#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 4.38 0.04 1.97 0.02 -1.26 -4.28 135.00 135.86 1xf7 s PRO 2 Ca 0.00 1.39 0.06 0.00 0.02 0.00 0.00 61.00 62.47 1xf7 s PRO 2 Cb 0.00 -3.57 -0.03 0.00 0.02 0.00 0.00 34.50 30.92 1xf7 s PRO 2 CO 0.00 -0.40 -0.15 -0.06 -0.33 0.00 0.00 177.00 176.06 1xf7 s PHE 3 N 2.32 2.63 0.10 6.54 0.08 -0.95 -4.98 117.98 123.73 1xf7 s PHE 3 Ca 0.47 -0.21 0.07 0.00 0.12 0.00 0.00 56.93 57.38 1xf7 s PHE 3 Cb -0.17 -1.49 -0.03 0.00 -0.57 0.00 0.00 43.02 40.75 1xf7 s PHE 3 CO 0.15 0.28 -0.17 -1.14 -0.10 0.00 0.00 175.22 174.24 1xf7 s GLN 4 N -1.47 1.02 -0.14 0.44 2.00 -1.26 -0.94 119.66 119.30 1xf7 s GLN 4 Ca 0.15 -1.12 -0.09 0.00 -2.00 0.00 0.00 55.36 52.30 1xf7 s GLN 4 Cb -0.11 -1.12 -0.04 0.00 0.80 0.00 0.00 33.01 32.54 1xf7 s GLN 4 CO 0.06 0.25 0.15 0.00 -0.50 0.00 0.00 175.29 175.25 1xf7 n LYS 6 N 2.55 3.85 -0.00 0.00 4.76 -1.26 -2.03 118.16 126.03 1xf7 n LYS 6 Ca -0.18 -2.98 -0.00 0.00 -2.87 0.00 0.00 58.31 52.28 1xf7 n LYS 6 Cb 0.54 -2.20 -0.00 0.00 -1.84 0.00 0.00 35.03 31.52 1xf7 n LYS 6 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1xf7 n THR 7 N -0.00 0.01 -0.40 -0.18 -1.04 -1.26 -4.85 114.28 106.57 1xf7 n THR 7 Ca 0.38 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.39 1xf7 n THR 7 Cb 1.33 -0.96 0.00 0.00 -1.82 0.00 0.00 70.33 68.88 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 -0.34 -1.60 -4.94 0.00 1.13 -0.86 -4.97 117.38 105.81 1xf7 n GLN 9 Ca 0.00 0.40 -0.33 0.00 -1.94 0.00 0.00 57.00 55.14 1xf7 n GLN 9 Cb 0.35 -4.04 -0.15 0.00 0.11 0.00 0.00 30.24 26.50 1xf7 n GLN 9 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1xf7 s ARG 10 N -6.26 3.26 0.30 -1.09 3.52 -1.25 -4.86 118.95 112.57 1xf7 s ARG 10 Ca 0.37 -0.76 0.07 0.00 -0.13 0.00 0.00 55.73 55.28 1xf7 s ARG 10 Cb -0.14 -2.51 -0.03 0.00 -1.56 0.00 0.00 34.95 30.71 1xf7 s ARG 10 CO 0.88 0.20 0.32 -1.59 -0.81 0.00 0.00 175.30 174.30 1xf7 s LYS 11 N 0.34 2.98 0.29 5.12 -2.85 -1.26 -0.34 119.74 124.02 1xf7 s LYS 11 Ca -0.14 -1.09 0.04 0.00 -1.00 0.00 0.00 55.97 53.78 1xf7 s LYS 11 Cb -0.17 -2.64 -0.03 0.00 -2.06 0.00 0.00 37.83 32.92 1xf7 s LYS 11 CO 0.07 0.21 0.20 -0.06 0.10 0.00 0.00 175.35 175.87 1xf7 s PHE 12 N -2.18 1.55 -0.14 1.78 0.08 -0.12 -4.98 117.98 113.97 1xf7 s PHE 12 Ca 0.39 -1.49 0.17 0.00 0.12 0.00 0.00 56.93 56.12 1xf7 s PHE 12 Cb -0.08 -0.73 -0.25 0.00 -0.57 0.00 0.00 43.02 41.40 1xf7 s PHE 12 CO 0.28 -0.69 0.16 -1.13 -0.10 0.00 0.00 175.22 173.74 1xf7 n SER 13 N -1.01 0.43 -4.60 1.36 3.41 -1.26 -2.23 113.62 109.71 1xf7 n SER 13 Ca 0.04 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.39 1xf7 n SER 13 Cb 0.64 1.21 -0.10 0.00 -0.26 0.00 0.00 64.21 65.71 1xf7 n SER 13 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1xf7 s ARG 14 N -2.70 1.96 -0.04 4.33 0.52 -1.26 -4.56 118.95 117.20 1xf7 s ARG 14 Ca -0.09 -1.89 -0.09 0.00 -0.52 0.00 0.00 55.73 53.15 1xf7 s ARG 14 Cb 0.07 -1.79 -0.30 0.00 0.52 0.00 0.00 34.95 33.45 1xf7 s ARG 14 CO 0.78 0.10 0.71 0.66 0.02 0.00 0.00 175.30 177.57 1xf7 h SER 15 N 1.88 0.57 -0.51 0.23 4.64 -1.94 -2.84 113.55 115.58 1xf7 h SER 15 Ca -0.43 -0.85 -0.03 0.00 -0.47 0.00 0.00 61.79 60.02 1xf7 h SER 15 Cb 1.25 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 63.13 1xf7 h SER 15 CO 0.70 1.71 0.22 -2.24 -0.87 0.00 0.00 176.83 176.36 1xf7 h ASP 16 N 0.10 0.72 0.54 4.97 2.03 -1.99 -0.79 116.42 122.00 1xf7 h ASP 16 Ca -0.32 -0.09 -0.03 0.00 -0.73 0.00 0.00 57.03 55.86 1xf7 h ASP 16 Cb 2.09 -0.19 0.01 0.00 -0.83 0.00 0.00 39.33 40.41 1xf7 h ASP 16 CO 0.18 0.65 -0.26 0.45 -1.03 0.00 0.00 179.24 179.23 1xf7 h HIS 17 N 0.79 -0.67 -0.99 4.15 3.86 -1.98 -2.41 115.15 117.89 1xf7 h HIS 17 Ca 0.19 -0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.52 1xf7 h HIS 17 Cb 0.15 0.22 -0.15 0.00 1.06 0.00 0.00 27.41 28.69 1xf7 h HIS 17 CO 0.01 -0.42 -0.43 1.25 0.86 0.00 0.00 177.93 179.21 1xf7 h LEU 18 N -0.97 -1.57 0.33 2.43 5.85 -1.23 -1.21 115.31 118.94 1xf7 h LEU 18 Ca -0.07 0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1xf7 h LEU 18 Cb 0.56 0.79 -0.02 0.00 0.37 0.00 0.00 40.66 42.36 1xf7 h LEU 18 CO 0.12 -0.28 -0.42 0.11 -0.34 0.00 0.00 178.44 177.64 1xf7 h LYS 19 N -0.00 -0.74 -0.91 1.25 1.57 -1.18 -0.67 116.57 115.89 1xf7 h LYS 19 Ca 0.31 0.05 0.26 0.00 -1.87 0.00 0.00 60.65 59.40 1xf7 h LYS 19 Cb 0.56 0.17 -0.14 0.00 0.08 0.00 0.00 32.23 32.90 1xf7 h LYS 19 CO -0.98 -0.49 0.31 1.15 -0.57 0.00 0.00 179.45 178.87 1xf7 h THR 20 N -0.77 0.31 0.59 -0.16 2.02 -0.83 -0.28 112.91 113.80 1xf7 h THR 20 Ca -0.04 -0.08 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 1xf7 h THR 20 Cb 0.69 0.05 0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1xf7 h THR 20 CO -0.10 0.04 -0.28 -0.74 0.37 0.00 0.00 175.52 174.81 1xf7 h HIS 21 N 0.24 -0.74 -0.86 3.16 -0.00 -0.77 -3.24 115.15 112.93 1xf7 h HIS 21 Ca 0.60 -0.02 0.16 0.00 -0.00 0.00 0.00 60.37 61.11 1xf7 h HIS 21 Cb 1.25 0.24 -0.10 0.00 -0.00 0.00 0.00 27.41 28.80 1xf7 h HIS 21 CO -0.21 -0.46 0.43 1.79 -0.00 0.00 0.00 177.93 179.49 1xf7 h THR 22 N -0.85 0.67 -1.30 6.26 1.35 -0.40 -2.58 112.91 116.06 1xf7 h THR 22 Ca -0.08 -0.20 0.39 0.00 -0.55 0.00 0.00 66.41 65.97 1xf7 h THR 22 Cb 0.61 0.04 -0.07 0.00 -1.73 0.00 0.00 68.15 67.00 1xf7 h THR 22 CO 0.13 0.11 0.92 -1.14 -0.25 0.00 0.00 175.52 175.29 1xf7 n ARG 23 N -4.90 -0.01 -0.03 4.72 0.63 -0.18 0.47 116.66 117.36 1xf7 n ARG 23 Ca 0.18 0.80 -0.16 0.00 -0.92 0.00 0.00 57.85 57.76 1xf7 n ARG 23 Cb 0.49 -1.77 -0.13 0.00 0.45 0.00 0.00 32.46 31.49 1xf7 n ARG 23 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1xf7 h THR 24 N 0.00 1.65 -0.87 5.15 1.03 -1.62 -3.34 112.91 114.91 1xf7 h THR 24 Ca 0.66 -2.27 -0.49 0.00 -0.01 0.00 0.00 66.41 64.29 1xf7 h THR 24 Cb 2.52 3.16 -0.42 0.00 -1.07 0.00 0.00 68.15 72.35 1xf7 h THR 24 CO -0.09 0.61 -0.88 0.00 -0.01 0.00 0.00 175.52 175.15 1xf7 n HIS 25 N -4.46 2.53 0.00 0.00 1.44 0.18 -4.49 115.22 110.42 1xf7 n HIS 25 Ca -0.11 -2.43 0.00 0.00 -2.01 0.00 0.00 57.72 53.17 1xf7 n HIS 25 Cb 0.57 -0.27 0.00 0.00 0.12 0.00 0.00 29.99 30.41 1xf7 n HIS 25 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 1xf7 n THR 26 N -0.60 0.00 -2.66 0.61 -1.04 0.77 -4.82 114.28 106.54 1xf7 n THR 26 Ca 0.34 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 62.09 1xf7 n THR 26 Cb 0.87 -0.21 -0.01 0.00 -1.82 0.00 0.00 70.33 69.15 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 1.47 5.80 2.49 3.41 0.00 -1.25 -4.86 105.19 112.27 1xf7 n GLY 27 Ca 0.00 -2.76 -0.25 0.00 0.00 0.00 0.00 46.02 43.01 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 -0.39 2.23 0.00 1.61 2.13 -1.26 -4.86 120.64 120.10 1xf7 n GLU 28 Ca 0.36 -4.33 0.00 0.00 0.66 0.00 0.00 57.16 53.85 1xf7 n GLU 28 Cb 0.56 -2.01 0.00 0.00 0.27 0.00 0.00 31.44 30.26 1xf7 n GLU 28 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35