#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 2.66 0.18 -0.14 0.04 -1.26 -2.92 135.00 133.55 1va2 s PRO 566 Ca 0.00 -0.02 0.06 0.00 0.04 0.00 0.00 61.00 61.07 1va2 s PRO 566 Cb 0.00 -4.81 -0.04 0.00 0.04 0.00 0.00 34.50 29.69 1va2 s PRO 566 CO 0.00 -3.04 0.13 0.12 0.04 0.00 0.00 177.00 174.24 1va2 s PHE 567 N 9.29 3.11 -0.29 0.56 2.19 -0.12 -4.99 117.98 127.74 1va2 s PHE 567 Ca 0.66 -0.04 -0.00 0.00 0.33 0.00 0.00 56.93 57.88 1va2 s PHE 567 Cb -0.08 -1.48 0.14 0.00 -1.31 0.00 0.00 43.02 40.28 1va2 s PHE 567 CO 0.07 0.52 0.30 1.41 1.83 0.00 0.00 175.22 179.35 1va2 s MET 568 N -3.17 0.32 -1.01 10.12 -2.45 -1.26 0.13 119.30 121.98 1va2 s MET 568 Ca 0.31 -0.11 -0.24 0.00 -1.25 0.00 0.00 55.69 54.41 1va2 s MET 568 Cb -0.10 -0.66 -0.04 0.00 1.25 0.00 0.00 34.83 35.28 1va2 s MET 568 CO 0.23 -1.01 1.88 0.00 1.05 0.00 0.00 175.02 177.17 1va2 h THR 570 N 6.84 0.90 -0.05 0.00 2.02 -1.93 -3.02 112.91 117.68 1va2 h THR 570 Ca 0.16 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.70 1va2 h THR 570 Cb 0.98 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 69.39 1va2 h THR 570 CO 1.25 0.39 0.00 0.79 0.37 0.00 0.00 175.52 178.32 1va2 n TRP 571 N -3.50 -0.42 0.22 3.16 5.03 -1.26 -0.84 117.44 119.84 1va2 n TRP 571 Ca -0.00 0.00 0.09 0.00 3.03 0.00 0.00 57.50 60.62 1va2 n TRP 571 Cb 0.54 0.01 0.47 0.00 -1.03 0.00 0.00 31.31 31.30 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 0.00 0.00 0.00 -0.99 0.02 -2.04 -3.39 113.55 107.15 1va2 h SER 572 Ca 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1va2 h SER 572 Cb 0.00 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 1va2 h SER 572 CO 0.00 0.25 -0.07 0.00 -1.14 0.00 0.00 176.83 175.87 1va2 n TYR 573 N -3.49 -0.91 -0.11 3.45 9.36 -1.20 -5.02 117.16 119.25 1va2 n TYR 573 Ca -0.00 -0.82 -0.23 0.00 3.32 0.00 0.00 57.90 60.17 1va2 n TYR 573 Cb 0.42 1.07 -0.11 0.00 -0.63 0.00 0.00 39.34 40.09 1va2 n TYR 573 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1va2 n GLY 575 N 1.40 1.54 3.83 0.00 0.00 -1.04 -4.94 105.19 105.98 1va2 n GLY 575 Ca -0.36 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.53 4.12 -0.03 1.61 2.20 -1.14 -4.95 119.74 118.01 1va2 s LYS 576 Ca 0.00 0.68 0.04 0.00 -0.36 0.00 0.00 55.97 56.33 1va2 s LYS 576 Cb 0.00 -2.91 -0.03 0.00 -1.51 0.00 0.00 37.83 33.38 1va2 s LYS 576 CO 0.00 0.44 -0.15 1.03 -0.36 0.00 0.00 175.35 176.31 1va2 s ARG 577 N -1.95 2.42 0.20 4.03 0.52 -1.26 -1.51 118.95 121.41 1va2 s ARG 577 Ca 0.40 -0.75 0.04 0.00 -0.52 0.00 0.00 55.73 54.89 1va2 s ARG 577 Cb -0.16 -2.34 -0.05 0.00 0.52 0.00 0.00 34.95 32.92 1va2 s ARG 577 CO 0.20 0.61 -0.03 -0.06 0.02 0.00 0.00 175.30 176.04 1va2 s PHE 578 N -0.78 1.46 -1.02 -0.53 0.08 0.35 -4.94 117.98 112.60 1va2 s PHE 578 Ca 0.12 -0.88 0.13 0.00 0.12 0.00 0.00 56.93 56.42 1va2 s PHE 578 Cb -0.11 -0.82 -0.04 0.00 -0.57 0.00 0.00 43.02 41.48 1va2 s PHE 578 CO 0.02 -0.01 0.68 2.41 -0.10 0.00 0.00 175.22 178.21 1va2 n THR 579 N -0.35 0.00 -4.25 0.64 -1.04 -1.26 -0.94 114.28 107.08 1va2 n THR 579 Ca -0.07 -0.32 -0.17 0.00 -2.04 0.00 0.00 64.05 61.45 1va2 n THR 579 Cb 0.63 1.11 -0.14 0.00 -1.82 0.00 0.00 70.33 70.11 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 -1.77 0.67 0.14 -2.82 1.81 -1.15 -3.94 118.95 111.88 1va2 s ARG 580 Ca 0.09 -0.50 -0.15 0.00 -1.72 0.00 0.00 55.73 53.45 1va2 s ARG 580 Cb 0.10 -0.61 0.00 0.00 -0.45 0.00 0.00 34.95 34.00 1va2 s ARG 580 CO 0.38 0.15 1.64 0.77 -0.68 0.00 0.00 175.30 177.56 1va2 h SER 581 N 5.37 0.66 -0.82 0.23 0.02 -1.94 -2.77 113.55 114.30 1va2 h SER 581 Ca -0.33 -0.23 0.19 0.00 -0.84 0.00 0.00 61.79 60.57 1va2 h SER 581 Cb 1.19 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 63.50 1va2 h SER 581 CO 0.46 0.72 0.55 -0.78 -1.14 0.00 0.00 176.83 176.64 1va2 h ASP 582 N 0.57 0.33 0.23 3.07 1.82 -1.97 -2.34 116.42 118.14 1va2 h ASP 582 Ca 0.14 0.03 0.01 0.00 -0.39 0.00 0.00 57.03 56.81 1va2 h ASP 582 Cb 0.31 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.26 1va2 h ASP 582 CO 0.00 0.15 -0.33 -0.08 -1.61 0.00 0.00 179.24 177.37 1va2 h GLU 583 N 0.34 -0.61 -0.26 0.28 4.81 -1.92 -1.57 114.58 115.65 1va2 h GLU 583 Ca 0.41 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.66 1va2 h GLU 583 Cb 1.09 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 1va2 h GLU 583 CO -0.13 -0.41 0.04 1.37 -0.73 0.00 0.00 179.01 179.16 1va2 h LEU 584 N -0.63 0.35 0.58 1.64 -0.00 -1.53 0.95 115.31 116.66 1va2 h LEU 584 Ca 0.00 -0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 57.82 1va2 h LEU 584 Cb 0.61 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 41.18 1va2 h LEU 584 CO -0.13 0.38 -0.34 1.56 -0.00 0.00 0.00 178.44 179.92 1va2 h GLN 585 N 0.38 -0.83 -0.09 0.17 4.20 -1.12 0.55 115.11 118.37 1va2 h GLN 585 Ca 0.09 0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.74 1va2 h GLN 585 Cb 0.19 0.19 0.01 0.00 0.30 0.00 0.00 27.48 28.17 1va2 h GLN 585 CO 0.00 -0.55 -0.41 0.07 -0.67 0.00 0.00 178.83 177.27 1va2 h ARG 586 N -0.86 0.43 0.20 1.46 0.11 -1.08 -2.11 114.38 112.53 1va2 h ARG 586 Ca -0.07 -0.35 -0.01 0.00 0.10 0.00 0.00 59.98 59.65 1va2 h ARG 586 Cb 0.69 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.84 1va2 h ARG 586 CO 0.08 0.98 -0.10 1.25 0.10 0.00 0.00 179.97 182.29 1va2 h HIS 587 N -0.02 -0.26 -0.50 4.08 -0.00 0.94 -0.73 115.15 118.66 1va2 h HIS 587 Ca -0.03 -0.01 0.10 0.00 -0.00 0.00 0.00 60.37 60.44 1va2 h HIS 587 Cb 1.05 0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 28.52 1va2 h HIS 587 CO 0.12 -0.15 0.34 1.57 -0.00 0.00 0.00 177.93 179.82 1va2 h LYS 588 N -0.29 0.23 -0.70 5.26 2.10 0.02 0.15 116.57 123.33 1va2 h LYS 588 Ca -0.03 -0.01 0.20 0.00 -2.00 0.00 0.00 60.65 58.81 1va2 h LYS 588 Cb 0.22 -0.05 -0.03 0.00 -0.90 0.00 0.00 32.23 31.47 1va2 h LYS 588 CO 0.05 0.15 0.51 -0.09 -2.00 0.00 0.00 179.45 178.06 1va2 h ARG 589 N 0.23 0.00 -0.18 0.07 9.65 -0.41 0.75 114.38 124.50 1va2 h ARG 589 Ca 0.23 -0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 59.02 1va2 h ARG 589 Cb 0.61 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.13 1va2 h ARG 589 CO -0.04 0.00 -0.28 0.25 2.80 0.00 0.00 179.97 182.70 1va2 n THR 590 N -4.33 2.38 -3.13 0.20 -2.24 0.50 -5.01 114.28 102.66 1va2 n THR 590 Ca 0.14 -2.97 -0.40 0.00 -2.27 0.00 0.00 64.05 58.55 1va2 n THR 590 Cb 0.77 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.66 1va2 n THR 590 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1va2 s HIS 591 N -3.23 3.37 0.00 4.78 2.46 0.25 -4.95 115.29 117.97 1va2 s HIS 591 Ca 0.41 0.91 0.00 0.00 0.47 0.00 0.00 55.06 56.86 1va2 s HIS 591 Cb 0.39 -2.79 0.00 0.00 -0.13 0.00 0.00 32.58 30.05 1va2 s HIS 591 CO -0.03 -0.17 0.00 -2.37 -2.47 0.00 0.00 174.74 169.70 1va2 n THR 592 N 4.68 0.00 -2.65 0.89 5.66 -1.26 -3.72 114.28 117.88 1va2 n THR 592 Ca -0.02 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.56 1va2 n THR 592 Cb 0.50 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.29 1va2 n THR 592 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1va2 n GLY 593 N 0.00 5.25 3.45 1.09 0.00 -1.26 -4.97 105.19 108.74 1va2 n GLY 593 Ca 0.00 -2.43 -0.23 0.00 0.00 0.00 0.00 46.02 43.36 1va2 n GLY 593 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1va2 s GLU 594 N -2.04 1.61 0.00 1.61 2.12 -1.24 -5.26 118.70 115.49 1va2 s GLU 594 Ca 0.37 -1.74 0.00 0.00 0.36 0.00 0.00 54.97 53.96 1va2 s GLU 594 Cb 0.10 -1.62 0.00 0.00 0.26 0.00 0.00 34.13 32.87 1va2 s GLU 594 CO 0.02 0.28 0.00 1.63 -0.54 0.00 0.00 175.26 176.65