#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1va2 n PRO 566 N 0.00 1.88 -3.73 5.56 -0.04 -1.26 -4.70 135.00 132.72 1va2 n PRO 566 Ca 0.00 -1.06 -0.30 0.00 -0.04 0.00 0.00 63.50 62.10 1va2 n PRO 566 Cb 0.00 -1.84 -0.13 0.00 -0.04 0.00 0.00 33.50 31.49 1va2 n PRO 566 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1va2 s PHE 567 N 0.29 2.03 -0.03 0.54 0.08 -1.25 -5.02 117.98 114.63 1va2 s PHE 567 Ca 0.53 -2.40 0.01 0.00 0.12 0.00 0.00 56.93 55.18 1va2 s PHE 567 Cb 0.27 -1.93 0.02 0.00 -0.57 0.00 0.00 43.02 40.81 1va2 s PHE 567 CO -0.03 -0.79 -0.03 0.00 -0.10 0.00 0.00 175.22 174.26 1va2 s MET 568 N 0.45 0.52 0.25 0.44 0.23 -1.26 0.13 119.30 120.05 1va2 s MET 568 Ca 0.17 -0.07 -0.31 0.00 -1.03 0.00 0.00 55.69 54.45 1va2 s MET 568 Cb -0.24 -0.57 -0.11 0.00 -1.53 0.00 0.00 34.83 32.38 1va2 s MET 568 CO -0.02 -0.04 1.61 0.00 -2.03 0.00 0.00 175.02 174.55 1va2 n THR 570 N 2.97 2.38 -1.08 0.00 -2.24 -1.26 -4.90 114.28 110.15 1va2 n THR 570 Ca 0.11 -1.09 -0.21 0.00 -2.27 0.00 0.00 64.05 60.59 1va2 n THR 570 Cb 0.37 -1.38 0.17 0.00 -2.10 0.00 0.00 70.33 67.39 1va2 n THR 570 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1va2 n TRP 571 N 0.83 -3.72 0.01 4.78 5.03 -1.26 -5.00 117.44 118.11 1va2 n TRP 571 Ca 0.16 -0.73 -0.14 0.00 3.03 0.00 0.00 57.50 59.82 1va2 n TRP 571 Cb 0.56 -0.78 -0.14 0.00 -1.03 0.00 0.00 31.31 29.91 1va2 n TRP 571 CO 0.00 0.00 0.00 0.77 -0.03 0.00 0.00 177.69 178.43 1va2 h SER 572 N -1.97 0.22 -0.17 -0.99 0.02 -2.01 -3.43 113.55 105.22 1va2 h SER 572 Ca -0.29 -0.42 -0.25 0.00 -0.84 0.00 0.00 61.79 59.99 1va2 h SER 572 Cb 0.87 -0.07 -0.18 0.00 0.14 0.00 0.00 62.40 63.16 1va2 h SER 572 CO 0.20 1.37 -0.49 0.00 -1.14 0.00 0.00 176.83 176.77 1va2 n TYR 573 N -3.29 -2.10 -0.00 3.45 4.19 -1.26 -4.97 117.16 113.18 1va2 n TYR 573 Ca -0.20 -2.12 -0.21 0.00 3.31 0.00 0.00 57.90 58.67 1va2 n TYR 573 Cb 1.04 1.34 -0.14 0.00 0.49 0.00 0.00 39.34 42.08 1va2 n TYR 573 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1va2 n GLY 575 N 1.73 -0.69 2.84 0.00 0.00 -1.26 -5.01 105.19 102.80 1va2 n GLY 575 Ca -0.25 0.32 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 1va2 n GLY 575 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1va2 s LYS 576 N -5.36 0.14 0.51 1.61 2.20 -1.26 -5.15 119.74 112.43 1va2 s LYS 576 Ca 0.22 0.44 -0.03 0.00 -0.36 0.00 0.00 55.97 56.24 1va2 s LYS 576 Cb -0.05 -0.66 -0.01 0.00 -1.51 0.00 0.00 37.83 35.60 1va2 s LYS 576 CO 0.78 -0.47 0.78 1.03 -0.36 0.00 0.00 175.35 177.11 1va2 s ARG 577 N 2.34 3.11 0.11 4.03 0.52 -1.26 -3.84 118.95 123.96 1va2 s ARG 577 Ca 0.04 -0.17 -0.01 0.00 -0.52 0.00 0.00 55.73 55.08 1va2 s ARG 577 Cb -0.14 -2.42 -0.04 0.00 0.52 0.00 0.00 34.95 32.88 1va2 s ARG 577 CO -0.10 -0.41 0.03 -0.06 0.02 0.00 0.00 175.30 174.78 1va2 s PHE 578 N -2.75 0.79 -0.61 -0.53 0.40 0.34 -4.97 117.98 110.65 1va2 s PHE 578 Ca 0.50 -1.17 0.12 0.00 -0.60 0.00 0.00 56.93 55.78 1va2 s PHE 578 Cb -0.10 -0.47 -0.13 0.00 0.51 0.00 0.00 43.02 42.83 1va2 s PHE 578 CO 0.42 -0.46 0.54 2.41 0.70 0.00 0.00 175.22 178.83 1va2 n THR 579 N -0.05 0.00 -3.78 0.64 -1.04 -1.26 -3.91 114.28 104.88 1va2 n THR 579 Ca -0.08 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.05 61.59 1va2 n THR 579 Cb 0.63 1.01 -0.12 0.00 -1.82 0.00 0.00 70.33 70.02 1va2 n THR 579 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1va2 s ARG 580 N -2.14 0.23 0.52 -2.82 1.81 -1.26 -4.95 118.95 110.34 1va2 s ARG 580 Ca 0.05 0.36 0.21 0.00 -1.72 0.00 0.00 55.73 54.63 1va2 s ARG 580 Cb 0.09 0.05 1.32 0.00 -0.45 0.00 0.00 34.95 35.97 1va2 s ARG 580 CO 0.50 -0.07 2.06 0.77 -0.68 0.00 0.00 175.30 177.88 1va2 h SER 581 N 6.21 0.02 -0.97 0.23 0.02 -1.93 -1.60 113.55 115.53 1va2 h SER 581 Ca -0.30 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.74 1va2 h SER 581 Cb 1.18 -0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.64 1va2 h SER 581 CO 0.38 0.01 0.61 0.44 -1.14 0.00 0.00 176.83 177.13 1va2 h ASP 582 N 0.02 0.93 0.02 3.07 3.32 -2.00 -2.47 116.42 119.31 1va2 h ASP 582 Ca 0.15 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.26 1va2 h ASP 582 Cb 0.57 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.92 1va2 h ASP 582 CO -0.01 0.55 -0.20 -0.08 -1.72 0.00 0.00 179.24 177.78 1va2 h GLU 583 N 1.04 -0.33 -0.72 3.56 4.57 -1.71 -0.92 114.58 120.07 1va2 h GLU 583 Ca 0.45 0.02 0.16 0.00 -1.18 0.00 0.00 59.36 58.81 1va2 h GLU 583 Cb 0.32 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 1va2 h GLU 583 CO -0.22 -0.22 0.49 -0.07 -1.18 0.00 0.00 179.01 177.82 1va2 h LEU 584 N -0.34 0.27 0.43 1.64 3.38 -1.55 2.22 115.31 121.36 1va2 h LEU 584 Ca 0.05 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1va2 h LEU 584 Cb 0.41 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1va2 h LEU 584 CO -0.18 0.14 -0.21 1.56 0.09 0.00 0.00 178.44 179.84 1va2 h GLN 585 N 0.28 -0.56 -0.19 1.13 1.08 -0.98 0.74 115.11 116.63 1va2 h GLN 585 Ca 0.35 0.04 -0.20 0.00 -1.45 0.00 0.00 58.65 57.40 1va2 h GLN 585 Cb 0.98 0.13 0.01 0.00 -0.05 0.00 0.00 27.48 28.54 1va2 h GLN 585 CO -0.09 -0.26 -0.65 0.07 -0.95 0.00 0.00 178.83 176.95 1va2 h ARG 586 N -0.83 0.77 -0.32 1.46 0.11 -0.44 -0.72 114.38 114.41 1va2 h ARG 586 Ca -0.06 -0.58 -0.03 0.00 0.10 0.00 0.00 59.98 59.41 1va2 h ARG 586 Cb 0.55 0.11 -0.01 0.00 1.11 0.00 0.00 29.97 31.73 1va2 h ARG 586 CO 0.10 1.20 0.07 1.25 0.10 0.00 0.00 179.97 182.68 1va2 h HIS 587 N 0.50 0.55 -0.12 4.08 -0.00 0.36 -2.14 115.15 118.38 1va2 h HIS 587 Ca -0.03 -0.07 -0.07 0.00 -0.00 0.00 0.00 60.37 60.20 1va2 h HIS 587 Cb 1.28 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 28.52 1va2 h HIS 587 CO 0.09 0.58 -0.26 1.57 -0.00 0.00 0.00 177.93 179.91 1va2 h LYS 588 N 0.36 0.22 -1.22 5.26 2.10 -0.90 -2.56 116.57 119.84 1va2 h LYS 588 Ca 0.10 -0.07 0.35 0.00 -2.00 0.00 0.00 60.65 59.03 1va2 h LYS 588 Cb 0.32 -0.02 -0.05 0.00 -0.90 0.00 0.00 32.23 31.58 1va2 h LYS 588 CO 0.00 0.47 0.94 -0.09 -2.00 0.00 0.00 179.45 178.78 1va2 h ARG 589 N 0.20 0.00 -0.89 0.07 9.65 -0.42 0.11 114.38 123.10 1va2 h ARG 589 Ca 0.03 0.00 -0.43 0.00 -1.10 0.00 0.00 59.98 58.48 1va2 h ARG 589 Cb 0.57 0.00 -0.41 0.00 -1.39 0.00 0.00 29.97 28.74 1va2 h ARG 589 CO 0.04 0.00 -0.97 -2.37 2.80 0.00 0.00 179.97 179.47 1va2 n THR 590 N -3.99 1.79 -1.64 0.20 5.66 -0.97 -4.66 114.28 110.67 1va2 n THR 590 Ca 0.26 -3.75 -0.02 0.00 -3.05 0.00 0.00 64.05 57.49 1va2 n THR 590 Cb 1.33 -0.07 -0.02 0.00 -1.55 0.00 0.00 70.33 70.02 1va2 n THR 590 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 1va2 n HIS 591 N -0.48 0.00 -0.05 1.09 -0.00 0.29 -4.98 115.22 111.09 1va2 n HIS 591 Ca 0.25 -0.16 -0.06 0.00 -0.00 0.00 0.00 57.72 57.75 1va2 n HIS 591 Cb 0.82 0.32 -0.09 0.00 -0.00 0.00 0.00 29.99 31.04 1va2 n HIS 591 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 1va2 n THR 592 N 0.00 0.75 0.00 3.57 -1.04 -0.75 -4.88 114.28 111.94 1va2 n THR 592 Ca -0.09 -0.46 0.00 0.00 -2.04 0.00 0.00 64.05 61.47 1va2 n THR 592 Cb 0.38 -0.72 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 1va2 n THR 592 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1va2 n GLY 593 N 2.35 2.74 1.55 3.41 0.00 -1.26 -4.76 105.19 109.22 1va2 n GLY 593 Ca -0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.84 1va2 n GLY 593 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1va2 n GLU 594 N -0.49 0.26 -0.51 1.61 0.28 -1.26 -5.21 120.64 115.31 1va2 n GLU 594 Ca 0.00 -1.80 0.00 0.00 -0.16 0.00 0.00 57.16 55.20 1va2 n GLU 594 Cb 0.00 0.02 0.00 0.00 1.43 0.00 0.00 31.44 32.89 1va2 n GLU 594 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60