#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 -0.28 0.43 1.61 0.01 -1.26 -5.09 113.70 109.13 1bak s SER 553 Ca 0.00 -0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1bak s SER 553 Cb 0.00 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.68 1bak s SER 553 CO 0.00 -0.79 0.00 1.57 0.41 0.00 0.00 173.24 174.43 1bak n HIS 554 N -0.37 -2.71 -3.29 2.43 -0.00 -1.26 -4.96 115.22 105.05 1bak n HIS 554 Ca -0.08 1.50 -0.09 0.00 -0.00 0.00 0.00 57.72 59.05 1bak n HIS 554 Cb 0.61 -2.47 -0.05 0.00 -0.00 0.00 0.00 29.99 28.09 1bak n HIS 554 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 1bak s MET 555 N -3.99 0.68 0.77 1.57 1.00 -1.26 -5.07 119.30 113.00 1bak s MET 555 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 55.69 55.21 1bak s MET 555 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 34.83 34.48 1bak s MET 555 CO 0.00 -1.17 0.00 0.41 0.00 0.00 0.00 175.02 174.26 1bak n GLY 556 N 4.47 0.62 2.45 -0.03 0.00 -1.26 -4.55 105.19 106.89 1bak n GLY 556 Ca 0.10 -0.87 -0.23 0.00 0.00 0.00 0.00 46.02 45.02 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 0.00 0.28 -3.38 1.61 4.81 -1.26 -5.01 118.16 115.22 1bak n LYS 557 Ca 0.00 -2.96 -0.12 0.00 -0.87 0.00 0.00 58.31 54.36 1bak n LYS 557 Cb 0.00 -1.61 -0.09 0.00 0.02 0.00 0.00 35.03 33.36 1bak n LYS 557 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1bak s ASP 558 N 0.10 0.64 0.30 3.14 1.11 -1.26 -5.14 116.67 115.56 1bak s ASP 558 Ca 0.33 -0.05 -0.29 0.00 0.18 0.00 0.00 52.55 52.72 1bak s ASP 558 Cb 0.04 0.90 -0.10 0.00 1.07 0.00 0.00 42.92 44.84 1bak s ASP 558 CO -0.17 -0.32 1.25 0.00 1.18 0.00 0.00 175.17 177.11 1bak n ILE 560 N 1.15 1.45 -3.82 0.00 5.41 -1.12 -4.99 119.36 117.45 1bak n ILE 560 Ca 0.00 0.14 -0.12 0.00 1.00 0.00 0.00 62.75 63.77 1bak n ILE 560 Cb 0.43 -2.29 -0.10 0.00 -0.71 0.00 0.00 39.64 36.97 1bak n ILE 560 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 176.55 176.23 1bak s MET 561 N -2.29 0.43 0.01 0.38 1.75 -1.06 -5.07 119.30 113.45 1bak s MET 561 Ca -0.19 -0.09 -0.13 0.00 -1.25 0.00 0.00 55.69 54.03 1bak s MET 561 Cb 0.03 0.19 0.02 0.00 2.84 0.00 0.00 34.83 37.91 1bak s MET 561 CO 0.33 -0.09 0.27 -3.38 -0.65 0.00 0.00 175.02 171.50 1bak s HIS 562 N -0.80 -0.10 -5.00 4.11 -3.43 -1.26 -0.35 115.29 108.46 1bak s HIS 562 Ca -0.09 0.05 0.00 0.00 -0.80 0.00 0.00 55.06 54.22 1bak s HIS 562 Cb -0.05 0.06 0.00 0.00 -1.43 0.00 0.00 32.58 31.16 1bak s HIS 562 CO 0.02 -0.42 0.00 0.41 -2.00 0.00 0.00 174.74 172.75 1bak n GLY 563 N 1.00 -0.28 3.69 -1.38 0.00 -1.06 -5.02 105.19 102.14 1bak n GLY 563 Ca -0.20 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.22 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 -3.11 3.48 -0.07 1.61 6.14 -1.26 -2.00 117.35 122.13 1bak s TYR 564 Ca 0.00 1.07 -0.04 0.00 0.64 0.00 0.00 57.07 58.74 1bak s TYR 564 Cb 0.00 -2.78 0.03 0.00 0.42 0.00 0.00 41.96 39.63 1bak s TYR 564 CO 0.00 -0.03 0.17 1.41 0.64 0.00 0.00 175.55 177.74 1bak s MET 565 N 1.32 0.15 -0.34 4.97 1.75 0.59 -4.85 119.30 122.89 1bak s MET 565 Ca 0.32 0.34 -0.12 0.00 -1.25 0.00 0.00 55.69 54.98 1bak s MET 565 Cb -0.16 -0.05 -0.00 0.00 2.84 0.00 0.00 34.83 37.45 1bak s MET 565 CO 0.13 -0.10 0.22 -1.54 -0.65 0.00 0.00 175.02 173.08 1bak s SER 566 N 0.72 5.86 -0.18 1.11 1.04 -0.81 -2.73 113.70 118.71 1bak s SER 566 Ca -0.05 -0.59 -0.16 0.00 0.48 0.00 0.00 55.95 55.62 1bak s SER 566 Cb -0.07 -2.08 0.05 0.00 0.10 0.00 0.00 66.02 64.02 1bak s SER 566 CO -0.04 -0.27 0.48 -0.75 0.98 0.00 0.00 173.24 173.64 1bak s LYS 567 N 1.66 0.55 0.00 4.02 2.20 -1.22 0.28 119.74 127.23 1bak s LYS 567 Ca 0.05 0.69 0.00 0.00 -0.36 0.00 0.00 55.97 56.35 1bak s LYS 567 Cb -0.18 0.25 0.00 0.00 -1.51 0.00 0.00 37.83 36.39 1bak s LYS 567 CO 0.09 -0.08 0.00 -0.12 -0.36 0.00 0.00 175.35 174.88 1bak n MET 568 N 2.97 -0.02 -1.36 4.03 1.56 -1.03 -4.83 117.12 118.43 1bak n MET 568 Ca -0.14 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.29 1bak n MET 568 Cb 0.57 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.94 1bak n MET 568 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1bak n GLY 569 N 0.00 -4.38 2.06 -5.12 0.00 -1.26 -3.07 105.19 93.42 1bak n GLY 569 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1bak n GLY 569 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bak n ASN 570 N -0.96 -1.16 0.09 1.61 3.02 -1.26 -4.25 115.26 112.35 1bak n ASN 570 Ca 0.00 0.42 -0.07 0.00 -0.03 0.00 0.00 54.58 54.90 1bak n ASN 570 Cb 0.02 1.24 0.03 0.00 -0.61 0.00 0.00 39.78 40.46 1bak n ASN 570 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1bak h PRO 571 N 0.00 0.17 -2.86 3.52 0.13 -1.97 -3.38 132.00 127.61 1bak h PRO 571 Ca 0.00 -0.16 -0.61 0.00 -0.87 0.00 0.00 66.00 64.36 1bak h PRO 571 Cb 0.00 0.04 -0.40 0.00 0.13 0.00 0.00 31.00 30.77 1bak h PRO 571 CO 0.00 0.87 -0.72 -0.06 -0.23 0.00 0.00 178.00 177.86 1bak s PHE 572 N -3.35 2.57 -1.11 1.56 0.08 -1.26 -5.03 117.98 111.44 1bak s PHE 572 Ca -0.03 -2.90 -0.19 0.00 0.12 0.00 0.00 56.93 53.94 1bak s PHE 572 Cb 0.11 -2.04 0.10 0.00 -0.57 0.00 0.00 43.02 40.61 1bak s PHE 572 CO 0.81 -0.67 1.46 -1.17 -0.10 0.00 0.00 175.22 175.55 1bak s LEU 573 N -0.70 4.22 0.00 -0.37 2.96 -1.26 -4.38 118.68 119.15 1bak s LEU 573 Ca 0.26 -2.15 0.00 0.00 -0.22 0.00 0.00 54.13 52.02 1bak s LEU 573 Cb -0.05 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1bak s LEU 573 CO -0.15 -1.17 0.00 1.07 -1.32 0.00 0.00 176.35 174.78 1bak n THR 574 N 6.02 0.00 -4.22 3.68 5.66 -1.26 -5.09 114.28 119.07 1bak n THR 574 Ca 0.36 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 61.16 1bak n THR 574 Cb 0.48 -0.34 -0.12 0.00 -1.55 0.00 0.00 70.33 68.80 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 -1.53 0.96 0.50 1.09 -2.07 -1.26 -5.16 119.66 112.19 1bak s GLN 575 Ca 0.00 -1.06 0.06 0.00 -1.82 0.00 0.00 55.36 52.54 1bak s GLN 575 Cb 0.00 -1.07 0.01 0.00 -1.09 0.00 0.00 33.01 30.86 1bak s GLN 575 CO 0.00 0.24 0.31 -1.58 -1.32 0.00 0.00 175.29 172.94 1bak s TRP 576 N -1.27 1.97 -0.04 9.60 0.51 -1.26 -4.73 118.94 123.72 1bak s TRP 576 Ca 0.02 -0.76 -0.05 0.00 -2.12 0.00 0.00 56.10 53.19 1bak s TRP 576 Cb -0.10 -1.92 0.01 0.00 -0.81 0.00 0.00 33.47 30.66 1bak s TRP 576 CO 0.03 -0.22 0.13 -0.65 -0.51 0.00 0.00 176.95 175.73 1bak s GLN 577 N -4.14 0.17 -0.27 4.98 -1.52 -1.26 -5.09 119.66 112.53 1bak s GLN 577 Ca 0.34 0.14 -0.26 0.00 -1.95 0.00 0.00 55.36 53.63 1bak s GLN 577 Cb -0.01 0.08 0.00 0.00 -0.22 0.00 0.00 33.01 32.87 1bak s GLN 577 CO 0.20 -0.02 0.89 1.03 -0.25 0.00 0.00 175.29 177.13 1bak s ARG 578 N -0.03 4.11 0.10 2.91 3.00 -1.26 -3.42 118.95 124.37 1bak s ARG 578 Ca -0.01 0.93 -0.04 0.00 0.00 0.00 0.00 55.73 56.61 1bak s ARG 578 Cb -0.01 -3.68 -0.03 0.00 0.00 0.00 0.00 34.95 31.23 1bak s ARG 578 CO 0.00 -0.64 0.10 1.03 0.00 0.00 0.00 175.30 175.79 1bak s ARG 579 N 3.05 0.86 -0.26 3.54 0.52 -1.11 -4.96 118.95 120.60 1bak s ARG 579 Ca 0.37 -1.23 -0.21 0.00 -0.52 0.00 0.00 55.73 54.14 1bak s ARG 579 Cb -0.14 0.28 -0.02 0.00 0.52 0.00 0.00 34.95 35.59 1bak s ARG 579 CO 0.10 -0.25 0.67 -0.47 0.02 0.00 0.00 175.30 175.37 1bak s TYR 580 N -3.96 3.28 0.21 -0.53 6.14 -0.93 -0.30 117.35 121.27 1bak s TYR 580 Ca 0.14 0.86 0.11 0.00 0.64 0.00 0.00 57.07 58.82 1bak s TYR 580 Cb 0.06 -2.90 -0.05 0.00 0.42 0.00 0.00 41.96 39.50 1bak s TYR 580 CO -0.05 -0.36 -0.21 -0.06 0.64 0.00 0.00 175.55 175.52 1bak s PHE 581 N 2.59 2.35 -0.09 4.97 0.40 -0.85 -1.51 117.98 125.84 1bak s PHE 581 Ca 0.28 -0.33 -0.02 0.00 -0.60 0.00 0.00 56.93 56.26 1bak s PHE 581 Cb -0.15 -1.12 0.03 0.00 0.51 0.00 0.00 43.02 42.29 1bak s PHE 581 CO 0.09 0.56 0.02 0.71 0.70 0.00 0.00 175.22 177.29 1bak s TYR 582 N -1.89 0.64 -0.26 0.36 1.51 -0.24 -2.55 117.35 114.91 1bak s TYR 582 Ca 0.24 -0.24 -0.21 0.00 -1.01 0.00 0.00 57.07 55.85 1bak s TYR 582 Cb -0.07 -0.80 -0.02 0.00 -0.11 0.00 0.00 41.96 40.96 1bak s TYR 582 CO 0.12 -0.37 0.66 -1.17 -1.11 0.00 0.00 175.55 173.68 1bak s LEU 583 N 1.98 4.07 0.00 -1.29 0.20 0.52 -2.62 118.68 121.55 1bak s LEU 583 Ca 0.04 0.72 0.03 0.00 0.69 0.00 0.00 54.13 55.61 1bak s LEU 583 Cb -0.13 -2.90 0.03 0.00 -0.43 0.00 0.00 46.19 42.76 1bak s LEU 583 CO -0.06 -0.41 0.26 0.49 -0.29 0.00 0.00 176.35 176.35 1bak n PHE 584 N 5.78 -0.74 1.51 5.38 3.01 -0.44 -2.57 117.46 129.39 1bak n PHE 584 Ca 0.00 -1.63 0.02 0.00 1.01 0.00 0.00 57.45 56.86 1bak n PHE 584 Cb 0.49 -0.31 0.14 0.00 -0.01 0.00 0.00 39.48 39.79 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 -1.36 0.75 0.00 -1.08 -0.04 -1.26 -4.35 135.00 127.67 1bak n PRO 585 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1bak n PRO 585 Cb 0.44 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 1bak n PRO 585 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1bak n ASN 586 N -0.60 0.00 -4.77 3.54 6.94 -1.26 -4.77 115.26 114.34 1bak n ASN 586 Ca 0.04 0.00 -0.24 0.00 -0.02 0.00 0.00 54.58 54.36 1bak n ASN 586 Cb 0.02 0.00 0.09 0.00 -2.36 0.00 0.00 39.78 37.52 1bak n ASN 586 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1bak s ARG 587 N 0.00 1.95 -0.29 -3.83 0.52 -1.26 0.17 118.95 116.20 1bak s ARG 587 Ca 0.00 -0.76 -0.17 0.00 -0.52 0.00 0.00 55.73 54.28 1bak s ARG 587 Cb 0.00 -2.29 0.14 0.00 0.52 0.00 0.00 34.95 33.32 1bak s ARG 587 CO 0.00 -1.28 1.00 -1.17 0.02 0.00 0.00 175.30 173.87 1bak s LEU 588 N -5.13 -0.48 0.12 2.53 2.96 0.51 -1.33 118.68 117.86 1bak s LEU 588 Ca 0.63 0.79 0.09 0.00 -0.22 0.00 0.00 54.13 55.42 1bak s LEU 588 Cb -0.08 1.73 -0.04 0.00 0.50 0.00 0.00 46.19 48.31 1bak s LEU 588 CO 0.43 -0.13 -0.19 -1.83 -1.32 0.00 0.00 176.35 173.32 1bak s GLU 589 N 1.18 1.75 -0.37 1.98 -1.05 -1.08 0.24 118.70 121.34 1bak s GLU 589 Ca -0.07 -1.21 0.02 0.00 -0.15 0.00 0.00 54.97 53.56 1bak s GLU 589 Cb -0.04 -2.09 0.15 0.00 -0.44 0.00 0.00 34.13 31.72 1bak s GLU 589 CO -0.14 0.47 0.31 1.67 0.95 0.00 0.00 175.26 178.53 1bak s TRP 590 N -1.16 0.33 0.57 4.83 1.48 -0.42 -1.08 118.94 123.48 1bak s TRP 590 Ca 0.18 -1.42 0.08 0.00 -1.06 0.00 0.00 56.10 53.88 1bak s TRP 590 Cb -0.10 -0.68 0.07 0.00 -1.16 0.00 0.00 33.47 31.60 1bak s TRP 590 CO 0.10 -0.90 0.66 1.03 -4.06 0.00 0.00 176.95 173.78 1bak s ARG 591 N 1.01 2.28 0.00 3.25 1.81 -0.57 -4.67 118.95 122.06 1bak s ARG 591 Ca 0.21 -1.79 0.00 0.00 -1.72 0.00 0.00 55.73 52.42 1bak s ARG 591 Cb -0.15 -2.44 0.00 0.00 -0.45 0.00 0.00 34.95 31.91 1bak s ARG 591 CO -0.04 -0.79 0.00 0.41 -0.68 0.00 0.00 175.30 174.20 1bak n GLY 592 N -2.08 -1.17 3.89 -3.53 0.00 -1.26 -2.18 105.19 98.86 1bak n GLY 592 Ca 0.09 -1.39 -0.29 0.00 0.00 0.00 0.00 46.02 44.43 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 -1.96 2.69 -0.44 1.61 1.03 -1.26 -4.50 118.70 115.88 1bak s GLU 593 Ca 0.00 0.31 -0.36 0.00 0.03 0.00 0.00 54.97 54.96 1bak s GLU 593 Cb 0.00 -2.05 0.05 0.00 -0.80 0.00 0.00 34.13 31.33 1bak s GLU 593 CO 0.00 -1.09 0.63 0.41 -1.33 0.00 0.00 175.26 173.88 1bak n GLY 594 N -3.00 0.11 3.61 -3.83 0.00 -1.26 -4.96 105.19 95.85 1bak n GLY 594 Ca 0.07 1.07 -0.01 0.00 0.00 0.00 0.00 46.02 47.15 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 -2.45 0.17 0.68 1.61 2.56 -1.26 -5.17 118.70 114.84 1bak s GLU 595 Ca 0.35 -0.08 -0.11 0.00 0.00 0.00 0.00 54.97 55.12 1bak s GLU 595 Cb -0.04 0.07 -0.00 0.00 2.00 0.00 0.00 34.13 36.16 1bak s GLU 595 CO 0.83 -0.08 1.07 0.00 -0.56 0.00 0.00 175.26 176.52 1bak s ALA 596 N -2.21 2.94 -0.79 6.30 0.00 -1.26 -4.95 121.76 121.79 1bak s ALA 596 Ca 0.12 -0.22 0.23 0.00 0.00 0.00 0.00 51.96 52.09 1bak s ALA 596 Cb 0.02 -3.06 0.91 0.00 0.00 0.00 0.00 23.12 21.00 1bak s ALA 596 CO -0.04 -0.99 1.72 -0.35 0.00 0.00 0.00 175.76 176.10 1bak n PRO 597 N -2.93 0.12 -3.03 0.00 -0.04 -1.26 -4.45 135.00 123.41 1bak n PRO 597 Ca 0.07 0.23 -0.44 0.00 -0.04 0.00 0.00 63.50 63.31 1bak n PRO 597 Cb 0.56 -1.68 -0.03 0.00 -0.04 0.00 0.00 33.50 32.30 1bak n PRO 597 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1bak s GLN 598 N -3.11 3.34 -0.48 0.54 0.74 -1.26 -4.86 119.66 114.56 1bak s GLN 598 Ca 0.09 -1.56 0.06 0.00 0.05 0.00 0.00 55.36 54.00 1bak s GLN 598 Cb 0.12 -4.52 0.20 0.00 1.10 0.00 0.00 33.01 29.91 1bak s GLN 598 CO 0.45 -1.64 0.66 0.43 -0.55 0.00 0.00 175.29 174.64 1bak n SER 599 N 6.31 -2.48 -3.59 6.67 7.64 -1.26 -5.09 113.62 121.82 1bak n SER 599 Ca 0.07 -2.86 -0.26 0.00 1.01 0.00 0.00 58.87 56.83 1bak n SER 599 Cb 0.46 1.11 -0.16 0.00 -1.01 0.00 0.00 64.21 64.61 1bak n SER 599 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1bak s LEU 600 N 0.26 0.36 0.42 -3.43 1.43 -1.26 -1.30 118.68 115.16 1bak s LEU 600 Ca 0.31 -0.74 0.08 0.00 -1.03 0.00 0.00 54.13 52.76 1bak s LEU 600 Cb 0.06 -0.23 -0.00 0.00 0.03 0.00 0.00 46.19 46.05 1bak s LEU 600 CO -0.12 -0.37 0.50 -0.76 0.23 0.00 0.00 176.35 175.83 1bak s LEU 601 N 2.14 3.57 0.00 1.79 2.01 0.66 -4.89 118.68 123.96 1bak s LEU 601 Ca 0.04 -0.53 0.02 0.00 0.01 0.00 0.00 54.13 53.67 1bak s LEU 601 Cb -0.16 -2.44 -0.01 0.00 0.01 0.00 0.00 46.19 43.59 1bak s LEU 601 CO -0.15 -0.71 0.08 0.35 1.01 0.00 0.00 176.35 176.92 1bak n THR 602 N -1.74 0.00 -2.41 5.49 -2.24 -1.26 0.19 114.28 112.31 1bak n THR 602 Ca 0.06 -1.80 -0.18 0.00 -2.27 0.00 0.00 64.05 59.86 1bak n THR 602 Cb 0.60 0.57 0.02 0.00 -2.10 0.00 0.00 70.33 69.42 1bak n THR 602 CO 0.00 0.00 0.00 1.15 -0.57 0.00 0.00 175.07 175.65 1bak n MET 603 N -0.77 2.81 -2.42 -0.78 0.00 0.13 -4.79 117.12 111.29 1bak n MET 603 Ca -0.08 -4.00 -0.18 0.00 0.00 0.00 0.00 57.70 53.45 1bak n MET 603 Cb 0.47 -1.98 0.02 0.00 0.00 0.00 0.00 33.22 31.73 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 -0.52 2.79 0.03 3.17 0.28 -1.26 -2.84 120.64 122.29 1bak n GLU 604 Ca 0.30 -3.99 0.00 0.00 -0.16 0.00 0.00 57.16 53.31 1bak n GLU 604 Cb 0.82 -1.97 0.00 0.00 1.43 0.00 0.00 31.44 31.72 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 -0.51 0.00 -0.43 3.44 0.28 -1.26 -4.93 120.64 117.23 1bak n GLU 605 Ca 0.30 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 57.13 1bak n GLU 605 Cb 0.82 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.67 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 -2.62 0.19 0.06 3.84 -0.00 -1.26 -1.67 119.36 117.90 1bak n ILE 606 Ca 0.00 -0.05 -0.21 0.00 -0.00 0.00 0.00 62.75 62.50 1bak n ILE 606 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 39.64 39.49 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 0.69 0.33 -1.25 0.38 -0.00 -0.64 -3.38 115.11 111.24 1bak h GLN 607 Ca -0.13 -0.56 0.16 0.00 -0.00 0.00 0.00 58.65 58.13 1bak h GLN 607 Cb 0.42 0.21 -0.31 0.00 0.00 0.00 0.00 27.48 27.80 1bak h GLN 607 CO 0.18 1.22 0.66 -1.12 0.00 0.00 0.00 178.83 179.77 1bak s SER 608 N -7.13 -0.22 -0.09 -0.69 0.01 -1.08 -4.92 113.70 99.58 1bak s SER 608 Ca -0.14 0.37 -0.01 0.00 1.31 0.00 0.00 55.95 57.47 1bak s SER 608 Cb 0.06 0.81 -0.03 0.00 0.21 0.00 0.00 66.02 67.07 1bak s SER 608 CO 0.84 -0.06 -0.01 0.54 0.41 0.00 0.00 173.24 174.96 1bak s VAL 609 N 0.74 4.19 0.00 3.43 0.11 -1.26 -2.58 120.40 125.02 1bak s VAL 609 Ca -0.03 -0.29 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 1bak s VAL 609 Cb -0.04 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 32.06 1bak s VAL 609 CO -0.12 0.60 0.00 -1.84 -3.33 0.00 0.00 175.10 170.41 1bak n GLU 610 N 2.24 0.00 -4.01 1.54 0.28 -1.07 -4.97 120.64 114.65 1bak n GLU 610 Ca -0.18 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.70 1bak n GLU 610 Cb 0.53 0.00 -0.12 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 -1.32 0.34 0.28 3.44 2.12 -1.26 0.24 118.70 122.54 1bak s GLU 611 Ca 0.00 -0.51 0.08 0.00 0.36 0.00 0.00 54.97 54.90 1bak s GLU 611 Cb 0.00 -0.09 -0.04 0.00 0.26 0.00 0.00 34.13 34.26 1bak s GLU 611 CO 0.00 0.01 0.11 -0.08 -0.54 0.00 0.00 175.26 174.76 1bak s THR 612 N -1.05 3.70 0.26 -1.70 -1.32 0.46 -4.79 115.64 111.20 1bak s THR 612 Ca -0.10 -1.66 0.07 0.00 -1.21 0.00 0.00 61.69 58.79 1bak s THR 612 Cb -0.08 -3.08 -0.05 0.00 -1.51 0.00 0.00 72.50 67.78 1bak s THR 612 CO -0.00 -0.31 -0.09 -1.10 -2.21 0.00 0.00 174.62 170.91 1bak s GLN 613 N -3.79 1.50 -0.44 7.08 -0.21 -1.26 -2.11 119.66 120.43 1bak s GLN 613 Ca 0.34 -1.73 0.05 0.00 0.02 0.00 0.00 55.36 54.03 1bak s GLN 613 Cb -0.06 -1.18 0.17 0.00 1.00 0.00 0.00 33.01 32.95 1bak s GLN 613 CO 0.23 0.09 0.49 0.42 -2.12 0.00 0.00 175.29 174.40 1bak s ILE 614 N -2.98 -0.30 0.00 1.08 1.09 -1.23 -4.56 121.20 114.29 1bak s ILE 614 Ca 0.28 -1.66 0.00 0.00 -1.10 0.00 0.00 60.65 58.16 1bak s ILE 614 Cb 0.02 -0.66 0.00 0.00 -1.06 0.00 0.00 42.46 40.76 1bak s ILE 614 CO 0.11 -0.64 0.00 0.29 -0.10 0.00 0.00 174.94 174.60 1bak n LYS 615 N 3.20 0.00 0.00 2.79 4.76 -1.26 -3.77 118.16 123.88 1bak n LYS 615 Ca 0.21 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 1bak n LYS 615 Cb 0.50 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.69 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 -3.64 1.97 2.13 -1.26 -5.14 120.64 114.70 1bak n GLU 616 Ca 0.00 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.68 1bak n GLU 616 Cb 0.00 -0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.63 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 -1.98 0.79 0.00 5.31 3.52 -1.25 -4.93 118.95 120.42 1bak s ARG 617 Ca 0.00 0.78 0.00 0.00 -0.13 0.00 0.00 55.73 56.38 1bak s ARG 617 Cb 0.00 0.38 0.00 0.00 -1.56 0.00 0.00 34.95 33.77 1bak s ARG 617 CO 0.00 -0.12 0.00 1.17 -0.81 0.00 0.00 175.30 175.54 1bak n LYS 618 N 2.45 0.00 -3.11 5.12 3.00 -0.96 -3.58 118.16 121.08 1bak n LYS 618 Ca -0.15 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.09 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 4.42 0.30 0.00 0.20 -0.44 0.18 118.68 123.34 1bak s LEU 620 Ca 0.14 0.69 0.04 0.00 0.69 0.00 0.00 54.13 55.68 1bak s LEU 620 Cb -0.03 -2.35 -0.03 0.00 -0.43 0.00 0.00 46.19 43.36 1bak s LEU 620 CO 0.10 0.36 0.46 -0.22 -0.29 0.00 0.00 176.35 176.76 1bak s LEU 621 N -1.12 4.12 -0.39 -0.68 2.96 0.64 0.80 118.68 125.02 1bak s LEU 621 Ca 0.20 0.16 0.07 0.00 -0.22 0.00 0.00 54.13 54.33 1bak s LEU 621 Cb -0.14 -3.00 0.18 0.00 0.50 0.00 0.00 46.19 43.73 1bak s LEU 621 CO 0.09 -0.24 0.57 -0.22 -1.32 0.00 0.00 176.35 175.23 1bak s LEU 622 N -4.15 -1.22 -0.07 -0.68 0.20 0.20 -2.58 118.68 110.37 1bak s LEU 622 Ca 0.39 -0.84 -0.13 0.00 0.69 0.00 0.00 54.13 54.23 1bak s LEU 622 Cb -0.09 1.66 -0.05 0.00 -0.43 0.00 0.00 46.19 47.28 1bak s LEU 622 CO 0.32 -0.21 0.34 -1.59 -0.29 0.00 0.00 176.35 174.92 1bak s LYS 623 N 1.88 3.97 -0.04 1.98 -2.85 -1.07 0.18 119.74 123.79 1bak s LYS 623 Ca 0.15 0.24 -0.03 0.00 -1.00 0.00 0.00 55.97 55.33 1bak s LYS 623 Cb -0.07 -3.29 -0.04 0.00 -2.06 0.00 0.00 37.83 32.37 1bak s LYS 623 CO -0.09 0.53 0.12 0.42 0.10 0.00 0.00 175.35 176.43 1bak s ILE 624 N -0.49 5.10 -2.00 3.79 1.01 -0.41 -0.01 121.20 128.20 1bak s ILE 624 Ca 0.20 -0.15 0.21 0.00 0.00 0.00 0.00 60.65 60.91 1bak s ILE 624 Cb -0.15 -3.30 0.60 0.00 0.01 0.00 0.00 42.46 39.62 1bak s ILE 624 CO 0.09 0.44 1.78 -2.11 0.00 0.00 0.00 174.94 175.14 1bak n ARG 625 N 1.42 0.96 0.06 2.79 1.85 -0.67 -2.86 116.66 120.22 1bak n ARG 625 Ca -0.15 0.00 0.02 0.00 -1.00 0.00 0.00 57.85 56.72 1bak n ARG 625 Cb 0.53 -1.34 -0.05 0.00 -1.05 0.00 0.00 32.46 30.55 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 5.12 0.00 0.00 2.89 0.00 -1.94 -3.48 103.07 105.66 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 1.34 1.00 3.31 4.60 0.00 -1.13 -5.15 105.19 109.14 1bak n GLY 627 Ca -0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 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 0.01 1.34 -0.06 1.61 1.02 -1.24 -5.03 119.74 117.39 1bak s LYS 628 Ca 0.00 -1.57 -0.05 0.00 0.02 0.00 0.00 55.97 54.37 1bak s LYS 628 Cb 0.00 0.33 0.02 0.00 -0.52 0.00 0.00 37.83 37.66 1bak s LYS 628 CO 0.00 -0.48 0.15 -1.14 -0.92 0.00 0.00 175.35 172.96 1bak s GLN 629 N -4.04 0.15 0.12 1.68 0.74 -1.26 -1.29 119.66 115.76 1bak s GLN 629 Ca 0.35 0.26 0.05 0.00 0.05 0.00 0.00 55.36 56.07 1bak s GLN 629 Cb 0.05 0.01 -0.04 0.00 1.10 0.00 0.00 33.01 34.13 1bak s GLN 629 CO 0.13 -0.06 -0.12 -0.06 -0.55 0.00 0.00 175.29 174.62 1bak s PHE 630 N 0.41 1.28 -0.09 1.67 0.08 0.48 -4.28 117.98 117.52 1bak s PHE 630 Ca -0.03 -0.60 0.00 0.00 0.12 0.00 0.00 56.93 56.43 1bak s PHE 630 Cb -0.04 -0.68 0.02 0.00 -0.57 0.00 0.00 43.02 41.76 1bak s PHE 630 CO -0.02 0.09 -0.08 -1.50 -0.10 0.00 0.00 175.22 173.62 1bak s ILE 631 N -2.31 0.95 0.22 0.64 1.10 -1.17 0.59 121.20 121.22 1bak s ILE 631 Ca 0.08 -0.28 0.01 0.00 -0.51 0.00 0.00 60.65 59.94 1bak s ILE 631 Cb -0.04 -0.96 -0.04 0.00 0.15 0.00 0.00 42.46 41.57 1bak s ILE 631 CO 0.02 0.34 0.40 -0.76 -2.11 0.00 0.00 174.94 172.83 1bak s LEU 632 N 1.42 4.22 -0.26 8.50 1.02 0.24 -2.48 118.68 131.34 1bak s LEU 632 Ca -0.01 0.34 -0.12 0.00 0.02 0.00 0.00 54.13 54.36 1bak s LEU 632 Cb -0.13 -3.12 0.10 0.00 0.02 0.00 0.00 46.19 43.05 1bak s LEU 632 CO -0.04 -0.08 0.60 -1.58 0.02 0.00 0.00 176.35 175.26 1bak s GLN 633 N -3.56 0.56 0.03 1.70 -0.44 0.81 -1.33 119.66 117.43 1bak s GLN 633 Ca 0.38 1.22 -0.00 0.00 -2.50 0.00 0.00 55.36 54.45 1bak s GLN 633 Cb -0.10 0.40 -0.03 0.00 -1.64 0.00 0.00 33.01 31.63 1bak s GLN 633 CO 0.30 -0.18 -0.03 0.00 0.50 0.00 0.00 175.29 175.87 1bak h ASP 635 N 4.01 0.00 -3.65 0.00 2.03 -2.00 -3.45 116.42 113.36 1bak h ASP 635 Ca -0.33 0.00 -0.50 0.00 -0.73 0.00 0.00 57.03 55.47 1bak h ASP 635 Cb 1.18 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.65 1bak h ASP 635 CO 0.52 0.10 0.07 -0.44 -1.03 0.00 0.00 179.24 178.46 1bak s SER 636 N -6.24 6.82 -0.09 4.15 0.01 -1.26 -5.00 113.70 112.08 1bak s SER 636 Ca 0.06 1.27 -0.18 0.00 1.31 0.00 0.00 55.95 58.41 1bak s SER 636 Cb 0.06 -2.37 -0.28 0.00 0.21 0.00 0.00 66.02 63.64 1bak s SER 636 CO 0.68 -0.13 0.63 0.44 0.41 0.00 0.00 173.24 175.26 1bak h ASP 637 N 2.56 0.38 0.07 2.44 5.19 -2.02 -3.39 116.42 121.66 1bak h ASP 637 Ca -0.48 -0.87 -0.00 0.00 -0.62 0.00 0.00 57.03 55.06 1bak h ASP 637 Cb 1.18 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.56 1bak h ASP 637 CO 0.66 1.55 -0.04 1.55 -3.12 0.00 0.00 179.24 179.84 1bak h PRO 638 N -0.36 -0.09 0.00 3.56 0.13 -1.98 -3.16 132.00 130.10 1bak h PRO 638 Ca -0.26 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1bak h PRO 638 Cb 1.70 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.86 1bak h PRO 638 CO 0.07 0.47 0.00 0.39 -0.23 0.00 0.00 178.00 178.70 1bak n GLU 639 N -4.81 0.00 -0.24 0.86 -0.58 -1.26 0.21 120.64 114.83 1bak n GLU 639 Ca -0.08 0.10 0.04 0.00 -0.42 0.00 0.00 57.16 56.80 1bak n GLU 639 Cb 0.30 -0.22 0.15 0.00 -0.57 0.00 0.00 31.44 31.10 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 -0.13 -0.57 -4.62 7.12 -1.75 0.40 115.31 115.76 1bak h LEU 640 Ca 0.00 0.15 0.08 0.00 0.13 0.00 0.00 57.88 58.25 1bak h LEU 640 Cb 0.00 0.24 -0.10 0.00 -0.53 0.00 0.00 40.66 40.27 1bak h LEU 640 CO 0.00 -0.08 -0.45 1.62 -0.13 0.00 0.00 178.44 179.40 1bak h VAL 641 N 0.20 0.08 -0.57 1.05 3.04 0.26 0.91 116.25 121.21 1bak h VAL 641 Ca 0.39 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 66.03 1bak h VAL 641 Cb 0.65 0.08 -0.02 0.00 -2.01 0.00 0.00 31.29 29.99 1bak h VAL 641 CO -0.54 0.00 0.17 -0.61 -1.01 0.00 0.00 177.57 175.59 1bak h GLN 642 N -0.24 0.88 -0.96 4.17 5.75 0.35 -1.57 115.11 123.49 1bak h GLN 642 Ca 0.17 -0.19 0.15 0.00 -0.15 0.00 0.00 58.65 58.63 1bak h GLN 642 Cb 0.56 -0.13 -0.09 0.00 1.07 0.00 0.00 27.48 28.89 1bak h GLN 642 CO -0.69 0.80 0.57 -1.49 -2.65 0.00 0.00 178.83 175.37 1bak h TRP 643 N 0.79 1.01 0.68 3.99 4.06 0.23 0.25 115.95 126.97 1bak h TRP 643 Ca 0.18 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 61.13 1bak h TRP 643 Cb 0.29 -0.31 0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1bak h TRP 643 CO 0.02 0.30 -0.33 -0.22 -3.56 0.00 0.00 178.44 174.65 1bak h LYS 644 N 0.81 -0.88 -0.97 0.49 1.63 0.13 1.03 116.57 118.81 1bak h LYS 644 Ca 0.51 0.06 0.15 0.00 -0.85 0.00 0.00 60.65 60.52 1bak h LYS 644 Cb 0.67 0.20 -0.16 0.00 -0.60 0.00 0.00 32.23 32.34 1bak h LYS 644 CO -0.33 -0.59 -0.38 1.17 -3.45 0.00 0.00 179.45 175.87 1bak n LYS 645 N -4.97 -0.23 0.10 1.90 0.00 -0.65 0.27 118.16 114.59 1bak n LYS 645 Ca -0.11 1.50 -0.02 0.00 0.00 0.00 0.00 58.31 59.68 1bak n LYS 645 Cb 0.36 -2.22 0.22 0.00 0.00 0.00 0.00 35.03 33.39 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 0.21 0.61 1.64 3.07 -0.92 -2.89 114.58 116.29 1bak h GLU 646 Ca 0.34 -0.10 -0.03 0.00 -0.50 0.00 0.00 59.36 59.07 1bak h GLU 646 Cb 0.58 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.50 1bak h GLU 646 CO -0.97 0.61 -0.29 -0.07 -1.40 0.00 0.00 179.01 176.89 1bak h LEU 647 N 0.17 -0.69 -0.95 1.33 3.38 1.12 0.10 115.31 119.77 1bak h LEU 647 Ca 0.01 0.02 0.17 0.00 0.09 0.00 0.00 57.88 58.17 1bak h LEU 647 Cb 0.84 0.18 -0.17 0.00 0.09 0.00 0.00 40.66 41.61 1bak h LEU 647 CO 0.07 -0.29 -0.33 -0.09 0.09 0.00 0.00 178.44 177.88 1bak h ARG 648 N -1.22 -0.01 -0.49 1.13 2.43 0.39 0.97 114.38 117.58 1bak h ARG 648 Ca -0.08 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 1bak h ARG 648 Cb 0.63 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1bak h ARG 648 CO 0.14 -0.01 0.16 0.22 -1.51 0.00 0.00 179.97 178.96 1bak h ASP 649 N -0.01 0.71 -0.73 -3.80 1.82 -1.53 0.74 116.42 113.62 1bak h ASP 649 Ca 0.38 -0.20 0.14 0.00 -0.39 0.00 0.00 57.03 56.96 1bak h ASP 649 Cb 0.63 -0.19 -0.10 0.00 0.68 0.00 0.00 39.33 40.36 1bak h ASP 649 CO -0.97 0.73 0.24 0.00 -1.61 0.00 0.00 179.24 177.63 1bak h ALA 650 N 1.01 0.98 0.13 -0.78 0.00 0.34 1.69 119.26 122.64 1bak h ALA 650 Ca 0.16 0.13 -0.30 0.00 0.00 0.00 0.00 54.91 54.90 1bak h ALA 650 Cb 0.27 0.15 0.03 0.00 0.00 0.00 0.00 17.79 18.23 1bak h ALA 650 CO -0.01 -0.27 -1.27 1.88 0.00 0.00 0.00 179.25 179.58 1bak h TYR 651 N 0.36 1.02 0.61 0.00 0.05 0.08 -2.63 116.97 116.46 1bak h TYR 651 Ca 0.40 -0.65 -0.03 0.00 0.05 0.00 0.00 58.73 58.50 1bak h TYR 651 Cb 0.64 -0.08 0.01 0.00 1.01 0.00 0.00 36.73 38.31 1bak h TYR 651 CO -0.21 1.49 -0.29 0.00 -1.05 0.00 0.00 178.16 178.10 1bak h ARG 652 N 0.27 -0.79 -0.21 4.88 3.08 0.18 -2.21 114.38 119.57 1bak h ARG 652 Ca -0.20 0.05 0.05 0.00 0.07 0.00 0.00 59.98 59.96 1bak h ARG 652 Cb 1.95 0.18 -0.07 0.00 0.08 0.00 0.00 29.97 32.10 1bak h ARG 652 CO 0.24 -0.53 -0.37 0.93 -1.07 0.00 0.00 179.97 179.18 1bak h GLU 653 N -0.97 -0.38 -1.21 0.04 3.07 0.23 0.42 114.58 115.77 1bak h GLU 653 Ca -0.08 0.03 0.36 0.00 -0.50 0.00 0.00 59.36 59.16 1bak h GLU 653 Cb 0.63 0.09 -0.10 0.00 -0.84 0.00 0.00 28.75 28.53 1bak h GLU 653 CO 0.14 -0.25 0.80 0.00 -1.40 0.00 0.00 179.01 178.30 1bak h ALA 654 N 0.39 2.65 0.07 3.43 0.00 -1.52 1.53 119.26 125.81 1bak h ALA 654 Ca 0.11 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1bak h ALA 654 Cb 0.58 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1bak h ALA 654 CO -0.43 -1.13 -0.03 1.96 0.00 0.00 0.00 179.25 179.62 1bak h GLN 655 N 0.20 -0.09 -0.11 0.00 4.20 0.33 -0.96 115.11 118.68 1bak h GLN 655 Ca 0.69 0.01 0.03 0.00 0.06 0.00 0.00 58.65 59.44 1bak h GLN 655 Cb 2.14 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.93 1bak h GLN 655 CO -0.28 -0.06 0.42 -0.56 -0.67 0.00 0.00 178.83 177.68 1bak h GLN 656 N -0.29 0.00 0.00 1.46 3.07 0.25 1.99 115.11 121.59 1bak h GLN 656 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.59 1bak h GLN 656 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.61 1bak h GLN 656 CO 0.02 0.00 -1.08 -0.07 0.09 0.00 0.00 178.83 177.79 1bak h LEU 657 N 0.00 0.00 -3.00 0.06 4.07 0.21 -3.28 115.31 113.37 1bak h LEU 657 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1bak h LEU 657 Cb 0.88 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.62 1bak h LEU 657 CO -0.00 0.53 0.00 0.55 -1.08 0.00 0.00 178.44 178.44 1bak n VAL 658 N -3.00 1.41 0.00 1.22 3.14 0.56 -4.32 118.33 117.34 1bak n VAL 658 Ca -0.05 -1.25 0.00 0.00 -2.96 0.00 0.00 64.34 60.08 1bak n VAL 658 Cb 0.79 0.27 0.00 0.00 -1.06 0.00 0.00 33.84 33.84 1bak n VAL 658 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1bak n GLN 659 N 0.35 0.00 -2.69 1.45 6.02 0.49 -4.77 117.38 118.22 1bak n GLN 659 Ca 0.16 0.31 -0.07 0.00 -0.01 0.00 0.00 57.00 57.39 1bak n GLN 659 Cb 0.60 -1.05 0.08 0.00 1.02 0.00 0.00 30.24 30.88 1bak n GLN 659 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1bak n ARG 660 N -1.42 1.24 -4.14 -1.09 1.85 -1.26 -5.08 116.66 106.75 1bak n ARG 660 Ca 0.00 -2.47 -0.34 0.00 -1.00 0.00 0.00 57.85 54.03 1bak n ARG 660 Cb 0.00 -0.61 -0.11 0.00 -1.05 0.00 0.00 32.46 30.70 1bak n ARG 660 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1bak s VAL 661 N -1.46 4.40 1.07 8.89 1.01 -1.26 -5.10 120.40 127.94 1bak s VAL 661 Ca 0.23 -0.17 -0.17 0.00 0.00 0.00 0.00 61.98 61.87 1bak s VAL 661 Cb 0.42 -2.97 0.24 0.00 0.00 0.00 0.00 36.38 34.07 1bak s VAL 661 CO -0.04 0.46 1.22 -2.16 0.00 0.00 0.00 175.10 174.58 1bak s PRO 662 N 0.46 -0.21 -1.16 2.72 0.04 -1.26 -4.73 135.00 130.86 1bak s PRO 662 Ca 0.00 -0.22 -0.12 0.00 0.04 0.00 0.00 61.00 60.70 1bak s PRO 662 Cb -0.13 -1.73 -0.07 0.00 0.04 0.00 0.00 34.50 32.61 1bak s PRO 662 CO 0.02 -3.01 2.31 1.17 0.04 0.00 0.00 177.00 177.52 1bak n LYS 663 N -4.23 2.51 -3.04 4.56 0.00 -1.26 -4.49 118.16 112.21 1bak n LYS 663 Ca 0.14 -1.94 -0.16 0.00 0.00 0.00 0.00 58.31 56.35 1bak n LYS 663 Cb 0.59 -2.80 0.02 0.00 0.00 0.00 0.00 35.03 32.85 1bak n LYS 663 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 1bak n MET 664 N 5.01 -2.22 -3.18 1.64 0.00 -1.26 -4.18 117.12 112.93 1bak n MET 664 Ca 0.56 1.91 -0.01 0.00 0.00 0.00 0.00 57.70 60.15 1bak n MET 664 Cb 0.26 -4.69 0.00 0.00 0.00 0.00 0.00 33.22 28.80 1bak n MET 664 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1bak n LYS 665 N -0.35 -0.36 -1.33 2.12 3.00 -1.26 -4.68 118.16 115.30 1bak n LYS 665 Ca 0.06 0.82 -0.35 0.00 -0.00 0.00 0.00 58.31 58.84 1bak n LYS 665 Cb 0.52 -1.10 -0.05 0.00 0.00 0.00 0.00 35.03 34.41 1bak n LYS 665 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1bak n ASN 666 N 1.25 8.15 -3.67 3.14 3.02 -1.26 -4.75 115.26 121.14 1bak n ASN 666 Ca -0.00 -2.62 -0.10 0.00 -0.03 0.00 0.00 54.58 51.83 1bak n ASN 666 Cb 0.49 -1.51 -0.11 0.00 -0.61 0.00 0.00 39.78 38.04 1bak n ASN 666 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1bak s LYS 667 N 1.61 0.31 0.11 3.52 2.20 -1.26 -5.04 119.74 121.18 1bak s LYS 667 Ca 0.68 0.89 -0.10 0.00 -0.36 0.00 0.00 55.97 57.08 1bak s LYS 667 Cb 0.21 0.15 -0.15 0.00 -1.51 0.00 0.00 37.83 36.52 1bak s LYS 667 CO -0.06 -0.23 1.27 -1.00 -0.36 0.00 0.00 175.35 174.98 1bak h PRO 668 N 7.85 0.63 -3.54 4.03 0.13 -1.99 -3.50 132.00 135.61 1bak h PRO 668 Ca -0.23 -0.61 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 1bak h PRO 668 Cb 1.13 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1bak h PRO 668 CO 0.18 1.22 -0.90 -2.13 -0.23 0.00 0.00 178.00 176.15 1bak n ARG 669 N -3.85 -4.08 0.00 0.86 3.00 -1.26 -5.27 116.66 106.06 1bak n ARG 669 Ca -0.08 3.12 0.01 0.00 -0.00 0.00 0.00 57.85 60.90 1bak n ARG 669 Cb 0.82 -3.75 0.01 0.00 0.00 0.00 0.00 32.46 29.54 1bak n ARG 669 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08