#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1va2 s PRO 566 N 0.00 1.98 -0.40 -0.14 0.04 -1.26 -4.02 135.00 131.20 1va2 s PRO 566 Ca 0.00 -0.85 -0.10 0.00 0.04 0.00 0.00 61.00 60.10 1va2 s PRO 566 Cb 0.00 -5.13 0.06 0.00 0.04 0.00 0.00 34.50 29.46 1va2 s PRO 566 CO 0.00 -4.57 0.23 0.12 0.04 0.00 0.00 177.00 172.82 1va2 s PHE 567 N 13.38 3.30 -0.11 0.56 2.19 0.12 -4.95 117.98 132.47 1va2 s PHE 567 Ca 0.74 -1.33 -0.00 0.00 0.33 0.00 0.00 56.93 56.67 1va2 s PHE 567 Cb -0.03 -2.72 -0.02 0.00 -1.31 0.00 0.00 43.02 38.94 1va2 s PHE 567 CO 0.15 -0.77 -0.10 0.00 1.83 0.00 0.00 175.22 176.33 1va2 s MET 568 N 1.47 3.16 -0.01 10.12 0.23 -1.25 -0.86 119.30 132.15 1va2 s MET 568 Ca 0.02 -0.61 -0.35 0.00 -1.03 0.00 0.00 55.69 53.72 1va2 s MET 568 Cb -0.21 -2.65 -0.13 0.00 -1.53 0.00 0.00 34.83 30.30 1va2 s MET 568 CO 0.04 0.40 1.71 0.00 -2.03 0.00 0.00 175.02 175.13 1va2 n THR 570 N 4.23 2.96 -0.48 0.00 -2.24 -1.26 -4.77 114.28 112.73 1va2 n THR 570 Ca 0.21 -1.91 -0.29 0.00 -2.27 0.00 0.00 64.05 59.78 1va2 n THR 570 Cb 0.26 -0.99 0.27 0.00 -2.10 0.00 0.00 70.33 67.77 1va2 n THR 570 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1va2 s TRP 571 N -2.63 0.48 0.20 4.78 0.23 -1.26 -4.89 118.94 115.84 1va2 s TRP 571 Ca 0.45 0.89 -0.11 0.00 -2.03 0.00 0.00 56.10 55.29 1va2 s TRP 571 Cb 0.36 -3.01 0.23 0.00 0.03 0.00 0.00 33.47 31.09 1va2 s TRP 571 CO 0.03 -4.40 1.72 0.77 0.96 0.00 0.00 176.95 176.02 1va2 h SER 572 N -3.00 0.05 -0.40 2.95 0.02 -2.05 -3.39 113.55 107.72 1va2 h SER 572 Ca -0.54 0.09 -0.11 0.00 -0.84 0.00 0.00 61.79 60.39 1va2 h SER 572 Cb 1.34 0.12 -0.15 0.00 0.14 0.00 0.00 62.40 63.85 1va2 h SER 572 CO 0.41 0.05 -0.33 0.00 -1.14 0.00 0.00 176.83 175.82 1va2 n TYR 573 N -5.09 -2.44 -0.13 3.45 4.11 -1.26 -5.03 117.16 110.76 1va2 n TYR 573 Ca 0.07 -1.18 -0.28 0.00 -0.00 0.00 0.00 57.90 56.52 1va2 n TYR 573 Cb 0.27 1.35 -0.10 0.00 -0.00 0.00 0.00 39.34 40.85 1va2 n TYR 573 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1va2 n GLY 575 N 1.30 0.23 3.11 0.00 0.00 -1.26 -5.06 105.19 103.50 1va2 n GLY 575 Ca -0.49 -0.22 -0.08 0.00 0.00 0.00 0.00 46.02 45.22 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 -4.12 0.34 0.25 1.61 2.20 -1.26 -5.15 119.74 113.61 1va2 s LYS 576 Ca 0.04 0.82 -0.03 0.00 -0.36 0.00 0.00 55.97 56.44 1va2 s LYS 576 Cb -0.01 -0.00 -0.05 0.00 -1.51 0.00 0.00 37.83 36.26 1va2 s LYS 576 CO 0.22 -0.43 0.48 1.03 -0.36 0.00 0.00 175.35 176.29 1va2 s ARG 577 N 2.59 3.57 0.11 4.03 0.52 -1.26 -3.17 118.95 125.35 1va2 s ARG 577 Ca 0.05 -0.17 -0.01 0.00 -0.52 0.00 0.00 55.73 55.08 1va2 s ARG 577 Cb -0.14 -2.73 -0.04 0.00 0.52 0.00 0.00 34.95 32.56 1va2 s ARG 577 CO -0.14 0.29 0.03 -0.06 0.02 0.00 0.00 175.30 175.44 1va2 s PHE 578 N -2.01 0.80 -1.10 -0.53 0.08 -0.04 -4.92 117.98 110.26 1va2 s PHE 578 Ca 0.41 -1.18 0.16 0.00 0.12 0.00 0.00 56.93 56.44 1va2 s PHE 578 Cb -0.11 -0.47 -0.09 0.00 -0.57 0.00 0.00 43.02 41.78 1va2 s PHE 578 CO 0.30 -0.46 0.76 2.41 -0.10 0.00 0.00 175.22 178.12 1va2 n THR 579 N -0.05 0.00 -4.17 0.64 -1.04 -1.25 0.15 114.28 108.56 1va2 n THR 579 Ca -0.08 -0.23 -0.17 0.00 -2.04 0.00 0.00 64.05 61.53 1va2 n THR 579 Cb 0.63 1.09 -0.15 0.00 -1.82 0.00 0.00 70.33 70.08 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 -2.20 0.53 0.39 -2.82 1.81 -1.26 -4.18 118.95 111.23 1va2 s ARG 580 Ca 0.10 -0.16 0.06 0.00 -1.72 0.00 0.00 55.73 54.01 1va2 s ARG 580 Cb 0.12 -0.53 0.80 0.00 -0.45 0.00 0.00 34.95 34.89 1va2 s ARG 580 CO 0.53 0.06 2.02 0.66 -0.68 0.00 0.00 175.30 177.89 1va2 h SER 581 N 6.34 0.48 -0.97 0.23 4.64 -1.89 -2.13 113.55 120.24 1va2 h SER 581 Ca -0.32 -0.03 0.13 0.00 -0.47 0.00 0.00 61.79 61.11 1va2 h SER 581 Cb 1.18 -0.12 -0.08 0.00 -0.31 0.00 0.00 62.40 63.06 1va2 h SER 581 CO 0.49 0.39 0.62 0.44 -0.87 0.00 0.00 176.83 177.90 1va2 h ASP 582 N 0.55 0.85 0.18 4.97 5.19 -1.99 -2.08 116.42 124.09 1va2 h ASP 582 Ca 0.14 0.05 0.01 0.00 -0.62 0.00 0.00 57.03 56.62 1va2 h ASP 582 Cb 0.02 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 39.38 1va2 h ASP 582 CO -0.02 0.43 -0.30 -0.08 -3.12 0.00 0.00 179.24 176.15 1va2 h GLU 583 N 0.90 -0.54 -0.82 3.56 4.57 -1.80 -1.73 114.58 118.72 1va2 h GLU 583 Ca 0.49 0.04 0.14 0.00 -1.18 0.00 0.00 59.36 58.85 1va2 h GLU 583 Cb 0.58 0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.24 1va2 h GLU 583 CO -0.26 -0.36 0.54 -0.07 -1.18 0.00 0.00 179.01 177.68 1va2 h LEU 584 N -0.56 0.53 0.62 1.64 4.07 -1.47 2.13 115.31 122.26 1va2 h LEU 584 Ca 0.02 0.03 -0.03 0.00 0.08 0.00 0.00 57.88 57.98 1va2 h LEU 584 Cb 0.56 -0.07 0.01 0.00 1.08 0.00 0.00 40.66 42.23 1va2 h LEU 584 CO -0.14 0.27 -0.30 1.56 -1.08 0.00 0.00 178.44 178.76 1va2 h GLN 585 N 0.56 -0.80 -0.11 1.13 1.08 -0.95 -2.19 115.11 113.84 1va2 h GLN 585 Ca 0.41 0.05 -0.18 0.00 -1.45 0.00 0.00 58.65 57.48 1va2 h GLN 585 Cb 0.77 0.18 0.01 0.00 -0.05 0.00 0.00 27.48 28.39 1va2 h GLN 585 CO -0.16 -0.50 -0.62 0.00 -0.95 0.00 0.00 178.83 176.60 1va2 h ARG 586 N -0.94 0.61 -0.53 1.46 3.08 -0.62 -3.25 114.38 114.19 1va2 h ARG 586 Ca -0.08 -0.51 0.07 0.00 0.07 0.00 0.00 59.98 59.52 1va2 h ARG 586 Cb 0.67 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 1va2 h ARG 586 CO 0.14 1.13 0.35 1.25 -1.07 0.00 0.00 179.97 181.77 1va2 h HIS 587 N 0.24 0.43 -0.49 3.04 -0.00 0.34 0.21 115.15 118.92 1va2 h HIS 587 Ca -0.05 0.01 0.14 0.00 -0.00 0.00 0.00 60.37 60.48 1va2 h HIS 587 Cb 1.27 -0.14 -0.02 0.00 -0.00 0.00 0.00 27.41 28.51 1va2 h HIS 587 CO 0.11 0.23 0.44 1.57 -0.00 0.00 0.00 177.93 180.28 1va2 h LYS 588 N 0.43 0.00 -1.45 5.26 2.10 -1.42 -1.08 116.57 120.41 1va2 h LYS 588 Ca 0.23 0.00 0.42 0.00 -2.00 0.00 0.00 60.65 59.31 1va2 h LYS 588 Cb 0.37 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.63 1va2 h LYS 588 CO -0.06 0.00 1.02 0.07 -2.00 0.00 0.00 179.45 178.48 1va2 h ARG 589 N 0.00 0.04 -0.75 0.07 -0.00 -0.73 1.24 114.38 114.24 1va2 h ARG 589 Ca 0.23 -0.00 -0.47 0.00 -0.00 0.00 0.00 59.98 59.74 1va2 h ARG 589 Cb 1.12 -0.01 -0.26 0.00 -0.00 0.00 0.00 29.97 30.82 1va2 h ARG 589 CO -0.00 0.03 0.20 -2.37 -0.00 0.00 0.00 179.97 177.82 1va2 n THR 590 N -4.19 3.00 0.00 0.08 5.66 -0.41 -4.66 114.28 113.76 1va2 n THR 590 Ca 0.33 -2.94 -0.00 0.00 -3.05 0.00 0.00 64.05 58.39 1va2 n THR 590 Cb 1.49 -0.76 -0.00 0.00 -1.55 0.00 0.00 70.33 69.51 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 -0.99 0.00 -4.08 1.09 -0.00 0.42 -5.12 115.22 106.55 1va2 n HIS 591 Ca 0.49 0.00 -0.08 0.00 0.46 0.00 0.00 57.72 58.60 1va2 n HIS 591 Cb 1.04 -0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.81 1va2 n HIS 591 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1va2 s THR 592 N -1.01 0.25 0.00 3.57 -4.23 -1.22 -5.12 115.64 107.89 1va2 s THR 592 Ca -0.00 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1va2 s THR 592 Cb 0.00 -1.29 0.00 0.00 1.34 0.00 0.00 72.50 72.55 1va2 s THR 592 CO 0.00 -0.89 0.00 0.61 -0.54 0.00 0.00 174.62 173.80 1va2 n GLY 593 N 0.39 -1.81 0.14 3.99 0.00 -1.26 -4.79 105.19 101.85 1va2 n GLY 593 Ca -0.16 -2.03 -0.12 0.00 0.00 0.00 0.00 46.02 43.72 1va2 n GLY 593 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1va2 n GLU 594 N 0.00 0.38 0.00 1.61 -0.58 -1.26 -5.12 120.64 115.67 1va2 n GLU 594 Ca 0.00 0.10 0.16 0.00 -0.42 0.00 0.00 57.16 57.00 1va2 n GLU 594 Cb 0.00 -1.27 0.91 0.00 -0.57 0.00 0.00 31.44 30.51 1va2 n GLU 594 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82