#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bak s SER 553 N 0.00 -0.04 -0.30 1.61 0.01 -1.26 -5.16 113.70 108.57 1bak s SER 553 Ca 0.00 0.03 -0.15 0.00 1.31 0.00 0.00 55.95 57.14 1bak s SER 553 Cb 0.00 0.03 0.17 0.00 0.21 0.00 0.00 66.02 66.44 1bak s SER 553 CO 0.00 -0.04 1.14 -1.38 0.41 0.00 0.00 173.24 173.36 1bak s HIS 554 N -1.26 -0.33 -0.22 2.43 -0.00 -1.26 -5.17 115.29 109.48 1bak s HIS 554 Ca 0.09 0.36 -0.25 0.00 -0.00 0.00 0.00 55.06 55.27 1bak s HIS 554 Cb -0.01 0.12 0.07 0.00 -0.00 0.00 0.00 32.58 32.76 1bak s HIS 554 CO -0.07 -0.18 0.68 1.41 -0.00 0.00 0.00 174.74 176.59 1bak s MET 555 N 2.92 0.85 0.53 -0.38 -2.45 -1.26 -5.14 119.30 114.38 1bak s MET 555 Ca -0.05 0.81 0.06 0.00 -1.25 0.00 0.00 55.69 55.26 1bak s MET 555 Cb -0.09 0.41 0.04 0.00 1.25 0.00 0.00 34.83 36.44 1bak s MET 555 CO -0.10 -0.14 0.44 0.20 1.05 0.00 0.00 175.02 176.47 1bak s GLY 556 N 0.05 2.28 -0.36 2.11 0.00 -1.26 -5.07 107.32 105.06 1bak s GLY 556 Ca -0.02 -1.43 0.13 0.00 0.00 0.00 0.00 44.72 43.40 1bak s GLY 556 CO 0.03 -1.89 1.21 1.17 0.00 0.00 0.00 173.10 173.62 1bak n LYS 557 N -1.79 1.21 -3.25 2.90 4.81 -1.26 -5.05 118.16 115.74 1bak n LYS 557 Ca 0.01 -2.38 -0.04 0.00 -0.87 0.00 0.00 58.31 55.03 1bak n LYS 557 Cb 0.64 -0.52 -0.04 0.00 0.02 0.00 0.00 35.03 35.13 1bak n LYS 557 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1bak s ASP 558 N -2.01 -0.34 0.31 3.14 -1.08 -1.26 -5.14 116.67 110.29 1bak s ASP 558 Ca 0.23 -0.18 -0.29 0.00 -0.52 0.00 0.00 52.55 51.79 1bak s ASP 558 Cb 0.42 1.44 -0.10 0.00 -1.46 0.00 0.00 42.92 43.22 1bak s ASP 558 CO -0.04 -0.33 1.24 0.00 0.52 0.00 0.00 175.17 176.55 1bak h ILE 560 N 3.06 0.00 -3.68 0.00 2.04 -1.74 -3.48 117.51 113.72 1bak h ILE 560 Ca -0.48 -0.89 -0.26 0.00 1.00 0.00 0.00 64.86 64.23 1bak h ILE 560 Cb 1.22 0.00 -0.30 0.00 -0.74 0.00 0.00 36.82 37.00 1bak h ILE 560 CO 0.66 0.00 -0.73 -0.32 0.00 0.00 0.00 178.15 177.76 1bak s MET 561 N -1.84 0.03 0.08 2.37 1.75 -1.05 -5.07 119.30 115.58 1bak s MET 561 Ca -0.07 0.04 -0.02 0.00 -1.25 0.00 0.00 55.69 54.39 1bak s MET 561 Cb 0.01 -0.11 -0.04 0.00 2.84 0.00 0.00 34.83 37.53 1bak s MET 561 CO 0.11 -0.04 0.02 -3.38 -0.65 0.00 0.00 175.02 171.08 1bak s HIS 562 N 0.31 0.61 -5.00 4.11 -3.43 -1.26 -0.97 115.29 109.66 1bak s HIS 562 Ca -0.03 -1.09 0.00 0.00 -0.80 0.00 0.00 55.06 53.14 1bak s HIS 562 Cb -0.04 -0.39 0.00 0.00 -1.43 0.00 0.00 32.58 30.72 1bak s HIS 562 CO -0.01 -0.45 0.00 0.41 -2.00 0.00 0.00 174.74 172.69 1bak n GLY 563 N 0.02 0.46 3.69 -1.38 0.00 -1.15 -5.04 105.19 101.79 1bak n GLY 563 Ca -0.11 -1.61 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 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 -3.02 3.49 -0.05 1.61 6.14 -1.26 -1.82 117.35 122.45 1bak s TYR 564 Ca 0.00 1.26 -0.02 0.00 0.64 0.00 0.00 57.07 58.95 1bak s TYR 564 Cb 0.00 -2.92 0.03 0.00 0.42 0.00 0.00 41.96 39.49 1bak s TYR 564 CO 0.00 -0.09 0.08 1.41 0.64 0.00 0.00 175.55 177.59 1bak s MET 565 N 1.53 -0.04 -0.04 4.97 1.75 0.39 -4.85 119.30 123.00 1bak s MET 565 Ca 0.38 0.39 -0.25 0.00 -1.25 0.00 0.00 55.69 54.96 1bak s MET 565 Cb -0.17 -0.40 -0.04 0.00 2.84 0.00 0.00 34.83 37.06 1bak s MET 565 CO 0.16 -0.29 0.75 -1.54 -0.65 0.00 0.00 175.02 173.45 1bak s SER 566 N 1.97 7.08 0.06 1.11 1.04 -0.81 -2.58 113.70 121.57 1bak s SER 566 Ca 0.02 1.30 -0.09 0.00 0.48 0.00 0.00 55.95 57.66 1bak s SER 566 Cb -0.12 -2.45 -0.00 0.00 0.10 0.00 0.00 66.02 63.55 1bak s SER 566 CO -0.04 -0.12 0.18 -0.75 0.98 0.00 0.00 173.24 173.50 1bak s LYS 567 N 0.71 0.76 0.00 4.02 2.20 0.02 0.02 119.74 127.46 1bak s LYS 567 Ca 0.40 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 55.21 1bak s LYS 567 Cb -0.19 0.31 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 1bak s LYS 567 CO 0.20 -0.23 0.00 -0.12 -0.36 0.00 0.00 175.35 174.85 1bak n MET 568 N 0.33 0.00 -3.33 4.03 1.56 -0.87 -4.22 117.12 114.62 1bak n MET 568 Ca -0.17 0.00 0.03 0.00 -0.27 0.00 0.00 57.70 57.29 1bak n MET 568 Cb 0.61 0.00 -0.05 0.00 2.15 0.00 0.00 33.22 35.93 1bak n MET 568 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 1bak s GLY 569 N 0.00 0.37 0.22 -5.12 0.00 -1.26 -2.79 107.32 98.73 1bak s GLY 569 Ca 0.00 3.69 -0.15 0.00 0.00 0.00 0.00 44.72 48.26 1bak s GLY 569 CO 0.00 3.19 0.77 0.70 0.00 0.00 0.00 173.10 177.76 1bak n ASN 570 N 4.12 -1.60 -0.64 1.64 3.02 -1.26 -5.00 115.26 115.55 1bak n ASN 570 Ca -0.10 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.49 1bak n ASN 570 Cb 0.56 2.63 0.00 0.00 -0.61 0.00 0.00 39.78 42.35 1bak n ASN 570 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1bak n PRO 571 N -0.53 0.75 -3.34 3.52 -0.04 -1.26 -4.15 135.00 129.95 1bak n PRO 571 Ca -0.04 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.19 1bak n PRO 571 Cb 0.48 -1.30 -0.09 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.64 0.38 -1.04 0.54 0.08 -1.26 -5.06 117.98 110.98 1bak s PHE 572 Ca 0.00 -1.61 -0.18 0.00 0.12 0.00 0.00 56.93 55.27 1bak s PHE 572 Cb 0.00 -0.67 0.13 0.00 -0.57 0.00 0.00 43.02 41.91 1bak s PHE 572 CO 0.00 -0.91 1.28 -1.17 -0.10 0.00 0.00 175.22 174.33 1bak s LEU 573 N 0.74 4.80 0.00 -0.37 1.98 -1.26 -4.05 118.68 120.52 1bak s LEU 573 Ca 0.25 -2.26 0.00 0.00 -2.89 0.00 0.00 54.13 49.23 1bak s LEU 573 Cb -0.08 -2.43 0.00 0.00 0.66 0.00 0.00 46.19 44.34 1bak s LEU 573 CO -0.09 -1.04 0.00 1.07 -1.89 0.00 0.00 176.35 174.41 1bak n THR 574 N 5.48 0.00 -3.01 3.68 5.66 -1.26 -5.14 114.28 119.69 1bak n THR 574 Ca 0.30 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 61.10 1bak n THR 574 Cb 0.47 0.00 0.07 0.00 -1.55 0.00 0.00 70.33 69.32 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 -0.19 2.24 -0.09 1.09 -2.07 -1.26 -5.13 119.66 114.25 1bak s GLN 575 Ca 0.00 -1.63 -0.06 0.00 -1.82 0.00 0.00 55.36 51.84 1bak s GLN 575 Cb 0.00 -2.62 0.03 0.00 -1.09 0.00 0.00 33.01 29.33 1bak s GLN 575 CO 0.00 -0.93 0.22 -1.58 -1.32 0.00 0.00 175.29 171.68 1bak s TRP 576 N -2.71 -0.26 -0.24 9.60 0.51 -1.26 -5.07 118.94 119.50 1bak s TRP 576 Ca 0.63 0.63 -0.00 0.00 -2.12 0.00 0.00 56.10 55.24 1bak s TRP 576 Cb -0.05 0.06 0.03 0.00 -0.81 0.00 0.00 33.47 32.70 1bak s TRP 576 CO 0.40 -0.15 -0.10 -1.14 -0.51 0.00 0.00 176.95 175.45 1bak s GLN 577 N 0.53 2.72 -0.30 4.98 -0.44 -1.26 -5.07 119.66 120.82 1bak s GLN 577 Ca -0.03 -1.04 -0.17 0.00 -2.50 0.00 0.00 55.36 51.61 1bak s GLN 577 Cb -0.05 -2.89 -0.02 0.00 -1.64 0.00 0.00 33.01 28.41 1bak s GLN 577 CO -0.03 -0.41 0.47 1.03 0.50 0.00 0.00 175.29 176.86 1bak s ARG 578 N 1.26 3.85 0.14 1.67 3.00 -1.26 -0.80 118.95 126.81 1bak s ARG 578 Ca -0.01 0.02 -0.03 0.00 0.00 0.00 0.00 55.73 55.71 1bak s ARG 578 Cb -0.17 -3.72 -0.03 0.00 0.00 0.00 0.00 34.95 31.03 1bak s ARG 578 CO -0.06 -0.46 0.11 1.03 0.00 0.00 0.00 175.30 175.92 1bak s ARG 579 N 2.27 1.00 -0.21 3.54 0.52 -1.06 -4.93 118.95 120.08 1bak s ARG 579 Ca 0.18 -1.39 -0.14 0.00 -0.52 0.00 0.00 55.73 53.86 1bak s ARG 579 Cb -0.16 0.28 -0.04 0.00 0.52 0.00 0.00 34.95 35.55 1bak s ARG 579 CO 0.11 -0.31 0.30 -0.47 0.02 0.00 0.00 175.30 174.96 1bak s TYR 580 N -4.04 3.37 0.49 -0.53 6.14 0.54 0.15 117.35 123.47 1bak s TYR 580 Ca 0.23 0.49 0.03 0.00 0.64 0.00 0.00 57.07 58.46 1bak s TYR 580 Cb 0.06 -2.41 -0.02 0.00 0.42 0.00 0.00 41.96 40.01 1bak s TYR 580 CO 0.02 0.06 0.05 -0.06 0.64 0.00 0.00 175.55 176.26 1bak s PHE 581 N 1.09 2.00 -0.25 4.97 0.08 -0.75 0.22 117.98 125.34 1bak s PHE 581 Ca 0.15 -0.87 -0.02 0.00 0.12 0.00 0.00 56.93 56.31 1bak s PHE 581 Cb -0.14 -1.69 0.13 0.00 -0.57 0.00 0.00 43.02 40.75 1bak s PHE 581 CO 0.06 0.20 0.36 0.71 -0.10 0.00 0.00 175.22 176.45 1bak s TYR 582 N -2.82 -0.78 -0.38 0.36 1.51 -0.86 -2.95 117.35 111.43 1bak s TYR 582 Ca 0.16 0.63 -0.23 0.00 -1.01 0.00 0.00 57.07 56.62 1bak s TYR 582 Cb 0.03 -0.07 0.01 0.00 -0.11 0.00 0.00 41.96 41.82 1bak s TYR 582 CO 0.09 -0.76 0.77 -1.17 -1.11 0.00 0.00 175.55 173.37 1bak s LEU 583 N 2.51 4.16 0.00 -1.29 0.20 -0.14 -2.43 118.68 121.69 1bak s LEU 583 Ca 0.12 0.26 0.02 0.00 0.69 0.00 0.00 54.13 55.22 1bak s LEU 583 Cb -0.15 -2.99 0.09 0.00 -0.43 0.00 0.00 46.19 42.71 1bak s LEU 583 CO -0.19 -0.75 0.68 0.49 -0.29 0.00 0.00 176.35 176.29 1bak n PHE 584 N 6.44 -2.87 1.15 5.38 3.01 0.14 -2.37 117.46 128.35 1bak n PHE 584 Ca 0.03 -1.36 0.00 0.00 1.01 0.00 0.00 57.45 57.12 1bak n PHE 584 Cb 0.48 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1bak n PHE 584 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1bak n PRO 585 N -2.20 0.75 0.00 -1.08 -0.04 -1.25 -4.36 135.00 126.82 1bak n PRO 585 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1bak n PRO 585 Cb 0.43 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 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 -0.21 0.00 -2.85 3.54 3.02 -1.26 -5.02 115.26 112.47 1bak n ASN 586 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.48 1bak n ASN 586 Cb 0.09 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.29 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 0.00 0.44 -3.62 3.52 1.74 -1.26 -1.04 116.66 116.44 1bak n ARG 587 Ca 0.00 -0.91 -0.10 0.00 -0.77 0.00 0.00 57.85 56.06 1bak n ARG 587 Cb 0.00 -0.20 -0.07 0.00 -1.02 0.00 0.00 32.46 31.17 1bak n ARG 587 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1bak s LEU 588 N 0.00 -0.47 -0.06 0.55 2.96 -0.31 -0.68 118.68 120.67 1bak s LEU 588 Ca 0.22 0.82 0.04 0.00 -0.22 0.00 0.00 54.13 54.99 1bak s LEU 588 Cb -0.01 1.97 -0.00 0.00 0.50 0.00 0.00 46.19 48.64 1bak s LEU 588 CO 0.14 -0.22 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.06 1bak s GLU 589 N -0.09 2.13 0.36 1.98 2.12 -1.02 -3.07 118.70 121.12 1bak s GLU 589 Ca 0.01 -0.68 -0.23 0.00 0.36 0.00 0.00 54.97 54.43 1bak s GLU 589 Cb -0.04 -1.77 -0.10 0.00 0.26 0.00 0.00 34.13 32.48 1bak s GLU 589 CO -0.03 0.23 0.92 1.67 -0.54 0.00 0.00 175.26 177.51 1bak s TRP 590 N 0.14 3.50 0.04 5.30 1.48 -0.93 -2.03 118.94 126.43 1bak s TRP 590 Ca -0.08 1.64 -0.07 0.00 -1.06 0.00 0.00 56.10 56.54 1bak s TRP 590 Cb -0.14 -2.85 -0.01 0.00 -1.16 0.00 0.00 33.47 29.32 1bak s TRP 590 CO 0.04 0.07 0.13 1.03 -4.06 0.00 0.00 176.95 174.15 1bak s ARG 591 N -2.61 0.62 0.00 3.25 1.81 0.59 -4.96 118.95 117.64 1bak s ARG 591 Ca 0.55 -0.70 0.00 0.00 -1.72 0.00 0.00 55.73 53.86 1bak s ARG 591 Cb -0.14 0.25 0.00 0.00 -0.45 0.00 0.00 34.95 34.61 1bak s ARG 591 CO 0.18 -0.16 0.00 0.41 -0.68 0.00 0.00 175.30 175.05 1bak n GLY 592 N 0.76 2.73 3.96 -3.53 0.00 -1.26 -0.34 105.19 107.52 1bak n GLY 592 Ca -0.19 -1.62 -0.25 0.00 0.00 0.00 0.00 46.02 43.96 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 -1.92 1.66 7.87 1.61 -1.05 -1.26 -4.86 118.70 120.75 1bak s GLU 593 Ca 0.00 -0.76 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 1bak s GLU 593 Cb 0.00 -2.21 0.00 0.00 -0.44 0.00 0.00 34.13 31.48 1bak s GLU 593 CO 0.00 -1.53 0.00 0.41 0.95 0.00 0.00 175.26 175.09 1bak n GLY 594 N -2.99 3.57 3.60 -3.83 0.00 -1.26 -4.85 105.19 99.42 1bak n GLY 594 Ca 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 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 0.71 -0.08 1.61 2.12 -1.26 -5.19 118.70 116.61 1bak s GLU 595 Ca 0.00 -0.32 -0.32 0.00 0.36 0.00 0.00 54.97 54.69 1bak s GLU 595 Cb 0.00 0.29 0.13 0.00 0.26 0.00 0.00 34.13 34.81 1bak s GLU 595 CO 0.00 -0.32 1.34 0.00 -0.54 0.00 0.00 175.26 175.75 1bak s ALA 596 N -2.87 -2.32 -1.18 6.30 0.00 -1.26 -5.07 121.76 115.36 1bak s ALA 596 Ca 0.09 0.94 -0.21 0.00 0.00 0.00 0.00 51.96 52.78 1bak s ALA 596 Cb -0.00 0.23 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 1bak s ALA 596 CO -0.05 -0.99 1.80 -1.25 0.00 0.00 0.00 175.76 175.28 1bak s PRO 597 N -2.26 3.21 0.15 0.00 0.04 -1.26 -4.87 135.00 130.01 1bak s PRO 597 Ca 0.14 -1.38 -0.07 0.00 0.04 0.00 0.00 61.00 59.73 1bak s PRO 597 Cb 0.05 -5.35 -0.02 0.00 0.04 0.00 0.00 34.50 29.22 1bak s PRO 597 CO -0.05 -3.03 0.21 -0.65 0.04 0.00 0.00 177.00 173.52 1bak s GLN 598 N 5.48 1.06 0.00 4.56 -0.21 -1.26 -5.15 119.66 124.14 1bak s GLN 598 Ca 0.60 -1.22 0.00 0.00 0.02 0.00 0.00 55.36 54.77 1bak s GLN 598 Cb 0.00 0.34 0.00 0.00 1.00 0.00 0.00 33.01 34.35 1bak s GLN 598 CO 0.07 -0.36 0.00 0.43 -2.12 0.00 0.00 175.29 173.31 1bak n SER 599 N -0.16 1.40 -3.63 5.90 7.64 -1.26 -5.01 113.62 118.50 1bak n SER 599 Ca -0.08 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.53 1bak n SER 599 Cb 0.63 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.72 1bak n SER 599 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1bak s LEU 600 N 0.00 2.94 0.00 -3.43 0.05 -1.26 -2.19 118.68 114.80 1bak s LEU 600 Ca 0.00 -3.38 -0.02 0.00 0.05 0.00 0.00 54.13 50.78 1bak s LEU 600 Cb 0.00 -0.98 0.02 0.00 -2.05 0.00 0.00 46.19 43.18 1bak s LEU 600 CO 0.00 -0.14 0.15 0.18 -0.55 0.00 0.00 176.35 175.99 1bak n LEU 601 N 2.51 0.00 0.00 1.48 4.77 -1.17 -4.67 117.00 119.92 1bak n LEU 601 Ca 0.24 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1bak n LEU 601 Cb 0.42 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1bak n LEU 601 CO 0.17 -0.60 0.00 0.41 -1.33 0.00 0.00 177.39 176.04 1bak n THR 602 N -2.08 0.00 -2.67 -5.08 -1.04 -1.26 -1.16 114.28 100.99 1bak n THR 602 Ca 0.02 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.97 1bak n THR 602 Cb 0.07 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 68.62 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 0.00 2.02 -2.80 -2.82 0.00 -0.21 -4.80 117.12 108.51 1bak n MET 603 Ca 0.00 -3.62 -0.24 0.00 0.00 0.00 0.00 57.70 53.84 1bak n MET 603 Cb 0.00 -1.69 -0.02 0.00 0.00 0.00 0.00 33.22 31.51 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 -0.54 2.78 0.14 3.17 0.28 -1.26 -3.58 120.64 121.62 1bak n GLU 604 Ca 0.15 -4.39 0.00 0.00 -0.16 0.00 0.00 57.16 52.76 1bak n GLU 604 Cb 0.83 -2.07 0.00 0.00 1.43 0.00 0.00 31.44 31.63 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 -0.23 0.00 -1.18 3.44 0.28 -1.26 -5.04 120.64 116.64 1bak n GLU 605 Ca 0.30 0.00 -0.46 0.00 -0.16 0.00 0.00 57.16 56.84 1bak n GLU 605 Cb 0.56 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.36 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 -3.06 0.06 0.03 3.84 -0.00 -1.26 -0.02 119.36 118.95 1bak n ILE 606 Ca 0.00 -0.01 -0.17 0.00 -0.00 0.00 0.00 62.75 62.57 1bak n ILE 606 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 39.64 39.50 1bak n ILE 606 CO 0.00 0.00 0.00 -0.61 -0.00 0.00 0.00 176.55 175.94 1bak h GLN 607 N 2.31 0.21 -1.34 0.38 -0.00 -1.00 -3.40 115.11 112.28 1bak h GLN 607 Ca -0.40 -0.35 0.13 0.00 -0.00 0.00 0.00 58.65 58.03 1bak h GLN 607 Cb 1.13 0.13 -0.30 0.00 0.00 0.00 0.00 27.48 28.45 1bak h GLN 607 CO 0.51 1.02 0.66 -1.12 0.00 0.00 0.00 178.83 179.90 1bak s SER 608 N -6.82 -0.26 -0.11 -0.69 0.01 -1.12 -4.93 113.70 99.78 1bak s SER 608 Ca -0.13 0.49 -0.02 0.00 1.31 0.00 0.00 55.95 57.60 1bak s SER 608 Cb 0.07 0.54 -0.03 0.00 0.21 0.00 0.00 66.02 66.81 1bak s SER 608 CO 0.82 -0.08 -0.03 0.54 0.41 0.00 0.00 173.24 174.89 1bak s VAL 609 N 0.21 3.97 0.01 3.43 0.11 -1.26 -2.41 120.40 124.45 1bak s VAL 609 Ca 0.04 -0.36 -0.00 0.00 -2.93 0.00 0.00 61.98 58.74 1bak s VAL 609 Cb -0.05 -2.69 0.00 0.00 -1.53 0.00 0.00 36.38 32.11 1bak s VAL 609 CO -0.11 0.55 0.01 -1.84 -3.33 0.00 0.00 175.10 170.38 1bak n GLU 610 N 2.78 0.02 -3.90 1.54 0.28 -1.03 -5.01 120.64 115.30 1bak n GLU 610 Ca -0.18 -0.05 -0.11 0.00 -0.16 0.00 0.00 57.16 56.67 1bak n GLU 610 Cb 0.53 0.05 -0.12 0.00 1.43 0.00 0.00 31.44 33.32 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 -2.01 0.19 0.34 3.44 2.12 -1.26 0.25 118.70 121.76 1bak s GLU 611 Ca 0.00 -0.24 0.08 0.00 0.36 0.00 0.00 54.97 55.17 1bak s GLU 611 Cb -0.00 0.07 -0.03 0.00 0.26 0.00 0.00 34.13 34.43 1bak s GLU 611 CO 0.00 -0.03 0.24 -0.08 -0.54 0.00 0.00 175.26 174.85 1bak s THR 612 N -0.67 3.29 0.19 -1.70 -1.32 0.25 -4.81 115.64 110.87 1bak s THR 612 Ca -0.07 -1.48 0.07 0.00 -1.21 0.00 0.00 61.69 58.99 1bak s THR 612 Cb -0.05 -3.10 -0.05 0.00 -1.51 0.00 0.00 72.50 67.80 1bak s THR 612 CO -0.00 -0.16 -0.13 -1.10 -2.21 0.00 0.00 174.62 171.02 1bak s GLN 613 N -3.95 1.24 -0.43 7.08 1.11 -1.26 -2.27 119.66 121.19 1bak s GLN 613 Ca 0.40 -1.55 0.04 0.00 0.01 0.00 0.00 55.36 54.27 1bak s GLN 613 Cb -0.04 -0.94 0.17 0.00 -1.01 0.00 0.00 33.01 31.18 1bak s GLN 613 CO 0.25 0.14 0.41 0.42 0.01 0.00 0.00 175.29 176.52 1bak s ILE 614 N -3.10 0.00 0.00 1.08 1.01 -1.23 -4.52 121.20 114.44 1bak s ILE 614 Ca 0.21 -2.14 0.00 0.00 0.00 0.00 0.00 60.65 58.72 1bak s ILE 614 Cb 0.01 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.53 1bak s ILE 614 CO 0.05 -0.93 0.00 0.29 0.00 0.00 0.00 174.94 174.35 1bak n LYS 615 N 3.04 0.00 0.00 2.79 4.76 -1.26 -3.72 118.16 123.77 1bak n LYS 615 Ca 0.25 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.69 1bak n LYS 615 Cb 0.49 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.68 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 -3.65 1.97 2.13 -1.26 -5.14 120.64 114.69 1bak n GLU 616 Ca 0.00 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.70 1bak n GLU 616 Cb 0.00 -0.01 -0.08 0.00 0.27 0.00 0.00 31.44 31.62 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 -1.88 0.72 0.00 5.31 3.52 -1.24 -4.93 118.95 120.44 1bak s ARG 617 Ca 0.00 0.97 0.00 0.00 -0.13 0.00 0.00 55.73 56.57 1bak s ARG 617 Cb 0.00 0.28 0.00 0.00 -1.56 0.00 0.00 34.95 33.67 1bak s ARG 617 CO 0.00 -0.11 0.00 1.17 -0.81 0.00 0.00 175.30 175.55 1bak n LYS 618 N 3.24 0.00 -3.03 5.12 3.00 -0.96 -3.56 118.16 121.97 1bak n LYS 618 Ca -0.16 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.07 1bak n LYS 618 Cb 0.56 0.00 0.01 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 4.34 0.36 0.00 0.20 0.41 0.86 118.68 124.85 1bak s LEU 620 Ca 0.14 0.56 0.00 0.00 0.69 0.00 0.00 54.13 55.53 1bak s LEU 620 Cb -0.02 -2.29 -0.03 0.00 -0.43 0.00 0.00 46.19 43.42 1bak s LEU 620 CO 0.10 0.26 0.56 -0.22 -0.29 0.00 0.00 176.35 176.77 1bak s LEU 621 N -0.37 3.98 -0.51 -0.68 2.96 0.68 0.11 118.68 124.85 1bak s LEU 621 Ca 0.17 0.47 0.07 0.00 -0.22 0.00 0.00 54.13 54.61 1bak s LEU 621 Cb -0.13 -3.34 0.19 0.00 0.50 0.00 0.00 46.19 43.41 1bak s LEU 621 CO 0.05 -0.32 0.69 0.18 -1.32 0.00 0.00 176.35 175.63 1bak n LEU 622 N -1.82 -3.17 -4.74 -0.68 4.32 0.49 -2.48 117.00 108.91 1bak n LEU 622 Ca -0.04 -3.07 -0.40 0.00 -0.02 0.00 0.00 56.01 52.48 1bak n LEU 622 Cb 0.56 0.74 -0.05 0.00 -1.62 0.00 0.00 43.42 43.05 1bak n LEU 622 CO 0.49 1.93 0.66 -1.59 -1.22 0.00 0.00 177.39 177.66 1bak s LYS 623 N 0.79 4.80 -0.03 3.23 -2.85 -1.01 0.97 119.74 125.63 1bak s LYS 623 Ca 0.30 1.49 -0.01 0.00 -1.00 0.00 0.00 55.97 56.75 1bak s LYS 623 Cb 0.01 -3.31 -0.04 0.00 -2.06 0.00 0.00 37.83 32.43 1bak s LYS 623 CO -0.07 0.40 0.08 0.42 0.10 0.00 0.00 175.35 176.28 1bak s ILE 624 N -0.76 4.76 -2.00 3.79 1.01 0.67 -0.48 121.20 128.19 1bak s ILE 624 Ca 0.43 -0.32 0.20 0.00 0.00 0.00 0.00 60.65 60.96 1bak s ILE 624 Cb -0.25 -3.14 0.56 0.00 0.01 0.00 0.00 42.46 39.63 1bak s ILE 624 CO 0.31 0.41 1.72 -2.11 0.00 0.00 0.00 174.94 175.28 1bak n ARG 625 N 1.39 0.95 0.11 2.79 1.85 0.98 -2.78 116.66 121.95 1bak n ARG 625 Ca -0.14 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 56.82 1bak n ARG 625 Cb 0.53 -1.32 0.03 0.00 -1.05 0.00 0.00 32.46 30.65 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 5.11 0.00 0.00 2.89 0.00 -1.94 -3.48 103.07 105.65 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 1.19 1.14 3.30 4.60 0.00 -1.12 -5.14 105.19 109.16 1bak n GLY 627 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 1bak n GLY 627 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bak s LYS 628 N -0.03 1.34 -0.05 1.61 2.20 -1.22 -5.03 119.74 118.56 1bak s LYS 628 Ca 0.00 -1.57 -0.03 0.00 -0.36 0.00 0.00 55.97 54.00 1bak s LYS 628 Cb 0.00 0.32 0.02 0.00 -1.51 0.00 0.00 37.83 36.66 1bak s LYS 628 CO 0.00 -0.48 0.11 -0.65 -0.36 0.00 0.00 175.35 173.97 1bak s GLN 629 N -4.04 0.10 0.09 4.03 -0.21 -1.26 -0.24 119.66 118.13 1bak s GLN 629 Ca 0.35 0.21 0.09 0.00 0.02 0.00 0.00 55.36 56.04 1bak s GLN 629 Cb 0.05 -0.03 -0.03 0.00 1.00 0.00 0.00 33.01 33.99 1bak s GLN 629 CO 0.13 -0.07 -0.24 -0.06 -2.12 0.00 0.00 175.29 172.93 1bak s PHE 630 N 0.44 2.05 -0.18 0.91 0.08 0.27 -4.93 117.98 116.63 1bak s PHE 630 Ca -0.03 -0.40 -0.03 0.00 0.12 0.00 0.00 56.93 56.59 1bak s PHE 630 Cb -0.05 -1.15 0.06 0.00 -0.57 0.00 0.00 43.02 41.31 1bak s PHE 630 CO -0.02 0.22 0.03 0.42 -0.10 0.00 0.00 175.22 175.78 1bak s ILE 631 N -1.02 0.49 0.23 0.64 1.09 -1.12 0.18 121.20 121.70 1bak s ILE 631 Ca 0.10 -0.48 0.11 0.00 -1.10 0.00 0.00 60.65 59.28 1bak s ILE 631 Cb -0.10 -0.97 -0.05 0.00 -1.06 0.00 0.00 42.46 40.28 1bak s ILE 631 CO 0.04 -0.17 -0.20 -1.48 -0.10 0.00 0.00 174.94 173.03 1bak s LEU 632 N 1.88 2.53 0.13 2.97 2.34 0.12 -2.05 118.68 126.59 1bak s LEU 632 Ca -0.00 -0.97 -0.11 0.00 0.06 0.00 0.00 54.13 53.11 1bak s LEU 632 Cb -0.17 -1.03 0.01 0.00 -0.56 0.00 0.00 46.19 44.44 1bak s LEU 632 CO -0.08 0.03 0.30 -1.58 -1.06 0.00 0.00 176.35 173.96 1bak s GLN 633 N -3.23 1.04 -0.02 1.48 2.00 0.10 0.16 119.66 121.19 1bak s GLN 633 Ca 0.25 -0.96 -0.04 0.00 -2.00 0.00 0.00 55.36 52.61 1bak s GLN 633 Cb -0.05 0.40 0.00 0.00 0.80 0.00 0.00 33.01 34.16 1bak s GLN 633 CO 0.12 -0.38 0.10 0.00 -0.50 0.00 0.00 175.29 174.62 1bak h ASP 635 N 5.29 0.00 -3.31 0.00 1.82 -1.99 -3.43 116.42 114.80 1bak h ASP 635 Ca -0.28 0.00 -0.49 0.00 -0.39 0.00 0.00 57.03 55.88 1bak h ASP 635 Cb 1.20 0.00 0.03 0.00 0.68 0.00 0.00 39.33 41.24 1bak h ASP 635 CO 0.43 0.03 0.01 -0.44 -1.61 0.00 0.00 179.24 177.66 1bak s SER 636 N -5.63 6.26 -0.16 2.28 0.01 -1.26 -5.03 113.70 110.18 1bak s SER 636 Ca -0.02 0.77 -0.15 0.00 1.31 0.00 0.00 55.95 57.86 1bak s SER 636 Cb 0.11 -2.17 -0.23 0.00 0.21 0.00 0.00 66.02 63.95 1bak s SER 636 CO 0.51 -0.49 0.32 -0.78 0.41 0.00 0.00 173.24 173.21 1bak h ASP 637 N 0.39 0.23 0.16 2.44 1.82 -2.02 -3.41 116.42 116.03 1bak h ASP 637 Ca -0.48 -0.74 -0.01 0.00 -0.39 0.00 0.00 57.03 55.41 1bak h ASP 637 Cb 1.21 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.15 1bak h ASP 637 CO 0.61 1.67 -0.08 1.55 -1.61 0.00 0.00 179.24 181.39 1bak h PRO 638 N -0.45 -0.21 0.00 0.28 0.13 -1.97 -3.17 132.00 126.61 1bak h PRO 638 Ca -0.38 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1bak h PRO 638 Cb 1.68 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.85 1bak h PRO 638 CO -0.05 0.14 0.00 -1.91 -0.23 0.00 0.00 178.00 175.96 1bak n GLU 639 N -4.90 0.00 -0.19 0.86 2.13 -1.26 0.29 120.64 117.56 1bak n GLU 639 Ca -0.06 0.01 -0.00 0.00 0.66 0.00 0.00 57.16 57.77 1bak n GLU 639 Cb 0.22 -0.03 0.09 0.00 0.27 0.00 0.00 31.44 31.99 1bak n GLU 639 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1bak h LEU 640 N 0.00 -0.29 -0.59 4.31 7.12 -1.78 0.43 115.31 124.50 1bak h LEU 640 Ca 0.00 0.15 0.10 0.00 0.13 0.00 0.00 57.88 58.25 1bak h LEU 640 Cb 0.00 0.27 -0.11 0.00 -0.53 0.00 0.00 40.66 40.29 1bak h LEU 640 CO 0.00 -0.12 -0.40 0.58 -0.13 0.00 0.00 178.44 178.38 1bak h VAL 641 N 0.10 0.11 -0.74 1.05 2.07 0.42 1.00 116.25 120.28 1bak h VAL 641 Ca 0.30 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.77 1bak h VAL 641 Cb 0.48 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1bak h VAL 641 CO -0.51 0.00 0.25 1.56 0.02 0.00 0.00 177.57 178.89 1bak h GLN 642 N -0.20 1.13 -0.67 1.57 7.50 0.39 -1.22 115.11 123.62 1bak h GLN 642 Ca 0.20 -0.23 0.07 0.00 0.50 0.00 0.00 58.65 59.19 1bak h GLN 642 Cb 0.56 -0.17 -0.06 0.00 0.05 0.00 0.00 27.48 27.86 1bak h GLN 642 CO -0.69 0.96 0.34 -1.49 -1.50 0.00 0.00 178.83 176.45 1bak h TRP 643 N 1.08 0.63 0.87 2.96 4.06 0.32 -0.70 115.95 125.17 1bak h TRP 643 Ca 0.24 0.03 -0.04 0.00 2.06 0.00 0.00 58.89 61.17 1bak h TRP 643 Cb 0.28 -0.18 0.01 0.00 -1.00 0.00 0.00 29.16 28.27 1bak h TRP 643 CO 0.02 0.26 -0.42 -0.22 -3.56 0.00 0.00 178.44 174.53 1bak h LYS 644 N 0.62 -1.12 -0.92 0.49 3.64 0.14 1.55 116.57 120.97 1bak h LYS 644 Ca 0.31 0.08 0.15 0.00 -1.27 0.00 0.00 60.65 59.92 1bak h LYS 644 Cb 0.27 0.26 -0.15 0.00 -0.41 0.00 0.00 32.23 32.19 1bak h LYS 644 CO -0.22 -0.75 -0.34 1.17 -2.27 0.00 0.00 179.45 177.04 1bak n LYS 645 N -5.29 -0.19 0.13 1.90 0.00 -0.51 0.34 118.16 114.52 1bak n LYS 645 Ca -0.14 1.42 -0.02 0.00 0.00 0.00 0.00 58.31 59.56 1bak n LYS 645 Cb 0.46 -2.11 0.15 0.00 0.00 0.00 0.00 35.03 33.54 1bak n LYS 645 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1bak h GLU 646 N 0.00 0.04 0.48 1.64 3.07 -0.98 -2.96 114.58 115.88 1bak h GLU 646 Ca 0.34 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 59.14 1bak h GLU 646 Cb 0.57 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1bak h GLU 646 CO -0.92 0.66 -0.23 -0.07 -1.40 0.00 0.00 179.01 177.05 1bak h LEU 647 N 0.03 -0.54 -0.94 1.33 3.38 1.52 -1.39 115.31 118.71 1bak h LEU 647 Ca -0.01 0.02 0.14 0.00 0.09 0.00 0.00 57.88 58.12 1bak h LEU 647 Cb 1.11 0.14 -0.15 0.00 0.09 0.00 0.00 40.66 41.86 1bak h LEU 647 CO 0.08 -0.13 -0.41 -0.09 0.09 0.00 0.00 178.44 177.98 1bak h ARG 648 N -1.16 -0.03 -0.43 1.13 2.43 0.56 0.78 114.38 117.67 1bak h ARG 648 Ca -0.07 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1bak h ARG 648 Cb 0.49 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.01 1bak h ARG 648 CO 0.11 -0.02 0.21 0.22 -1.51 0.00 0.00 179.97 178.98 1bak h ASP 649 N -0.03 0.31 -0.54 -3.80 3.58 -1.59 0.95 116.42 115.30 1bak h ASP 649 Ca 0.30 0.02 0.11 0.00 0.42 0.00 0.00 57.03 57.88 1bak h ASP 649 Cb 0.57 -0.03 -0.10 0.00 1.72 0.00 0.00 39.33 41.48 1bak h ASP 649 CO -0.94 0.22 -0.15 0.00 -2.88 0.00 0.00 179.24 175.49 1bak h ALA 650 N 1.23 0.32 -0.16 -0.78 0.00 0.16 1.41 119.26 121.44 1bak h ALA 650 Ca 0.19 0.21 -0.19 0.00 0.00 0.00 0.00 54.91 55.12 1bak h ALA 650 Cb 0.10 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1bak h ALA 650 CO -0.13 -0.46 -0.65 1.88 0.00 0.00 0.00 179.25 179.89 1bak h TYR 651 N -0.02 0.80 0.41 0.00 0.05 0.07 -2.92 116.97 115.36 1bak h TYR 651 Ca 0.26 -0.32 -0.02 0.00 0.05 0.00 0.00 58.73 58.70 1bak h TYR 651 Cb 0.42 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.02 1bak h TYR 651 CO -0.47 1.09 -0.20 0.00 -1.05 0.00 0.00 178.16 177.54 1bak h ARG 652 N 0.44 -0.53 -0.91 4.88 3.08 0.29 -2.47 114.38 119.17 1bak h ARG 652 Ca -0.02 0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.20 1bak h ARG 652 Cb 1.23 0.12 -0.14 0.00 0.08 0.00 0.00 29.97 31.26 1bak h ARG 652 CO 0.13 -0.35 -0.43 0.93 -1.07 0.00 0.00 179.97 179.18 1bak h GLU 653 N -0.65 -0.04 -1.01 0.04 3.07 0.17 1.57 114.58 117.74 1bak h GLU 653 Ca -0.06 0.00 0.26 0.00 -0.50 0.00 0.00 59.36 59.07 1bak h GLU 653 Cb 0.42 0.01 -0.13 0.00 -0.84 0.00 0.00 28.75 28.21 1bak h GLU 653 CO 0.09 -0.03 0.59 0.00 -1.40 0.00 0.00 179.01 178.27 1bak h ALA 654 N 1.10 1.84 0.02 3.43 0.00 -1.53 2.23 119.26 126.35 1bak h ALA 654 Ca 0.28 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.33 1bak h ALA 654 Cb 0.56 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1bak h ALA 654 CO -0.92 -0.34 -0.01 1.96 0.00 0.00 0.00 179.25 179.94 1bak h GLN 655 N 0.53 -0.03 -0.05 0.00 4.20 0.26 0.15 115.11 120.17 1bak h GLN 655 Ca 0.66 0.00 0.01 0.00 0.06 0.00 0.00 58.65 59.39 1bak h GLN 655 Cb 1.32 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 29.11 1bak h GLN 655 CO -0.49 -0.02 0.37 -0.56 -0.67 0.00 0.00 178.83 177.45 1bak h GLN 656 N -0.06 0.00 0.00 1.46 3.07 -0.18 2.18 115.11 121.58 1bak h GLN 656 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.68 1bak h GLN 656 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.58 1bak h GLN 656 CO 0.01 0.00 -0.97 -0.07 0.09 0.00 0.00 178.83 177.89 1bak h LEU 657 N 0.00 0.00 -3.04 0.06 3.38 0.37 -3.30 115.31 112.78 1bak h LEU 657 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1bak h LEU 657 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1bak h LEU 657 CO -0.00 0.20 0.00 0.55 0.09 0.00 0.00 178.44 179.28 1bak n VAL 658 N -2.83 1.59 0.07 1.22 3.14 0.58 -4.69 118.33 117.43 1bak n VAL 658 Ca -0.02 -1.60 -0.06 0.00 -2.96 0.00 0.00 64.34 59.71 1bak n VAL 658 Cb 0.64 0.09 -0.03 0.00 -1.06 0.00 0.00 33.84 33.48 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 0.88 -0.28 -4.18 1.45 1.08 0.26 -3.36 115.11 110.96 1bak h GLN 659 Ca 0.00 0.02 -0.48 0.00 -1.45 0.00 0.00 58.65 56.74 1bak h GLN 659 Cb 0.94 0.06 0.05 0.00 -0.05 0.00 0.00 27.48 28.48 1bak h GLN 659 CO 0.06 -0.12 2.09 0.54 -0.95 0.00 0.00 178.83 180.44 1bak n ARG 660 N -4.96 1.26 -2.28 1.46 1.74 -1.26 -4.88 116.66 107.73 1bak n ARG 660 Ca -0.04 -1.43 -0.42 0.00 -0.77 0.00 0.00 57.85 55.19 1bak n ARG 660 Cb 0.14 -2.60 -0.03 0.00 -1.02 0.00 0.00 32.46 28.96 1bak n ARG 660 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1bak s VAL 661 N 4.83 3.73 -0.38 1.55 1.01 -1.26 -4.95 120.40 124.93 1bak s VAL 661 Ca 0.46 1.18 -0.29 0.00 0.00 0.00 0.00 61.98 63.34 1bak s VAL 661 Cb 0.11 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1bak s VAL 661 CO 0.09 0.05 1.39 -2.16 0.00 0.00 0.00 175.10 174.47 1bak s PRO 662 N 1.71 3.66 -0.09 2.72 0.04 -1.26 -4.90 135.00 136.89 1bak s PRO 662 Ca 0.62 1.04 -0.02 0.00 0.04 0.00 0.00 61.00 62.68 1bak s PRO 662 Cb -0.32 -3.99 -0.01 0.00 0.04 0.00 0.00 34.50 30.23 1bak s PRO 662 CO 0.28 -1.45 -0.03 -0.22 0.04 0.00 0.00 177.00 175.62 1bak h LYS 663 N 10.36 0.00 0.00 4.56 3.64 -2.01 -3.33 116.57 129.79 1bak h LYS 663 Ca -0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1bak h LYS 663 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1bak h LYS 663 CO 1.07 0.00 0.00 -1.33 -2.27 0.00 0.00 179.45 176.92 1bak n MET 664 N -4.31 0.02 -2.30 1.90 2.81 -1.26 -4.93 117.12 109.04 1bak n MET 664 Ca -0.01 0.20 -0.03 0.00 -1.81 0.00 0.00 57.70 56.04 1bak n MET 664 Cb 0.05 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 1bak n MET 664 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1bak n LYS 665 N -1.49 -1.68 -2.15 0.03 4.76 -1.25 -4.88 118.16 111.49 1bak n LYS 665 Ca 0.04 1.63 -0.41 0.00 -2.87 0.00 0.00 58.31 56.71 1bak n LYS 665 Cb 0.20 -3.96 -0.00 0.00 -1.84 0.00 0.00 35.03 29.43 1bak n LYS 665 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1bak n ASN 666 N -0.13 7.23 0.12 4.39 4.13 -1.26 -4.14 115.26 125.60 1bak n ASN 666 Ca 0.05 -3.18 0.00 0.00 1.68 0.00 0.00 54.58 53.14 1bak n ASN 666 Cb 0.19 -1.38 0.00 0.00 -1.54 0.00 0.00 39.78 37.06 1bak n ASN 666 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1bak n LYS 667 N 2.13 0.00 -0.43 3.52 4.01 -1.26 -4.93 118.16 121.20 1bak n LYS 667 Ca 0.55 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 58.33 1bak n LYS 667 Cb 0.28 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 34.78 1bak n LYS 667 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 1bak n PRO 668 N -3.00 0.85 -2.15 1.97 -0.04 -1.26 -4.87 135.00 126.50 1bak n PRO 668 Ca 0.00 -0.11 -0.42 0.00 -0.04 0.00 0.00 63.50 62.93 1bak n PRO 668 Cb 0.00 -1.23 -0.03 0.00 -0.04 0.00 0.00 33.50 32.20 1bak n PRO 668 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1bak s ARG 669 N 0.64 4.27 0.00 0.54 6.06 -1.26 -5.12 118.95 124.08 1bak s ARG 669 Ca 0.07 2.06 0.10 0.00 -2.50 0.00 0.00 55.73 55.45 1bak s ARG 669 Cb 0.03 -3.54 0.57 0.00 0.06 0.00 0.00 34.95 32.07 1bak s ARG 669 CO 0.00 -0.59 1.01 0.45 -2.50 0.00 0.00 175.30 173.67