#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fkw n GLN 3 N 0.00 3.67 0.00 -3.83 1.13 -1.26 -4.64 117.38 112.45 2fkw n GLN 3 Ca 0.00 -3.07 0.11 0.00 -1.94 0.00 0.00 57.00 52.10 2fkw n GLN 3 Cb 0.00 -2.22 0.52 0.00 0.11 0.00 0.00 30.24 28.65 2fkw n GLN 3 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2fkw n GLY 4 N -0.19 -1.07 1.08 1.08 0.00 -1.26 -1.32 105.19 103.51 2fkw n GLY 4 Ca 0.42 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.46 2fkw n GLY 4 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fkw n LYS 5 N -1.35 2.38 -0.15 1.61 5.02 -1.26 -4.41 118.16 120.01 2fkw n LYS 5 Ca 0.09 -2.12 0.12 0.00 -2.02 0.00 0.00 58.31 54.38 2fkw n LYS 5 Cb 0.20 -1.49 0.46 0.00 -0.02 0.00 0.00 35.03 34.18 2fkw n LYS 5 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 2fkw h ILE 6 N 3.78 0.87 -0.09 -0.18 6.09 -1.59 -0.03 117.51 126.35 2fkw h ILE 6 Ca 0.00 -0.17 0.00 0.00 -1.37 0.00 0.00 64.86 63.32 2fkw h ILE 6 Cb 0.85 0.33 0.00 0.00 0.47 0.00 0.00 36.82 38.47 2fkw h ILE 6 CO 0.00 0.09 0.00 0.79 -3.07 0.00 0.00 178.15 175.96 2fkw n TRP 7 N -4.48 0.12 0.61 2.19 7.02 -1.26 -0.26 117.44 121.37 2fkw n TRP 7 Ca 0.12 -0.06 0.12 0.00 -1.02 0.00 0.00 57.50 56.66 2fkw n TRP 7 Cb 0.42 0.00 0.14 0.00 -2.42 0.00 0.00 31.31 29.45 2fkw n TRP 7 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2fkw n THR 8 N -0.26 0.27 -0.01 -0.99 -2.24 -0.03 -4.49 114.28 106.53 2fkw n THR 8 Ca 0.08 -0.24 -0.01 0.00 -2.27 0.00 0.00 64.05 61.60 2fkw n THR 8 Cb 0.11 -0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 2fkw n THR 8 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2fkw n VAL 9 N -2.02 0.19 -3.74 2.28 0.24 -0.49 -4.99 118.33 109.81 2fkw n VAL 9 Ca 0.03 -0.12 -0.35 0.00 -2.04 0.00 0.00 64.34 61.86 2fkw n VAL 9 Cb 0.43 -0.92 -0.08 0.00 -1.47 0.00 0.00 33.84 31.80 2fkw n VAL 9 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2fkw s VAL 10 N -2.07 5.41 -0.29 3.34 1.01 0.64 -5.06 120.40 123.39 2fkw s VAL 10 Ca -0.01 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.89 2fkw s VAL 10 Cb 0.01 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.91 2fkw s VAL 10 CO 0.11 0.46 1.38 0.21 0.00 0.00 0.00 175.10 177.26 2fkw s ASN 11 N 0.21 6.58 0.58 3.32 3.84 -1.26 -4.28 114.94 123.93 2fkw s ASN 11 Ca 0.09 1.27 0.36 0.00 0.21 0.00 0.00 52.86 54.80 2fkw s ASN 11 Cb -0.11 -2.54 1.70 0.00 -0.55 0.00 0.00 41.25 39.75 2fkw s ASN 11 CO -0.01 -1.15 2.11 1.55 -2.79 0.00 0.00 177.10 176.81 2fkw h PRO 12 N 9.73 0.00 -0.20 0.43 0.13 -1.95 0.25 132.00 140.39 2fkw h PRO 12 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2fkw h PRO 12 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2fkw h PRO 12 CO 1.03 0.02 0.12 0.00 -0.23 0.00 0.00 178.00 178.94 2fkw h ALA 13 N 1.98 1.83 0.04 -0.56 0.00 -2.00 -1.29 119.26 119.27 2fkw h ALA 13 Ca -0.00 -0.03 -0.37 0.00 0.00 0.00 0.00 54.91 54.52 2fkw h ALA 13 Cb 0.34 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2fkw h ALA 13 CO 0.00 0.15 -2.10 -0.89 0.00 0.00 0.00 179.25 176.41 2fkw n ILE 14 N -4.49 1.60 -0.07 0.00 2.08 -0.33 -4.58 119.36 113.57 2fkw n ILE 14 Ca 0.00 -0.46 -0.10 0.00 0.56 0.00 0.00 62.75 62.75 2fkw n ILE 14 Cb 0.09 -1.73 0.05 0.00 -0.75 0.00 0.00 39.64 37.30 2fkw n ILE 14 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2fkw h GLY 15 N 0.57 0.82 0.53 7.39 0.00 -0.42 -1.10 103.07 110.86 2fkw h GLY 15 Ca -0.51 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.02 2fkw h GLY 15 CO -0.12 0.73 -0.00 -2.22 0.00 0.00 0.00 176.54 174.93 2fkw h ILE 16 N 0.62 1.38 -0.95 2.60 2.04 -1.47 -0.10 117.51 121.63 2fkw h ILE 16 Ca 0.06 -1.11 0.04 0.00 1.00 0.00 0.00 64.86 64.85 2fkw h ILE 16 Cb 0.91 2.13 -0.05 0.00 -0.74 0.00 0.00 36.82 39.06 2fkw h ILE 16 CO 0.08 0.29 0.62 -0.65 0.00 0.00 0.00 178.15 178.49 2fkw h PRO 17 N -0.47 1.16 -0.85 2.37 0.11 -1.74 0.06 132.00 132.64 2fkw h PRO 17 Ca 0.00 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 2fkw h PRO 17 Cb 0.47 -0.26 -0.04 0.00 0.11 0.00 0.00 31.00 31.28 2fkw h PRO 17 CO 0.00 0.77 0.48 0.00 -0.21 0.00 0.00 178.00 179.04 2fkw h ALA 18 N 1.45 1.09 0.45 -0.75 0.00 -1.08 0.16 119.26 120.57 2fkw h ALA 18 Ca 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2fkw h ALA 18 Cb 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.46 2fkw h ALA 18 CO -0.11 0.59 -0.22 1.25 0.00 0.00 0.00 179.25 180.76 2fkw h LEU 19 N 1.19 -0.52 -1.17 0.00 5.85 -0.39 0.29 115.31 120.56 2fkw h LEU 19 Ca 0.30 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 2fkw h LEU 19 Cb 0.01 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2fkw h LEU 19 CO -0.05 -0.26 0.45 -0.07 -0.34 0.00 0.00 178.44 178.17 2fkw h LEU 20 N -0.76 0.90 -0.27 2.25 3.38 -0.77 -0.84 115.31 119.20 2fkw h LEU 20 Ca -0.06 -0.05 -0.21 0.00 0.09 0.00 0.00 57.88 57.65 2fkw h LEU 20 Cb 0.54 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2fkw h LEU 20 CO 0.10 0.69 -0.79 1.23 0.09 0.00 0.00 178.44 179.77 2fkw h GLY 21 N 1.06 0.61 0.93 0.83 0.00 -0.94 -2.53 103.07 103.03 2fkw h GLY 21 Ca 0.27 -0.90 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 2fkw h GLY 21 CO -0.05 0.80 0.13 1.76 0.00 0.00 0.00 176.54 179.18 2fkw h SER 22 N 0.37 0.38 -0.69 0.19 0.02 -0.53 -0.94 113.55 112.36 2fkw h SER 22 Ca -0.05 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2fkw h SER 22 Cb 1.39 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 2fkw h SER 22 CO 0.15 0.42 0.43 0.58 -1.14 0.00 0.00 176.83 177.26 2fkw h VAL 23 N 0.33 1.19 -0.64 2.27 2.07 -1.19 0.97 116.25 121.25 2fkw h VAL 23 Ca 0.10 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 2fkw h VAL 23 Cb 0.14 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 2fkw h VAL 23 CO -0.01 0.20 0.19 0.74 0.02 0.00 0.00 177.57 178.71 2fkw h THR 24 N 0.94 1.25 -0.67 2.57 2.02 -1.27 -1.09 112.91 116.66 2fkw h THR 24 Ca 0.25 -0.87 -0.05 0.00 0.77 0.00 0.00 66.41 66.51 2fkw h THR 24 Cb -0.05 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 2fkw h THR 24 CO -0.05 0.33 0.23 0.58 0.37 0.00 0.00 175.52 176.98 2fkw h VAL 25 N 0.94 1.25 -0.14 3.16 2.07 -0.41 0.64 116.25 123.76 2fkw h VAL 25 Ca 0.21 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.89 2fkw h VAL 25 Cb 0.31 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2fkw h VAL 25 CO -0.00 0.33 0.08 0.40 0.02 0.00 0.00 177.57 178.39 2fkw h ILE 26 N 0.98 1.02 -0.97 4.57 2.04 -0.51 0.24 117.51 124.87 2fkw h ILE 26 Ca 0.22 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 66.06 2fkw h ILE 26 Cb 0.28 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 37.13 2fkw h ILE 26 CO -0.01 0.03 0.64 0.00 0.00 0.00 0.00 178.15 178.81 2fkw h ALA 27 N 1.06 1.39 -0.51 1.87 0.00 -0.74 0.17 119.26 122.50 2fkw h ALA 27 Ca 0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2fkw h ALA 27 Cb -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2fkw h ALA 27 CO -0.03 0.51 0.27 0.82 0.00 0.00 0.00 179.25 180.82 2fkw h ILE 28 N 1.20 1.18 -0.45 0.00 2.04 -0.41 -2.32 117.51 118.76 2fkw h ILE 28 Ca 0.39 -0.47 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 2fkw h ILE 28 Cb 0.05 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2fkw h ILE 28 CO -0.13 0.20 0.11 -0.07 0.00 0.00 0.00 178.15 178.26 2fkw h LEU 29 N 0.68 0.68 -0.34 1.44 3.38 0.24 -1.69 115.31 119.70 2fkw h LEU 29 Ca 0.18 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2fkw h LEU 29 Cb 0.07 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2fkw h LEU 29 CO -0.03 0.73 0.22 0.58 0.09 0.00 0.00 178.44 180.04 2fkw h VAL 30 N 0.59 1.09 -0.51 1.22 2.07 -0.66 0.15 116.25 120.19 2fkw h VAL 30 Ca 0.14 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2fkw h VAL 30 Cb 0.32 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2fkw h VAL 30 CO 0.00 0.09 0.32 0.45 0.02 0.00 0.00 177.57 178.44 2fkw h HIS 31 N 0.45 0.60 -0.49 1.57 3.86 -1.20 -0.66 115.15 119.29 2fkw h HIS 31 Ca 0.12 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.24 2fkw h HIS 31 Cb -0.05 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.21 2fkw h HIS 31 CO -0.05 0.36 -0.12 -0.07 0.86 0.00 0.00 177.93 178.90 2fkw h LEU 32 N 0.64 0.91 0.25 2.43 3.38 -0.90 -0.32 115.31 121.70 2fkw h LEU 32 Ca 0.20 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2fkw h LEU 32 Cb -0.02 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 2fkw h LEU 32 CO -0.07 1.04 -0.15 0.00 0.09 0.00 0.00 178.44 179.34 2fkw h ALA 33 N 1.04 -0.38 -0.13 1.53 0.00 -0.26 -1.39 119.26 119.66 2fkw h ALA 33 Ca 0.13 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2fkw h ALA 33 Cb 0.65 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2fkw h ALA 33 CO 0.05 -0.72 -0.18 0.82 0.00 0.00 0.00 179.25 179.22 2fkw h ILE 34 N -0.39 1.20 -0.41 0.00 2.04 -0.99 0.39 117.51 119.34 2fkw h ILE 34 Ca -0.02 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 64.90 2fkw h ILE 34 Cb 0.32 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 2fkw h ILE 34 CO 0.03 0.28 0.09 0.25 0.00 0.00 0.00 178.15 178.79 2fkw h LEU 35 N 0.21 0.56 0.00 1.44 5.85 -0.79 -2.07 115.31 120.51 2fkw h LEU 35 Ca 0.04 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2fkw h LEU 35 Cb 0.44 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.33 2fkw h LEU 35 CO 0.03 0.57 -0.66 0.28 -0.34 0.00 0.00 178.44 178.32 2fkw h SER 36 N 0.60 0.00 0.00 1.25 0.02 0.17 -3.38 113.55 112.20 2fkw h SER 36 Ca 0.14 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2fkw h SER 36 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2fkw h SER 36 CO -0.00 0.01 -0.00 1.41 -1.14 0.00 0.00 176.83 177.11 2fkw n HIS 37 N -2.74 0.00 -4.40 3.45 8.25 -0.57 -4.99 115.22 114.23 2fkw n HIS 37 Ca 0.02 -0.50 -0.20 0.00 -0.26 0.00 0.00 57.72 56.77 2fkw n HIS 37 Cb 0.53 -0.05 -0.10 0.00 1.12 0.00 0.00 29.99 31.49 2fkw n HIS 37 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2fkw s THR 38 N -1.01 1.86 -0.15 1.59 -4.23 -0.80 -5.03 115.64 107.87 2fkw s THR 38 Ca 0.00 -2.22 0.20 0.00 -1.18 0.00 0.00 61.69 58.49 2fkw s THR 38 Cb 0.00 -2.22 -0.14 0.00 1.34 0.00 0.00 72.50 71.48 2fkw s THR 38 CO 0.00 -0.47 0.77 0.35 -0.54 0.00 0.00 174.62 174.73 2fkw n THR 39 N -0.49 0.73 0.08 3.99 -2.24 -1.26 -4.52 114.28 110.57 2fkw n THR 39 Ca -0.07 -0.61 -0.08 0.00 -2.27 0.00 0.00 64.05 61.02 2fkw n THR 39 Cb 0.61 -0.41 -0.09 0.00 -2.10 0.00 0.00 70.33 68.34 2fkw n THR 39 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 2fkw h TRP 40 N 0.00 0.11 0.28 4.78 5.08 -1.95 -1.74 115.95 122.50 2fkw h TRP 40 Ca -0.10 -0.07 -0.01 0.00 1.08 0.00 0.00 58.89 59.79 2fkw h TRP 40 Cb 1.29 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 27.45 2fkw h TRP 40 CO 0.00 1.01 -0.13 0.35 -1.28 0.00 0.00 178.44 178.39 2fkw h PHE 41 N 0.02 -0.35 -1.01 0.12 3.04 -1.87 0.50 116.94 117.40 2fkw h PHE 41 Ca -0.03 -0.01 0.16 0.00 3.98 0.00 0.00 57.97 62.07 2fkw h PHE 41 Cb 1.72 0.11 -0.10 0.00 2.56 0.00 0.00 35.95 40.25 2fkw h PHE 41 CO 0.01 -0.01 0.62 -1.00 -2.02 0.00 0.00 178.31 175.92 2fkw h PRO 42 N -0.74 0.84 -0.21 6.41 0.13 -1.79 -1.42 132.00 135.22 2fkw h PRO 42 Ca -0.04 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.97 2fkw h PRO 42 Cb 0.49 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 2fkw h PRO 42 CO 0.06 0.55 -0.18 0.00 -0.23 0.00 0.00 178.00 178.21 2fkw h ALA 43 N 1.60 1.30 -0.41 -0.56 0.00 -0.99 0.26 119.26 120.47 2fkw h ALA 43 Ca 0.55 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.23 2fkw h ALA 43 Cb 0.73 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2fkw h ALA 43 CO -0.33 0.47 0.16 -0.92 0.00 0.00 0.00 179.25 178.62 2fkw h TYR 44 N 0.33 0.28 -0.17 0.00 3.20 0.22 -0.36 116.97 120.48 2fkw h TYR 44 Ca 0.06 0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.76 2fkw h TYR 44 Cb 0.52 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.72 2fkw h TYR 44 CO 0.01 0.11 -0.66 -1.49 -1.64 0.00 0.00 178.16 174.49 2fkw h TRP 45 N 0.33 0.85 -0.31 -3.82 6.55 -1.09 -3.15 115.95 115.31 2fkw h TRP 45 Ca 0.19 -0.34 -0.00 0.00 0.95 0.00 0.00 58.89 59.68 2fkw h TRP 45 Cb 0.16 -0.15 -0.02 0.00 -0.86 0.00 0.00 29.16 28.30 2fkw h TRP 45 CO -0.14 1.13 0.18 0.37 -1.05 0.00 0.00 178.44 178.92 2fkw h GLN 46 N 0.47 0.42 0.00 0.49 5.75 0.12 -3.48 115.11 118.87 2fkw h GLN 46 Ca -0.02 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 2fkw h GLN 46 Cb 1.25 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.71 2fkw h GLN 46 CO 0.13 0.30 0.00 0.41 -2.65 0.00 0.00 178.83 177.02 2fkw n GLY 47 N -1.41 1.01 3.81 2.39 0.00 -0.20 -4.92 105.19 105.87 2fkw n GLY 47 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2fkw n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fkw n GLY 48 N 0.00 2.89 3.32 -0.02 0.00 -1.26 -4.96 105.19 105.16 2fkw n GLY 48 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2fkw n GLY 48 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2fkw n VAL 49 N -1.97 3.85 0.00 1.61 3.14 -1.26 -4.91 118.33 118.79 2fkw n VAL 49 Ca 0.00 -3.87 0.00 0.00 -2.96 0.00 0.00 64.34 57.51 2fkw n VAL 49 Cb 0.00 -2.43 0.00 0.00 -1.06 0.00 0.00 33.84 30.35 2fkw n VAL 49 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2fkw n LYS 50 N 7.42 0.00 0.00 1.45 0.00 -1.26 -5.11 118.16 120.67 2fkw n LYS 50 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 2fkw n LYS 50 Cb 0.44 -0.24 0.00 0.00 -0.00 0.00 0.00 35.03 35.23 2fkw n LYS 50 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2fkw n LYS 51 N 0.00 0.00 0.00 -1.58 4.81 -1.26 -5.07 118.16 115.06 2fkw n LYS 51 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2fkw n LYS 51 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2fkw n LYS 51 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2fkw n ALA 52 N 0.00 0.00 0.00 3.14 0.00 -1.26 -5.32 120.51 117.07 2fkw n ALA 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2fkw n ALA 52 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2fkw n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50