#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fkw n THR 2 N 0.00 4.49 -4.15 0.00 -1.04 -1.26 -5.00 114.28 107.33 2fkw n THR 2 Ca 0.00 -0.48 -0.23 0.00 -2.04 0.00 0.00 64.05 61.30 2fkw n THR 2 Cb 0.00 -1.39 -0.07 0.00 -1.82 0.00 0.00 70.33 67.05 2fkw n THR 2 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2fkw s LEU 3 N -3.96 3.24 0.95 -4.42 1.43 -1.26 -5.12 118.68 109.54 2fkw s LEU 3 Ca 0.81 -0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 53.02 2fkw s LEU 3 Cb -0.38 -1.71 0.16 0.00 0.03 0.00 0.00 46.19 44.29 2fkw s LEU 3 CO 0.42 -0.25 1.10 0.42 0.23 0.00 0.00 176.35 178.27 2fkw s THR 4 N -2.42 2.31 0.23 5.49 -4.23 -1.26 -4.76 115.64 111.00 2fkw s THR 4 Ca 0.37 0.10 -0.07 0.00 -1.18 0.00 0.00 61.69 60.91 2fkw s THR 4 Cb -0.03 -2.62 0.18 0.00 1.34 0.00 0.00 72.50 71.37 2fkw s THR 4 CO 0.22 -0.13 1.77 0.00 -0.54 0.00 0.00 174.62 175.94 2fkw h ALA 5 N -1.71 0.97 -0.04 3.99 0.00 -2.00 0.49 119.26 120.96 2fkw h ALA 5 Ca -0.52 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 2fkw h ALA 5 Cb 1.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2fkw h ALA 5 CO 0.57 -0.08 -0.16 1.49 0.00 0.00 0.00 179.25 181.07 2fkw h GLU 6 N 0.57 0.18 -0.50 0.00 4.81 -2.00 -1.91 114.58 115.73 2fkw h GLU 6 Ca 0.35 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 2fkw h GLU 6 Cb 0.40 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2fkw h GLU 6 CO -0.29 0.78 0.15 1.96 -0.73 0.00 0.00 179.01 180.88 2fkw h GLN 7 N -0.39 0.74 -0.22 1.92 4.20 -1.89 -1.65 115.11 117.82 2fkw h GLN 7 Ca -0.01 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 2fkw h GLN 7 Cb 0.81 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 2fkw h GLN 7 CO 0.03 0.65 0.09 1.03 -0.67 0.00 0.00 178.83 179.96 2fkw h SER 8 N 0.72 0.31 -0.88 1.46 0.87 -0.79 0.10 113.55 115.35 2fkw h SER 8 Ca 0.17 -0.17 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2fkw h SER 8 Cb 0.23 -0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.06 2fkw h SER 8 CO -0.01 0.39 0.58 -0.33 -0.53 0.00 0.00 176.83 176.94 2fkw h GLU 9 N 0.21 1.15 -0.35 2.24 4.39 -1.15 -0.91 114.58 120.16 2fkw h GLU 9 Ca 0.07 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.71 2fkw h GLU 9 Cb 0.18 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 2fkw h GLU 9 CO -0.01 0.76 0.22 0.93 -1.16 0.00 0.00 179.01 179.76 2fkw h GLU 10 N 1.18 0.44 -0.39 2.33 5.08 -1.08 -2.59 114.58 119.56 2fkw h GLU 10 Ca 0.33 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.53 2fkw h GLU 10 Cb -0.12 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 2fkw h GLU 10 CO -0.08 0.29 -0.29 1.25 -1.00 0.00 0.00 179.01 179.18 2fkw h LEU 11 N 0.46 0.87 -1.80 1.33 5.85 -0.57 -2.93 115.31 118.52 2fkw h LEU 11 Ca 0.13 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.47 2fkw h LEU 11 Cb -0.03 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.75 2fkw h LEU 11 CO -0.04 1.10 -0.14 -0.74 -0.34 0.00 0.00 178.44 178.28 2fkw h HIS 12 N 0.71 0.00 -0.57 1.25 2.76 -0.95 -1.56 115.15 116.79 2fkw h HIS 12 Ca 0.08 0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.34 2fkw h HIS 12 Cb 0.84 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.73 2fkw h HIS 12 CO 0.05 0.14 0.20 0.87 -1.30 0.00 0.00 177.93 177.88 2fkw h LYS 13 N 0.00 0.36 -0.17 5.26 6.56 -1.27 0.18 116.57 127.49 2fkw h LYS 13 Ca -0.00 -0.02 -0.09 0.00 -1.06 0.00 0.00 60.65 59.48 2fkw h LYS 13 Cb 0.27 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 31.83 2fkw h LYS 13 CO 0.02 0.24 -0.30 1.88 -2.06 0.00 0.00 179.45 179.23 2fkw h TYR 14 N 0.37 0.36 -0.11 -1.35 -1.99 -1.38 -0.27 116.97 112.59 2fkw h TYR 14 Ca 0.29 -0.08 -0.21 0.00 2.00 0.00 0.00 58.73 60.72 2fkw h TYR 14 Cb 0.35 -0.09 0.01 0.00 2.00 0.00 0.00 36.73 39.00 2fkw h TYR 14 CO -0.18 0.60 -0.79 0.28 -0.00 0.00 0.00 178.16 178.07 2fkw h VAL 15 N 0.28 1.31 -0.42 -2.88 2.07 -1.04 0.91 116.25 116.49 2fkw h VAL 15 Ca 0.04 -2.06 -0.10 0.00 0.82 0.00 0.00 66.70 65.39 2fkw h VAL 15 Cb 0.68 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 2fkw h VAL 15 CO 0.05 0.64 -0.14 0.40 0.02 0.00 0.00 177.57 178.54 2fkw h ILE 16 N 0.44 1.28 -0.35 4.57 1.08 -0.50 -1.61 117.51 122.42 2fkw h ILE 16 Ca -0.05 -1.26 -0.04 0.00 -0.39 0.00 0.00 64.86 63.12 2fkw h ILE 16 Cb 1.40 1.20 -0.01 0.00 -3.07 0.00 0.00 36.82 36.34 2fkw h ILE 16 CO 0.15 0.43 0.05 -0.78 -0.69 0.00 0.00 178.15 177.31 2fkw h ASP 17 N 0.67 0.56 -1.00 1.72 3.58 -0.98 -0.86 116.42 120.11 2fkw h ASP 17 Ca 0.10 -0.26 0.05 0.00 0.42 0.00 0.00 57.03 57.34 2fkw h ASP 17 Cb 0.68 -0.15 -0.06 0.00 1.72 0.00 0.00 39.33 41.52 2fkw h ASP 17 CO 0.05 0.69 0.65 1.23 -2.88 0.00 0.00 179.24 178.97 2fkw h GLY 18 N 0.42 1.49 1.10 -0.78 0.00 -0.79 -0.30 103.07 104.21 2fkw h GLY 18 Ca 0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 2fkw h GLY 18 CO 0.01 0.38 0.30 -0.84 0.00 0.00 0.00 176.54 176.39 2fkw h THR 19 N 1.21 1.25 -0.43 4.70 2.02 -0.97 -1.14 112.91 119.55 2fkw h THR 19 Ca 0.41 -0.80 -0.08 0.00 0.77 0.00 0.00 66.41 66.70 2fkw h THR 19 Cb 0.09 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2fkw h THR 19 CO -0.15 0.33 -0.06 0.03 0.37 0.00 0.00 175.52 176.04 2fkw h ARG 20 N 1.11 0.81 -0.50 6.66 3.08 -0.54 0.56 114.38 125.56 2fkw h ARG 20 Ca 0.26 -0.29 0.06 0.00 0.07 0.00 0.00 59.98 60.08 2fkw h ARG 20 Cb 0.21 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 2fkw h ARG 20 CO -0.02 0.90 0.21 0.28 -1.07 0.00 0.00 179.97 180.27 2fkw h VAL 21 N 0.64 0.88 -0.39 2.04 2.07 -0.92 0.55 116.25 121.11 2fkw h VAL 21 Ca 0.12 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2fkw h VAL 21 Cb 0.58 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 2fkw h VAL 21 CO 0.03 0.07 0.22 0.15 0.02 0.00 0.00 177.57 178.07 2fkw h PHE 22 N 0.41 0.42 -0.41 1.57 3.57 -0.95 -1.86 116.94 119.68 2fkw h PHE 22 Ca 0.23 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.78 2fkw h PHE 22 Cb 0.21 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 2fkw h PHE 22 CO -0.14 0.24 0.21 1.25 -2.23 0.00 0.00 178.31 177.64 2fkw h LEU 23 N 0.45 0.31 -0.01 0.59 5.85 -0.48 -0.69 115.31 121.34 2fkw h LEU 23 Ca 0.16 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.92 2fkw h LEU 23 Cb 0.02 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2fkw h LEU 23 CO -0.08 0.22 -0.16 1.23 -0.34 0.00 0.00 178.44 179.31 2fkw h GLY 24 N 0.42 -0.20 1.26 3.75 0.00 -0.55 0.24 103.07 107.99 2fkw h GLY 24 Ca 0.18 0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.65 2fkw h GLY 24 CO -0.12 -0.15 0.20 1.41 0.00 0.00 0.00 176.54 177.88 2fkw h LEU 25 N -0.26 0.87 -0.92 3.11 3.38 -1.30 -2.37 115.31 117.82 2fkw h LEU 25 Ca 0.05 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2fkw h LEU 25 Cb 0.33 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2fkw h LEU 25 CO -0.16 0.81 0.08 0.00 0.09 0.00 0.00 178.44 179.27 2fkw h ALA 26 N 1.31 1.12 -0.35 1.53 0.00 -0.29 0.07 119.26 122.63 2fkw h ALA 26 Ca 0.21 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 2fkw h ALA 26 Cb 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2fkw h ALA 26 CO -0.01 0.58 -0.10 -0.07 0.00 0.00 0.00 179.25 179.65 2fkw h LEU 27 N 0.83 0.70 -0.34 0.00 3.38 -0.27 0.16 115.31 119.76 2fkw h LEU 27 Ca 0.17 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.80 2fkw h LEU 27 Cb 0.38 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2fkw h LEU 27 CO 0.01 0.91 0.15 0.58 0.09 0.00 0.00 178.44 180.18 2fkw h VAL 28 N 0.48 0.95 -0.91 1.22 2.07 -1.05 -0.37 116.25 118.64 2fkw h VAL 28 Ca 0.09 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2fkw h VAL 28 Cb 0.61 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 2fkw h VAL 28 CO 0.04 0.06 0.57 0.00 0.02 0.00 0.00 177.57 178.26 2fkw h ALA 29 N 1.20 1.29 -0.24 1.67 0.00 -0.66 0.19 119.26 122.71 2fkw h ALA 29 Ca 0.15 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 2fkw h ALA 29 Cb 0.09 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2fkw h ALA 29 CO -0.12 0.63 -0.45 0.45 0.00 0.00 0.00 179.25 179.75 2fkw h HIS 30 N 1.25 0.73 -0.42 0.00 -0.00 -0.08 -0.65 115.15 115.98 2fkw h HIS 30 Ca 0.33 -0.23 -0.06 0.00 -0.00 0.00 0.00 60.37 60.42 2fkw h HIS 30 Cb -0.09 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.41 27.15 2fkw h HIS 30 CO 0.00 0.95 0.04 0.35 -0.00 0.00 0.00 177.93 179.27 2fkw h PHE 31 N 0.49 0.77 -0.77 2.45 3.57 -0.23 0.18 116.94 123.39 2fkw h PHE 31 Ca 0.03 -0.12 0.04 0.00 3.53 0.00 0.00 57.97 61.45 2fkw h PHE 31 Cb 0.98 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.47 2fkw h PHE 31 CO 0.04 0.75 0.51 -0.07 -2.23 0.00 0.00 178.31 177.31 2fkw h LEU 32 N 0.56 0.81 -0.21 0.59 3.38 -0.45 -0.36 115.31 119.63 2fkw h LEU 32 Ca 0.12 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.87 2fkw h LEU 32 Cb 0.42 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2fkw h LEU 32 CO 0.01 0.55 -0.92 0.00 0.09 0.00 0.00 178.44 178.18 2fkw h ALA 33 N 1.55 0.41 -0.51 1.53 0.00 -0.53 -0.16 119.26 121.55 2fkw h ALA 33 Ca 0.31 -0.72 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2fkw h ALA 33 Cb 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2fkw h ALA 33 CO -0.09 0.85 0.33 0.35 0.00 0.00 0.00 179.25 180.69 2fkw h PHE 34 N 0.19 0.62 -0.24 0.00 3.57 -0.34 -2.76 116.94 117.98 2fkw h PHE 34 Ca -0.07 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 2fkw h PHE 34 Cb 1.56 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 40.08 2fkw h PHE 34 CO 0.05 0.38 -0.17 0.77 -2.23 0.00 0.00 178.31 177.11 2fkw h SER 35 N 0.67 0.57 -0.03 0.41 0.02 -0.90 -3.30 113.55 110.98 2fkw h SER 35 Ca 0.19 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2fkw h SER 35 Cb -0.05 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.33 2fkw h SER 35 CO -0.06 0.88 0.00 0.00 -1.14 0.00 0.00 176.83 176.52 2fkw n ALA 36 N -2.44 2.49 -2.61 3.77 0.00 -0.09 -4.96 120.51 116.68 2fkw n ALA 36 Ca -0.04 -0.63 -0.16 0.00 0.00 0.00 0.00 53.44 52.60 2fkw n ALA 36 Cb 0.38 -0.90 -0.11 0.00 0.00 0.00 0.00 19.45 18.82 2fkw n ALA 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2fkw s THR 37 N -1.99 1.03 -1.22 0.00 2.01 -1.04 -5.02 115.64 109.41 2fkw s THR 37 Ca 0.31 -1.47 0.13 0.00 0.31 0.00 0.00 61.69 60.96 2fkw s THR 37 Cb 0.20 -1.20 0.16 0.00 0.01 0.00 0.00 72.50 71.67 2fkw s THR 37 CO 0.31 -0.39 1.36 -2.65 -0.69 0.00 0.00 174.62 172.56 2fkw n PRO 38 N 0.91 0.09 -1.69 4.92 -0.02 -1.26 -4.72 135.00 133.24 2fkw n PRO 38 Ca -0.19 0.22 -0.44 0.00 -2.02 0.00 0.00 63.50 61.08 2fkw n PRO 38 Cb 0.56 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.50 2fkw n PRO 38 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 2fkw n TRP 39 N -1.39 2.51 -1.45 6.00 -0.00 -1.26 -0.75 117.44 121.10 2fkw n TRP 39 Ca 0.05 0.10 -0.15 0.00 -0.00 0.00 0.00 57.50 57.49 2fkw n TRP 39 Cb 0.12 -2.63 -0.07 0.00 -0.00 0.00 0.00 31.31 28.74 2fkw n TRP 39 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 2fkw n LEU 40 N 4.20 -0.97 0.00 5.87 4.77 -1.26 -4.79 117.00 124.82 2fkw n LEU 40 Ca 0.17 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 2fkw n LEU 40 Cb 0.32 -2.53 0.00 0.00 -2.33 0.00 0.00 43.42 38.89 2fkw n LEU 40 CO 0.65 -0.95 0.00 1.41 -1.33 0.00 0.00 177.39 177.17