 0.00 0.00 43.02 40.34 1bak s PHE 584 CO 0.14 -0.31 0.88 -0.35 -0.10 0.00 0.00 175.22 175.48 1bak n PRO 585 N -1.67 0.75 0.00 0.24 -0.04 -1.24 -4.25 135.00 128.78 1bak n PRO 585 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1bak n PRO 585 Cb 0.62 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 33.02 1bak n PRO 585 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1bak n ASN 586 N -0.56 0.00 -1.97 3.54 3.02 -1.26 -4.97 115.26 113.06 1bak n ASN 586 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1bak n ASN 586 Cb 0.01 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 1bak n ASN 586 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bak n ARG 587 N -0.59 0.58 0.00 3.52 1.74 -1.26 0.34 116.66 120.99 1bak n ARG 587 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1bak n ARG 587 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1bak n ARG 587 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1bak n LEU 588 N 0.00 0.00 -4.86 0.55 7.94 0.17 -2.56 117.00 118.24 1bak n LEU 588 Ca 0.00 0.00 -0.34 0.00 -1.11 0.00 0.00 56.01 54.56 1bak n LEU 588 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 1bak n LEU 588 CO 0.00 0.00 0.20 -1.61 -1.11 0.00 0.00 177.39 174.87 1bak s GLU 589 N 0.00 3.87 -0.34 1.96 2.02 -0.76 -1.60 118.70 123.85 1bak s GLU 589 Ca 0.00 0.34 0.02 0.00 0.02 0.00 0.00 54.97 55.36 1bak s GLU 589 Cb 0.00 -2.83 0.15 0.00 0.10 0.00 0.00 34.13 31.56 1bak s GLU 589 CO 0.00 0.43 0.39 1.67 0.02 0.00 0.00 175.26 177.76 1bak s TRP 590 N -1.60 -0.61 0.10 1.61 1.48 -0.97 0.45 118.94 119.41 1bak s TRP 590 Ca 0.41 -0.34 0.02 0.00 -1.06 0.00 0.00 56.10 55.13 1bak s TRP 590 Cb -0.13 -0.31 -0.01 0.00 -1.16 0.00 0.00 33.47 31.86 1bak s TRP 590 CO 0.20 -0.98 0.07 0.54 -4.06 0.00 0.00 176.95 172.72 1bak n ARG 591 N 4.74 0.28 -1.14 3.25 5.12 0.11 -4.55 116.66 124.49 1bak n ARG 591 Ca 0.06 -1.00 0.00 0.00 -1.93 0.00 0.00 57.85 54.98 1bak n ARG 591 Cb 0.47 0.75 0.00 0.00 -1.16 0.00 0.00 32.46 32.53 1bak n ARG 591 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1bak n GLY 592 N 0.17 1.06 3.96 -0.13 0.00 -1.26 0.10 105.19 109.10 1bak n GLY 592 Ca 0.01 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 44.97 1bak n GLY 592 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bak s GLU 593 N -1.02 1.03 1.08 1.61 4.04 -1.26 -4.76 118.70 119.42 1bak s GLU 593 Ca 0.00 -0.77 0.00 0.00 0.04 0.00 0.00 54.97 54.24 1bak s GLU 593 Cb 0.00 -2.06 0.00 0.00 0.02 0.00 0.00 34.13 32.09 1bak s GLU 593 CO 0.00 -2.03 0.00 0.41 -1.84 0.00 0.00 175.26 171.80 1bak n GLY 594 N -3.37 1.19 3.64 -3.83 0.00 -1.26 -4.88 105.19 96.68 1bak n GLY 594 Ca 0.16 -0.64 -0.06 0.00 0.00 0.00 0.00 46.02 45.48 1bak n GLY 594 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bak s GLU 595 N 0.00 0.27 0.00 1.61 -6.30 -1.26 -5.19 118.70 107.83 1bak s GLU 595 Ca 0.00 0.31 0.00 0.00 -2.50 0.00 0.00 54.97 52.78 1bak s GLU 595 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 34.13 34.26 1bak s GLU 595 CO 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 175.26 175.25 1bak n ALA 596 N 1.84 0.00 -1.00 6.30 0.00 -1.26 -5.10 120.51 121.29 1bak n ALA 596 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1bak n ALA 596 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1bak n ALA 596 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1bak n PRO 597 N -0.22 0.61 -2.98 0.00 -0.04 -1.26 -5.00 135.00 126.12 1bak n PRO 597 Ca 0.00 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 1bak n PRO 597 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 1bak n PRO 597 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1bak s GLN 598 N -0.77 4.47 -0.38 0.54 -2.07 -1.26 -5.02 119.66 115.16 1bak s GLN 598 Ca 0.00 1.02 0.01 0.00 -1.82 0.00 0.00 55.36 54.56 1bak s GLN 598 Cb 0.00 -3.43 0.13 0.00 -1.09 0.00 0.00 33.01 28.62 1bak s GLN 598 CO 0.00 0.10 0.20 -1.12 -1.32 0.00 0.00 175.29 173.15 1bak s SER 599 N 0.61 3.50 -0.00 12.60 0.01 -1.26 -5.10 113.70 124.06 1bak s SER 599 Ca 0.40 -2.27 -0.01 0.00 1.31 0.00 0.00 55.95 55.39 1bak s SER 599 Cb -0.19 -0.78 0.00 0.00 0.21 0.00 0.00 66.02 65.26 1bak s SER 599 CO 0.21 -0.31 0.01 -1.48 0.41 0.00 0.00 173.24 172.08 1bak s LEU 600 N 0.86 1.96 0.00 2.44 -0.00 -1.26 -2.29 118.68 120.38 1bak s LEU 600 Ca 0.16 0.01 0.01 0.00 -0.00 0.00 0.00 54.13 54.31 1bak s LEU 600 Cb -0.23 0.05 -0.00 0.00 -0.00 0.00 0.00 46.19 46.02 1bak s LEU 600 CO -0.05 -0.02 0.06 0.18 -0.00 0.00 0.00 176.35 176.52 1bak n LEU 601 N 3.00 0.00 0.00 1.48 4.77 -0.63 -4.99 117.00 120.64 1bak n LEU 601 Ca -0.13 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1bak n LEU 601 Cb 0.60 0.33 0.00 0.00 -2.33 0.00 0.00 43.42 42.02 1bak n LEU 601 CO 0.25 -0.10 0.00 0.41 -1.33 0.00 0.00 177.39 176.63 1bak n THR 602 N -0.11 0.00 -2.10 -5.08 -1.04 -1.26 0.45 114.28 105.14 1bak n THR 602 Ca 0.01 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.97 1bak n THR 602 Cb 0.10 -0.29 0.09 0.00 -1.82 0.00 0.00 70.33 68.42 1bak n THR 602 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58 1bak n MET 603 N -0.21 1.95 -3.04 -2.82 0.00 1.04 -4.65 117.12 109.39 1bak n MET 603 Ca 0.00 -3.37 -0.25 0.00 0.00 0.00 0.00 57.70 54.08 1bak n MET 603 Cb 0.00 -1.52 -0.04 0.00 0.00 0.00 0.00 33.22 31.65 1bak n MET 603 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 1bak n GLU 604 N -0.61 2.64 0.03 3.17 0.28 -1.26 -3.24 120.64 121.65 1bak n GLU 604 Ca 0.22 -4.49 0.00 0.00 -0.16 0.00 0.00 57.16 52.73 1bak n GLU 604 Cb 0.88 -2.10 0.00 0.00 1.43 0.00 0.00 31.44 31.65 1bak n GLU 604 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1bak n GLU 605 N -0.02 0.00 -0.95 3.44 0.28 -1.26 -4.88 120.64 117.26 1bak n GLU 605 Ca 0.29 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.98 1bak n GLU 605 Cb 0.45 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.31 1bak n GLU 605 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1bak n ILE 606 N -2.60 1.07 -0.04 3.84 -0.00 -1.26 -1.48 119.36 118.88 1bak n ILE 606 Ca 0.00 -0.35 -0.19 0.00 -0.00 0.00 0.00 62.75 62.21 1bak n ILE 606 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 39.64 39.51 1bak n ILE 606 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.55 178.22 1bak n GLN 607 N 0.77 0.71 -3.64 0.38 0.00 0.71 -4.28 117.38 112.03 1bak n GLN 607 Ca 0.11 0.22 -0.04 0.00 -0.00 0.00 0.00 57.00 57.29 1bak n GLN 607 Cb 0.21 -1.65 -0.07 0.00 0.00 0.00 0.00 30.24 28.73 1bak n GLN 607 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 1bak s SER 608 N -6.75 -0.27 -0.05 1.69 0.01 -1.07 -4.92 113.70 102.35 1bak s SER 608 Ca -0.25 0.48 0.01 0.00 1.31 0.00 0.00 55.95 57.51 1bak s SER 608 Cb 0.07 0.69 -0.03 0.00 0.21 0.00 0.00 66.02 66.96 1bak s SER 608 CO 0.72 -0.08 -0.05 0.54 0.41 0.00 0.00 173.24 174.78 1bak s VAL 609 N 0.48 3.79 0.00 3.43 0.11 -1.26 -2.26 120.40 124.69 1bak s VAL 609 Ca 0.01 -0.54 0.00 0.00 -2.93 0.00 0.00 61.98 58.52 1bak s VAL 609 Cb -0.04 -2.59 0.00 0.00 -1.53 0.00 0.00 36.38 32.21 1bak s VAL 609 CO -0.12 0.53 0.00 -1.84 -3.33 0.00 0.00 175.10 170.34 1bak n GLU 610 N 1.97 0.00 -4.02 1.54 0.28 -1.03 -4.97 120.64 114.41 1bak n GLU 610 Ca -0.17 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.72 1bak n GLU 610 Cb 0.53 0.00 -0.11 0.00 1.43 0.00 0.00 31.44 33.28 1bak n GLU 610 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1bak s GLU 611 N -1.90 0.41 0.36 3.44 2.12 -1.26 0.27 118.70 122.13 1bak s GLU 611 Ca 0.00 -0.64 0.08 0.00 0.36 0.00 0.00 54.97 54.78 1bak s GLU 611 Cb 0.00 -0.12 -0.05 0.00 0.26 0.00 0.00 34.13 34.22 1bak s GLU 611 CO 0.00 0.01 0.07 -0.08 -0.54 0.00 0.00 175.26 174.72 1bak s THR 612 N -1.29 2.64 0.14 -1.70 -1.32 0.37 -4.79 115.64 109.69 1bak s THR 612 Ca -0.11 -1.86 0.03 0.00 -1.21 0.00 0.00 61.69 58.54 1bak s THR 612 Cb -0.09 -2.88 -0.04 0.00 -1.51 0.00 0.00 72.50 67.97 1bak s THR 612 CO -0.00 -0.15 -0.07 -1.10 -2.21 0.00 0.00 174.62 171.09 1bak s GLN 613 N -3.78 1.00 -0.39 7.08 1.11 -1.26 -2.21 119.66 121.20 1bak s GLN 613 Ca 0.37 -1.43 0.03 0.00 0.01 0.00 0.00 55.36 54.33 1bak s GLN 613 Cb 0.00 -0.42 0.16 0.00 -1.01 0.00 0.00 33.01 31.74 1bak s GLN 613 CO 0.21 0.00 0.36 0.42 0.01 0.00 0.00 175.29 176.29 1bak s ILE 614 N -3.49 -0.08 0.00 1.08 1.09 -1.22 -4.55 121.20 114.02 1bak s ILE 614 Ca 0.16 -1.66 0.00 0.00 -1.10 0.00 0.00 60.65 58.05 1bak s ILE 614 Cb 0.04 -0.88 0.00 0.00 -1.06 0.00 0.00 42.46 40.56 1bak s ILE 614 CO -0.01 -0.82 0.00 0.29 -0.10 0.00 0.00 174.94 174.30 1bak n LYS 615 N 3.64 0.00 0.00 2.79 4.76 -1.26 -3.67 118.16 124.42 1bak n LYS 615 Ca 0.18 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.62 1bak n LYS 615 Cb 0.45 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.64 1bak n LYS 615 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1bak n GLU 616 N 0.00 0.00 -3.70 1.97 2.13 -1.26 -5.13 120.64 114.64 1bak n GLU 616 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 1bak n GLU 616 Cb 0.00 -0.01 -0.09 0.00 0.27 0.00 0.00 31.44 31.60 1bak n GLU 616 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1bak s ARG 617 N -1.87 0.54 0.00 5.31 3.52 -1.24 -4.93 118.95 120.29 1bak s ARG 617 Ca 0.00 0.71 0.00 0.00 -0.13 0.00 0.00 55.73 56.31 1bak s ARG 617 Cb 0.00 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.62 1bak s ARG 617 CO 0.00 -0.08 0.00 1.17 -0.81 0.00 0.00 175.30 175.58 1bak n LYS 618 N 3.09 0.00 -1.06 5.12 3.00 -1.08 -3.45 118.16 123.78 1bak n LYS 618 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1bak n LYS 618 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.60 1bak n LYS 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1bak s LEU 620 N 0.00 4.06 0.19 0.00 0.20 0.52 0.14 118.68 123.78 1bak s LEU 620 Ca 0.00 0.16 0.05 0.00 0.69 0.00 0.00 54.13 55.02 1bak s LEU 620 Cb 0.00 -2.58 -0.04 0.00 -0.43 0.00 0.00 46.19 43.14 1bak s LEU 620 CO 0.00 0.21 0.21 -0.22 -0.29 0.00 0.00 176.35 176.26 1bak s LEU 621 N -2.20 4.01 -0.46 -0.68 2.96 0.75 -0.05 118.68 123.01 1bak s LEU 621 Ca 0.29 -0.05 0.07 0.00 -0.22 0.00 0.00 54.13 54.22 1bak s LEU 621 Cb -0.12 -2.59 0.18 0.00 0.50 0.00 0.00 46.19 44.16 1bak s LEU 621 CO 0.21 0.03 0.63 -0.76 -1.32 0.00 0.00 176.35 175.14 1bak s LEU 622 N -3.39 -1.10 0.06 -0.68 1.43 0.78 -2.45 118.68 113.32 1bak s LEU 622 Ca 0.33 -1.51 -0.21 0.00 -1.03 0.00 0.00 54.13 51.70 1bak s LEU 622 Cb -0.10 1.60 -0.06 0.00 0.03 0.00 0.00 46.19 47.65 1bak s LEU 622 CO 0.26 -0.12 0.61 -1.59 0.23 0.00 0.00 176.35 175.74 1bak s LYS 623 N 1.19 4.30 -0.01 1.70 -2.85 -0.96 0.73 119.74 123.83 1bak s LYS 623 Ca 0.24 0.81 -0.01 0.00 -1.00 0.00 0.00 55.97 56.01 1bak s LYS 623 Cb -0.03 -3.28 -0.04 0.00 -2.06 0.00 0.00 37.83 32.43 1bak s LYS 623 CO -0.07 0.54 0.09 0.42 0.10 0.00 0.00 175.35 176.43 1bak s ILE 624 N -0.80 4.79 -2.00 3.79 1.01 -0.49 -0.21 121.20 127.30 1bak s ILE 624 Ca 0.31 -0.36 0.25 0.00 0.00 0.00 0.00 60.65 60.85 1bak s ILE 624 Cb -0.20 -3.18 0.71 0.00 0.01 0.00 0.00 42.46 39.80 1bak s ILE 624 CO 0.20 0.37 1.96 -2.11 0.00 0.00 0.00 174.94 175.35 1bak n ARG 625 N 1.24 1.00 0.09 2.79 1.85 -0.55 -2.85 116.66 120.23 1bak n ARG 625 Ca -0.13 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 56.80 1bak n ARG 625 Cb 0.53 -1.39 -0.01 0.00 -1.05 0.00 0.00 32.46 30.54 1bak n ARG 625 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 1bak h GLY 626 N 5.19 0.00 0.00 2.89 0.00 -1.94 -3.48 103.07 105.73 1bak h GLY 626 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1bak h GLY 626 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1bak n GLY 627 N 1.22 0.97 3.22 4.60 0.00 -1.13 -4.76 105.19 109.32 1bak n GLY 627 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 1bak n GLY 627 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bak s LYS 628 N 0.05 1.30 -0.16 1.61 1.02 -1.23 -5.02 119.74 117.32 1bak s LYS 628 Ca 0.00 -1.70 -0.07 0.00 0.02 0.00 0.00 55.97 54.22 1bak s LYS 628 Cb 0.00 0.24 0.06 0.00 -0.52 0.00 0.00 37.83 37.61 1bak s LYS 628 CO 0.00 -0.42 0.36 -0.65 -0.92 0.00 0.00 175.35 173.71 1bak s GLN 629 N -4.05 0.31 0.34 1.68 1.11 -1.26 -1.40 119.66 116.39 1bak s GLN 629 Ca 0.39 0.77 0.07 0.00 0.01 0.00 0.00 55.36 56.60 1bak s GLN 629 Cb 0.06 0.02 -0.07 0.00 -1.01 0.00 0.00 33.01 32.01 1bak s GLN 629 CO 0.14 -0.19 -0.01 -0.06 0.01 0.00 0.00 175.29 175.18 1bak s PHE 630 N 1.73 2.21 -0.14 0.91 0.08 0.22 -4.77 117.98 118.21 1bak s PHE 630 Ca -0.07 -0.72 -0.04 0.00 0.12 0.00 0.00 56.93 56.22 1bak s PHE 630 Cb -0.10 -1.41 0.07 0.00 -0.57 0.00 0.00 43.02 41.01 1bak s PHE 630 CO -0.11 0.32 0.20 0.42 -0.10 0.00 0.00 175.22 175.95 1bak s ILE 631 N -2.92 -0.31 0.44 0.64 1.09 -0.99 -0.15 121.20 118.99 1bak s ILE 631 Ca 0.34 0.13 -0.13 0.00 -1.10 0.00 0.00 60.65 59.89 1bak s ILE 631 Cb 0.07 -0.49 -0.07 0.00 -1.06 0.00 0.00 42.46 40.91 1bak s ILE 631 CO 0.16 -0.01 0.84 -0.76 -0.10 0.00 0.00 174.94 175.06 1bak s LEU 632 N 2.33 3.78 -0.20 2.97 1.43 0.93 -2.30 118.68 127.62 1bak s LEU 632 Ca 0.04 1.29 -0.14 0.00 -1.03 0.00 0.00 54.13 54.30 1bak s LEU 632 Cb -0.14 -4.19 0.06 0.00 0.03 0.00 0.00 46.19 41.96 1bak s LEU 632 CO -0.09 -0.45 0.51 -1.10 0.23 0.00 0.00 176.35 175.45 1bak s GLN 633 N -3.86 0.54 0.17 1.70 -0.21 0.40 -0.36 119.66 118.04 1bak s GLN 633 Ca 0.54 0.86 -0.18 0.00 0.02 0.00 0.00 55.36 56.61 1bak s GLN 633 Cb -0.10 0.12 0.04 0.00 1.00 0.00 0.00 33.01 34.06 1bak s GLN 633 CO 0.30 -0.13 0.49 0.00 -2.12 0.00 0.00 175.29 173.83 1bak h ASP 635 N 2.23 0.00 -3.36 0.00 3.58 -2.00 -3.45 116.42 113.42 1bak h ASP 635 Ca -0.31 -0.07 -0.56 0.00 0.42 0.00 0.00 57.03 56.51 1bak h ASP 635 Cb 1.27 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.27 1bak h ASP 635 CO 0.41 0.03 0.07 -0.44 -2.88 0.00 0.00 179.24 176.43 1bak s SER 636 N -4.91 7.06 -0.00 2.28 0.01 -1.26 -4.97 113.70 111.91 1bak s SER 636 Ca 0.07 1.26 -0.19 0.00 1.31 0.00 0.00 55.95 58.40 1bak s SER 636 Cb 0.11 -2.41 -0.29 0.00 0.21 0.00 0.00 66.02 63.64 1bak s SER 636 CO 0.68 0.02 1.01 0.44 0.41 0.00 0.00 173.24 175.80 1bak h ASP 637 N 5.91 0.61 0.03 2.44 5.19 -2.02 -3.36 116.42 125.21 1bak h ASP 637 Ca -0.44 -0.87 -0.00 0.00 -0.62 0.00 0.00 57.03 55.11 1bak h ASP 637 Cb 1.20 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.52 1bak h ASP 637 CO 0.71 1.42 -0.01 1.55 -3.12 0.00 0.00 179.24 179.79 1bak h PRO 638 N -0.11 -0.04 0.00 3.56 0.13 -1.98 -3.14 132.00 130.42 1bak h PRO 638 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1bak h PRO 638 Cb 1.65 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.79 1bak h PRO 638 CO 0.17 0.64 0.00 0.39 -0.23 0.00 0.00 178.00 178.97 1bak n GLU 639 N -4.76 0.00 -0.25 0.86 -0.58 -1.26 0.20 120.64 114.85 1bak n GLU 639 Ca -0.09 0.15 0.05 0.00 -0.42 0.00 0.00 57.16 56.86 1bak n GLU 639 Cb 0.34 -0.32 0.18 0.00 -0.57 0.00 0.00 31.44 31.08 1bak n GLU 639 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1bak h LEU 640 N 0.00 0.09 -0.34 -4.62 7.12 -1.75 0.64 115.31 116.45 1bak h LEU 640 Ca 0.00 0.14 0.06 0.00 0.13 0.00 0.00 57.88 58.20 1bak h LEU 640 Cb 0.00 0.17 -0.08 0.00 -0.53 0.00 0.00 40.66 40.21 1bak h LEU 640 CO 0.00 -0.00 -0.47 0.58 -0.13 0.00 0.00 178.44 178.41 1bak h VAL 641 N 0.31 0.07 -0.60 1.05 2.07 0.23 1.30 116.25 120.68 1bak h VAL 641 Ca 0.41 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.86 1bak h VAL 641 Cb 0.69 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1bak h VAL 641 CO -0.48 0.00 0.09 -0.61 0.02 0.00 0.00 177.57 176.59 1bak h GLN 642 N -0.40 0.97 -0.86 1.57 4.15 0.39 -2.10 115.11 118.83 1bak h GLN 642 Ca 0.10 -0.24 0.06 0.00 0.77 0.00 0.00 58.65 59.34 1bak h GLN 642 Cb 0.61 -0.12 -0.06 0.00 0.21 0.00 0.00 27.48 28.11 1bak h GLN 642 CO -0.54 0.90 0.54 -1.49 -1.93 0.00 0.00 178.83 176.31 1bak h TRP 643 N 0.92 1.00 0.72 3.99 4.06 0.24 -1.84 115.95 125.04 1bak h TRP 643 Ca 0.19 0.03 -0.04 0.00 2.06 0.00 0.00 58.89 61.13 1bak h TRP 643 Cb 0.41 -0.33 0.01 0.00 -1.00 0.00 0.00 29.16 28.25 1bak h TRP 643 CO 0.03 0.52 -0.35 -0.22 -3.56 0.00 0.00 178.44 174.86 1bak h LYS 644 N 1.00 -0.93 -0.96 0.49 1.63 0.22 2.09 116.57 120.11 1bak h LYS 644 Ca 0.37 0.06 0.18 0.00 -0.85 0.00 0.00 60.65 60.41 1bak h LYS 644 Cb 0.14 0.21 -0.17 0.00 -0.60 0.00 0.00 32.23 31.81 1bak h LYS 644 CO -0.16 -0.62 -0.28 -0.22 -3.45 0.00 0.00 179.45 174.71 1bak h LYS 645 N -0.97 -0.01 -0.01 1.90 3.11 -0.84 2.66 116.57 122.41 1bak h LYS 645 Ca -0.10 0.00 -0.20 0.00 -2.81 0.00 0.00 60.65 57.54 1bak h LYS 645 Cb 0.74 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.97 1bak h LYS 645 CO 0.16 -0.00 -0.86 0.93 -2.81 0.00 0.00 179.45 176.87 1bak h GLU 646 N -0.01 0.25 0.42 1.90 5.08 -1.04 -2.86 114.58 118.32 1bak h GLU 646 Ca 0.42 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1bak h GLU 646 Cb 0.67 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1bak h GLU 646 CO -0.98 0.97 -0.20 -0.07 -1.00 0.00 0.00 179.01 177.73 1bak h LEU 647 N 0.15 -0.47 -0.86 1.33 3.38 1.18 0.56 115.31 120.58 1bak h LEU 647 Ca -0.05 0.02 0.20 0.00 0.09 0.00 0.00 57.88 58.14 1bak h LEU 647 Cb 1.47 0.12 -0.16 0.00 0.09 0.00 0.00 40.66 42.19 1bak h LEU 647 CO 0.14 -0.25 -0.04 -0.09 0.09 0.00 0.00 178.44 178.29 1bak h ARG 648 N -0.73 0.05 -0.09 1.13 2.43 0.40 0.43 114.38 118.00 1bak h ARG 648 Ca -0.06 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1bak h ARG 648 Cb 0.43 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1bak h ARG 648 CO 0.09 0.03 0.02 0.22 -1.51 0.00 0.00 179.97 178.82 1bak h ASP 649 N 0.05 0.14 -0.97 -3.80 1.82 -1.49 0.56 116.42 112.73 1bak h ASP 649 Ca 0.47 -0.25 0.26 0.00 -0.39 0.00 0.00 57.03 57.13 1bak h ASP 649 Cb 0.87 -0.04 -0.13 0.00 0.68 0.00 0.00 39.33 40.70 1bak h ASP 649 CO -0.80 0.36 0.52 0.00 -1.61 0.00 0.00 179.24 177.71 1bak h ALA 650 N 0.79 1.74 0.19 -0.78 0.00 0.43 4.23 119.26 125.86 1bak h ALA 650 Ca 0.03 0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.84 1bak h ALA 650 Cb 0.28 0.11 0.03 0.00 0.00 0.00 0.00 17.79 18.20 1bak h ALA 650 CO 0.00 -0.39 -1.11 1.88 0.00 0.00 0.00 179.25 179.62 1bak h TYR 651 N 0.44 0.73 -0.40 0.00 0.05 -0.41 -2.54 116.97 114.85 1bak h TYR 651 Ca 0.65 -0.54 -0.11 0.00 0.05 0.00 0.00 58.73 58.78 1bak h TYR 651 Cb 1.33 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 39.03 1bak h TYR 651 CO -0.05 1.43 -0.20 0.07 -1.05 0.00 0.00 178.16 178.35 1bak h ARG 652 N -0.15 0.77 -0.39 4.88 0.11 0.27 0.88 114.38 120.75 1bak h ARG 652 Ca -0.20 -0.30 -0.13 0.00 0.10 0.00 0.00 59.98 59.46 1bak h ARG 652 Cb 1.87 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 32.90 1bak h ARG 652 CO 0.20 0.91 -0.27 1.49 0.10 0.00 0.00 179.97 182.40 1bak h GLU 653 N 0.68 0.82 0.06 0.08 4.81 0.80 -0.69 114.58 121.14 1bak h GLU 653 Ca 0.10 -0.36 -0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1bak h GLU 653 Cb 0.71 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1bak h GLU 653 CO 0.05 0.99 -0.03 0.00 -0.73 0.00 0.00 179.01 179.30 1bak h ALA 654 N 0.99 -0.08 -0.76 2.92 0.00 -1.22 -3.29 119.26 117.82 1bak h ALA 654 Ca 0.09 -0.26 0.17 0.00 0.00 0.00 0.00 54.91 54.90 1bak h ALA 654 Cb 0.81 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.52 1bak h ALA 654 CO 0.07 -0.12 0.20 -0.56 0.00 0.00 0.00 179.25 178.84 1bak h GLN 655 N -0.94 0.28 0.00 0.00 3.07 0.74 1.15 115.11 119.41 1bak h GLN 655 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.71 1bak h GLN 655 Cb 0.56 -0.06 0.00 0.00 0.08 0.00 0.00 27.48 28.05 1bak h GLN 655 CO 0.01 0.18 0.30 0.37 0.09 0.00 0.00 178.83 179.78 1bak h GLN 656 N 0.29 0.00 0.04 0.06 5.75 -1.21 1.68 115.11 121.72 1bak h GLN 656 Ca 0.43 0.00 -0.28 0.00 -0.15 0.00 0.00 58.65 58.66 1bak h GLN 656 Cb 0.75 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.27 1bak h GLN 656 CO -0.52 0.00 -1.46 -0.07 -2.65 0.00 0.00 178.83 174.14 1bak h LEU 657 N 0.00 0.14 -3.12 -2.39 3.38 0.13 -3.29 115.31 110.16 1bak h LEU 657 Ca 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1bak h LEU 657 Cb 0.59 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1bak h LEU 657 CO 0.00 1.18 0.00 0.55 0.09 0.00 0.00 178.44 180.26 1bak n VAL 658 N -3.28 1.78 0.03 1.22 3.14 0.27 -4.40 118.33 117.09 1bak n VAL 658 Ca -0.12 -1.32 -0.20 0.00 -2.96 0.00 0.00 64.34 59.74 1bak n VAL 658 Cb 1.02 0.11 -0.10 0.00 -1.06 0.00 0.00 33.84 33.81 1bak n VAL 658 CO 0.00 0.00 0.00 1.56 -6.46 0.00 0.00 176.83 171.93 1bak h GLN 659 N 3.06 0.72 0.00 1.45 4.20 0.20 -2.96 115.11 121.79 1bak h GLN 659 Ca 0.00 -0.74 0.00 0.00 0.06 0.00 0.00 58.65 57.97 1bak h GLN 659 Cb 1.30 0.20 0.00 0.00 0.30 0.00 0.00 27.48 29.28 1bak h GLN 659 CO 0.18 1.31 0.00 -2.13 -0.67 0.00 0.00 178.83 177.53 1bak n ARG 660 N -3.87 0.99 -1.72 1.46 0.00 -1.26 -4.99 116.66 107.28 1bak n ARG 660 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 1bak n ARG 660 Cb 0.86 -1.29 0.00 0.00 0.00 0.00 0.00 32.46 32.03 1bak n ARG 660 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1bak n VAL 661 N -0.79 -5.38 -1.35 5.15 0.31 -1.12 -4.99 118.33 110.17 1bak n VAL 661 Ca 0.14 2.44 -0.24 0.00 -0.01 0.00 0.00 64.34 66.67 1bak n VAL 661 Cb 0.06 -3.26 0.18 0.00 -0.91 0.00 0.00 33.84 29.91 1bak n VAL 661 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1bak n PRO 662 N 0.42 -1.89 0.31 5.55 -0.04 -1.26 -5.00 135.00 133.09 1bak n PRO 662 Ca 0.00 -1.55 -0.13 0.00 -0.04 0.00 0.00 63.50 61.79 1bak n PRO 662 Cb 0.00 -1.22 -0.06 0.00 -0.04 0.00 0.00 33.50 32.18 1bak n PRO 662 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1bak h LYS 663 N 0.00 -0.79 -4.22 0.54 3.11 -2.01 -3.42 116.57 109.77 1bak h LYS 663 Ca -0.34 0.05 -0.57 0.00 -2.81 0.00 0.00 60.65 56.98 1bak h LYS 663 Cb 0.99 0.18 -0.38 0.00 -1.00 0.00 0.00 32.23 32.02 1bak h LYS 663 CO 0.23 -0.53 -0.79 1.41 -2.81 0.00 0.00 179.45 176.96 1bak s MET 664 N -4.41 1.51 -0.08 1.90 1.75 -1.26 -5.10 119.30 113.62 1bak s MET 664 Ca -0.12 -0.65 -0.32 0.00 -1.25 0.00 0.00 55.69 53.35 1bak s MET 664 Cb 0.01 -2.19 0.14 0.00 2.84 0.00 0.00 34.83 35.63 1bak s MET 664 CO 0.36 -0.48 1.35 0.21 -0.65 0.00 0.00 175.02 175.82 1bak s LYS 665 N 1.57 0.21 0.00 4.11 2.20 -1.26 -5.08 119.74 121.48 1bak s LYS 665 Ca -0.01 -0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 1bak s LYS 665 Cb -0.16 0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.23 1bak s LYS 665 CO -0.08 -0.10 0.00 -1.71 -0.36 0.00 0.00 175.35 173.11 1bak n ASN 666 N -0.44 0.00 -2.68 1.43 5.15 -1.26 -4.99 115.26 112.48 1bak n ASN 666 Ca -0.08 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.89 1bak n ASN 666 Cb 0.63 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.88 1bak n ASN 666 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1bak n LYS 667 N 0.00 -3.23 -0.96 1.20 4.81 -1.26 -4.75 118.16 113.97 1bak n LYS 667 Ca 0.00 2.63 -0.27 0.00 -0.87 0.00 0.00 58.31 59.80 1bak n LYS 667 Cb 0.00 -5.24 -0.04 0.00 0.02 0.00 0.00 35.03 29.77 1bak n LYS 667 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1bak n PRO 668 N 0.55 2.62 -3.14 1.64 -0.04 -1.26 -4.69 135.00 130.69 1bak n PRO 668 Ca 0.01 -1.64 -0.00 0.00 -0.04 0.00 0.00 63.50 61.83 1bak n PRO 668 Cb 0.05 -2.51 -0.00 0.00 -0.04 0.00 0.00 33.50 31.01 1bak n PRO 668 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1bak n ARG 669 N 3.75 -0.62 0.00 0.54 0.00 -1.26 -5.24 116.66 113.83 1bak n ARG 669 Ca 0.56 0.98 0.16 0.00 -0.00 0.00 0.00 57.85 59.55 1bak n ARG 669 Cb 0.24 -1.38 0.93 0.00 0.00 0.00 0.00 32.46 32.26 1bak n ARG 669 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08