#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 4.32 0.15 1.64 0.02 -1.26 -4.36 135.00 135.51 1xf7 s PRO 2 Ca 0.00 1.13 0.06 0.00 0.02 0.00 0.00 61.00 62.21 1xf7 s PRO 2 Cb 0.00 -2.44 -0.04 0.00 0.02 0.00 0.00 34.50 32.04 1xf7 s PRO 2 CO 0.00 0.11 -0.13 -0.06 -0.33 0.00 0.00 177.00 176.58 1xf7 s PHE 3 N -1.95 1.47 0.03 6.54 0.40 -0.63 -4.97 117.98 118.88 1xf7 s PHE 3 Ca 0.56 -0.60 -0.00 0.00 -0.60 0.00 0.00 56.93 56.29 1xf7 s PHE 3 Cb -0.13 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.64 1xf7 s PHE 3 CO 0.17 0.20 -0.03 -1.14 0.70 0.00 0.00 175.22 175.12 1xf7 s GLN 4 N -3.19 0.45 -0.24 0.44 0.74 -1.26 -0.71 119.66 115.89 1xf7 s GLN 4 Ca 0.15 -0.89 -0.08 0.00 0.05 0.00 0.00 55.36 54.58 1xf7 s GLN 4 Cb -0.02 0.15 -0.04 0.00 1.10 0.00 0.00 33.01 34.20 1xf7 s GLN 4 CO 0.04 -0.08 0.09 0.00 -0.55 0.00 0.00 175.29 174.79 1xf7 n LYS 6 N 4.57 2.61 0.00 0.00 4.76 -1.26 -1.51 118.16 127.33 1xf7 n LYS 6 Ca -0.16 -3.14 0.00 0.00 -2.87 0.00 0.00 58.31 52.14 1xf7 n LYS 6 Cb 0.52 -2.21 0.00 0.00 -1.84 0.00 0.00 35.03 31.50 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 -0.37 0.00 0.00 -0.18 -1.04 -1.26 -4.90 114.28 106.52 1xf7 n THR 7 Ca 0.54 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.55 1xf7 n THR 7 Cb 0.43 -0.57 0.00 0.00 -1.82 0.00 0.00 70.33 68.37 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 -1.53 0.00 -4.29 0.00 1.13 -0.57 -5.08 117.38 107.04 1xf7 n GLN 9 Ca 0.00 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 54.81 1xf7 n GLN 9 Cb 0.19 -1.64 -0.09 0.00 0.11 0.00 0.00 30.24 28.81 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 -2.85 2.14 0.29 -1.09 3.52 -1.23 -4.92 118.95 114.81 1xf7 s ARG 10 Ca 0.00 -1.32 0.11 0.00 -0.13 0.00 0.00 55.73 54.38 1xf7 s ARG 10 Cb 0.00 -2.16 -0.05 0.00 -1.56 0.00 0.00 34.95 31.18 1xf7 s ARG 10 CO 0.00 0.41 -0.16 -1.59 -0.81 0.00 0.00 175.30 173.15 1xf7 s LYS 11 N -3.12 1.69 0.36 5.12 0.00 -1.26 -0.89 119.74 121.64 1xf7 s LYS 11 Ca 0.27 -1.80 0.06 0.00 0.00 0.00 0.00 55.97 54.50 1xf7 s LYS 11 Cb -0.08 -1.68 -0.03 0.00 0.00 0.00 0.00 37.83 36.05 1xf7 s LYS 11 CO 0.17 0.26 0.23 -0.06 0.00 0.00 0.00 175.35 175.95 1xf7 s PHE 12 N -2.59 1.77 -0.15 1.78 0.08 0.11 -4.96 117.98 114.02 1xf7 s PHE 12 Ca 0.30 -1.55 0.13 0.00 0.12 0.00 0.00 56.93 55.93 1xf7 s PHE 12 Cb -0.02 -0.86 -0.19 0.00 -0.57 0.00 0.00 43.02 41.38 1xf7 s PHE 12 CO 0.15 -0.69 0.05 -1.13 -0.10 0.00 0.00 175.22 173.49 1xf7 n SER 13 N -1.51 1.27 -4.49 1.36 3.41 -1.26 -1.61 113.62 110.79 1xf7 n SER 13 Ca 0.03 -0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.34 1xf7 n SER 13 Cb 0.63 0.84 -0.08 0.00 -0.26 0.00 0.00 64.21 65.34 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 -2.37 2.07 -0.14 4.33 0.52 -1.26 -4.09 118.95 118.01 1xf7 s ARG 14 Ca -0.08 -2.30 0.05 0.00 -0.52 0.00 0.00 55.73 52.89 1xf7 s ARG 14 Cb 0.05 -1.16 -0.23 0.00 0.52 0.00 0.00 34.95 34.13 1xf7 s ARG 14 CO 0.62 -0.39 0.27 -1.13 0.02 0.00 0.00 175.30 174.69 1xf7 n SER 15 N -1.26 1.34 0.00 0.23 3.41 -1.26 -2.87 113.62 113.21 1xf7 n SER 15 Ca -0.13 0.15 -0.02 0.00 -0.26 0.00 0.00 58.87 58.62 1xf7 n SER 15 Cb 0.66 -0.19 0.25 0.00 -0.26 0.00 0.00 64.21 64.67 1xf7 n SER 15 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1xf7 h ASP 16 N 0.02 0.50 0.53 4.04 2.03 -1.99 -0.43 116.42 121.11 1xf7 h ASP 16 Ca -0.44 -0.13 -0.03 0.00 -0.73 0.00 0.00 57.03 55.71 1xf7 h ASP 16 Cb 2.04 -0.13 0.01 0.00 -0.83 0.00 0.00 39.33 40.42 1xf7 h ASP 16 CO 0.04 0.64 -0.25 0.45 -1.03 0.00 0.00 179.24 179.09 1xf7 h HIS 17 N 0.48 -0.66 -0.84 4.15 3.86 -1.99 -2.30 115.15 117.86 1xf7 h HIS 17 Ca 0.09 -0.02 0.15 0.00 -1.16 0.00 0.00 60.37 59.43 1xf7 h HIS 17 Cb 0.48 0.22 -0.15 0.00 1.06 0.00 0.00 27.41 29.02 1xf7 h HIS 17 CO 0.02 -0.41 -0.31 1.25 0.86 0.00 0.00 177.93 179.34 1xf7 h LEU 18 N -0.79 -1.12 -0.55 2.43 5.85 -1.34 0.02 115.31 119.81 1xf7 h LEU 18 Ca -0.07 0.27 0.11 0.00 0.84 0.00 0.00 57.88 59.03 1xf7 h LEU 18 Cb 0.54 0.63 -0.09 0.00 0.37 0.00 0.00 40.66 42.11 1xf7 h LEU 18 CO 0.12 -0.29 0.01 0.50 -0.34 0.00 0.00 178.44 178.43 1xf7 h LYS 19 N -0.05 0.12 -0.49 1.25 3.64 -1.02 0.73 116.57 120.76 1xf7 h LYS 19 Ca 0.34 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.63 1xf7 h LYS 19 Cb 0.60 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1xf7 h LYS 19 CO -0.87 0.08 -0.03 1.15 -2.27 0.00 0.00 179.45 177.51 1xf7 h THR 20 N 0.12 1.25 0.32 1.00 2.02 -0.52 -2.57 112.91 114.54 1xf7 h THR 20 Ca 0.28 -1.08 -0.02 0.00 0.77 0.00 0.00 66.41 66.37 1xf7 h THR 20 Cb 0.44 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1xf7 h THR 20 CO -0.46 0.38 -0.15 -0.74 0.37 0.00 0.00 175.52 174.91 1xf7 h HIS 21 N 0.77 -0.40 0.00 3.16 -0.00 0.22 -1.74 115.15 117.16 1xf7 h HIS 21 Ca 0.14 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.50 1xf7 h HIS 21 Cb 0.51 0.13 0.00 0.00 -0.00 0.00 0.00 27.41 28.05 1xf7 h HIS 21 CO 0.03 -0.16 0.00 0.25 -0.00 0.00 0.00 177.93 178.05 1xf7 n THR 22 N -5.22 1.41 -0.41 6.26 -2.24 0.12 -1.36 114.28 112.85 1xf7 n THR 22 Ca -0.10 0.35 -0.15 0.00 -2.27 0.00 0.00 64.05 61.88 1xf7 n THR 22 Cb 0.23 -1.33 0.09 0.00 -2.10 0.00 0.00 70.33 67.23 1xf7 n THR 22 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1xf7 n ARG 23 N -1.37 1.76 0.00 -0.78 3.00 -0.65 -2.59 116.66 116.03 1xf7 n ARG 23 Ca 0.01 -1.75 0.00 0.00 -0.00 0.00 0.00 57.85 56.11 1xf7 n ARG 23 Cb 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 32.46 30.79 1xf7 n ARG 23 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1xf7 n THR 24 N -0.33 0.00 -0.12 5.15 -1.04 -0.46 -4.51 114.28 112.97 1xf7 n THR 24 Ca 0.35 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 62.09 1xf7 n THR 24 Cb 1.06 -0.39 -0.11 0.00 -1.82 0.00 0.00 70.33 69.07 1xf7 n THR 24 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1xf7 n HIS 25 N -1.34 0.31 -2.79 -1.42 8.25 -1.11 -4.62 115.22 112.49 1xf7 n HIS 25 Ca 0.00 0.12 -0.25 0.00 -0.26 0.00 0.00 57.72 57.33 1xf7 n HIS 25 Cb 0.24 -1.03 -0.02 0.00 1.12 0.00 0.00 29.99 30.30 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 -4.19 2.46 0.00 1.59 -1.04 -1.07 -5.00 114.28 107.03 1xf7 n THR 26 Ca -0.48 -5.15 0.00 0.00 -2.04 0.00 0.00 64.05 56.39 1xf7 n THR 26 Cb 0.85 -1.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 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 -0.27 0.00 3.22 3.41 0.00 -1.26 -4.14 105.19 106.16 1xf7 n GLY 27 Ca 0.32 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.11 1xf7 n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xf7 s GLU 28 N -0.73 1.17 0.00 1.61 2.56 -1.26 -4.76 118.70 117.29 1xf7 s GLU 28 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 54.97 54.03 1xf7 s GLU 28 Cb 0.00 -1.29 0.00 0.00 2.00 0.00 0.00 34.13 34.84 1xf7 s GLU 28 CO 0.00 0.32 0.31 1.17 -0.56 0.00 0.00 175.26 176.49