#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 2.89 -4.24 0.00 -1.04 -1.26 -5.00 114.28 105.64 2fkw n THR 2 Ca 0.00 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.05 61.28 2fkw n THR 2 Cb 0.00 -0.88 -0.07 0.00 -1.82 0.00 0.00 70.33 67.56 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 -0.46 3.22 0.90 -4.42 1.43 -1.26 -5.12 118.68 112.97 2fkw s LEU 3 Ca 0.72 -0.69 -0.11 0.00 -1.03 0.00 0.00 54.13 53.02 2fkw s LEU 3 Cb -0.44 -1.72 0.13 0.00 0.03 0.00 0.00 46.19 44.19 2fkw s LEU 3 CO 0.51 -0.10 1.09 0.42 0.23 0.00 0.00 176.35 178.51 2fkw s THR 4 N -2.36 2.66 0.22 5.49 -4.23 -1.26 -4.75 115.64 111.42 2fkw s THR 4 Ca 0.33 0.21 -0.10 0.00 -1.18 0.00 0.00 61.69 60.96 2fkw s THR 4 Cb -0.05 -2.61 0.23 0.00 1.34 0.00 0.00 72.50 71.40 2fkw s THR 4 CO 0.21 -0.28 1.65 0.00 -0.54 0.00 0.00 174.62 175.66 2fkw h ALA 5 N -1.60 0.65 0.06 3.99 0.00 -2.00 0.13 119.26 120.49 2fkw h ALA 5 Ca -0.49 0.21 -0.24 0.00 0.00 0.00 0.00 54.91 54.39 2fkw h ALA 5 Cb 1.28 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 2fkw h ALA 5 CO 0.52 -0.40 -1.09 1.49 0.00 0.00 0.00 179.25 179.77 2fkw h GLU 6 N 0.11 0.17 -0.26 0.00 4.81 -2.00 -1.77 114.58 115.65 2fkw h GLU 6 Ca 0.35 -0.27 -0.14 0.00 -0.13 0.00 0.00 59.36 59.17 2fkw h GLU 6 Cb 0.58 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 2fkw h GLU 6 CO -0.58 1.10 -0.40 1.96 -0.73 0.00 0.00 179.01 180.37 2fkw h GLN 7 N 0.06 0.62 0.27 1.92 4.20 -1.80 -1.44 115.11 118.94 2fkw h GLN 7 Ca -0.08 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.32 2fkw h GLN 7 Cb 1.82 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.59 2fkw h GLN 7 CO 0.17 0.91 -0.23 1.03 -0.67 0.00 0.00 178.83 180.04 2fkw h SER 8 N 0.51 -0.60 -0.58 1.46 0.87 -0.58 -0.29 113.55 114.33 2fkw h SER 8 Ca 0.04 0.05 0.06 0.00 -1.23 0.00 0.00 61.79 60.71 2fkw h SER 8 Cb 0.91 0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 63.02 2fkw h SER 8 CO 0.08 -0.34 0.29 -0.33 -0.53 0.00 0.00 176.83 176.00 2fkw h GLU 9 N -0.51 0.53 -0.19 2.24 4.39 -1.25 0.29 114.58 120.07 2fkw h GLU 9 Ca -0.01 -0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.68 2fkw h GLU 9 Cb 0.46 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 2fkw h GLU 9 CO -0.03 0.35 0.03 0.93 -1.16 0.00 0.00 179.01 179.14 2fkw h GLU 10 N 0.55 0.10 -0.68 2.33 5.08 -1.07 -2.25 114.58 118.64 2fkw h GLU 10 Ca 0.27 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.55 2fkw h GLU 10 Cb 0.20 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2fkw h GLU 10 CO -0.19 0.07 0.15 1.25 -1.00 0.00 0.00 179.01 179.28 2fkw h LEU 11 N 0.10 1.04 -1.66 1.33 5.85 -0.08 -2.59 115.31 119.30 2fkw h LEU 11 Ca 0.09 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2fkw h LEU 11 Cb 0.09 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 2fkw h LEU 11 CO -0.13 1.01 0.11 -0.74 -0.34 0.00 0.00 178.44 178.35 2fkw h HIS 12 N 1.04 0.32 -0.91 1.25 2.76 0.02 -0.15 115.15 119.48 2fkw h HIS 12 Ca 0.21 -0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.49 2fkw h HIS 12 Cb 0.39 -0.11 -0.07 0.00 1.55 0.00 0.00 27.41 29.17 2fkw h HIS 12 CO 0.03 0.25 0.58 0.87 -1.30 0.00 0.00 177.93 178.36 2fkw h LYS 13 N 0.34 0.84 -0.16 5.26 1.57 -1.00 0.22 116.57 123.64 2fkw h LYS 13 Ca 0.09 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 2fkw h LYS 13 Cb 0.05 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 2fkw h LYS 13 CO -0.01 0.56 -0.44 1.88 -0.57 0.00 0.00 179.45 180.87 2fkw h TYR 14 N 0.87 0.47 -0.32 -1.35 -1.99 -1.12 -0.01 116.97 113.52 2fkw h TYR 14 Ca 0.43 -0.14 -0.16 0.00 2.00 0.00 0.00 58.73 60.87 2fkw h TYR 14 Cb 0.48 -0.10 -0.00 0.00 2.00 0.00 0.00 36.73 39.11 2fkw h TYR 14 CO -0.00 0.77 -0.41 0.28 -0.00 0.00 0.00 178.16 178.79 2fkw h VAL 15 N 0.32 1.28 -0.35 -2.88 2.07 -0.86 0.30 116.25 116.13 2fkw h VAL 15 Ca 0.02 -1.59 -0.03 0.00 0.82 0.00 0.00 66.70 65.92 2fkw h VAL 15 Cb 0.91 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 2fkw h VAL 15 CO 0.08 0.52 0.10 0.40 0.02 0.00 0.00 177.57 178.69 2fkw h ILE 16 N 0.62 1.21 -0.25 4.57 1.08 -0.49 0.05 117.51 124.30 2fkw h ILE 16 Ca 0.04 -0.71 -0.01 0.00 -0.39 0.00 0.00 64.86 63.79 2fkw h ILE 16 Cb 1.01 1.01 -0.01 0.00 -3.07 0.00 0.00 36.82 35.76 2fkw h ILE 16 CO 0.10 0.24 0.12 0.44 -0.69 0.00 0.00 178.15 178.36 2fkw h ASP 17 N 0.42 0.33 -0.56 1.72 3.32 -0.84 -0.21 116.42 120.59 2fkw h ASP 17 Ca 0.11 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 2fkw h ASP 17 Cb 0.27 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 2fkw h ASP 17 CO -0.00 0.36 0.29 1.23 -1.72 0.00 0.00 179.24 179.40 2fkw h GLY 18 N 0.28 0.89 0.99 2.75 0.00 -0.18 0.14 103.07 107.94 2fkw h GLY 18 Ca 0.09 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 2fkw h GLY 18 CO -0.01 0.39 0.14 -0.84 0.00 0.00 0.00 176.54 176.22 2fkw h THR 19 N 0.83 1.24 -0.51 4.70 2.02 -0.56 -0.35 112.91 120.28 2fkw h THR 19 Ca 0.21 -0.85 -0.06 0.00 0.77 0.00 0.00 66.41 66.48 2fkw h THR 19 Cb 0.08 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 2fkw h THR 19 CO -0.03 0.31 0.08 0.03 0.37 0.00 0.00 175.52 176.28 2fkw h ARG 20 N 0.75 0.81 -0.50 6.66 3.08 0.17 0.51 114.38 125.87 2fkw h ARG 20 Ca 0.17 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2fkw h ARG 20 Cb 0.32 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2fkw h ARG 20 CO -0.00 0.77 0.27 0.28 -1.07 0.00 0.00 179.97 180.22 2fkw h VAL 21 N 0.77 1.17 -0.11 2.04 2.07 -0.54 0.13 116.25 121.79 2fkw h VAL 21 Ca 0.16 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.28 2fkw h VAL 21 Cb 0.36 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2fkw h VAL 21 CO 0.01 0.18 -0.06 0.15 0.02 0.00 0.00 177.57 177.87 2fkw h PHE 22 N 0.66 -0.14 -0.70 1.57 3.57 -0.29 -1.96 116.94 119.65 2fkw h PHE 22 Ca 0.17 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 2fkw h PHE 22 Cb 0.05 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 2fkw h PHE 22 CO -0.02 -0.10 0.44 1.25 -2.23 0.00 0.00 178.31 177.65 2fkw h LEU 23 N -0.05 0.72 0.07 0.59 5.85 -0.46 -0.02 115.31 122.00 2fkw h LEU 23 Ca 0.06 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.80 2fkw h LEU 23 Cb 0.15 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 2fkw h LEU 23 CO -0.14 0.50 -0.20 1.23 -0.34 0.00 0.00 178.44 179.48 2fkw h GLY 24 N 0.85 -0.33 1.53 3.75 0.00 -0.71 0.50 103.07 108.66 2fkw h GLY 24 Ca 0.28 0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.78 2fkw h GLY 24 CO -0.11 -0.18 -0.04 1.41 0.00 0.00 0.00 176.54 177.62 2fkw h LEU 25 N -0.36 0.55 -0.65 3.11 3.38 -1.10 -2.25 115.31 117.99 2fkw h LEU 25 Ca 0.04 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2fkw h LEU 25 Cb 0.40 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2fkw h LEU 25 CO -0.14 0.65 0.10 0.00 0.09 0.00 0.00 178.44 179.14 2fkw h ALA 26 N 1.42 0.86 -0.03 1.53 0.00 0.04 0.13 119.26 123.21 2fkw h ALA 26 Ca 0.11 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2fkw h ALA 26 Cb 0.41 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2fkw h ALA 26 CO 0.02 0.63 0.01 -0.07 0.00 0.00 0.00 179.25 179.84 2fkw h LEU 27 N 0.99 0.02 -0.30 0.00 3.38 0.51 0.21 115.31 120.12 2fkw h LEU 27 Ca 0.20 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.23 2fkw h LEU 27 Cb 0.44 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 2fkw h LEU 27 CO 0.01 0.02 -0.07 0.58 0.09 0.00 0.00 178.44 179.07 2fkw h VAL 28 N 0.03 0.70 -0.47 1.22 2.07 -0.91 0.67 116.25 119.57 2fkw h VAL 28 Ca 0.01 -0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.59 2fkw h VAL 28 Cb 0.00 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 2fkw h VAL 28 CO -0.01 0.00 0.19 0.00 0.02 0.00 0.00 177.57 177.77 2fkw h ALA 29 N 1.30 0.58 -0.48 1.67 0.00 -0.14 0.24 119.26 122.43 2fkw h ALA 29 Ca 0.14 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2fkw h ALA 29 Cb 0.22 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2fkw h ALA 29 CO -0.31 -0.20 -0.10 0.45 0.00 0.00 0.00 179.25 179.10 2fkw h HIS 30 N 0.37 0.97 -0.06 0.00 -0.00 0.10 0.14 115.15 116.67 2fkw h HIS 30 Ca 0.22 -0.18 0.02 0.00 -0.00 0.00 0.00 60.37 60.43 2fkw h HIS 30 Cb 0.20 -0.25 -0.03 0.00 -0.00 0.00 0.00 27.41 27.34 2fkw h HIS 30 CO -0.14 0.93 -0.08 0.35 -0.00 0.00 0.00 177.93 178.98 2fkw h PHE 31 N 0.79 -0.20 -0.97 2.45 3.57 0.12 0.50 116.94 123.20 2fkw h PHE 31 Ca 0.13 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.73 2fkw h PHE 31 Cb 0.61 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.38 2fkw h PHE 31 CO 0.04 -0.13 0.62 -0.07 -2.23 0.00 0.00 178.31 176.54 2fkw h LEU 32 N -0.11 0.95 -0.34 0.59 3.38 -0.37 -1.10 115.31 118.31 2fkw h LEU 32 Ca 0.05 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 2fkw h LEU 32 Cb 0.19 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2fkw h LEU 32 CO -0.13 0.58 -0.25 0.00 0.09 0.00 0.00 178.44 178.72 2fkw h ALA 33 N 1.50 0.49 -0.74 1.53 0.00 0.04 0.35 119.26 122.42 2fkw h ALA 33 Ca 0.44 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2fkw h ALA 33 Cb 0.29 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2fkw h ALA 33 CO -0.19 0.48 0.49 0.35 0.00 0.00 0.00 179.25 180.38 2fkw h PHE 34 N 0.54 0.92 -0.44 0.00 3.57 0.38 -2.53 116.94 119.39 2fkw h PHE 34 Ca 0.06 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 2fkw h PHE 34 Cb 0.82 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 2fkw h PHE 34 CO 0.07 0.57 -0.05 0.77 -2.23 0.00 0.00 178.31 177.44 2fkw h SER 35 N 0.99 0.80 0.06 0.41 0.02 -0.87 -3.30 113.55 111.66 2fkw h SER 35 Ca 0.28 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2fkw h SER 35 Cb -0.09 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.23 2fkw h SER 35 CO -0.07 0.95 -0.52 0.00 -1.14 0.00 0.00 176.83 176.05 2fkw n ALA 36 N -2.44 3.67 -2.63 3.77 0.00 0.08 -4.97 120.51 117.99 2fkw n ALA 36 Ca -0.00 -0.58 -0.16 0.00 0.00 0.00 0.00 53.44 52.70 2fkw n ALA 36 Cb 0.34 -0.87 -0.11 0.00 0.00 0.00 0.00 19.45 18.80 2fkw n ALA 36 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2fkw s THR 37 N -2.59 1.02 -1.13 0.00 -1.32 -0.96 -5.02 115.64 105.63 2fkw s THR 37 Ca 0.18 -1.44 0.10 0.00 -1.21 0.00 0.00 61.69 59.31 2fkw s THR 37 Cb 0.18 -1.17 0.11 0.00 -1.51 0.00 0.00 72.50 70.11 2fkw s THR 37 CO 0.62 -0.37 1.28 -2.65 -2.21 0.00 0.00 174.62 171.28 2fkw n PRO 38 N 0.98 0.04 -1.67 7.08 -0.02 -1.26 -4.70 135.00 135.45 2fkw n PRO 38 Ca -0.19 0.29 -0.46 0.00 -2.02 0.00 0.00 63.50 61.13 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 -1.44 2.26 -0.90 6.00 -0.00 -1.26 -1.09 117.44 121.00 2fkw n TRP 39 Ca 0.03 0.31 0.00 0.00 -0.00 0.00 0.00 57.50 57.84 2fkw n TRP 39 Cb 0.10 -2.52 0.00 0.00 -0.00 0.00 0.00 31.31 28.89 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 3.05 0.78 0.00 5.87 4.77 -1.26 -4.81 117.00 125.40 2fkw n LEU 40 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2fkw n LEU 40 Cb 0.30 -1.83 0.00 0.00 -2.33 0.00 0.00 43.42 39.56 2fkw n LEU 40 CO 0.63 -0.68 0.00 1.41 -1.33 0.00 0.00 177.39 177.42