#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 -0.07 0.34 1.61 0.15 -1.26 -5.16 113.70 109.32 1bak s SER 553 Ca 0.00 0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.76 1bak s SER 553 Cb 0.00 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 1bak s SER 553 CO 0.00 -0.04 0.00 1.41 1.20 0.00 0.00 173.24 175.81 1bak n HIS 554 N 1.15 -2.49 -2.83 3.44 -0.00 -1.26 -4.95 115.22 108.28 1bak n HIS 554 Ca -0.06 1.35 -0.28 0.00 -0.00 0.00 0.00 57.72 58.72 1bak n HIS 554 Cb 0.58 -2.31 -0.01 0.00 -0.00 0.00 0.00 29.99 28.25 1bak n HIS 554 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1bak s MET 555 N -4.81 3.62 0.42 -0.41 0.00 -1.26 -5.10 119.30 111.77 1bak s MET 555 Ca 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 55.69 55.87 1bak s MET 555 Cb 0.00 -2.43 0.09 0.00 0.00 0.00 0.00 34.83 32.49 1bak s MET 555 CO 0.00 -0.08 0.58 0.41 0.00 0.00 0.00 175.02 175.93 1bak n GLY 556 N -1.78 -0.46 2.36 3.16 0.00 -1.26 -5.06 105.19 102.14 1bak n GLY 556 Ca 0.00 -1.82 -0.17 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.17 0.89 -3.26 1.61 4.81 -1.26 -5.03 118.16 113.75 1bak n LYS 557 Ca 0.08 -2.86 -0.04 0.00 -0.87 0.00 0.00 58.31 54.62 1bak n LYS 557 Cb 0.28 -1.42 -0.04 0.00 0.02 0.00 0.00 35.03 33.87 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 -1.79 -0.44 0.35 3.14 -1.08 -1.26 -5.14 116.67 110.45 1bak s ASP 558 Ca 0.34 0.29 -0.27 0.00 -0.52 0.00 0.00 52.55 52.39 1bak s ASP 558 Cb 0.28 1.54 -0.09 0.00 -1.46 0.00 0.00 42.92 43.18 1bak s ASP 558 CO -0.10 -0.30 1.21 0.00 0.52 0.00 0.00 175.17 176.50 1bak h ILE 560 N 2.73 0.49 -3.62 0.00 2.04 -1.55 -3.48 117.51 114.11 1bak h ILE 560 Ca -0.48 -1.52 -0.13 0.00 1.00 0.00 0.00 64.86 63.73 1bak h ILE 560 Cb 1.23 1.08 -0.18 0.00 -0.74 0.00 0.00 36.82 38.20 1bak h ILE 560 CO 0.64 0.17 -0.46 -0.32 0.00 0.00 0.00 178.15 178.17 1bak s MET 561 N -2.17 0.60 0.24 2.37 1.75 -0.94 -5.03 119.30 116.12 1bak s MET 561 Ca -0.17 -0.60 -0.13 0.00 -1.25 0.00 0.00 55.69 53.54 1bak s MET 561 Cb 0.02 0.24 -0.00 0.00 2.84 0.00 0.00 34.83 37.93 1bak s MET 561 CO 0.35 -0.16 0.47 -3.38 -0.65 0.00 0.00 175.02 171.66 1bak s HIS 562 N -2.23 0.37 -4.58 4.11 -3.43 -1.26 0.16 115.29 108.43 1bak s HIS 562 Ca -0.08 -0.73 0.00 0.00 -0.80 0.00 0.00 55.06 53.45 1bak s HIS 562 Cb -0.03 0.18 0.00 0.00 -1.43 0.00 0.00 32.58 31.30 1bak s HIS 562 CO -0.02 -0.98 0.00 0.41 -2.00 0.00 0.00 174.74 172.14 1bak n GLY 563 N -0.38 0.90 3.69 -1.38 0.00 -1.07 -5.01 105.19 101.95 1bak n GLY 563 Ca -0.02 -1.87 -0.38 0.00 0.00 0.00 0.00 46.02 43.75 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 -2.90 3.43 -0.09 1.61 6.14 -1.26 -1.76 117.35 122.52 1bak s TYR 564 Ca 0.00 0.78 -0.06 0.00 0.64 0.00 0.00 57.07 58.43 1bak s TYR 564 Cb 0.00 -2.57 0.03 0.00 0.42 0.00 0.00 41.96 39.84 1bak s TYR 564 CO 0.00 0.04 0.21 1.41 0.64 0.00 0.00 175.55 177.86 1bak s MET 565 N 1.10 0.20 -0.12 4.97 1.75 0.14 -4.82 119.30 122.51 1bak s MET 565 Ca 0.23 0.40 -0.06 0.00 -1.25 0.00 0.00 55.69 55.02 1bak s MET 565 Cb -0.15 -0.04 -0.04 0.00 2.84 0.00 0.00 34.83 37.44 1bak s MET 565 CO 0.09 -0.11 0.09 -1.54 -0.65 0.00 0.00 175.02 172.90 1bak s SER 566 N 0.79 5.98 -0.25 1.11 1.04 -0.70 -2.71 113.70 118.95 1bak s SER 566 Ca -0.06 0.34 -0.26 0.00 0.48 0.00 0.00 55.95 56.45 1bak s SER 566 Cb -0.07 -1.88 0.07 0.00 0.10 0.00 0.00 66.02 64.24 1bak s SER 566 CO -0.05 0.38 0.73 -0.75 0.98 0.00 0.00 173.24 174.53 1bak s LYS 567 N -0.84 0.85 0.32 4.02 2.20 -1.22 0.11 119.74 125.17 1bak s LYS 567 Ca 0.13 0.92 -0.12 0.00 -0.36 0.00 0.00 55.97 56.54 1bak s LYS 567 Cb -0.12 0.41 0.02 0.00 -1.51 0.00 0.00 37.83 36.63 1bak s LYS 567 CO 0.03 -0.12 0.62 0.00 -0.36 0.00 0.00 175.35 175.52 1bak s MET 568 N 0.24 1.91 -0.30 4.03 0.23 0.08 -4.76 119.30 120.73 1bak s MET 568 Ca -0.01 -1.41 -0.20 0.00 -1.03 0.00 0.00 55.69 53.04 1bak s MET 568 Cb -0.05 0.54 0.20 0.00 -1.53 0.00 0.00 34.83 33.99 1bak s MET 568 CO 0.01 -0.84 1.31 0.20 -2.03 0.00 0.00 175.02 173.67 1bak s GLY 569 N -3.08 0.33 0.20 3.16 0.00 -1.26 -2.63 107.32 104.04 1bak s GLY 569 Ca 0.21 3.72 -0.16 0.00 0.00 0.00 0.00 44.72 48.48 1bak s GLY 569 CO 0.13 3.39 0.79 0.70 0.00 0.00 0.00 173.10 178.10 1bak n ASN 570 N 4.49 -1.55 -0.11 1.64 3.02 -1.26 -4.99 115.26 116.50 1bak n ASN 570 Ca -0.06 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.59 1bak n ASN 570 Cb 0.56 2.54 0.00 0.00 -0.61 0.00 0.00 39.78 42.26 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 -0.55 0.75 -3.45 3.52 -0.04 -1.26 -4.15 135.00 129.82 1bak n PRO 571 Ca -0.03 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.14 1bak n PRO 571 Cb 0.48 -1.08 -0.12 0.00 -0.04 0.00 0.00 33.50 32.74 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 -1.78 0.83 -1.07 0.54 0.08 -1.26 -5.06 117.98 110.26 1bak s PHE 572 Ca 0.00 -1.81 -0.20 0.00 0.12 0.00 0.00 56.93 55.05 1bak s PHE 572 Cb 0.00 -0.93 0.10 0.00 -0.57 0.00 0.00 43.02 41.62 1bak s PHE 572 CO 0.00 -0.83 1.40 -1.17 -0.10 0.00 0.00 175.22 174.52 1bak s LEU 573 N 0.81 4.26 0.00 -0.37 2.96 -1.26 -3.99 118.68 121.08 1bak s LEU 573 Ca 0.22 -2.02 0.00 0.00 -0.22 0.00 0.00 54.13 52.11 1bak s LEU 573 Cb -0.16 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.03 1bak s LEU 573 CO -0.04 -1.21 0.00 1.07 -1.32 0.00 0.00 176.35 174.85 1bak n THR 574 N 6.06 0.00 -3.55 3.68 5.66 -1.26 -5.13 114.28 119.74 1bak n THR 574 Ca 0.33 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 61.04 1bak n THR 574 Cb 0.48 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.23 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 -0.92 3.60 -0.01 1.09 -2.07 -1.26 -5.10 119.66 115.00 1bak s GLN 575 Ca 0.00 -0.11 0.00 0.00 -1.82 0.00 0.00 55.36 53.43 1bak s GLN 575 Cb 0.00 -2.76 0.01 0.00 -1.09 0.00 0.00 33.01 29.17 1bak s GLN 575 CO 0.00 0.35 0.01 -1.58 -1.32 0.00 0.00 175.29 172.75 1bak s TRP 576 N -1.87 0.02 -0.10 9.60 0.51 -1.26 -4.96 118.94 120.87 1bak s TRP 576 Ca 0.42 0.05 0.02 0.00 -2.12 0.00 0.00 56.10 54.47 1bak s TRP 576 Cb -0.11 -0.09 0.01 0.00 -0.81 0.00 0.00 33.47 32.46 1bak s TRP 576 CO 0.27 -0.03 -0.17 -1.14 -0.51 0.00 0.00 176.95 175.37 1bak s GLN 577 N 0.40 2.33 -0.29 4.98 0.74 -1.26 -5.11 119.66 121.45 1bak s GLN 577 Ca -0.03 -0.61 -0.20 0.00 0.05 0.00 0.00 55.36 54.57 1bak s GLN 577 Cb -0.05 -1.89 -0.01 0.00 1.10 0.00 0.00 33.01 32.15 1bak s GLN 577 CO -0.01 0.02 0.60 1.03 -0.55 0.00 0.00 175.29 176.37 1bak s ARG 578 N 0.75 3.95 0.19 1.67 3.00 -1.26 -3.43 118.95 123.81 1bak s ARG 578 Ca -0.11 0.31 0.01 0.00 0.00 0.00 0.00 55.73 55.94 1bak s ARG 578 Cb -0.16 -3.71 -0.05 0.00 0.00 0.00 0.00 34.95 31.04 1bak s ARG 578 CO 0.02 -0.51 0.04 1.03 0.00 0.00 0.00 175.30 175.88 1bak s ARG 579 N 2.51 1.17 -0.20 3.54 1.81 -1.10 -4.84 118.95 121.84 1bak s ARG 579 Ca 0.24 -1.59 -0.22 0.00 -1.72 0.00 0.00 55.73 52.44 1bak s ARG 579 Cb -0.15 -0.19 -0.02 0.00 -0.45 0.00 0.00 34.95 34.14 1bak s ARG 579 CO 0.11 -0.20 0.70 -0.47 -0.68 0.00 0.00 175.30 174.76 1bak s TYR 580 N -3.75 3.37 0.23 -0.53 6.14 0.37 0.23 117.35 123.41 1bak s TYR 580 Ca 0.28 1.02 0.10 0.00 0.64 0.00 0.00 57.07 59.11 1bak s TYR 580 Cb 0.07 -2.89 -0.04 0.00 0.42 0.00 0.00 41.96 39.52 1bak s TYR 580 CO 0.07 -0.24 -0.11 -0.06 0.64 0.00 0.00 175.55 175.85 1bak s PHE 581 N 2.16 2.53 -0.07 4.97 0.40 -0.72 0.93 117.98 128.17 1bak s PHE 581 Ca 0.31 -0.26 -0.03 0.00 -0.60 0.00 0.00 56.93 56.35 1bak s PHE 581 Cb -0.16 -1.17 0.04 0.00 0.51 0.00 0.00 43.02 42.25 1bak s PHE 581 CO 0.10 0.60 0.14 1.52 0.70 0.00 0.00 175.22 178.28 1bak s TYR 582 N -2.10 -0.14 -0.20 0.36 -0.85 -0.55 -2.58 117.35 111.29 1bak s TYR 582 Ca 0.28 0.51 -0.13 0.00 -0.52 0.00 0.00 57.07 57.21 1bak s TYR 582 Cb -0.07 -0.22 -0.05 0.00 0.38 0.00 0.00 41.96 42.01 1bak s TYR 582 CO 0.16 -0.22 0.25 -1.17 -1.52 0.00 0.00 175.55 173.05 1bak s LEU 583 N 1.81 4.18 0.51 -3.49 2.96 0.12 -2.88 118.68 121.90 1bak s LEU 583 Ca -0.02 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.29 1bak s LEU 583 Cb -0.12 -2.28 -0.00 0.00 0.50 0.00 0.00 46.19 44.29 1bak s LEU 583 CO -0.05 0.07 0.19 -0.36 -1.32 0.00 0.00 176.35 174.87 1bak s PHE 584 N 0.78 1.90 -2.00 5.38 0.40 -0.62 -1.50 117.98 122.32 1bak s PHE 584 Ca 0.13 -0.85 0.22 0.00 -0.60 0.00 0.00 56.93 55.84 1bak s PHE 584 Cb -0.13 -1.79 1.32 0.00 0.51 0.00 0.00 43.02 42.94 1bak s PHE 584 CO 0.04 -0.05 1.72 -0.35 0.70 0.00 0.00 175.22 177.28 1bak n PRO 585 N -1.45 0.75 0.00 0.24 -0.04 -1.25 -4.34 135.00 128.92 1bak n PRO 585 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1bak n PRO 585 Cb 0.66 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 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 -0.96 0.00 -4.37 3.54 4.13 -1.26 -4.90 115.26 111.43 1bak n ASN 586 Ca 0.17 0.00 -0.26 0.00 1.68 0.00 0.00 54.58 56.16 1bak n ASN 586 Cb 0.08 0.06 0.15 0.00 -1.54 0.00 0.00 39.78 38.53 1bak n ASN 586 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1bak s ARG 587 N -1.18 1.07 0.00 3.52 0.52 -1.26 0.23 118.95 121.85 1bak s ARG 587 Ca 0.00 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.27 1bak s ARG 587 Cb 0.00 -2.12 0.00 0.00 0.52 0.00 0.00 34.95 33.35 1bak s ARG 587 CO 0.00 -1.97 0.00 -0.11 0.02 0.00 0.00 175.30 173.24 1bak n LEU 588 N -3.28 0.00 -4.13 2.53 7.94 0.17 -1.59 117.00 118.63 1bak n LEU 588 Ca 0.17 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.93 1bak n LEU 588 Cb 0.60 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.49 1bak n LEU 588 CO 0.42 0.00 0.01 -1.83 -1.11 0.00 0.00 177.39 174.88 1bak s GLU 589 N 0.00 1.64 0.01 1.96 -1.05 -1.14 -1.61 118.70 118.51 1bak s GLU 589 Ca 0.00 -1.68 0.01 0.00 -0.15 0.00 0.00 54.97 53.15 1bak s GLU 589 Cb 0.00 0.39 -0.01 0.00 -0.44 0.00 0.00 34.13 34.07 1bak s GLU 589 CO 0.00 -0.64 -0.03 1.67 0.95 0.00 0.00 175.26 177.21 1bak s TRP 590 N -3.58 0.24 0.21 4.83 1.48 -1.14 -1.48 118.94 119.51 1bak s TRP 590 Ca 0.33 -0.21 -0.06 0.00 -1.06 0.00 0.00 56.10 55.10 1bak s TRP 590 Cb 0.02 -0.16 -0.03 0.00 -1.16 0.00 0.00 33.47 32.14 1bak s TRP 590 CO 0.17 -0.06 0.26 1.03 -4.06 0.00 0.00 176.95 174.29 1bak s ARG 591 N -0.59 1.30 0.00 3.25 0.52 0.26 -4.81 118.95 118.89 1bak s ARG 591 Ca -0.05 -1.46 0.00 0.00 -0.52 0.00 0.00 55.73 53.70 1bak s ARG 591 Cb -0.04 0.34 0.00 0.00 0.52 0.00 0.00 34.95 35.77 1bak s ARG 591 CO -0.00 -0.47 0.00 0.41 0.02 0.00 0.00 175.30 175.26 1bak n GLY 592 N -0.30 -0.76 3.74 -3.53 0.00 -1.26 0.14 105.19 103.22 1bak n GLY 592 Ca -0.00 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.60 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 -1.87 0.19 0.89 1.61 -1.05 -1.26 -4.78 118.70 112.44 1bak s GLU 593 Ca 0.00 0.07 0.00 0.00 -0.15 0.00 0.00 54.97 54.89 1bak s GLU 593 Cb 0.00 -1.75 0.00 0.00 -0.44 0.00 0.00 34.13 31.94 1bak s GLU 593 CO 0.00 -2.80 0.00 0.41 0.95 0.00 0.00 175.26 173.82 1bak n GLY 594 N -1.96 1.01 3.58 -3.83 0.00 -1.26 -4.98 105.19 97.75 1bak n GLY 594 Ca 0.10 -1.16 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 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 0.48 -0.25 1.61 -6.30 -1.26 -5.19 118.70 107.80 1bak s GLU 595 Ca 0.00 -0.01 -0.36 0.00 -2.50 0.00 0.00 54.97 52.10 1bak s GLU 595 Cb 0.00 0.23 0.16 0.00 0.00 0.00 0.00 34.13 34.51 1bak s GLU 595 CO 0.00 -0.18 1.31 0.00 0.02 0.00 0.00 175.26 176.41 1bak s ALA 596 N -1.72 -2.14 0.00 6.30 0.00 -1.26 -5.12 121.76 117.82 1bak s ALA 596 Ca 0.03 1.79 0.00 0.00 0.00 0.00 0.00 51.96 53.78 1bak s ALA 596 Cb -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.64 1bak s ALA 596 CO -0.03 -0.51 0.01 -0.35 0.00 0.00 0.00 175.76 174.88 1bak n PRO 597 N 0.06 0.00 -3.86 0.00 -0.04 -1.26 -4.99 135.00 124.92 1bak n PRO 597 Ca 0.02 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.32 1bak n PRO 597 Cb 0.57 -0.17 -0.16 0.00 -0.04 0.00 0.00 33.50 33.70 1bak n PRO 597 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1bak s GLN 598 N -0.02 0.16 -0.38 0.54 1.11 -1.26 -5.06 119.66 114.74 1bak s GLN 598 Ca 0.00 0.13 0.10 0.00 0.01 0.00 0.00 55.36 55.59 1bak s GLN 598 Cb 0.00 -0.40 0.29 0.00 -1.01 0.00 0.00 33.01 31.89 1bak s GLN 598 CO 0.00 -0.15 0.61 -1.13 0.01 0.00 0.00 175.29 174.63 1bak n SER 599 N 4.19 0.42 -3.55 5.90 3.41 -1.26 -5.02 113.62 117.71 1bak n SER 599 Ca -0.26 -2.83 -0.29 0.00 -0.26 0.00 0.00 58.87 55.22 1bak n SER 599 Cb 0.50 -0.60 -0.13 0.00 -0.26 0.00 0.00 64.21 63.72 1bak n SER 599 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1bak s LEU 600 N -1.71 1.49 0.00 1.04 0.20 -1.26 -2.89 118.68 115.55 1bak s LEU 600 Ca 0.37 -2.25 0.03 0.00 0.69 0.00 0.00 54.13 52.97 1bak s LEU 600 Cb 0.25 -0.59 0.03 0.00 -0.43 0.00 0.00 46.19 45.44 1bak s LEU 600 CO -0.10 -0.31 0.25 0.18 -0.29 0.00 0.00 176.35 176.09 1bak n LEU 601 N 3.99 0.00 0.00 -0.68 7.99 -0.63 -4.92 117.00 122.75 1bak n LEU 601 Ca 0.10 -1.38 0.00 0.00 -0.01 0.00 0.00 56.01 54.71 1bak n LEU 601 Cb 0.37 -0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.61 1bak n LEU 601 CO 0.16 -0.47 0.00 0.35 -1.51 0.00 0.00 177.39 175.93 1bak n THR 602 N -1.26 0.00 -2.13 -5.08 -2.24 -1.26 -0.66 114.28 101.65 1bak n THR 602 Ca 0.01 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.77 1bak n THR 602 Cb 0.31 -0.67 0.09 0.00 -2.10 0.00 0.00 70.33 67.96 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 0.00 1.68 -3.06 -0.78 0.00 0.64 -4.62 117.12 110.98 1bak n MET 603 Ca 0.00 -3.21 -0.25 0.00 0.00 0.00 0.00 57.70 54.24 1bak n MET 603 Cb 0.00 -1.36 -0.04 0.00 0.00 0.00 0.00 33.22 31.81 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 -0.53 2.54 0.00 3.17 0.28 -1.26 -3.15 120.64 121.69 1bak n GLU 604 Ca 0.20 -4.43 0.00 0.00 -0.16 0.00 0.00 57.16 52.76 1bak n GLU 604 Cb 0.89 -2.08 0.00 0.00 1.43 0.00 0.00 31.44 31.68 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 0.05 0.00 -1.14 3.44 0.28 -1.26 -4.90 120.64 117.12 1bak n GLU 605 Ca 0.29 0.00 -0.39 0.00 -0.16 0.00 0.00 57.16 56.90 1bak n GLU 605 Cb 0.46 -0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.30 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 -2.44 1.59 -0.07 3.84 -0.00 -1.26 -1.24 119.36 119.77 1bak n ILE 606 Ca 0.00 -0.40 -0.15 0.00 -0.00 0.00 0.00 62.75 62.20 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 1.67 -0.00 0.00 0.00 176.55 178.22 1bak n GLN 607 N 0.82 0.68 -3.64 0.38 0.00 0.33 -4.38 117.38 111.57 1bak n GLN 607 Ca 0.15 0.16 -0.04 0.00 -0.00 0.00 0.00 57.00 57.27 1bak n GLN 607 Cb 0.20 -1.61 -0.07 0.00 0.00 0.00 0.00 30.24 28.76 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 -6.28 -0.31 -0.07 1.69 0.01 -1.12 -4.94 113.70 102.68 1bak s SER 608 Ca -0.20 0.55 -0.01 0.00 1.31 0.00 0.00 55.95 57.60 1bak s SER 608 Cb 0.07 0.82 -0.03 0.00 0.21 0.00 0.00 66.02 67.09 1bak s SER 608 CO 0.74 -0.09 -0.01 0.54 0.41 0.00 0.00 173.24 174.83 1bak s VAL 609 N 0.65 4.17 0.00 3.43 0.11 -1.26 -2.46 120.40 125.04 1bak s VAL 609 Ca -0.01 -0.34 0.00 0.00 -2.93 0.00 0.00 61.98 58.70 1bak s VAL 609 Cb -0.04 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 32.05 1bak s VAL 609 CO -0.12 0.58 0.00 -1.84 -3.33 0.00 0.00 175.10 170.39 1bak n GLU 610 N 2.06 0.00 -3.82 1.54 0.28 -1.08 -5.02 120.64 114.60 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 -0.11 0.00 1.43 0.00 0.00 31.44 33.29 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 -0.88 0.32 0.35 3.44 2.12 -1.26 0.17 118.70 122.96 1bak s GLU 611 Ca 0.00 0.06 0.07 0.00 0.36 0.00 0.00 54.97 55.47 1bak s GLU 611 Cb 0.00 0.14 -0.02 0.00 0.26 0.00 0.00 34.13 34.52 1bak s GLU 611 CO 0.00 -0.06 0.38 -0.08 -0.54 0.00 0.00 175.26 174.96 1bak s THR 612 N -0.37 3.60 0.16 -1.70 -1.32 0.36 -4.83 115.64 111.54 1bak s THR 612 Ca -0.05 -1.22 0.04 0.00 -1.21 0.00 0.00 61.69 59.25 1bak s THR 612 Cb -0.03 -3.23 -0.05 0.00 -1.51 0.00 0.00 72.50 67.68 1bak s THR 612 CO 0.01 -0.14 -0.07 -1.10 -2.21 0.00 0.00 174.62 171.10 1bak s GLN 613 N -4.09 1.10 -0.41 7.08 -0.21 -1.26 -2.29 119.66 119.58 1bak s GLN 613 Ca 0.44 -1.49 0.04 0.00 0.02 0.00 0.00 55.36 54.37 1bak s GLN 613 Cb -0.07 -0.57 0.16 0.00 1.00 0.00 0.00 33.01 33.54 1bak s GLN 613 CO 0.29 0.02 0.40 0.42 -2.12 0.00 0.00 175.29 174.30 1bak s ILE 614 N -3.39 -0.14 0.00 1.08 1.09 -1.23 -4.56 121.20 114.06 1bak s ILE 614 Ca 0.19 -1.68 0.00 0.00 -1.10 0.00 0.00 60.65 58.06 1bak s ILE 614 Cb 0.04 -0.83 0.00 0.00 -1.06 0.00 0.00 42.46 40.61 1bak s ILE 614 CO 0.02 -0.78 0.00 0.29 -0.10 0.00 0.00 174.94 174.37 1bak n LYS 615 N 3.51 0.00 0.00 2.79 4.76 -1.26 -3.72 118.16 124.24 1bak n LYS 615 Ca 0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 1bak n LYS 615 Cb 0.47 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.66 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 -3.68 1.97 2.13 -1.26 -5.14 120.64 114.66 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 31.62 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 -1.94 0.64 0.00 5.31 3.52 -1.24 -4.92 118.95 120.31 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 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.69 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 2.87 0.00 -3.00 5.12 3.00 -1.04 -3.51 118.16 121.60 1bak n LYS 618 Ca -0.14 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.10 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 4.27 0.26 0.00 2.96 0.16 0.13 118.68 126.46 1bak s LEU 620 Ca 0.13 0.55 0.09 0.00 -0.22 0.00 0.00 54.13 54.67 1bak s LEU 620 Cb -0.03 -3.28 -0.04 0.00 0.50 0.00 0.00 46.19 43.34 1bak s LEU 620 CO 0.10 0.05 0.06 -0.22 -1.32 0.00 0.00 176.35 175.02 1bak s LEU 621 N -2.73 3.39 -0.44 -0.68 2.96 0.46 0.16 118.68 121.81 1bak s LEU 621 Ca 0.40 -0.53 0.06 0.00 -0.22 0.00 0.00 54.13 53.85 1bak s LEU 621 Cb -0.12 -1.91 0.18 0.00 0.50 0.00 0.00 46.19 44.83 1bak s LEU 621 CO 0.25 -0.02 0.57 -0.76 -1.32 0.00 0.00 176.35 175.07 1bak s LEU 622 N -3.73 -0.80 0.09 -0.68 1.43 0.53 -2.64 118.68 112.88 1bak s LEU 622 Ca 0.32 -1.58 -0.24 0.00 -1.03 0.00 0.00 54.13 51.60 1bak s LEU 622 Cb -0.07 1.32 -0.07 0.00 0.03 0.00 0.00 46.19 47.41 1bak s LEU 622 CO 0.22 -0.15 0.72 -1.59 0.23 0.00 0.00 176.35 175.77 1bak s LYS 623 N 1.19 4.46 0.01 1.70 -2.85 -1.03 0.18 119.74 123.40 1bak s LYS 623 Ca 0.23 1.01 0.01 0.00 -1.00 0.00 0.00 55.97 56.22 1bak s LYS 623 Cb -0.04 -3.30 -0.04 0.00 -2.06 0.00 0.00 37.83 32.38 1bak s LYS 623 CO -0.07 0.46 0.05 0.42 0.10 0.00 0.00 175.35 176.31 1bak s ILE 624 N -0.64 4.47 -2.00 3.79 1.01 0.51 -0.51 121.20 127.84 1bak s ILE 624 Ca 0.35 -0.54 0.22 0.00 0.00 0.00 0.00 60.65 60.68 1bak s ILE 624 Cb -0.21 -3.04 0.62 0.00 0.01 0.00 0.00 42.46 39.84 1bak s ILE 624 CO 0.23 0.33 1.76 -2.11 0.00 0.00 0.00 174.94 175.15 1bak n ARG 625 N 1.17 0.87 0.10 2.79 1.85 -0.37 -2.59 116.66 120.48 1bak n ARG 625 Ca -0.13 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 56.83 1bak n ARG 625 Cb 0.53 -1.39 0.01 0.00 -1.05 0.00 0.00 32.46 30.56 1bak n ARG 625 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1bak n GLY 626 N 0.66 -1.45 0.00 2.89 0.00 -1.26 -4.95 105.19 101.08 1bak n GLY 626 Ca 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1bak n GLY 626 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bak n GLY 627 N 1.20 0.98 3.23 -0.02 0.00 -1.07 -5.14 105.19 104.36 1bak n GLY 627 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 0.04 1.22 0.01 1.61 3.01 -1.23 -5.01 119.74 119.38 1bak s LYS 628 Ca 0.00 -1.60 -0.02 0.00 -1.01 0.00 0.00 55.97 53.34 1bak s LYS 628 Cb 0.00 0.28 -0.01 0.00 -1.01 0.00 0.00 37.83 37.10 1bak s LYS 628 CO 0.00 -0.41 0.03 -0.65 0.51 0.00 0.00 175.35 174.83 1bak s GLN 629 N -4.15 0.29 0.06 1.68 1.11 -1.26 -0.36 119.66 117.03 1bak s GLN 629 Ca 0.38 -0.39 0.04 0.00 0.01 0.00 0.00 55.36 55.39 1bak s GLN 629 Cb 0.06 0.11 -0.03 0.00 -1.01 0.00 0.00 33.01 32.15 1bak s GLN 629 CO 0.12 -0.05 -0.11 -0.06 0.01 0.00 0.00 175.29 175.19 1bak s PHE 630 N -1.07 0.94 -0.11 0.91 0.08 0.47 -4.94 117.98 114.25 1bak s PHE 630 Ca -0.12 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.45 1bak s PHE 630 Cb -0.07 -0.54 0.02 0.00 -0.57 0.00 0.00 43.02 41.86 1bak s PHE 630 CO -0.00 -0.01 -0.10 0.42 -0.10 0.00 0.00 175.22 175.43 1bak s ILE 631 N -1.33 1.16 0.17 0.64 1.09 -1.08 0.20 121.20 122.04 1bak s ILE 631 Ca -0.06 -0.39 0.05 0.00 -1.10 0.00 0.00 60.65 59.15 1bak s ILE 631 Cb -0.10 -1.13 -0.04 0.00 -1.06 0.00 0.00 42.46 40.13 1bak s ILE 631 CO 0.01 0.38 0.14 -0.76 -0.10 0.00 0.00 174.94 174.61 1bak s LEU 632 N 1.48 3.80 -0.22 2.97 1.02 0.12 -0.74 118.68 127.11 1bak s LEU 632 Ca 0.01 -0.13 -0.16 0.00 0.02 0.00 0.00 54.13 53.87 1bak s LEU 632 Cb -0.13 -2.41 0.06 0.00 0.02 0.00 0.00 46.19 43.73 1bak s LEU 632 CO -0.07 0.07 0.55 -1.58 0.02 0.00 0.00 176.35 175.34 1bak s GLN 633 N -3.11 0.59 0.04 1.70 0.74 0.30 0.36 119.66 120.28 1bak s GLN 633 Ca 0.31 0.89 -0.05 0.00 0.05 0.00 0.00 55.36 56.56 1bak s GLN 633 Cb -0.10 0.18 -0.01 0.00 1.10 0.00 0.00 33.01 34.18 1bak s GLN 633 CO 0.23 -0.12 0.07 0.00 -0.55 0.00 0.00 175.29 174.93 1bak h ASP 635 N 3.66 0.00 -3.01 0.00 3.58 -1.98 -3.44 116.42 115.22 1bak h ASP 635 Ca -0.33 0.00 -0.61 0.00 0.42 0.00 0.00 57.03 56.52 1bak h ASP 635 Cb 1.18 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.19 1bak h ASP 635 CO 0.52 0.00 -0.34 -0.44 -2.88 0.00 0.00 179.24 176.09 1bak s SER 636 N -6.06 6.52 0.06 2.28 0.01 -1.26 -5.00 113.70 110.24 1bak s SER 636 Ca 0.06 0.60 -0.12 0.00 1.31 0.00 0.00 55.95 57.81 1bak s SER 636 Cb 0.06 -2.10 -0.30 0.00 0.21 0.00 0.00 66.02 63.88 1bak s SER 636 CO 0.65 0.18 1.09 0.44 0.41 0.00 0.00 173.24 176.01 1bak h ASP 637 N 3.60 0.72 0.22 2.44 5.19 -2.02 -3.37 116.42 123.20 1bak h ASP 637 Ca -0.48 -0.73 -0.01 0.00 -0.62 0.00 0.00 57.03 55.19 1bak h ASP 637 Cb 1.19 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 40.47 1bak h ASP 637 CO 0.68 1.56 -0.10 1.55 -3.12 0.00 0.00 179.24 179.80 1bak h PRO 638 N 0.17 -0.28 0.00 3.56 0.13 -1.97 -3.03 132.00 130.57 1bak h PRO 638 Ca -0.19 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1bak h PRO 638 Cb 2.01 0.06 0.00 0.00 0.13 0.00 0.00 31.00 33.21 1bak h PRO 638 CO 0.24 -0.19 0.00 0.39 -0.23 0.00 0.00 178.00 178.21 1bak n GLU 639 N -4.54 0.00 -0.14 0.86 -0.58 -1.26 0.26 120.64 115.23 1bak n GLU 639 Ca -0.04 0.03 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 1bak n GLU 639 Cb 0.11 -0.07 0.02 0.00 -0.57 0.00 0.00 31.44 30.94 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 -0.54 -0.67 -4.62 7.12 -1.76 0.31 115.31 115.15 1bak h LEU 640 Ca 0.00 0.15 0.07 0.00 0.13 0.00 0.00 57.88 58.23 1bak h LEU 640 Cb 0.00 0.33 -0.10 0.00 -0.53 0.00 0.00 40.66 40.36 1bak h LEU 640 CO 0.00 -0.19 -0.57 0.58 -0.13 0.00 0.00 178.44 178.13 1bak h VAL 641 N -0.05 0.00 -0.95 1.05 2.07 0.36 0.51 116.25 119.25 1bak h VAL 641 Ca 0.22 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.77 1bak h VAL 641 Cb 0.38 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.10 1bak h VAL 641 CO -0.49 0.00 0.62 1.56 0.02 0.00 0.00 177.57 179.28 1bak h GLN 642 N -0.22 1.18 -0.39 1.57 7.50 0.25 -1.75 115.11 123.25 1bak h GLN 642 Ca 0.11 -0.07 0.08 0.00 0.50 0.00 0.00 58.65 59.27 1bak h GLN 642 Cb 0.51 -0.27 -0.08 0.00 0.05 0.00 0.00 27.48 27.70 1bak h GLN 642 CO -0.75 0.78 -0.12 -1.49 -1.50 0.00 0.00 178.83 175.75 1bak h TRP 643 N 1.21 -0.26 0.27 2.96 4.06 0.35 -1.21 115.95 123.34 1bak h TRP 643 Ca 0.37 0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.36 1bak h TRP 643 Cb -0.02 0.17 -0.04 0.00 -1.00 0.00 0.00 29.16 28.27 1bak h TRP 643 CO -0.01 -0.19 -0.52 -0.22 -3.56 0.00 0.00 178.44 173.94 1bak h LYS 644 N -0.02 -0.82 -0.93 0.49 1.63 0.64 1.71 116.57 119.26 1bak h LYS 644 Ca 0.19 0.06 0.20 0.00 -0.85 0.00 0.00 60.65 60.25 1bak h LYS 644 Cb 0.32 0.19 -0.18 0.00 -0.60 0.00 0.00 32.23 31.96 1bak h LYS 644 CO -0.42 -0.55 -0.18 1.17 -3.45 0.00 0.00 179.45 176.03 1bak n LYS 645 N -5.48 -0.08 0.01 1.90 0.00 -0.71 0.32 118.16 114.13 1bak n LYS 645 Ca -0.10 1.44 -0.13 0.00 0.00 0.00 0.00 58.31 59.52 1bak n LYS 645 Cb 0.43 -2.18 -0.02 0.00 0.00 0.00 0.00 35.03 33.26 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 0.60 0.46 1.64 5.08 -0.10 -2.91 114.58 119.35 1bak h GLU 646 Ca 0.47 -0.48 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1bak h GLU 646 Cb 0.79 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1bak h GLU 646 CO -0.94 1.11 -0.22 -0.07 -1.00 0.00 0.00 179.01 177.88 1bak h LEU 647 N 0.41 -0.53 -0.96 1.33 3.38 1.46 0.34 115.31 120.75 1bak h LEU 647 Ca -0.04 0.02 0.18 0.00 0.09 0.00 0.00 57.88 58.13 1bak h LEU 647 Cb 1.35 0.14 -0.18 0.00 0.09 0.00 0.00 40.66 42.06 1bak h LEU 647 CO 0.14 -0.24 -0.26 -1.14 0.09 0.00 0.00 178.44 177.03 1bak n ARG 648 N -4.42 -0.11 0.19 1.13 0.63 0.96 -0.03 116.66 115.02 1bak n ARG 648 Ca -0.08 1.49 -0.14 0.00 -0.92 0.00 0.00 57.85 58.20 1bak n ARG 648 Cb 0.24 -2.22 -0.08 0.00 0.45 0.00 0.00 32.46 30.86 1bak n ARG 648 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 1bak h ASP 649 N 0.00 -0.42 -0.88 6.15 1.82 -1.52 0.49 116.42 122.06 1bak h ASP 649 Ca 0.44 -0.13 0.37 0.00 -0.39 0.00 0.00 57.03 57.32 1bak h ASP 649 Cb 0.68 0.11 -0.16 0.00 0.68 0.00 0.00 39.33 40.64 1bak h ASP 649 CO -0.98 -0.08 0.47 0.00 -1.61 0.00 0.00 179.24 177.04 1bak n ALA 650 N -2.48 0.90 0.13 -0.78 0.00 0.12 0.36 120.51 118.75 1bak n ALA 650 Ca -0.10 0.90 -0.24 0.00 0.00 0.00 0.00 53.44 54.00 1bak n ALA 650 Cb 0.27 -0.90 -0.16 0.00 0.00 0.00 0.00 19.45 18.67 1bak n ALA 650 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1bak h TYR 651 N 0.00 0.92 -0.21 0.00 0.05 -0.59 -2.52 116.97 114.62 1bak h TYR 651 Ca 0.75 -0.67 -0.13 0.00 0.05 0.00 0.00 58.73 58.73 1bak h TYR 651 Cb 1.97 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 39.66 1bak h TYR 651 CO -0.02 1.54 -0.42 0.07 -1.05 0.00 0.00 178.16 178.27 1bak h ARG 652 N 0.07 0.49 -0.18 4.88 0.11 0.51 0.63 114.38 120.89 1bak h ARG 652 Ca -0.25 -0.26 -0.15 0.00 0.10 0.00 0.00 59.98 59.43 1bak h ARG 652 Cb 2.09 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 33.17 1bak h ARG 652 CO 0.26 0.83 -0.53 1.49 0.10 0.00 0.00 179.97 182.11 1bak h GLU 653 N 0.40 0.51 0.02 0.08 4.57 0.61 -2.13 114.58 118.66 1bak h GLU 653 Ca 0.03 -0.31 -0.00 0.00 -1.18 0.00 0.00 59.36 57.90 1bak h GLU 653 Cb 0.91 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 1bak h GLU 653 CO 0.08 0.92 -0.01 0.00 -1.18 0.00 0.00 179.01 178.81 1bak h ALA 654 N 1.02 -0.03 -0.75 2.92 0.00 -1.25 -3.31 119.26 117.86 1bak h ALA 654 Ca 0.01 -0.31 0.16 0.00 0.00 0.00 0.00 54.91 54.78 1bak h ALA 654 Cb 1.06 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.73 1bak h ALA 654 CO 0.10 -0.05 -0.05 -0.56 0.00 0.00 0.00 179.25 178.69 1bak h GLN 655 N -0.97 0.07 0.00 0.00 3.07 0.21 1.82 115.11 119.32 1bak h GLN 655 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 1bak h GLN 655 Cb 0.63 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 28.17 1bak h GLN 655 CO 0.01 0.04 0.29 -0.56 0.09 0.00 0.00 178.83 178.70 1bak h GLN 656 N 0.07 0.00 0.06 0.06 3.07 -1.49 1.45 115.11 118.34 1bak h GLN 656 Ca 0.39 0.00 -0.30 0.00 0.09 0.00 0.00 58.65 58.84 1bak h GLN 656 Cb 0.67 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.21 1bak h GLN 656 CO -0.69 0.00 -1.58 -0.07 0.09 0.00 0.00 178.83 176.58 1bak h LEU 657 N 0.00 0.21 -3.26 0.06 3.38 0.27 -3.30 115.31 112.68 1bak h LEU 657 Ca 0.00 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1bak h LEU 657 Cb 0.57 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1bak h LEU 657 CO 0.00 1.30 0.00 0.55 0.09 0.00 0.00 178.44 180.38 1bak n VAL 658 N -3.31 2.11 -1.12 1.22 3.14 0.25 -4.65 118.33 115.97 1bak n VAL 658 Ca -0.16 -1.40 -0.16 0.00 -2.96 0.00 0.00 64.34 59.65 1bak n VAL 658 Cb 1.03 -0.03 -0.14 0.00 -1.06 0.00 0.00 33.84 33.64 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 0.54 2.18 -0.31 1.45 6.02 0.43 -4.36 117.38 123.32 1bak n GLN 659 Ca 0.24 -1.34 0.04 0.00 -0.01 0.00 0.00 57.00 55.94 1bak n GLN 659 Cb 0.93 -2.07 0.18 0.00 1.02 0.00 0.00 30.24 30.29 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 2.22 2.36 -1.17 -1.09 1.85 -1.26 -4.96 116.66 114.61 1bak n ARG 660 Ca 0.46 -1.40 -0.37 0.00 -1.00 0.00 0.00 57.85 55.54 1bak n ARG 660 Cb 0.81 -1.58 0.04 0.00 -1.05 0.00 0.00 32.46 30.68 1bak n ARG 660 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1bak n VAL 661 N 0.41 0.48 -1.53 8.89 0.24 -1.26 -4.93 118.33 120.63 1bak n VAL 661 Ca 0.13 -0.47 -0.29 0.00 -2.04 0.00 0.00 64.34 61.67 1bak n VAL 661 Cb 0.51 -0.21 0.17 0.00 -1.47 0.00 0.00 33.84 32.83 1bak n VAL 661 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1bak s PRO 662 N -1.83 0.58 0.09 7.34 0.04 -1.26 -4.99 135.00 134.98 1bak s PRO 662 Ca 0.54 0.08 -0.13 0.00 0.04 0.00 0.00 61.00 61.54 1bak s PRO 662 Cb -0.36 -1.79 -0.19 0.00 0.04 0.00 0.00 34.50 32.20 1bak s PRO 662 CO 0.69 -2.53 1.25 1.57 0.04 0.00 0.00 177.00 178.01 1bak h LYS 663 N -1.74 0.72 0.00 4.56 5.09 -1.93 -3.49 116.57 119.78 1bak h LYS 663 Ca -0.48 -0.69 0.19 0.00 0.09 0.00 0.00 60.65 59.75 1bak h LYS 663 Cb 1.31 0.18 -0.03 0.00 0.10 0.00 0.00 32.23 33.78 1bak h LYS 663 CO 0.52 1.28 0.49 -1.33 -2.09 0.00 0.00 179.45 178.32 1bak n MET 664 N -3.88 0.10 0.00 0.07 2.81 -1.26 -5.03 117.12 109.93 1bak n MET 664 Ca -0.09 -0.42 0.00 0.00 -1.81 0.00 0.00 57.70 55.38 1bak n MET 664 Cb 0.83 0.69 0.00 0.00 -0.71 0.00 0.00 33.22 34.03 1bak n MET 664 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1bak n LYS 665 N -0.50 0.00 -1.40 0.03 3.00 -1.26 -4.59 118.16 113.44 1bak n LYS 665 Ca 0.02 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.94 1bak n LYS 665 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.32 1bak n LYS 665 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1bak n ASN 666 N 3.03 5.03 -3.98 3.14 5.15 -1.26 -4.83 115.26 121.54 1bak n ASN 666 Ca 0.00 -2.68 -0.22 0.00 -0.60 0.00 0.00 54.58 51.08 1bak n ASN 666 Cb 0.00 -1.47 -0.16 0.00 -0.53 0.00 0.00 39.78 37.62 1bak n ASN 666 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1bak s LYS 667 N 3.28 1.21 0.11 1.20 2.47 -1.26 -4.66 119.74 122.08 1bak s LYS 667 Ca 0.54 -0.29 -0.09 0.00 -1.56 0.00 0.00 55.97 54.57 1bak s LYS 667 Cb 0.15 -1.08 -0.13 0.00 -1.46 0.00 0.00 37.83 35.31 1bak s LYS 667 CO -0.04 0.03 1.29 -1.00 0.16 0.00 0.00 175.35 175.78 1bak h PRO 668 N 6.84 0.60 -1.58 4.03 0.13 -2.02 -3.48 132.00 136.51 1bak h PRO 668 Ca -0.34 -0.58 0.29 0.00 -0.87 0.00 0.00 66.00 64.50 1bak h PRO 668 Cb 1.17 0.15 -0.13 0.00 0.13 0.00 0.00 31.00 32.32 1bak h PRO 668 CO 0.48 1.20 0.78 0.50 -0.23 0.00 0.00 178.00 180.72 1bak s ARG 669 N -3.45 0.49 0.00 0.86 3.52 -1.26 -5.26 118.95 113.86 1bak s ARG 669 Ca -0.08 -0.26 0.00 0.00 -0.13 0.00 0.00 55.73 55.26 1bak s ARG 669 Cb 0.08 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.65 1bak s ARG 669 CO 0.89 -0.22 0.30 -1.13 -0.81 0.00 0.00 175.30 174.32