#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xf7 s PRO 2 N 0.00 2.41 0.17 1.64 0.04 -1.26 -4.57 135.00 133.42 1xf7 s PRO 2 Ca 0.00 0.88 0.08 0.00 0.04 0.00 0.00 61.00 62.01 1xf7 s PRO 2 Cb 0.00 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 1xf7 s PRO 2 CO 0.00 -1.46 -0.17 -0.06 0.04 0.00 0.00 177.00 175.35 1xf7 s PHE 3 N -3.04 1.76 0.05 0.56 0.40 -0.71 -4.96 117.98 112.05 1xf7 s PHE 3 Ca 0.60 -0.49 0.02 0.00 -0.60 0.00 0.00 56.93 56.46 1xf7 s PHE 3 Cb -0.15 -0.87 -0.03 0.00 0.51 0.00 0.00 43.02 42.48 1xf7 s PHE 3 CO 0.55 0.32 -0.07 -1.14 0.70 0.00 0.00 175.22 175.57 1xf7 s GLN 4 N -2.89 0.58 -0.41 0.44 0.74 -1.26 -0.74 119.66 116.11 1xf7 s GLN 4 Ca 0.16 -0.87 -0.14 0.00 0.05 0.00 0.00 55.36 54.56 1xf7 s GLN 4 Cb -0.05 -0.25 0.03 0.00 1.10 0.00 0.00 33.01 33.84 1xf7 s GLN 4 CO 0.06 0.03 0.29 0.00 -0.55 0.00 0.00 175.29 175.13 1xf7 n LYS 6 N 5.13 1.68 0.00 0.00 0.00 -1.26 -0.73 118.16 122.97 1xf7 n LYS 6 Ca -0.11 -1.32 0.00 0.00 -0.00 0.00 0.00 58.31 56.87 1xf7 n LYS 6 Cb 0.46 -1.52 0.00 0.00 -0.00 0.00 0.00 35.03 33.97 1xf7 n LYS 6 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1xf7 n THR 7 N 0.50 0.00 0.00 0.58 -1.04 -1.26 -4.88 114.28 108.19 1xf7 n THR 7 Ca 0.25 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 1xf7 n THR 7 Cb 0.58 -0.44 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 1xf7 n THR 7 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xf7 n GLN 9 N -1.78 0.00 -4.37 0.00 -0.06 0.09 -5.09 117.38 106.16 1xf7 n GLN 9 Ca 0.00 0.00 -0.26 0.00 -2.00 0.00 0.00 57.00 54.74 1xf7 n GLN 9 Cb 0.37 -0.56 -0.10 0.00 -4.06 0.00 0.00 30.24 25.89 1xf7 n GLN 9 CO 0.00 0.00 0.00 0.50 -0.20 0.00 0.00 177.06 177.36 1xf7 s ARG 10 N -1.84 1.80 0.30 3.69 3.52 -1.22 -4.92 118.95 120.28 1xf7 s ARG 10 Ca 0.00 -1.47 0.11 0.00 -0.13 0.00 0.00 55.73 54.24 1xf7 s ARG 10 Cb 0.00 -1.97 -0.05 0.00 -1.56 0.00 0.00 34.95 31.37 1xf7 s ARG 10 CO 0.00 0.40 -0.13 -1.59 -0.81 0.00 0.00 175.30 173.16 1xf7 s LYS 11 N -2.96 1.83 0.20 5.12 -2.85 -1.26 -0.72 119.74 119.09 1xf7 s LYS 11 Ca 0.25 -1.75 0.04 0.00 -1.00 0.00 0.00 55.97 53.50 1xf7 s LYS 11 Cb -0.08 -1.82 -0.01 0.00 -2.06 0.00 0.00 37.83 33.86 1xf7 s LYS 11 CO 0.13 0.28 0.14 1.19 0.10 0.00 0.00 175.35 177.20 1xf7 n PHE 12 N -0.72 -0.33 -0.09 1.78 3.72 0.08 -4.96 117.46 116.94 1xf7 n PHE 12 Ca -0.05 -1.57 -0.12 0.00 -0.05 0.00 0.00 57.45 55.66 1xf7 n PHE 12 Cb 0.61 0.13 -0.10 0.00 -0.94 0.00 0.00 39.48 39.18 1xf7 n PHE 12 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1xf7 n SER 13 N -2.15 2.18 -3.60 4.37 3.41 -1.26 -1.74 113.62 114.84 1xf7 n SER 13 Ca 0.03 -0.08 -0.19 0.00 -0.26 0.00 0.00 58.87 58.37 1xf7 n SER 13 Cb 0.34 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 1xf7 n SER 13 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xf7 n ARG 14 N -2.94 1.24 -0.04 4.33 1.74 -1.26 -4.45 116.66 115.27 1xf7 n ARG 14 Ca -0.32 -2.18 -0.13 0.00 -0.77 0.00 0.00 57.85 54.45 1xf7 n ARG 14 Cb 0.90 0.54 -0.14 0.00 -1.02 0.00 0.00 32.46 32.74 1xf7 n ARG 14 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1xf7 n SER 15 N -1.28 1.13 0.00 0.55 3.41 -1.26 -3.09 113.62 113.09 1xf7 n SER 15 Ca -0.11 0.23 0.09 0.00 -0.26 0.00 0.00 58.87 58.82 1xf7 n SER 15 Cb 0.38 -0.10 0.53 0.00 -0.26 0.00 0.00 64.21 64.77 1xf7 n SER 15 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1xf7 n ASP 16 N -3.12 0.00 -0.11 4.04 5.75 -1.26 -1.43 116.55 120.42 1xf7 n ASP 16 Ca -0.27 -1.09 -0.18 0.00 -0.01 0.00 0.00 54.79 53.25 1xf7 n ASP 16 Cb 1.07 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 41.06 1xf7 n ASP 16 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1xf7 n HIS 17 N -0.84 0.00 -0.00 2.11 8.25 -1.24 -3.88 115.22 119.61 1xf7 n HIS 17 Ca 0.13 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.47 1xf7 n HIS 17 Cb 0.06 -0.85 -0.08 0.00 1.12 0.00 0.00 29.99 30.24 1xf7 n HIS 17 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1xf7 h LEU 18 N -0.19 0.06 0.32 2.41 5.85 -1.35 -2.05 115.31 120.36 1xf7 h LEU 18 Ca -0.52 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 57.91 1xf7 h LEU 18 Cb 1.71 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.71 1xf7 h LEU 18 CO -0.14 0.32 -0.29 0.50 -0.34 0.00 0.00 178.44 178.50 1xf7 h LYS 19 N -0.21 -0.57 -1.14 1.25 3.64 -1.47 -0.84 116.57 117.23 1xf7 h LYS 19 Ca 0.01 0.04 0.42 0.00 -1.27 0.00 0.00 60.65 59.85 1xf7 h LYS 19 Cb 0.29 0.13 -0.16 0.00 -0.41 0.00 0.00 32.23 32.08 1xf7 h LYS 19 CO 0.00 -0.38 0.68 1.15 -2.27 0.00 0.00 179.45 178.62 1xf7 h THR 20 N -0.60 0.06 0.18 1.00 2.02 -1.67 -1.46 112.91 112.45 1xf7 h THR 20 Ca -0.04 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1xf7 h THR 20 Cb 0.51 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1xf7 h THR 20 CO -0.01 0.01 -0.09 -0.74 0.37 0.00 0.00 175.52 175.06 1xf7 h HIS 21 N 0.06 -0.22 -0.35 3.16 -0.00 -0.81 -3.28 115.15 113.71 1xf7 h HIS 21 Ca 0.84 -0.01 0.10 0.00 -0.00 0.00 0.00 60.37 61.30 1xf7 h HIS 21 Cb 2.36 0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 29.83 1xf7 h HIS 21 CO -0.01 0.17 0.60 1.15 -0.00 0.00 0.00 177.93 179.85 1xf7 h THR 22 N -0.91 0.16 -0.79 6.26 2.02 -0.07 -1.04 112.91 118.53 1xf7 h THR 22 Ca -0.02 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.38 1xf7 h THR 22 Cb 0.50 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1xf7 h THR 22 CO 0.04 0.00 0.74 -0.09 0.37 0.00 0.00 175.52 176.58 1xf7 h ARG 23 N 0.00 0.00 0.00 6.66 2.43 -1.56 0.28 114.38 122.19 1xf7 h ARG 23 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1xf7 h ARG 23 Cb 1.37 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.92 1xf7 h ARG 23 CO -0.00 0.00 0.00 0.25 -1.51 0.00 0.00 179.97 178.71 1xf7 n THR 24 N -3.75 0.00 0.04 0.20 -2.24 -0.40 -1.09 114.28 107.05 1xf7 n THR 24 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1xf7 n THR 24 Cb 1.02 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1xf7 n THR 24 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1xf7 n HIS 25 N -0.73 -0.22 -2.88 4.78 8.25 0.90 -4.89 115.22 120.43 1xf7 n HIS 25 Ca 0.11 0.04 -0.23 0.00 -0.26 0.00 0.00 57.72 57.38 1xf7 n HIS 25 Cb 0.05 0.07 -0.02 0.00 1.12 0.00 0.00 29.99 31.21 1xf7 n HIS 25 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1xf7 n THR 26 N -3.32 1.93 -2.84 1.59 -1.04 -0.77 -4.89 114.28 104.93 1xf7 n THR 26 Ca 0.00 -4.95 -0.26 0.00 -2.04 0.00 0.00 64.05 56.79 1xf7 n THR 26 Cb 0.14 -0.88 -0.03 0.00 -1.82 0.00 0.00 70.33 67.74 1xf7 n THR 26 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xf7 n GLY 27 N -0.14 5.52 2.88 3.41 0.00 -0.25 -4.70 105.19 111.91 1xf7 n GLY 27 Ca 0.29 -2.69 -0.28 0.00 0.00 0.00 0.00 46.02 43.33 1xf7 n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xf7 n GLU 28 N -0.27 3.43 0.00 1.61 4.07 -1.26 -4.93 120.64 123.29 1xf7 n GLU 28 Ca 0.32 -4.84 0.05 0.00 -0.06 0.00 0.00 57.16 52.63 1xf7 n GLU 28 Cb 0.48 -2.27 0.04 0.00 -0.06 0.00 0.00 31.44 29.64 1xf7 n GLU 28 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24