#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkn s THR 22 N 0.00 2.72 -0.85 2.62 2.01 -1.26 -5.00 115.64 115.88 3dkn s THR 22 Ca 0.00 -1.09 0.08 0.00 0.31 0.00 0.00 61.69 60.99 3dkn s THR 22 Cb 0.00 -2.10 0.43 0.00 0.01 0.00 0.00 72.50 70.84 3dkn s THR 22 CO 0.00 0.42 1.20 0.49 -0.69 0.00 0.00 174.62 176.04 3dkn n PHE 23 N 1.83 1.02 -2.24 4.92 0.99 -1.26 -4.84 117.46 117.89 3dkn n PHE 23 Ca -0.16 -0.37 -0.37 0.00 -0.00 0.00 0.00 57.45 56.55 3dkn n PHE 23 Cb 0.52 -0.27 -0.03 0.00 -1.00 0.00 0.00 39.48 38.70 3dkn n PHE 23 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 3dkn s SER 24 N -0.52 5.63 0.37 4.37 0.01 -1.26 -4.81 113.70 117.50 3dkn s SER 24 Ca 0.29 -0.34 0.16 0.00 1.31 0.00 0.00 55.95 57.38 3dkn s SER 24 Cb 0.21 -2.55 0.90 0.00 0.21 0.00 0.00 66.02 64.79 3dkn s SER 24 CO 0.10 -2.21 1.43 0.50 0.41 0.00 0.00 173.24 173.47 3dkn h LYS 25 N 12.20 0.00 -6.29 12.44 3.64 -2.07 -3.40 116.57 133.10 3dkn h LYS 25 Ca -0.12 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 58.59 3dkn h LYS 25 Cb 1.08 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.73 3dkn h LYS 25 CO 1.26 0.00 -0.70 0.42 -2.27 0.00 0.00 179.45 178.17 3dkn s ILE 26 N -3.46 3.71 -0.13 2.00 1.01 -1.26 -5.12 121.20 117.96 3dkn s ILE 26 Ca -0.02 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3dkn s ILE 26 Cb 0.05 -2.63 -0.01 0.00 0.01 0.00 0.00 42.46 39.88 3dkn s ILE 26 CO 0.15 0.37 -0.16 -0.13 0.00 0.00 0.00 174.94 175.17 3dkn s ARG 27 N -1.50 3.28 -0.14 2.79 1.81 -1.26 -5.11 118.95 118.82 3dkn s ARG 27 Ca 0.18 -0.75 0.01 0.00 -1.72 0.00 0.00 55.73 53.45 3dkn s ARG 27 Cb -0.11 -2.54 0.02 0.00 -0.45 0.00 0.00 34.95 31.86 3dkn s ARG 27 CO 0.08 0.18 -0.16 0.08 -0.68 0.00 0.00 175.30 174.80 3dkn s VAL 28 N 0.41 1.67 -0.19 3.52 1.01 -1.26 -5.11 120.40 120.45 3dkn s VAL 28 Ca -0.12 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 60.89 3dkn s VAL 28 Cb -0.16 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 3dkn s VAL 28 CO 0.06 0.48 0.82 -0.54 0.00 0.00 0.00 175.10 175.92 3dkn s LYS 29 N 1.20 4.26 0.25 2.72 1.02 -1.26 -4.95 119.74 122.99 3dkn s LYS 29 Ca -0.01 0.98 0.13 0.00 0.02 0.00 0.00 55.97 57.09 3dkn s LYS 29 Cb -0.14 -3.59 0.89 0.00 -0.52 0.00 0.00 37.83 34.47 3dkn s LYS 29 CO -0.07 -0.38 1.11 -2.30 -0.92 0.00 0.00 175.35 172.80 3dkn n PRO 30 N 5.44 -0.04 -0.29 -1.68 -0.02 -1.26 0.42 135.00 137.56 3dkn n PRO 30 Ca 0.05 0.98 0.27 0.00 -2.02 0.00 0.00 63.50 62.77 3dkn n PRO 30 Cb 0.48 -1.73 0.61 0.00 -0.02 0.00 0.00 33.50 32.84 3dkn n PRO 30 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3dkn h GLU 31 N 0.00 0.22 0.26 -0.52 3.07 -2.00 -1.17 114.58 114.45 3dkn h GLU 31 Ca 0.57 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.41 3dkn h GLU 31 Cb 1.48 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.34 3dkn h GLU 31 CO -0.56 0.15 -0.13 0.45 -1.40 0.00 0.00 179.01 177.52 3dkn h HIS 32 N 0.23 -0.32 -0.96 4.33 3.86 -0.43 -2.13 115.15 119.72 3dkn h HIS 32 Ca 0.55 -0.01 0.30 0.00 -1.16 0.00 0.00 60.37 60.05 3dkn h HIS 32 Cb 1.72 0.11 -0.15 0.00 1.06 0.00 0.00 27.41 30.14 3dkn h HIS 32 CO -0.00 -0.20 0.41 -0.39 0.86 0.00 0.00 177.93 178.60 3dkn h VAL 33 N -0.60 0.25 0.69 2.45 -1.51 -1.54 0.80 116.25 116.78 3dkn h VAL 33 Ca -0.04 -0.08 -0.03 0.00 -1.23 0.00 0.00 66.70 65.32 3dkn h VAL 33 Cb 0.27 0.00 0.01 0.00 -2.13 0.00 0.00 31.29 29.44 3dkn h VAL 33 CO 0.06 0.04 -0.33 0.40 -1.23 0.00 0.00 177.57 176.51 3dkn h ILE 34 N 0.22 0.32 -0.59 7.19 1.08 -1.28 -0.14 117.51 124.32 3dkn h ILE 34 Ca 0.68 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 65.17 3dkn h ILE 34 Cb 1.52 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 35.55 3dkn h ILE 34 CO -0.67 0.00 0.39 1.23 -0.69 0.00 0.00 178.15 178.41 3dkn h GLY 35 N -0.93 0.79 1.98 5.37 0.00 0.26 0.10 103.07 110.63 3dkn h GLY 35 Ca -0.09 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 46.90 3dkn h GLY 35 CO 0.15 0.25 -0.28 -2.08 0.00 0.00 0.00 176.54 174.59 3dkn h VAL 36 N 0.71 1.21 0.04 4.60 2.07 0.70 -1.75 116.25 123.83 3dkn h VAL 36 Ca 0.23 -0.98 -0.23 0.00 0.82 0.00 0.00 66.70 66.53 3dkn h VAL 36 Cb 0.05 1.51 0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3dkn h VAL 36 CO -0.06 0.28 -0.94 0.74 0.02 0.00 0.00 177.57 177.61 3dkn h THR 37 N 0.03 1.34 -0.01 2.57 2.02 0.65 -2.48 112.91 117.02 3dkn h THR 37 Ca 0.00 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 64.92 3dkn h THR 37 Cb 0.51 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.50 3dkn h THR 37 CO 0.04 0.68 0.06 0.58 0.37 0.00 0.00 175.52 177.25 3dkn h VAL 38 N 0.16 0.11 0.27 3.16 2.07 -0.51 -1.36 116.25 120.14 3dkn h VAL 38 Ca -0.13 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3dkn h VAL 38 Cb 1.63 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 3dkn h VAL 38 CO 0.18 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.65 3dkn h ALA 39 N 1.89 -0.57 -0.88 1.67 0.00 -0.91 -2.38 119.26 118.07 3dkn h ALA 39 Ca 0.01 -0.08 0.21 0.00 0.00 0.00 0.00 54.91 55.05 3dkn h ALA 39 Cb 0.13 0.14 -0.16 0.00 0.00 0.00 0.00 17.79 17.90 3dkn h ALA 39 CO -0.00 -0.54 -0.03 0.74 0.00 0.00 0.00 179.25 179.41 3dkn h PHE 40 N -0.65 -0.14 0.04 0.00 -1.00 -0.86 -0.67 116.94 113.66 3dkn h PHE 40 Ca -0.04 0.07 -0.00 0.00 2.81 0.00 0.00 57.97 60.81 3dkn h PHE 40 Cb 0.27 0.20 -0.00 0.00 3.61 0.00 0.00 35.95 40.03 3dkn h PHE 40 CO 0.05 -0.35 -0.05 0.28 -1.61 0.00 0.00 178.31 176.63 3dkn h VAL 41 N 0.05 0.00 -0.71 -0.55 2.07 -1.39 -2.21 116.25 113.51 3dkn h VAL 41 Ca 0.49 0.00 0.13 0.00 0.82 0.00 0.00 66.70 68.15 3dkn h VAL 41 Cb 0.91 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.55 3dkn h VAL 41 CO -0.83 0.00 -0.26 0.40 0.02 0.00 0.00 177.57 176.91 3dkn h ILE 42 N -0.09 0.20 0.00 4.57 1.08 -0.77 0.90 117.51 123.40 3dkn h ILE 42 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3dkn h ILE 42 Cb 0.08 0.20 -0.00 0.00 -3.07 0.00 0.00 36.82 34.03 3dkn h ILE 42 CO -0.01 0.00 -0.02 0.40 -0.69 0.00 0.00 178.15 177.83 3dkn h ILE 43 N -0.06 0.00 -0.09 -0.67 2.04 -1.07 -1.87 117.51 115.79 3dkn h ILE 43 Ca 0.31 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 66.10 3dkn h ILE 43 Cb 0.56 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 3dkn h ILE 43 CO -0.76 0.00 -0.29 -0.33 0.00 0.00 0.00 178.15 176.77 3dkn h GLU 44 N -0.02 0.16 0.00 2.37 3.07 -1.17 1.94 114.58 120.93 3dkn h GLU 44 Ca -0.00 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.80 3dkn h GLU 44 Cb 0.02 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 3dkn h GLU 44 CO -0.01 0.45 -0.00 0.00 -1.40 0.00 0.00 179.01 178.05 3dkn h ALA 45 N 1.56 1.41 0.00 3.43 0.00 0.97 0.14 119.26 126.77 3dkn h ALA 45 Ca 0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 3dkn h ALA 45 Cb 0.60 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3dkn h ALA 45 CO 0.04 0.00 -1.52 -0.89 0.00 0.00 0.00 179.25 176.88 3dkn n ILE 46 N -3.68 0.52 -0.02 0.00 5.41 -0.72 -3.76 119.36 117.12 3dkn n ILE 46 Ca -0.03 -0.29 0.11 0.00 1.00 0.00 0.00 62.75 63.54 3dkn n ILE 46 Cb 0.08 -0.81 0.52 0.00 -0.71 0.00 0.00 39.64 38.72 3dkn n ILE 46 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 3dkn h LEU 47 N 0.00 0.30 0.00 1.39 5.85 0.33 -3.32 115.31 119.86 3dkn h LEU 47 Ca -0.21 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3dkn h LEU 47 Cb 1.43 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.39 3dkn h LEU 47 CO -0.00 0.19 0.00 0.41 -0.34 0.00 0.00 178.44 178.70 3dkn n THR 48 N -4.47 0.00 -0.73 1.05 -1.04 0.01 -4.97 114.28 104.13 3dkn n THR 48 Ca 0.07 0.38 -0.29 0.00 -2.04 0.00 0.00 64.05 62.17 3dkn n THR 48 Cb 0.31 -1.34 0.26 0.00 -1.82 0.00 0.00 70.33 67.73 3dkn n THR 48 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3dkn n TYR 49 N -2.16 -3.82 -1.59 -1.42 4.02 -1.25 -3.85 117.16 107.09 3dkn n TYR 49 Ca 0.00 -0.89 -0.18 0.00 -0.01 0.00 0.00 57.90 56.81 3dkn n TYR 49 Cb 0.00 -1.14 -0.07 0.00 -0.02 0.00 0.00 39.34 38.11 3dkn n TYR 49 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dkn n GLY 50 N -4.90 1.64 1.95 2.72 0.00 -1.26 -4.58 105.19 100.75 3dkn n GLY 50 Ca 0.14 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 3dkn n GLY 50 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3dkn n ARG 51 N -2.49 0.00 -0.89 1.61 0.00 -1.25 -5.09 116.66 108.55 3dkn n ARG 51 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.66 3dkn n ARG 51 Cb 0.61 -0.70 0.00 0.00 0.00 0.00 0.00 32.46 32.37 3dkn n ARG 51 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97