#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 3.30 0.00 -3.83 1.13 -1.26 -4.66 117.38 112.06 2fkw n GLN 3 Ca 0.00 -2.69 0.09 0.00 -1.94 0.00 0.00 57.00 52.46 2fkw n GLN 3 Cb 0.00 -2.10 0.43 0.00 0.11 0.00 0.00 30.24 28.67 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 -0.17 -0.91 0.71 1.08 0.00 -1.26 -0.80 105.19 103.85 2fkw n GLY 4 Ca 0.38 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.44 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 -1.33 1.96 -0.10 1.61 4.76 -1.26 -4.41 118.16 119.39 2fkw n LYS 5 Ca 0.07 -1.42 0.18 0.00 -2.87 0.00 0.00 58.31 54.27 2fkw n LYS 5 Cb 0.15 -1.46 0.59 0.00 -1.84 0.00 0.00 35.03 32.48 2fkw n LYS 5 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2fkw h ILE 6 N 3.14 0.76 -0.18 -0.18 6.09 -1.35 -0.31 117.51 125.47 2fkw h ILE 6 Ca 0.00 -0.07 0.00 0.00 -1.37 0.00 0.00 64.86 63.42 2fkw h ILE 6 Cb 0.68 0.52 0.00 0.00 0.47 0.00 0.00 36.82 38.49 2fkw h ILE 6 CO 0.00 0.04 0.00 0.79 -3.07 0.00 0.00 178.15 175.91 2fkw n TRP 7 N -4.43 0.24 0.16 2.19 7.02 -1.26 -0.46 117.44 120.91 2fkw n TRP 7 Ca 0.13 -0.12 0.12 0.00 -1.02 0.00 0.00 57.50 56.60 2fkw n TRP 7 Cb 0.58 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.50 2fkw n TRP 7 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 2fkw h THR 8 N 1.07 0.00 0.00 -0.99 1.35 -1.37 -3.40 112.91 109.57 2fkw h THR 8 Ca 0.00 -0.95 -0.05 0.00 -0.55 0.00 0.00 66.41 64.86 2fkw h THR 8 Cb 0.24 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.14 2fkw h THR 8 CO 0.00 0.00 -1.25 1.33 -0.25 0.00 0.00 175.52 175.35 2fkw n VAL 9 N -2.65 0.19 -4.19 6.82 0.24 -0.64 -4.97 118.33 113.11 2fkw n VAL 9 Ca 0.01 -0.15 -0.34 0.00 -2.04 0.00 0.00 64.34 61.82 2fkw n VAL 9 Cb 0.54 -0.45 -0.11 0.00 -1.47 0.00 0.00 33.84 32.35 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 -2.17 4.37 -0.30 3.34 1.01 0.39 -5.06 120.40 121.97 2fkw s VAL 10 Ca -0.02 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 2fkw s VAL 10 Cb 0.02 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.46 2fkw s VAL 10 CO 0.17 0.48 1.28 0.21 0.00 0.00 0.00 175.10 177.24 2fkw s ASN 11 N 0.36 6.70 0.53 3.32 3.84 -1.26 -4.26 114.94 124.17 2fkw s ASN 11 Ca -0.00 1.18 0.27 0.00 0.21 0.00 0.00 52.86 54.52 2fkw s ASN 11 Cb -0.13 -2.54 1.46 0.00 -0.55 0.00 0.00 41.25 39.49 2fkw s ASN 11 CO 0.01 -1.06 2.08 1.55 -2.79 0.00 0.00 177.10 176.89 2fkw h PRO 12 N 9.18 0.00 -0.73 0.43 0.13 -1.95 0.14 132.00 139.19 2fkw h PRO 12 Ca -0.26 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.99 2fkw h PRO 12 Cb 1.09 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.17 2fkw h PRO 12 CO 1.03 0.11 0.49 0.00 -0.23 0.00 0.00 178.00 179.40 2fkw h ALA 13 N 1.89 1.94 0.05 -0.56 0.00 -2.00 -1.64 119.26 118.95 2fkw h ALA 13 Ca -0.00 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 2fkw h ALA 13 Cb 0.32 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2fkw h ALA 13 CO 0.01 -0.12 -1.83 -0.89 0.00 0.00 0.00 179.25 176.43 2fkw n ILE 14 N -4.49 1.63 0.03 0.00 2.08 -0.02 -4.46 119.36 114.13 2fkw n ILE 14 Ca 0.13 -0.37 -0.08 0.00 0.56 0.00 0.00 62.75 62.99 2fkw n ILE 14 Cb 0.41 -1.84 0.08 0.00 -0.75 0.00 0.00 39.64 37.54 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 0.13 0.50 0.51 7.39 0.00 -0.67 -0.60 103.07 110.33 2fkw h GLY 15 Ca -0.44 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.28 2fkw h GLY 15 CO -0.11 0.52 -0.08 -2.22 0.00 0.00 0.00 176.54 174.66 2fkw h ILE 16 N 0.35 1.44 -0.97 2.60 2.04 -1.54 0.12 117.51 121.55 2fkw h ILE 16 Ca 0.00 -1.42 0.10 0.00 1.00 0.00 0.00 64.86 64.54 2fkw h ILE 16 Cb 1.08 2.31 -0.08 0.00 -0.74 0.00 0.00 36.82 39.39 2fkw h ILE 16 CO 0.10 0.38 0.61 -0.65 0.00 0.00 0.00 178.15 178.59 2fkw h PRO 17 N -0.42 1.00 -0.45 2.37 0.11 -1.73 -1.12 132.00 131.75 2fkw h PRO 17 Ca 0.00 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 65.99 2fkw h PRO 17 Cb 0.66 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.53 2fkw h PRO 17 CO 0.02 0.66 0.03 0.00 -0.21 0.00 0.00 178.00 178.49 2fkw h ALA 18 N 1.49 1.21 0.37 -0.75 0.00 -0.88 0.45 119.26 121.16 2fkw h ALA 18 Ca 0.46 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2fkw h ALA 18 Cb 0.35 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2fkw h ALA 18 CO -0.23 0.53 -0.18 1.25 0.00 0.00 0.00 179.25 180.62 2fkw h LEU 19 N 0.68 -0.43 -0.85 0.00 5.85 -0.23 -0.97 115.31 119.37 2fkw h LEU 19 Ca 0.14 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2fkw h LEU 19 Cb 0.38 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2fkw h LEU 19 CO 0.01 -0.13 0.35 -0.07 -0.34 0.00 0.00 178.44 178.27 2fkw h LEU 20 N -0.74 1.09 -0.49 2.25 3.38 -1.09 0.25 115.31 119.96 2fkw h LEU 20 Ca -0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 2fkw h LEU 20 Cb 0.51 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2fkw h LEU 20 CO 0.08 0.95 0.25 1.23 0.09 0.00 0.00 178.44 181.04 2fkw h GLY 21 N 1.18 0.75 1.05 0.83 0.00 -0.89 -2.13 103.07 103.86 2fkw h GLY 21 Ca 0.27 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 47.13 2fkw h GLY 21 CO -0.03 0.34 -0.21 1.76 0.00 0.00 0.00 176.54 178.40 2fkw h SER 22 N 0.65 0.91 -0.39 0.19 0.02 -0.55 -1.79 113.55 112.59 2fkw h SER 22 Ca 0.17 -0.41 0.01 0.00 -0.84 0.00 0.00 61.79 60.72 2fkw h SER 22 Cb 0.09 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2fkw h SER 22 CO -0.02 1.12 0.26 0.58 -1.14 0.00 0.00 176.83 177.62 2fkw h VAL 23 N 0.70 1.09 -0.60 2.27 2.07 -0.92 -0.28 116.25 120.58 2fkw h VAL 23 Ca 0.09 -0.18 0.02 0.00 0.82 0.00 0.00 66.70 67.45 2fkw h VAL 23 Cb 0.78 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 2fkw h VAL 23 CO 0.06 0.10 0.38 0.74 0.02 0.00 0.00 177.57 178.87 2fkw h THR 24 N 0.52 1.11 -0.84 2.57 2.02 -1.27 -0.96 112.91 116.06 2fkw h THR 24 Ca 0.14 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2fkw h THR 24 Cb -0.05 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 66.59 2fkw h THR 24 CO -0.04 0.14 0.48 0.58 0.37 0.00 0.00 175.52 177.06 2fkw h VAL 25 N 0.77 1.24 -0.28 3.16 2.07 -0.84 0.45 116.25 122.82 2fkw h VAL 25 Ca 0.23 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 2fkw h VAL 25 Cb -0.03 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 2fkw h VAL 25 CO -0.08 0.26 0.02 0.40 0.02 0.00 0.00 177.57 178.20 2fkw h ILE 26 N 1.16 1.25 -0.40 4.57 2.04 -0.51 -0.86 117.51 124.77 2fkw h ILE 26 Ca 0.30 -0.87 0.08 0.00 1.00 0.00 0.00 64.86 65.37 2fkw h ILE 26 Cb -0.00 1.26 -0.08 0.00 -0.74 0.00 0.00 36.82 37.26 2fkw h ILE 26 CO -0.05 0.28 -0.16 0.00 0.00 0.00 0.00 178.15 178.22 2fkw h ALA 27 N 0.85 0.16 -0.59 1.87 0.00 -0.80 0.10 119.26 120.85 2fkw h ALA 27 Ca 0.08 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.18 2fkw h ALA 27 Cb 0.39 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 2fkw h ALA 27 CO 0.01 -0.52 0.34 0.82 0.00 0.00 0.00 179.25 179.90 2fkw h ILE 28 N -0.08 1.02 -0.63 0.00 2.04 -0.54 -1.06 117.51 118.26 2fkw h ILE 28 Ca 0.19 -0.23 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 2fkw h ILE 28 Cb 0.38 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 2fkw h ILE 28 CO -0.45 0.12 0.09 -0.07 0.00 0.00 0.00 178.15 177.84 2fkw h LEU 29 N 0.66 1.01 -0.20 1.44 3.38 -0.11 -0.34 115.31 121.16 2fkw h LEU 29 Ca 0.25 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2fkw h LEU 29 Cb 0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2fkw h LEU 29 CO -0.13 1.03 0.10 0.58 0.09 0.00 0.00 178.44 180.11 2fkw h VAL 30 N 0.96 1.13 -0.62 1.22 2.07 -0.51 0.23 116.25 120.74 2fkw h VAL 30 Ca 0.19 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.40 2fkw h VAL 30 Cb 0.45 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 2fkw h VAL 30 CO 0.02 0.13 0.32 0.45 0.02 0.00 0.00 177.57 178.50 2fkw h HIS 31 N 0.20 0.58 -0.55 1.57 3.86 -0.88 -1.00 115.15 118.92 2fkw h HIS 31 Ca 0.07 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.19 2fkw h HIS 31 Cb 0.11 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.39 2fkw h HIS 31 CO -0.03 0.26 -0.10 -0.07 0.86 0.00 0.00 177.93 178.85 2fkw h LEU 32 N 0.59 1.03 -0.07 2.43 3.38 -0.79 -0.57 115.31 121.31 2fkw h LEU 32 Ca 0.28 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2fkw h LEU 32 Cb 0.21 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2fkw h LEU 32 CO -0.20 1.14 0.04 0.00 0.09 0.00 0.00 178.44 179.51 2fkw h ALA 33 N 0.95 0.09 -0.75 1.53 0.00 -0.17 -1.64 119.26 119.27 2fkw h ALA 33 Ca 0.14 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2fkw h ALA 33 Cb 0.67 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2fkw h ALA 33 CO 0.05 -0.38 0.30 0.82 0.00 0.00 0.00 179.25 180.04 2fkw h ILE 34 N 0.03 1.25 -0.91 0.00 2.04 -1.08 -1.66 117.51 117.18 2fkw h ILE 34 Ca 0.02 -0.79 0.10 0.00 1.00 0.00 0.00 64.86 65.20 2fkw h ILE 34 Cb 0.06 0.37 -0.07 0.00 -0.74 0.00 0.00 36.82 36.45 2fkw h ILE 34 CO -0.00 0.32 0.59 0.25 0.00 0.00 0.00 178.15 179.30 2fkw h LEU 35 N 1.07 0.81 -0.03 1.44 5.85 -1.03 -1.67 115.31 121.76 2fkw h LEU 35 Ca 0.25 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.91 2fkw h LEU 35 Cb 0.20 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2fkw h LEU 35 CO -0.02 0.47 -0.44 0.28 -0.34 0.00 0.00 178.44 178.39 2fkw h SER 36 N 0.89 0.00 -0.04 1.25 0.02 -0.42 -3.37 113.55 111.89 2fkw h SER 36 Ca 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.38 2fkw h SER 36 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 2fkw h SER 36 CO -0.19 0.44 0.00 1.41 -1.14 0.00 0.00 176.83 177.34 2fkw n HIS 37 N -3.22 0.11 -4.24 3.45 8.25 -0.75 -4.97 115.22 113.85 2fkw n HIS 37 Ca 0.02 -0.80 -0.14 0.00 -0.26 0.00 0.00 57.72 56.54 2fkw n HIS 37 Cb 0.70 -0.13 -0.10 0.00 1.12 0.00 0.00 29.99 31.59 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 -2.18 0.82 -0.12 1.59 -4.23 -0.70 -5.01 115.64 105.81 2fkw s THR 38 Ca 0.22 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.92 2fkw s THR 38 Cb 0.19 -2.03 -0.21 0.00 1.34 0.00 0.00 72.50 71.78 2fkw s THR 38 CO 0.03 -0.56 0.54 0.35 -0.54 0.00 0.00 174.62 174.44 2fkw n THR 39 N -0.23 1.03 0.09 3.99 -2.24 -1.26 -4.57 114.28 111.08 2fkw n THR 39 Ca -0.08 -0.70 -0.05 0.00 -2.27 0.00 0.00 64.05 60.95 2fkw n THR 39 Cb 0.62 -0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 68.29 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 0.00 -0.03 4.78 5.08 -1.95 -1.95 115.95 121.88 2fkw h TRP 40 Ca -0.24 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.72 2fkw h TRP 40 Cb 1.67 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.83 2fkw h TRP 40 CO 0.00 0.86 0.00 0.35 -1.28 0.00 0.00 178.44 178.37 2fkw h PHE 41 N 0.00 0.06 -0.86 0.12 3.04 -1.88 -1.09 116.94 116.32 2fkw h PHE 41 Ca -0.01 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.96 2fkw h PHE 41 Cb 1.58 -0.02 -0.05 0.00 2.56 0.00 0.00 35.95 40.03 2fkw h PHE 41 CO 0.00 0.33 0.57 -1.35 -2.02 0.00 0.00 178.31 175.84 2fkw h PRO 42 N -0.23 1.05 -0.32 6.41 0.11 -1.81 -2.42 132.00 134.80 2fkw h PRO 42 Ca 0.01 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.96 2fkw h PRO 42 Cb 0.31 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 2fkw h PRO 42 CO 0.00 0.70 -0.19 0.00 -0.21 0.00 0.00 178.00 178.30 2fkw h ALA 43 N 1.49 1.07 -0.22 -0.75 0.00 -1.27 0.13 119.26 119.72 2fkw h ALA 43 Ca 0.34 -0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2fkw h ALA 43 Cb 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2fkw h ALA 43 CO -0.10 0.57 -0.07 -0.92 0.00 0.00 0.00 179.25 178.73 2fkw h TYR 44 N 0.53 -0.16 -0.43 0.00 3.20 -0.70 -1.67 116.97 117.74 2fkw h TYR 44 Ca 0.08 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.87 2fkw h TYR 44 Cb 0.62 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 2fkw h TYR 44 CO 0.02 -0.12 -0.15 -1.49 -1.64 0.00 0.00 178.16 174.78 2fkw h TRP 45 N -0.03 0.89 -0.15 -3.82 6.55 -1.21 -3.11 115.95 115.08 2fkw h TRP 45 Ca 0.11 -0.18 -0.04 0.00 0.95 0.00 0.00 58.89 59.73 2fkw h TRP 45 Cb 0.19 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.26 2fkw h TRP 45 CO -0.24 0.90 -0.11 0.37 -1.05 0.00 0.00 178.44 178.31 2fkw h GLN 46 N 0.71 0.22 0.00 0.49 5.75 -0.32 -3.48 115.11 118.49 2fkw h GLN 46 Ca 0.11 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 2fkw h GLN 46 Cb 0.65 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.17 2fkw h GLN 46 CO 0.05 0.34 0.00 0.41 -2.65 0.00 0.00 178.83 176.98 2fkw n GLY 47 N -0.95 0.90 3.76 2.39 0.00 -0.67 -4.90 105.19 105.72 2fkw n GLY 47 Ca -0.01 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 2.64 3.55 -0.02 0.00 -1.26 -4.95 105.19 105.15 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 0.54 0.00 0.00 0.00 173.32 173.86 2fkw s VAL 49 N -1.66 4.28 0.00 1.61 0.11 -1.26 -4.88 120.40 118.60 2fkw s VAL 49 Ca 0.00 -1.88 0.00 0.00 -2.93 0.00 0.00 61.98 57.17 2fkw s VAL 49 Cb 0.00 -5.11 0.00 0.00 -1.53 0.00 0.00 36.38 29.74 2fkw s VAL 49 CO 0.00 -1.92 0.08 0.29 -3.33 0.00 0.00 175.10 170.22 2fkw n LYS 50 N 7.90 0.00 -1.40 1.54 4.01 -1.26 -5.10 118.16 123.85 2fkw n LYS 50 Ca 0.44 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.24 2fkw n LYS 50 Cb 0.46 -0.43 0.00 0.00 -0.51 0.00 0.00 35.03 34.55 2fkw n LYS 50 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2fkw n LYS 51 N -0.28 1.39 0.00 1.97 4.76 -1.26 -5.19 118.16 119.55 2fkw n LYS 51 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2fkw n LYS 51 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2fkw n LYS 51 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2fkw n ALA 52 N -3.00 0.00 0.00 7.82 0.00 -1.26 -5.29 120.51 118.78 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