#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1psb n ARG 63 N 0.00 2.42 -2.42 1.64 5.12 -1.26 -5.00 116.66 117.16 1psb n ARG 63 Ca 0.00 -3.89 -0.38 0.00 -1.93 0.00 0.00 57.85 51.65 1psb n ARG 63 Cb 0.00 -1.81 -0.02 0.00 -1.16 0.00 0.00 32.46 29.47 1psb n ARG 63 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1psb s LEU 64 N -3.43 3.59 0.00 0.55 1.43 -1.26 -4.12 118.68 115.44 1psb s LEU 64 Ca 0.38 -2.18 0.00 0.00 -1.03 0.00 0.00 54.13 51.30 1psb s LEU 64 Cb 0.41 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1psb s LEU 64 CO -0.06 -1.77 0.00 -1.14 0.23 0.00 0.00 176.35 173.61 1psb n ARG 65 N 8.38 0.00 -0.04 1.70 0.00 -1.26 -4.65 116.66 120.79 1psb n ARG 65 Ca 0.47 0.00 0.24 0.00 -0.00 0.00 0.00 57.85 58.56 1psb n ARG 65 Cb 0.46 0.00 0.66 0.00 0.00 0.00 0.00 32.46 33.58 1psb n ARG 65 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1psb h ARG 66 N 0.00 0.00 -5.04 -0.14 2.43 -1.99 -3.39 114.38 106.25 1psb h ARG 66 Ca 0.00 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.91 1psb h ARG 66 Cb 0.00 0.00 0.07 0.00 -0.42 0.00 0.00 29.97 29.62 1psb h ARG 66 CO 0.00 0.00 0.66 0.43 -1.51 0.00 0.00 179.97 179.55 1psb n SER 67 N -3.61 0.98 0.00 -3.80 7.64 -1.26 -4.82 113.62 108.75 1psb n SER 67 Ca 0.14 -2.39 0.00 0.00 1.01 0.00 0.00 58.87 57.63 1psb n SER 67 Cb 0.95 -1.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1psb n SER 67 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1psb n ALA 68 N 14.08 0.00 -1.59 -0.43 0.00 -1.26 -0.56 120.51 130.75 1psb n ALA 68 Ca 0.41 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.91 1psb n ALA 68 Cb 0.44 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.05 1psb n ALA 68 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1psb n HIS 69 N 7.16 0.00 -0.19 0.00 -0.00 -1.26 -4.64 115.22 116.29 1psb n HIS 69 Ca 0.00 -1.17 -0.10 0.00 0.46 0.00 0.00 57.72 56.91 1psb n HIS 69 Cb 0.00 -0.20 0.01 0.00 -0.12 0.00 0.00 29.99 29.68 1psb n HIS 69 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1psb h ALA 70 N 0.68 0.74 -6.24 1.57 0.00 -1.16 -3.46 119.26 111.39 1psb h ALA 70 Ca -0.03 -0.31 -0.47 0.00 0.00 0.00 0.00 54.91 54.10 1psb h ALA 70 Cb 1.13 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1psb h ALA 70 CO 0.01 0.58 -0.75 -2.13 0.00 0.00 0.00 179.25 176.97 1psb n ARG 71 N -4.24 -5.77 -0.32 0.00 3.00 -1.22 -4.83 116.66 103.29 1psb n ARG 71 Ca 0.02 0.62 0.20 0.00 -0.00 0.00 0.00 57.85 58.68 1psb n ARG 71 Cb 0.35 -5.53 0.40 0.00 0.00 0.00 0.00 32.46 27.67 1psb n ARG 71 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 1psb h LYS 72 N -2.14 0.19 -1.00 -0.14 1.63 -1.86 0.46 116.57 113.70 1psb h LYS 72 Ca -0.58 -0.01 0.23 0.00 -0.85 0.00 0.00 60.65 59.44 1psb h LYS 72 Cb 1.38 -0.04 -0.10 0.00 -0.60 0.00 0.00 32.23 32.87 1psb h LYS 72 CO 0.66 0.13 0.63 0.93 -3.45 0.00 0.00 179.45 178.35 1psb h GLU 73 N 0.20 0.52 0.00 1.90 5.08 -1.88 0.08 114.58 120.46 1psb h GLU 73 Ca 0.66 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.99 1psb h GLU 73 Cb 1.49 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1psb h GLU 73 CO -0.69 0.34 0.00 0.25 -1.00 0.00 0.00 179.01 177.91 1psb n THR 74 N -4.67 0.54 -0.25 1.13 -2.24 0.15 -4.15 114.28 104.79 1psb n THR 74 Ca 0.24 -0.11 0.06 0.00 -2.27 0.00 0.00 64.05 61.96 1psb n THR 74 Cb 0.73 -0.69 0.18 0.00 -2.10 0.00 0.00 70.33 68.45 1psb n THR 74 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1psb h GLU 75 N 0.00 0.21 0.00 -0.78 4.57 -1.08 0.16 114.58 117.65 1psb h GLU 75 Ca 0.00 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1psb h GLU 75 Cb 0.60 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1psb h GLU 75 CO 0.00 0.14 -0.02 0.74 -1.18 0.00 0.00 179.01 178.68 1psb h PHE 76 N 0.21 0.00 -0.68 0.92 0.04 -1.78 -3.36 116.94 112.30 1psb h PHE 76 Ca 0.42 0.00 0.11 0.00 2.80 0.00 0.00 57.97 61.30 1psb h PHE 76 Cb 0.74 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.84 1psb h PHE 76 CO -0.31 0.52 0.45 -0.07 -0.60 0.00 0.00 178.31 178.30 1psb h LEU 77 N -1.00 0.41 -0.81 1.54 3.38 -1.67 -0.47 115.31 116.70 1psb h LEU 77 Ca -0.00 0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.18 1psb h LEU 77 Cb 0.52 -0.07 -0.13 0.00 0.09 0.00 0.00 40.66 41.07 1psb h LEU 77 CO -0.00 0.24 0.20 -0.09 0.09 0.00 0.00 178.44 178.87 1psb h ARG 78 N 0.45 0.23 -0.80 1.13 2.43 -0.84 0.89 114.38 117.88 1psb h ARG 78 Ca 0.32 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.43 1psb h ARG 78 Cb 0.63 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.09 1psb h ARG 78 CO -0.10 0.15 0.32 -0.07 -1.51 0.00 0.00 179.97 178.77 1psb h LEU 79 N 0.24 1.10 0.29 3.80 -0.00 -1.26 0.21 115.31 119.68 1psb h LEU 79 Ca 0.48 -0.17 -0.01 0.00 -0.00 0.00 0.00 57.88 58.18 1psb h LEU 79 Cb 0.90 -0.28 0.00 0.00 -0.00 0.00 0.00 40.66 41.28 1psb h LEU 79 CO -0.59 0.97 -0.14 0.50 -0.00 0.00 0.00 178.44 179.18 1psb h LYS 80 N 1.16 -0.37 -0.94 1.13 3.11 -1.21 -3.05 116.57 116.40 1psb h LYS 80 Ca 0.27 0.03 0.11 0.00 -2.81 0.00 0.00 60.65 58.25 1psb h LYS 80 Cb 0.21 0.08 -0.08 0.00 -1.00 0.00 0.00 32.23 31.44 1psb h LYS 80 CO -0.02 -0.11 0.57 0.00 -2.81 0.00 0.00 179.45 177.07 1psb h ARG 81 N -0.60 0.88 0.00 1.90 2.47 -0.56 -1.39 114.38 117.09 1psb h ARG 81 Ca -0.04 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.63 1psb h ARG 81 Cb 0.43 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.55 1psb h ARG 81 CO 0.06 0.58 -0.01 1.15 0.56 0.00 0.00 179.97 182.32 1psb h THR 82 N 0.91 0.42 -0.92 2.04 2.02 -0.49 -3.00 112.91 113.88 1psb h THR 82 Ca 0.47 -0.05 0.26 0.00 0.77 0.00 0.00 66.41 67.85 1psb h THR 82 Cb 0.46 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 1psb h THR 82 CO -0.27 0.01 0.65 0.03 0.37 0.00 0.00 175.52 176.32 1psb h ARG 83 N 0.00 0.07 -0.57 6.66 2.47 -1.18 0.34 114.38 122.17 1psb h ARG 83 Ca -0.00 -0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.66 1psb h ARG 83 Cb 0.03 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.31 1psb h ARG 83 CO 0.00 0.05 0.14 -0.07 0.56 0.00 0.00 179.97 180.65 1psb h LEU 84 N 0.08 0.82 0.00 3.04 -0.00 -1.74 -3.29 115.31 114.22 1psb h LEU 84 Ca 0.45 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 58.18 1psb h LEU 84 Cb 1.66 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 42.11 1psb h LEU 84 CO -0.04 0.81 -1.74 0.61 -0.00 0.00 0.00 178.44 178.07 1psb n GLY 85 N -0.82 -0.79 0.33 0.83 0.00 0.70 -4.58 105.19 100.85 1psb n GLY 85 Ca 0.04 -0.42 0.16 0.00 0.00 0.00 0.00 46.02 45.79 1psb n GLY 85 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1psb n LEU 86 N -2.07 -0.08 0.00 0.99 7.94 0.85 -5.14 117.00 119.49 1psb n LEU 86 Ca -0.03 1.64 0.00 0.00 -1.11 0.00 0.00 56.01 56.51 1psb n LEU 86 Cb 0.45 -0.61 0.00 0.00 0.53 0.00 0.00 43.42 43.78 1psb n LEU 86 CO 0.37 -1.68 0.14 -0.62 -1.11 0.00 0.00 177.39 174.49