#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 -0.13 -0.09 1.61 1.04 -1.26 -5.18 113.70 109.69 1bak s SER 553 Ca 0.00 0.01 -0.32 0.00 0.48 0.00 0.00 55.95 56.12 1bak s SER 553 Cb 0.00 1.05 0.13 0.00 0.10 0.00 0.00 66.02 67.30 1bak s SER 553 CO 0.00 -0.02 1.24 -1.38 0.98 0.00 0.00 173.24 174.06 1bak s HIS 554 N 2.95 -0.09 0.31 5.02 -3.43 -1.26 -5.18 115.29 113.61 1bak s HIS 554 Ca 0.31 0.00 0.09 0.00 -0.80 0.00 0.00 55.06 54.66 1bak s HIS 554 Cb 0.00 0.53 -0.06 0.00 -1.43 0.00 0.00 32.58 31.63 1bak s HIS 554 CO -0.22 -0.26 -0.10 -1.64 -2.00 0.00 0.00 174.74 170.52 1bak s MET 555 N -2.45 1.69 0.10 -0.38 -1.94 -1.26 -5.15 119.30 109.91 1bak s MET 555 Ca 0.12 -1.85 -0.02 0.00 -1.71 0.00 0.00 55.69 52.23 1bak s MET 555 Cb 0.02 -1.50 0.02 0.00 2.01 0.00 0.00 34.83 35.39 1bak s MET 555 CO -0.04 0.13 0.14 0.41 -0.01 0.00 0.00 175.02 175.65 1bak n GLY 556 N -0.68 -1.26 2.30 -0.03 0.00 -1.26 -5.05 105.19 99.21 1bak n GLY 556 Ca -0.05 -1.66 -0.16 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.34 0.97 0.00 1.61 4.81 -1.26 -4.93 118.16 118.02 1bak n LYS 557 Ca 0.02 -3.06 0.00 0.00 -0.87 0.00 0.00 58.31 54.39 1bak n LYS 557 Cb 0.06 -1.55 0.00 0.00 0.02 0.00 0.00 35.03 33.56 1bak n LYS 557 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1bak n ASP 558 N 0.36 0.00 -3.60 3.14 5.75 -1.26 -5.02 116.55 115.92 1bak n ASP 558 Ca 0.21 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.83 1bak n ASP 558 Cb 0.66 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.69 1bak n ASP 558 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bak n ILE 560 N 0.89 1.49 -3.85 0.00 5.41 -0.21 -4.87 119.36 118.22 1bak n ILE 560 Ca -0.20 0.04 -0.12 0.00 1.00 0.00 0.00 62.75 63.48 1bak n ILE 560 Cb 0.57 -2.25 -0.10 0.00 -0.71 0.00 0.00 39.64 37.16 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 -2.68 0.52 -0.01 0.38 1.75 -1.00 -5.05 119.30 113.22 1bak s MET 561 Ca -0.28 -0.36 -0.07 0.00 -1.25 0.00 0.00 55.69 53.72 1bak s MET 561 Cb 0.06 0.22 0.00 0.00 2.84 0.00 0.00 34.83 37.95 1bak s MET 561 CO 0.41 -0.13 0.14 -3.38 -0.65 0.00 0.00 175.02 171.42 1bak s HIS 562 N -1.37 0.01 -2.48 4.11 -3.43 -1.26 -0.41 115.29 110.45 1bak s HIS 562 Ca -0.15 -0.06 0.00 0.00 -0.80 0.00 0.00 55.06 54.05 1bak s HIS 562 Cb -0.07 -0.03 0.00 0.00 -1.43 0.00 0.00 32.58 31.04 1bak s HIS 562 CO 0.02 -0.26 0.00 0.41 -2.00 0.00 0.00 174.74 172.91 1bak n GLY 563 N 1.64 -1.20 3.67 -1.38 0.00 -1.22 -5.04 105.19 101.66 1bak n GLY 563 Ca -0.21 -0.99 -0.37 0.00 0.00 0.00 0.00 46.02 44.44 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 -3.00 3.35 0.29 1.61 6.14 -1.26 -2.39 117.35 122.09 1bak s TYR 564 Ca 0.00 0.43 0.03 0.00 0.64 0.00 0.00 57.07 58.17 1bak s TYR 564 Cb 0.00 -2.39 -0.01 0.00 0.42 0.00 0.00 41.96 39.98 1bak s TYR 564 CO 0.00 0.04 0.10 -1.33 0.64 0.00 0.00 175.55 175.01 1bak n MET 565 N 4.32 0.69 -3.25 4.97 2.81 -0.18 -4.92 117.12 121.56 1bak n MET 565 Ca -0.12 -2.41 -0.04 0.00 -1.81 0.00 0.00 57.70 53.32 1bak n MET 565 Cb 0.52 1.31 -0.04 0.00 -0.71 0.00 0.00 33.22 34.29 1bak n MET 565 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1bak s SER 566 N -2.75 -0.34 0.26 7.83 1.04 0.79 -0.48 113.70 120.05 1bak s SER 566 Ca 0.14 -0.06 0.11 0.00 0.48 0.00 0.00 55.95 56.62 1bak s SER 566 Cb 0.01 1.45 -0.05 0.00 0.10 0.00 0.00 66.02 67.53 1bak s SER 566 CO 0.10 -0.33 -0.19 -0.75 0.98 0.00 0.00 173.24 173.05 1bak s LYS 567 N 2.65 1.61 0.08 4.02 2.36 -1.19 0.21 119.74 129.48 1bak s LYS 567 Ca 0.11 -1.73 -0.26 0.00 -2.55 0.00 0.00 55.97 51.54 1bak s LYS 567 Cb -0.12 -1.66 0.09 0.00 -1.05 0.00 0.00 37.83 35.09 1bak s LYS 567 CO -0.27 0.31 1.15 0.00 1.55 0.00 0.00 175.35 178.09 1bak s MET 568 N -3.49 0.83 -0.30 4.03 0.23 -0.99 -4.18 119.30 115.44 1bak s MET 568 Ca 0.28 -0.51 -0.17 0.00 -1.03 0.00 0.00 55.69 54.27 1bak s MET 568 Cb -0.04 0.25 0.18 0.00 -1.53 0.00 0.00 34.83 33.68 1bak s MET 568 CO 0.13 -0.39 1.10 0.20 -2.03 0.00 0.00 175.02 174.03 1bak s GLY 569 N -3.31 0.02 0.19 3.16 0.00 -1.26 -2.81 107.32 103.30 1bak s GLY 569 Ca 0.20 3.30 -0.15 0.00 0.00 0.00 0.00 44.72 48.06 1bak s GLY 569 CO 0.01 3.21 0.75 0.70 0.00 0.00 0.00 173.10 177.77 1bak n ASN 570 N 4.63 -1.46 -0.19 1.64 3.02 -1.26 -4.99 115.26 116.65 1bak n ASN 570 Ca -0.09 -1.84 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1bak n ASN 570 Cb 0.54 2.40 0.00 0.00 -0.61 0.00 0.00 39.78 42.11 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 -0.52 0.75 -3.42 3.52 -0.04 -1.26 -4.16 135.00 129.86 1bak n PRO 571 Ca -0.03 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.16 1bak n PRO 571 Cb 0.45 -1.14 -0.11 0.00 -0.04 0.00 0.00 33.50 32.67 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 -1.63 0.61 -1.08 0.54 0.08 -1.26 -5.06 117.98 110.18 1bak s PHE 572 Ca 0.00 -1.63 -0.20 0.00 0.12 0.00 0.00 56.93 55.23 1bak s PHE 572 Cb 0.00 -0.82 0.09 0.00 -0.57 0.00 0.00 43.02 41.72 1bak s PHE 572 CO 0.00 -0.86 1.42 -1.17 -0.10 0.00 0.00 175.22 174.52 1bak s LEU 573 N 0.93 4.19 0.00 -0.37 2.96 -1.26 -3.99 118.68 121.14 1bak s LEU 573 Ca 0.21 -2.02 0.00 0.00 -0.22 0.00 0.00 54.13 52.10 1bak s LEU 573 Cb -0.17 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.02 1bak s LEU 573 CO -0.03 -1.22 0.00 1.07 -1.32 0.00 0.00 176.35 174.85 1bak n THR 574 N 6.12 0.00 -3.20 3.68 5.66 -1.26 -5.13 114.28 120.14 1bak n THR 574 Ca 0.34 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 61.13 1bak n THR 574 Cb 0.48 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.27 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 -1.00 3.13 -0.09 1.09 -2.07 -1.26 -5.12 119.66 114.35 1bak s GLN 575 Ca 0.00 -0.64 -0.07 0.00 -1.82 0.00 0.00 55.36 52.83 1bak s GLN 575 Cb 0.00 -2.66 0.03 0.00 -1.09 0.00 0.00 33.01 29.29 1bak s GLN 575 CO 0.00 -0.11 0.23 -1.58 -1.32 0.00 0.00 175.29 172.51 1bak s TRP 576 N -2.40 -0.28 -0.29 9.60 0.51 -1.26 -4.93 118.94 119.89 1bak s TRP 576 Ca 0.46 0.67 -0.11 0.00 -2.12 0.00 0.00 56.10 55.01 1bak s TRP 576 Cb -0.10 0.07 -0.03 0.00 -0.81 0.00 0.00 33.47 32.60 1bak s TRP 576 CO 0.35 -0.16 0.18 -1.14 -0.51 0.00 0.00 176.95 175.67 1bak s GLN 577 N 0.57 3.71 -0.60 4.98 0.74 -1.26 -5.03 119.66 122.77 1bak s GLN 577 Ca -0.04 -0.48 -0.25 0.00 0.05 0.00 0.00 55.36 54.64 1bak s GLN 577 Cb -0.05 -3.62 0.04 0.00 1.10 0.00 0.00 33.01 30.48 1bak s GLN 577 CO -0.03 -0.28 1.06 0.50 -0.55 0.00 0.00 175.29 175.99 1bak s ARG 578 N 1.71 3.33 0.16 1.67 3.00 -1.26 -3.18 118.95 124.38 1bak s ARG 578 Ca 0.06 -0.20 0.01 0.00 -1.00 0.00 0.00 55.73 54.60 1bak s ARG 578 Cb -0.16 -4.09 -0.04 0.00 0.00 0.00 0.00 34.95 30.66 1bak s ARG 578 CO 0.09 -1.68 0.02 1.03 0.00 0.00 0.00 175.30 174.76 1bak s ARG 579 N 4.50 1.07 -0.13 5.12 1.81 0.36 -4.98 118.95 126.70 1bak s ARG 579 Ca 0.33 -1.52 -0.22 0.00 -1.72 0.00 0.00 55.73 52.61 1bak s ARG 579 Cb -0.11 -0.11 -0.03 0.00 -0.45 0.00 0.00 34.95 34.25 1bak s ARG 579 CO 0.19 -0.18 0.64 -0.47 -0.68 0.00 0.00 175.30 174.80 1bak s TYR 580 N -3.78 3.49 0.34 -0.53 6.14 0.43 -1.01 117.35 122.43 1bak s TYR 580 Ca 0.25 1.07 0.08 0.00 0.64 0.00 0.00 57.07 59.11 1bak s TYR 580 Cb 0.07 -2.77 -0.05 0.00 0.42 0.00 0.00 41.96 39.63 1bak s TYR 580 CO 0.04 -0.00 0.10 -0.06 0.64 0.00 0.00 175.55 176.26 1bak s PHE 581 N 1.22 2.64 -0.13 4.97 0.40 -1.00 -0.15 117.98 125.93 1bak s PHE 581 Ca 0.32 -0.42 -0.04 0.00 -0.60 0.00 0.00 56.93 56.20 1bak s PHE 581 Cb -0.16 -1.60 0.06 0.00 0.51 0.00 0.00 43.02 41.82 1bak s PHE 581 CO 0.14 0.38 0.19 0.71 0.70 0.00 0.00 175.22 177.33 1bak s TYR 582 N -2.47 -0.21 -0.36 0.36 1.51 0.82 -3.37 117.35 113.62 1bak s TYR 582 Ca 0.37 0.49 -0.20 0.00 -1.01 0.00 0.00 57.07 56.72 1bak s TYR 582 Cb -0.01 -0.29 0.00 0.00 -0.11 0.00 0.00 41.96 41.55 1bak s TYR 582 CO 0.21 -0.39 0.61 -1.17 -1.11 0.00 0.00 175.55 173.70 1bak s LEU 583 N 2.31 4.31 0.39 -1.29 2.96 0.45 -2.20 118.68 125.60 1bak s LEU 583 Ca 0.04 0.05 0.08 0.00 -0.22 0.00 0.00 54.13 54.07 1bak s LEU 583 Cb -0.13 -2.73 -0.02 0.00 0.50 0.00 0.00 46.19 43.80 1bak s LEU 583 CO -0.08 -0.59 0.35 -0.36 -1.32 0.00 0.00 176.35 174.35 1bak s PHE 584 N 2.65 2.78 -0.72 5.38 0.40 -0.73 -1.04 117.98 126.70 1bak s PHE 584 Ca 0.23 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 1bak s PHE 584 Cb -0.15 -2.04 0.00 0.00 0.51 0.00 0.00 43.02 41.34 1bak s PHE 584 CO 0.15 -0.02 0.48 -0.35 0.70 0.00 0.00 175.22 176.18 1bak n PRO 585 N -1.49 0.75 0.00 0.24 -0.04 -1.26 -4.13 135.00 129.06 1bak n PRO 585 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1bak n PRO 585 Cb 0.61 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 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 0.26 0.00 -3.03 3.54 0.23 -1.26 -5.01 115.26 109.99 1bak n ASN 586 Ca 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.95 1bak n ASN 586 Cb 0.24 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 37.99 1bak n ASN 586 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1bak n ARG 587 N 0.00 0.20 0.00 -3.83 1.74 -1.26 0.18 116.66 113.70 1bak n ARG 587 Ca 0.00 -1.10 0.00 0.00 -0.77 0.00 0.00 57.85 55.98 1bak n ARG 587 Cb 0.00 -0.32 0.00 0.00 -1.02 0.00 0.00 32.46 31.12 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 -4.71 0.55 7.94 0.60 -1.77 117.00 119.61 1bak n LEU 588 Ca 0.07 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.72 1bak n LEU 588 Cb 0.25 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.13 1bak n LEU 588 CO 0.17 0.00 -0.28 -1.61 -1.11 0.00 0.00 177.39 174.55 1bak s GLU 589 N 0.00 2.53 -0.27 1.96 2.02 -0.93 0.62 118.70 124.63 1bak s GLU 589 Ca 0.00 -1.16 -0.01 0.00 0.02 0.00 0.00 54.97 53.82 1bak s GLU 589 Cb 0.00 -2.37 0.15 0.00 0.10 0.00 0.00 34.13 32.00 1bak s GLU 589 CO 0.00 0.42 0.39 1.67 0.02 0.00 0.00 175.26 177.76 1bak s TRP 590 N -1.99 -0.88 0.05 1.61 1.48 -1.07 -0.13 118.94 118.00 1bak s TRP 590 Ca 0.30 0.57 -0.00 0.00 -1.06 0.00 0.00 56.10 55.90 1bak s TRP 590 Cb -0.08 -0.08 0.00 0.00 -1.16 0.00 0.00 33.47 32.15 1bak s TRP 590 CO 0.21 -0.84 0.06 0.54 -4.06 0.00 0.00 176.95 172.86 1bak n ARG 591 N 5.36 0.09 0.00 3.25 5.12 0.79 -4.64 116.66 126.62 1bak n ARG 591 Ca -0.02 -0.36 0.00 0.00 -1.93 0.00 0.00 57.85 55.54 1bak n ARG 591 Cb 0.50 0.35 0.00 0.00 -1.16 0.00 0.00 32.46 32.14 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 -0.07 0.58 3.71 -0.13 0.00 -1.26 0.16 105.19 108.17 1bak n GLY 592 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 3.30 4.44 0.00 1.61 4.04 -1.26 -4.61 118.70 126.22 1bak s GLU 593 Ca 0.00 1.05 0.00 0.00 0.04 0.00 0.00 54.97 56.06 1bak s GLU 593 Cb 0.00 -3.48 0.00 0.00 0.02 0.00 0.00 34.13 30.67 1bak s GLU 593 CO 0.00 -0.04 0.00 0.41 -1.84 0.00 0.00 175.26 173.79 1bak n GLY 594 N 3.12 0.32 0.00 -3.83 0.00 -1.26 -4.93 105.19 98.60 1bak n GLY 594 Ca 0.02 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1bak n GLY 594 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bak n GLU 595 N 0.00 0.00 -3.16 1.61 1.02 -1.26 -5.15 120.64 113.70 1bak n GLU 595 Ca 0.00 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.85 1bak n GLU 595 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 1bak n GLU 595 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bak s ALA 596 N 0.00 3.54 -0.01 0.62 0.00 -1.26 -5.04 121.76 119.61 1bak s ALA 596 Ca 0.00 -0.49 -0.30 0.00 0.00 0.00 0.00 51.96 51.17 1bak s ALA 596 Cb 0.00 -2.42 -0.04 0.00 0.00 0.00 0.00 23.12 20.66 1bak s ALA 596 CO 0.00 0.11 1.20 -1.25 0.00 0.00 0.00 175.76 175.82 1bak s PRO 597 N -3.78 4.38 0.00 0.00 0.04 -1.26 -4.77 135.00 129.62 1bak s PRO 597 Ca 0.46 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1bak s PRO 597 Cb -0.10 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.95 1bak s PRO 597 CO 0.32 -0.38 0.00 0.94 0.04 0.00 0.00 177.00 177.92 1bak n GLN 598 N 4.75 0.00 -3.61 4.56 7.27 -1.26 -5.07 117.38 124.03 1bak n GLN 598 Ca 0.10 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.77 1bak n GLN 598 Cb 0.46 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 33.02 1bak n GLN 598 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1bak s SER 599 N 0.13 5.61 0.08 1.69 0.01 -1.26 -5.05 113.70 114.90 1bak s SER 599 Ca 0.00 -2.08 0.06 0.00 1.31 0.00 0.00 55.95 55.24 1bak s SER 599 Cb 0.00 -1.97 -0.03 0.00 0.21 0.00 0.00 66.02 64.23 1bak s SER 599 CO 0.00 -0.62 -0.16 -1.48 0.41 0.00 0.00 173.24 171.38 1bak s LEU 600 N 1.10 2.27 0.06 2.44 2.34 -1.26 -2.59 118.68 123.04 1bak s LEU 600 Ca 0.08 -0.62 -0.14 0.00 0.06 0.00 0.00 54.13 53.52 1bak s LEU 600 Cb -0.24 -0.64 0.02 0.00 -0.56 0.00 0.00 46.19 44.77 1bak s LEU 600 CO -0.02 -0.02 0.31 -0.22 -1.06 0.00 0.00 176.35 175.34 1bak s LEU 601 N -1.70 0.84 0.00 1.48 2.96 0.20 -4.98 118.68 117.48 1bak s LEU 601 Ca 0.01 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.66 1bak s LEU 601 Cb -0.10 1.42 0.00 0.00 0.50 0.00 0.00 46.19 48.01 1bak s LEU 601 CO 0.03 -0.67 0.00 0.41 -1.32 0.00 0.00 176.35 174.79 1bak n THR 602 N 0.35 0.00 -2.12 3.68 -1.04 -1.26 0.22 114.28 114.11 1bak n THR 602 Ca -0.18 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.81 1bak n THR 602 Cb 0.61 -1.24 0.09 0.00 -1.82 0.00 0.00 70.33 67.97 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 -0.60 1.69 -2.91 -2.82 0.00 0.48 -4.70 117.12 108.27 1bak n MET 603 Ca 0.00 -3.22 -0.25 0.00 0.00 0.00 0.00 57.70 54.24 1bak n MET 603 Cb 0.00 -1.37 -0.03 0.00 0.00 0.00 0.00 33.22 31.82 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 2.75 0.04 3.17 0.28 -1.26 -3.40 120.64 121.69 1bak n GLU 604 Ca 0.20 -4.47 0.00 0.00 -0.16 0.00 0.00 57.16 52.73 1bak n GLU 604 Cb 0.89 -2.10 0.00 0.00 1.43 0.00 0.00 31.44 31.66 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 -0.18 0.00 -0.91 3.44 0.28 -1.26 -5.03 120.64 116.98 1bak n GLU 605 Ca 0.30 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.98 1bak n GLU 605 Cb 0.50 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.34 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 -2.67 0.94 -0.03 3.84 -0.00 -1.26 -0.93 119.36 119.25 1bak n ILE 606 Ca 0.00 -0.24 -0.18 0.00 -0.00 0.00 0.00 62.75 62.34 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 0.72 0.71 -3.65 0.38 0.00 0.14 -4.31 117.38 111.37 1bak n GLN 607 Ca 0.12 0.24 -0.02 0.00 -0.00 0.00 0.00 57.00 57.34 1bak n GLN 607 Cb 0.13 -1.69 -0.07 0.00 0.00 0.00 0.00 30.24 28.62 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 -6.68 -0.27 -0.08 1.69 0.01 -1.04 -4.92 113.70 102.41 1bak s SER 608 Ca -0.20 0.45 -0.03 0.00 1.31 0.00 0.00 55.95 57.48 1bak s SER 608 Cb 0.07 0.91 -0.04 0.00 0.21 0.00 0.00 66.02 67.18 1bak s SER 608 CO 0.76 -0.07 0.05 0.54 0.41 0.00 0.00 173.24 174.93 1bak s VAL 609 N 0.86 4.70 0.03 3.43 0.11 -1.26 -2.45 120.40 125.83 1bak s VAL 609 Ca -0.04 -0.16 -0.01 0.00 -2.93 0.00 0.00 61.98 58.84 1bak s VAL 609 Cb -0.04 -3.03 0.00 0.00 -1.53 0.00 0.00 36.38 31.79 1bak s VAL 609 CO -0.12 0.56 0.07 -1.84 -3.33 0.00 0.00 175.10 170.44 1bak n GLU 610 N 1.92 0.10 -3.90 1.54 0.28 -1.04 -5.01 120.64 114.52 1bak n GLU 610 Ca -0.18 -0.19 -0.11 0.00 -0.16 0.00 0.00 57.16 56.52 1bak n GLU 610 Cb 0.54 0.23 -0.12 0.00 1.43 0.00 0.00 31.44 33.52 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 0.20 0.37 3.44 2.12 -1.26 0.27 118.70 121.83 1bak s GLU 611 Ca 0.01 -0.25 0.08 0.00 0.36 0.00 0.00 54.97 55.17 1bak s GLU 611 Cb -0.00 0.08 -0.03 0.00 0.26 0.00 0.00 34.13 34.43 1bak s GLU 611 CO 0.01 -0.04 0.27 -0.08 -0.54 0.00 0.00 175.26 174.88 1bak s THR 612 N -0.72 2.97 0.13 -1.70 -1.32 0.41 -4.79 115.64 110.63 1bak s THR 612 Ca -0.08 -1.49 0.04 0.00 -1.21 0.00 0.00 61.69 58.96 1bak s THR 612 Cb -0.05 -3.05 -0.04 0.00 -1.51 0.00 0.00 72.50 67.85 1bak s THR 612 CO -0.00 -0.10 -0.10 -1.10 -2.21 0.00 0.00 174.62 171.11 1bak s GLN 613 N -3.99 0.99 -0.40 7.08 1.11 -1.26 -2.31 119.66 120.89 1bak s GLN 613 Ca 0.42 -1.36 0.03 0.00 0.01 0.00 0.00 55.36 54.46 1bak s GLN 613 Cb -0.03 -0.59 0.16 0.00 -1.01 0.00 0.00 33.01 31.54 1bak s GLN 613 CO 0.25 0.08 0.34 0.42 0.01 0.00 0.00 175.29 176.39 1bak s ILE 614 N -3.07 0.06 0.00 1.08 1.01 -1.22 -4.56 121.20 114.50 1bak s ILE 614 Ca 0.13 -1.97 0.00 0.00 0.00 0.00 0.00 60.65 58.81 1bak s ILE 614 Cb 0.01 -1.01 0.00 0.00 0.01 0.00 0.00 42.46 41.47 1bak s ILE 614 CO 0.00 -0.96 0.00 0.29 0.00 0.00 0.00 174.94 174.27 1bak n LYS 615 N 3.43 0.00 0.00 2.79 4.76 -1.26 -3.69 118.16 124.19 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 0.45 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 -3.69 1.97 2.13 -1.26 -5.13 120.64 114.66 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 -0.02 -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 -1.75 0.60 0.00 5.31 3.52 -1.24 -4.93 118.95 120.46 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 0.25 0.00 0.00 -1.56 0.00 0.00 34.95 33.64 1bak s ARG 617 CO 0.00 -0.09 0.00 1.17 -0.81 0.00 0.00 175.30 175.57 1bak n LYS 618 N 3.08 0.00 -2.72 5.12 3.00 -1.05 -3.42 118.16 122.16 1bak n LYS 618 Ca -0.15 0.00 -0.06 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 4.33 0.38 0.00 2.96 0.25 0.16 118.68 126.76 1bak s LEU 620 Ca 0.11 0.40 -0.01 0.00 -0.22 0.00 0.00 54.13 54.41 1bak s LEU 620 Cb -0.02 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 1bak s LEU 620 CO 0.08 0.34 0.61 -0.22 -1.32 0.00 0.00 176.35 175.84 1bak s LEU 621 N -0.63 3.92 -0.42 -0.68 2.96 0.76 0.11 118.68 124.69 1bak s LEU 621 Ca 0.13 0.59 0.07 0.00 -0.22 0.00 0.00 54.13 54.70 1bak s LEU 621 Cb -0.12 -3.47 0.18 0.00 0.50 0.00 0.00 46.19 43.28 1bak s LEU 621 CO 0.02 -0.36 0.60 -0.76 -1.32 0.00 0.00 176.35 174.53 1bak s LEU 622 N -4.37 -1.20 -0.01 -0.68 1.43 0.18 -2.51 118.68 111.52 1bak s LEU 622 Ca 0.42 -1.16 -0.17 0.00 -1.03 0.00 0.00 54.13 52.20 1bak s LEU 622 Cb -0.10 1.66 -0.06 0.00 0.03 0.00 0.00 46.19 47.73 1bak s LEU 622 CO 0.38 -0.16 0.47 -1.59 0.23 0.00 0.00 176.35 175.68 1bak s LYS 623 N 1.55 4.10 -0.02 1.70 -2.85 -1.02 0.13 119.74 123.32 1bak s LYS 623 Ca 0.19 0.52 -0.00 0.00 -1.00 0.00 0.00 55.97 55.68 1bak s LYS 623 Cb -0.05 -3.28 -0.04 0.00 -2.06 0.00 0.00 37.83 32.41 1bak s LYS 623 CO -0.06 0.55 0.03 0.42 0.10 0.00 0.00 175.35 176.39 1bak s ILE 624 N -0.69 4.41 -2.00 3.79 1.01 0.10 0.25 121.20 128.08 1bak s ILE 624 Ca 0.26 -0.44 0.21 0.00 0.00 0.00 0.00 60.65 60.67 1bak s ILE 624 Cb -0.17 -2.96 0.58 0.00 0.01 0.00 0.00 42.46 39.92 1bak s ILE 624 CO 0.14 0.42 1.76 -2.11 0.00 0.00 0.00 174.94 175.16 1bak n ARG 625 N 1.50 0.96 0.08 2.79 1.85 -0.11 -2.80 116.66 120.93 1bak n ARG 625 Ca -0.15 0.00 0.07 0.00 -1.00 0.00 0.00 57.85 56.77 1bak n ARG 625 Cb 0.53 -1.33 -0.03 0.00 -1.05 0.00 0.00 32.46 30.58 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 1.27 0.97 3.34 4.60 0.00 -1.12 -5.15 105.19 109.10 1bak n GLY 627 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 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 0.06 1.27 -0.08 1.61 1.02 -1.23 -5.03 119.74 117.36 1bak s LYS 628 Ca 0.00 -1.39 -0.08 0.00 0.02 0.00 0.00 55.97 54.52 1bak s LYS 628 Cb 0.00 0.35 0.02 0.00 -0.52 0.00 0.00 37.83 37.68 1bak s LYS 628 CO 0.00 -0.46 0.23 -0.65 -0.92 0.00 0.00 175.35 173.54 1bak s GLN 629 N -4.06 0.30 0.15 1.68 1.11 -1.26 -0.72 119.66 116.86 1bak s GLN 629 Ca 0.28 0.25 0.02 0.00 0.01 0.00 0.00 55.36 55.92 1bak s GLN 629 Cb 0.04 0.14 -0.05 0.00 -1.01 0.00 0.00 33.01 32.13 1bak s GLN 629 CO 0.07 -0.04 -0.03 -0.06 0.01 0.00 0.00 175.29 175.24 1bak s PHE 630 N -0.03 1.15 -0.14 0.91 0.08 0.36 -4.89 117.98 115.42 1bak s PHE 630 Ca -0.01 -0.96 -0.04 0.00 0.12 0.00 0.00 56.93 56.04 1bak s PHE 630 Cb -0.02 -0.65 0.05 0.00 -0.57 0.00 0.00 43.02 41.83 1bak s PHE 630 CO 0.01 -0.15 0.07 0.42 -0.10 0.00 0.00 175.22 175.46 1bak s ILE 631 N -3.60 0.05 0.46 0.64 1.09 -1.12 0.49 121.20 119.20 1bak s ILE 631 Ca 0.20 -0.08 -0.08 0.00 -1.10 0.00 0.00 60.65 59.59 1bak s ILE 631 Cb 0.05 -0.56 -0.05 0.00 -1.06 0.00 0.00 42.46 40.85 1bak s ILE 631 CO 0.02 -0.12 0.80 -0.76 -0.10 0.00 0.00 174.94 174.78 1bak s LEU 632 N 2.08 3.68 -0.21 2.97 1.02 0.29 -2.33 118.68 126.19 1bak s LEU 632 Ca 0.02 1.07 -0.20 0.00 0.02 0.00 0.00 54.13 55.05 1bak s LEU 632 Cb -0.15 -4.00 0.06 0.00 0.02 0.00 0.00 46.19 42.11 1bak s LEU 632 CO -0.07 -0.52 0.57 -1.58 0.02 0.00 0.00 176.35 174.76 1bak s GLN 633 N -4.37 0.67 0.12 1.70 2.00 0.58 -0.58 119.66 119.79 1bak s GLN 633 Ca 0.50 0.76 -0.16 0.00 -2.00 0.00 0.00 55.36 54.46 1bak s GLN 633 Cb -0.10 0.33 0.03 0.00 0.80 0.00 0.00 33.01 34.07 1bak s GLN 633 CO 0.39 -0.09 0.39 0.00 -0.50 0.00 0.00 175.29 175.49 1bak h ASP 635 N 2.38 0.00 -3.39 0.00 1.82 -1.98 -3.45 116.42 111.79 1bak h ASP 635 Ca -0.34 -0.04 -0.54 0.00 -0.39 0.00 0.00 57.03 55.73 1bak h ASP 635 Cb 1.25 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.24 1bak h ASP 635 CO 0.47 0.02 -0.13 -0.44 -1.61 0.00 0.00 179.24 177.56 1bak s SER 636 N -5.31 6.58 -0.10 2.28 0.01 -1.26 -5.01 113.70 110.90 1bak s SER 636 Ca 0.06 0.87 -0.12 0.00 1.31 0.00 0.00 55.95 58.07 1bak s SER 636 Cb 0.09 -2.21 -0.28 0.00 0.21 0.00 0.00 66.02 63.84 1bak s SER 636 CO 0.69 -0.10 0.52 0.44 0.41 0.00 0.00 173.24 175.20 1bak h ASP 637 N 2.38 0.45 0.23 2.44 3.32 -2.02 -3.40 116.42 119.82 1bak h ASP 637 Ca -0.47 -0.89 -0.01 0.00 0.02 0.00 0.00 57.03 55.68 1bak h ASP 637 Cb 1.17 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.58 1bak h ASP 637 CO 0.69 1.73 -0.11 1.55 -1.72 0.00 0.00 179.24 181.38 1bak h PRO 638 N -0.11 -0.29 0.00 3.56 0.13 -1.98 -3.13 132.00 130.19 1bak h PRO 638 Ca -0.35 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1bak h PRO 638 Cb 1.92 0.07 0.00 0.00 0.13 0.00 0.00 31.00 33.12 1bak h PRO 638 CO 0.09 -0.12 0.00 0.39 -0.23 0.00 0.00 178.00 178.14 1bak n GLU 639 N -4.97 0.00 -0.04 0.86 -0.58 -1.26 0.23 120.64 114.88 1bak n GLU 639 Ca -0.05 0.03 -0.09 0.00 -0.42 0.00 0.00 57.16 56.63 1bak n GLU 639 Cb 0.16 -0.05 -0.03 0.00 -0.57 0.00 0.00 31.44 30.95 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 -0.90 -0.87 -4.62 7.12 -1.76 0.46 115.31 114.74 1bak h LEU 640 Ca 0.00 0.15 0.10 0.00 0.13 0.00 0.00 57.88 58.26 1bak h LEU 640 Cb 0.00 0.41 -0.13 0.00 -0.53 0.00 0.00 40.66 40.41 1bak h LEU 640 CO 0.00 -0.31 -0.50 0.58 -0.13 0.00 0.00 178.44 178.07 1bak h VAL 641 N -0.31 0.02 -0.90 1.05 2.07 0.30 0.81 116.25 119.29 1bak h VAL 641 Ca 0.13 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.64 1bak h VAL 641 Cb 0.50 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 1bak h VAL 641 CO -0.39 0.00 0.53 1.56 0.02 0.00 0.00 177.57 179.29 1bak h GLN 642 N -0.08 1.23 -0.37 1.57 4.20 0.25 -2.13 115.11 119.78 1bak h GLN 642 Ca 0.21 -0.12 0.07 0.00 0.06 0.00 0.00 58.65 58.87 1bak h GLN 642 Cb 0.51 -0.25 -0.07 0.00 0.30 0.00 0.00 27.48 27.96 1bak h GLN 642 CO -0.88 0.87 -0.08 -1.49 -0.67 0.00 0.00 178.83 176.58 1bak h TRP 643 N 1.24 -0.18 0.16 2.96 4.06 0.51 -1.30 115.95 123.40 1bak h TRP 643 Ca 0.32 0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.32 1bak h TRP 643 Cb -0.04 0.13 -0.04 0.00 -1.00 0.00 0.00 29.16 28.22 1bak h TRP 643 CO 0.00 -0.15 -0.41 -0.22 -3.56 0.00 0.00 178.44 174.10 1bak h LYS 644 N 0.01 -0.65 -0.99 0.49 3.64 0.66 1.45 116.57 121.18 1bak h LYS 644 Ca 0.18 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.74 1bak h LYS 644 Cb 0.27 0.15 -0.15 0.00 -0.41 0.00 0.00 32.23 32.08 1bak h LYS 644 CO -0.37 -0.43 -0.42 -0.22 -2.27 0.00 0.00 179.45 175.74 1bak h LYS 645 N -0.67 -0.00 -0.01 1.90 3.11 -0.76 3.33 116.57 123.46 1bak h LYS 645 Ca 0.01 0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.75 1bak h LYS 645 Cb 0.68 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.90 1bak h LYS 645 CO -0.22 -0.00 -0.49 0.93 -2.81 0.00 0.00 179.45 176.86 1bak h GLU 646 N -0.00 0.02 0.33 1.90 3.07 -0.49 -2.93 114.58 116.47 1bak h GLU 646 Ca 0.32 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 59.15 1bak h GLU 646 Cb 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 1bak h GLU 646 CO -0.98 0.51 -0.16 -0.07 -1.40 0.00 0.00 179.01 176.91 1bak h LEU 647 N 0.02 -0.37 -0.89 1.33 3.38 1.34 -0.85 115.31 119.27 1bak h LEU 647 Ca -0.00 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.11 1bak h LEU 647 Cb 0.87 0.10 -0.14 0.00 0.09 0.00 0.00 40.66 41.57 1bak h LEU 647 CO 0.06 -0.06 -0.35 -1.14 0.09 0.00 0.00 178.44 177.04 1bak n ARG 648 N -4.30 -0.22 -0.22 1.13 0.63 0.98 0.20 116.66 114.86 1bak n ARG 648 Ca -0.05 1.36 -0.06 0.00 -0.92 0.00 0.00 57.85 58.17 1bak n ARG 648 Cb 0.17 -2.02 0.04 0.00 0.45 0.00 0.00 32.46 31.10 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 0.78 -0.56 6.15 1.82 -1.59 0.83 116.42 123.85 1bak h ASP 649 Ca 0.30 -0.09 0.11 0.00 -0.39 0.00 0.00 57.03 56.96 1bak h ASP 649 Cb 0.52 -0.20 -0.09 0.00 0.68 0.00 0.00 39.33 40.24 1bak h ASP 649 CO -0.88 0.65 0.04 0.00 -1.61 0.00 0.00 179.24 177.44 1bak h ALA 650 N 1.16 0.58 -0.03 -0.78 0.00 0.37 1.50 119.26 122.07 1bak h ALA 650 Ca 0.22 0.15 -0.25 0.00 0.00 0.00 0.00 54.91 55.03 1bak h ALA 650 Cb 0.04 0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.09 1bak h ALA 650 CO -0.04 -0.36 -0.98 1.88 0.00 0.00 0.00 179.25 179.75 1bak h TYR 651 N 0.16 1.00 0.60 0.00 0.05 0.11 -2.83 116.97 116.06 1bak h TYR 651 Ca 0.29 -0.52 -0.03 0.00 0.05 0.00 0.00 58.73 58.52 1bak h TYR 651 Cb 0.44 -0.12 0.01 0.00 1.01 0.00 0.00 36.73 38.06 1bak h TYR 651 CO -0.30 1.36 -0.29 0.00 -1.05 0.00 0.00 178.16 177.88 1bak h ARG 652 N 0.41 -0.77 -0.63 4.88 3.08 0.18 -2.32 114.38 119.20 1bak h ARG 652 Ca -0.11 0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.11 1bak h ARG 652 Cb 1.63 0.18 -0.12 0.00 0.08 0.00 0.00 29.97 31.73 1bak h ARG 652 CO 0.19 -0.52 -0.31 0.93 -1.07 0.00 0.00 179.97 179.20 1bak h GLU 653 N -0.92 -0.12 -1.05 0.04 3.07 0.19 1.05 114.58 116.85 1bak h GLU 653 Ca -0.08 0.01 0.27 0.00 -0.50 0.00 0.00 59.36 59.06 1bak h GLU 653 Cb 0.62 0.03 -0.10 0.00 -0.84 0.00 0.00 28.75 28.46 1bak h GLU 653 CO 0.13 -0.08 0.68 0.00 -1.40 0.00 0.00 179.01 178.34 1bak h ALA 654 N 1.15 2.25 0.12 3.43 0.00 -1.50 1.08 119.26 125.80 1bak h ALA 654 Ca 0.26 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1bak h ALA 654 Cb 0.55 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1bak h ALA 654 CO -0.70 -0.67 -0.06 1.96 0.00 0.00 0.00 179.25 179.77 1bak h GLN 655 N 0.38 -0.16 -0.10 0.00 4.20 0.16 -0.11 115.11 119.47 1bak h GLN 655 Ca 0.61 0.01 0.03 0.00 0.06 0.00 0.00 58.65 59.36 1bak h GLN 655 Cb 1.56 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 29.37 1bak h GLN 655 CO -0.30 -0.11 0.45 -0.56 -0.67 0.00 0.00 178.83 177.64 1bak h GLN 656 N -0.36 0.00 0.00 1.46 3.07 -0.17 2.11 115.11 121.22 1bak h GLN 656 Ca -0.02 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.56 1bak h GLN 656 Cb 0.13 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.66 1bak h GLN 656 CO 0.03 0.00 -1.19 -0.07 0.09 0.00 0.00 178.83 177.69 1bak h LEU 657 N 0.00 0.00 -3.09 0.06 4.07 0.12 -3.29 115.31 113.18 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 0.95 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.69 1bak h LEU 657 CO -0.00 0.60 0.00 0.55 -1.08 0.00 0.00 178.44 178.51 1bak n VAL 658 N -3.00 1.68 0.10 1.22 3.14 0.60 -4.44 118.33 117.62 1bak n VAL 658 Ca -0.07 -1.40 -0.21 0.00 -2.96 0.00 0.00 64.34 59.70 1bak n VAL 658 Cb 0.83 0.13 -0.15 0.00 -1.06 0.00 0.00 33.84 33.58 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 2.26 0.39 -0.01 1.45 4.20 0.18 -3.22 115.11 120.37 1bak h GLN 659 Ca 0.00 -0.67 0.00 0.00 0.06 0.00 0.00 58.65 58.04 1bak h GLN 659 Cb 1.15 0.25 0.00 0.00 0.30 0.00 0.00 27.48 29.18 1bak h GLN 659 CO 0.13 1.30 0.00 -2.13 -0.67 0.00 0.00 178.83 177.46 1bak n ARG 660 N -3.59 1.03 -3.79 1.46 0.63 -1.26 -4.91 116.66 106.22 1bak n ARG 660 Ca -0.18 -0.04 -0.29 0.00 -0.92 0.00 0.00 57.85 56.42 1bak n ARG 660 Cb 1.07 -1.20 0.01 0.00 0.45 0.00 0.00 32.46 32.79 1bak n ARG 660 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 1bak n VAL 661 N -0.65 -2.69 -0.85 5.15 3.14 -1.22 -4.04 118.33 117.17 1bak n VAL 661 Ca 0.09 -0.17 -0.17 0.00 -2.96 0.00 0.00 64.34 61.13 1bak n VAL 661 Cb 0.05 -2.37 -0.09 0.00 -1.06 0.00 0.00 33.84 30.38 1bak n VAL 661 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1bak n PRO 662 N -3.13 2.02 0.06 1.45 -0.04 -1.26 -2.33 135.00 131.76 1bak n PRO 662 Ca -0.23 -1.16 0.00 0.00 -0.04 0.00 0.00 63.50 62.07 1bak n PRO 662 Cb 0.59 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 1bak n PRO 662 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1bak n LYS 663 N 3.13 0.00 -4.02 0.54 4.81 -1.26 -5.00 118.16 116.36 1bak n LYS 663 Ca 0.43 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.56 1bak n LYS 663 Cb 0.49 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 35.38 1bak n LYS 663 CO 0.00 0.00 0.00 1.41 1.17 0.00 0.00 177.40 179.98 1bak s MET 664 N -2.00 2.21 0.00 1.64 1.75 -1.17 -4.78 119.30 116.95 1bak s MET 664 Ca 0.00 -0.86 0.00 0.00 -1.25 0.00 0.00 55.69 53.58 1bak s MET 664 Cb 0.00 -2.44 0.00 0.00 2.84 0.00 0.00 34.83 35.23 1bak s MET 664 CO 0.00 -0.39 0.00 1.17 -0.65 0.00 0.00 175.02 175.15 1bak n LYS 665 N 4.66 0.00 0.00 4.11 3.00 -1.26 -4.78 118.16 123.89 1bak n LYS 665 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.15 1bak n LYS 665 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.50 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 2.80 0.00 -1.62 3.14 4.13 -0.98 -4.74 115.26 117.98 1bak n ASN 666 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1bak n ASN 666 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1bak n ASN 666 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 1bak n LYS 667 N 0.00 -3.44 -0.88 3.52 0.00 -1.26 -4.45 118.16 111.65 1bak n LYS 667 Ca 0.00 2.64 -0.21 0.00 0.00 0.00 0.00 58.31 60.75 1bak n LYS 667 Cb 0.00 -2.86 -0.07 0.00 0.00 0.00 0.00 35.03 32.10 1bak n LYS 667 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1bak n PRO 668 N 1.18 2.23 0.00 1.64 -0.04 -1.26 -4.92 135.00 133.84 1bak n PRO 668 Ca 0.00 -1.34 0.00 0.00 -0.04 0.00 0.00 63.50 62.12 1bak n PRO 668 Cb 0.00 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.17 1bak n PRO 668 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1bak n ARG 669 N 3.38 0.00 0.00 0.54 1.85 -1.26 -5.28 116.66 115.89 1bak n ARG 669 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.33 1bak n ARG 669 Cb 0.39 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.80 1bak n ARG 669 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07