#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 3.43 0.23 1.64 0.04 -1.26 -4.75 135.00 134.33 1xf7 s PRO 2 Ca 0.00 -0.37 0.12 0.00 0.04 0.00 0.00 61.00 60.78 1xf7 s PRO 2 Cb 0.00 -2.66 -0.05 0.00 0.04 0.00 0.00 34.50 31.83 1xf7 s PRO 2 CO 0.00 0.11 -0.22 -0.06 0.04 0.00 0.00 177.00 176.87 1xf7 s PHE 3 N -2.33 2.27 0.03 0.56 0.40 -0.59 -4.95 117.98 113.37 1xf7 s PHE 3 Ca 0.41 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 56.41 1xf7 s PHE 3 Cb -0.10 -1.06 -0.02 0.00 0.51 0.00 0.00 43.02 42.36 1xf7 s PHE 3 CO 0.36 0.60 -0.08 -1.14 0.70 0.00 0.00 175.22 175.66 1xf7 s GLN 4 N -3.09 0.52 -0.16 0.44 2.00 -1.26 -1.11 119.66 117.00 1xf7 s GLN 4 Ca 0.25 -0.66 -0.10 0.00 -2.00 0.00 0.00 55.36 52.86 1xf7 s GLN 4 Cb -0.06 -0.33 -0.05 0.00 0.80 0.00 0.00 33.01 33.37 1xf7 s GLN 4 CO 0.12 0.07 0.17 0.00 -0.50 0.00 0.00 175.29 175.15 1xf7 n LYS 6 N 2.96 2.53 0.00 0.00 4.01 -1.26 -2.11 118.16 124.29 1xf7 n LYS 6 Ca -0.17 -3.34 0.00 0.00 -0.51 0.00 0.00 58.31 54.30 1xf7 n LYS 6 Cb 0.53 -2.16 0.00 0.00 -0.51 0.00 0.00 35.03 32.89 1xf7 n LYS 6 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1xf7 n THR 7 N -0.99 0.00 0.00 -0.18 -1.04 -1.26 -4.87 114.28 105.94 1xf7 n THR 7 Ca 0.53 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.54 1xf7 n THR 7 Cb 1.05 -0.49 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 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 -0.49 -1.34 -4.66 0.00 3.00 -0.90 -5.05 117.38 107.94 1xf7 n GLN 9 Ca 0.00 0.59 -0.31 0.00 -0.01 0.00 0.00 57.00 57.27 1xf7 n GLN 9 Cb 0.00 -4.18 -0.13 0.00 0.00 0.00 0.00 30.24 25.94 1xf7 n GLN 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 1xf7 s ARG 10 N -3.78 2.08 0.29 -1.09 3.52 -1.25 -4.89 118.95 113.83 1xf7 s ARG 10 Ca 0.26 -0.98 0.08 0.00 -0.13 0.00 0.00 55.73 54.96 1xf7 s ARG 10 Cb -0.03 -2.19 -0.03 0.00 -1.56 0.00 0.00 34.95 31.13 1xf7 s ARG 10 CO 0.46 0.54 0.19 -1.59 -0.81 0.00 0.00 175.30 174.09 1xf7 s LYS 11 N -1.43 2.70 0.34 5.12 -2.85 -1.26 -0.60 119.74 121.75 1xf7 s LYS 11 Ca 0.15 -1.25 0.07 0.00 -1.00 0.00 0.00 55.97 53.94 1xf7 s LYS 11 Cb -0.10 -2.42 -0.03 0.00 -2.06 0.00 0.00 37.83 33.21 1xf7 s LYS 11 CO 0.05 0.26 0.31 1.19 0.10 0.00 0.00 175.35 177.25 1xf7 n PHE 12 N -1.20 -0.87 -0.10 1.78 3.72 -0.26 -4.95 117.46 115.57 1xf7 n PHE 12 Ca -0.05 -2.81 -0.13 0.00 -0.05 0.00 0.00 57.45 54.40 1xf7 n PHE 12 Cb 0.59 0.32 -0.11 0.00 -0.94 0.00 0.00 39.48 39.34 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 -1.66 1.75 -3.89 4.37 3.41 -1.26 -1.54 113.62 114.80 1xf7 n SER 13 Ca 0.07 -0.08 -0.23 0.00 -0.26 0.00 0.00 58.87 58.37 1xf7 n SER 13 Cb 0.61 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.57 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 -2.99 1.10 -0.10 4.33 1.74 -1.26 -4.66 116.66 114.81 1xf7 n ARG 14 Ca -0.36 -2.66 -0.16 0.00 -0.77 0.00 0.00 57.85 53.90 1xf7 n ARG 14 Cb 0.97 0.74 -0.13 0.00 -1.02 0.00 0.00 32.46 33.01 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 -1.24 1.44 0.25 0.55 3.41 -1.26 -3.42 113.62 113.36 1xf7 n SER 15 Ca -0.15 -0.04 0.08 0.00 -0.26 0.00 0.00 58.87 58.50 1xf7 n SER 15 Cb 0.46 -0.08 0.63 0.00 -0.26 0.00 0.00 64.21 64.96 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 0.01 0.00 0.15 4.04 2.03 -1.99 -0.89 116.42 119.76 1xf7 h ASP 16 Ca -0.54 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.75 1xf7 h ASP 16 Cb 2.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.51 1xf7 h ASP 16 CO -0.03 0.05 -0.07 0.45 -1.03 0.00 0.00 179.24 178.60 1xf7 h HIS 17 N 0.00 -0.18 -0.93 4.15 3.86 -1.99 -2.62 115.15 117.43 1xf7 h HIS 17 Ca -0.00 -0.00 0.22 0.00 -1.16 0.00 0.00 60.37 59.43 1xf7 h HIS 17 Cb 0.09 0.06 -0.18 0.00 1.06 0.00 0.00 27.41 28.44 1xf7 h HIS 17 CO 0.00 -0.11 -0.11 -0.11 0.86 0.00 0.00 177.93 178.46 1xf7 n LEU 18 N -2.72 -0.22 0.05 2.43 7.94 -0.87 -1.17 117.00 122.45 1xf7 n LEU 18 Ca -0.02 1.59 -0.04 0.00 -1.11 0.00 0.00 56.01 56.43 1xf7 n LEU 18 Cb 0.08 -0.53 -0.02 0.00 0.53 0.00 0.00 43.42 43.48 1xf7 n LEU 18 CO 0.06 -1.57 0.50 0.50 -1.11 0.00 0.00 177.39 175.77 1xf7 h LYS 19 N 0.00 -0.20 -1.12 1.96 3.64 -1.20 -0.60 116.57 119.05 1xf7 h LYS 19 Ca 0.51 0.01 0.32 0.00 -1.27 0.00 0.00 60.65 60.22 1xf7 h LYS 19 Cb 0.92 0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 32.68 1xf7 h LYS 19 CO -0.92 -0.13 0.72 1.15 -2.27 0.00 0.00 179.45 178.00 1xf7 h THR 20 N -0.21 0.39 0.65 1.00 2.02 -0.89 -1.85 112.91 114.02 1xf7 h THR 20 Ca -0.01 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 1xf7 h THR 20 Cb 0.19 0.07 0.01 0.00 -1.74 0.00 0.00 68.15 66.68 1xf7 h THR 20 CO -0.03 0.05 -0.31 -0.74 0.37 0.00 0.00 175.52 174.86 1xf7 h HIS 21 N 0.29 -0.81 -0.48 3.16 -0.00 -0.71 -3.21 115.15 113.39 1xf7 h HIS 21 Ca 0.67 -0.02 0.14 0.00 -0.00 0.00 0.00 60.37 61.16 1xf7 h HIS 21 Cb 1.84 0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 29.50 1xf7 h HIS 21 CO -0.00 -0.51 0.57 1.15 -0.00 0.00 0.00 177.93 179.14 1xf7 h THR 22 N -1.22 0.27 0.00 6.26 2.02 -0.29 -0.08 112.91 119.88 1xf7 h THR 22 Ca -0.09 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1xf7 h THR 22 Cb 0.67 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1xf7 h THR 22 CO 0.15 0.00 0.03 -1.14 0.37 0.00 0.00 175.52 174.92 1xf7 n ARG 23 N -3.55 0.00 0.00 6.66 0.63 -1.01 -0.35 116.66 119.03 1xf7 n ARG 23 Ca 0.09 0.38 0.13 0.00 -0.92 0.00 0.00 57.85 57.53 1xf7 n ARG 23 Cb 0.76 -1.53 0.36 0.00 0.45 0.00 0.00 32.46 32.50 1xf7 n ARG 23 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 1xf7 n THR 24 N -1.38 0.00 -0.06 5.15 5.66 -0.04 -0.72 114.28 122.88 1xf7 n THR 24 Ca 0.00 -0.18 -0.12 0.00 -3.05 0.00 0.00 64.05 60.70 1xf7 n THR 24 Cb 0.03 0.54 -0.05 0.00 -1.55 0.00 0.00 70.33 69.29 1xf7 n THR 24 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1xf7 n HIS 25 N -0.36 0.00 -0.04 1.09 8.25 0.52 -4.83 115.22 119.86 1xf7 n HIS 25 Ca 0.13 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.59 1xf7 n HIS 25 Cb 0.37 -0.47 -0.09 0.00 1.12 0.00 0.00 29.99 30.92 1xf7 n HIS 25 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1xf7 n THR 26 N -3.38 0.46 -2.62 1.59 5.66 -0.87 -4.77 114.28 110.36 1xf7 n THR 26 Ca -0.25 -0.40 -0.40 0.00 -3.05 0.00 0.00 64.05 59.96 1xf7 n THR 26 Cb 0.70 -0.31 0.02 0.00 -1.55 0.00 0.00 70.33 69.18 1xf7 n THR 26 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1xf7 n GLY 27 N 2.08 6.05 2.55 1.09 0.00 0.10 -4.66 105.19 112.41 1xf7 n GLY 27 Ca -0.12 -2.59 -0.28 0.00 0.00 0.00 0.00 46.02 43.03 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 -0.12 3.38 0.00 1.61 2.13 -1.22 -4.59 120.64 121.84 1xf7 n GLU 28 Ca 0.46 -4.48 0.00 0.00 0.66 0.00 0.00 57.16 53.80 1xf7 n GLU 28 Cb 0.27 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.73 1xf7 n GLU 28 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89