#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ce4 n THR 2 N 0.00 0.00 -1.23 0.00 5.66 -1.26 -4.92 114.28 112.53 1ce4 n THR 2 Ca 0.00 -1.40 -0.49 0.00 -3.05 0.00 0.00 64.05 59.11 1ce4 n THR 2 Cb 0.00 0.53 -0.08 0.00 -1.55 0.00 0.00 70.33 69.23 1ce4 n THR 2 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 1ce4 n ARG 3 N -0.52 0.00 -1.66 1.09 0.63 -1.26 -4.84 116.66 110.10 1ce4 n ARG 3 Ca -0.02 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.49 1ce4 n ARG 3 Cb 0.36 -1.10 0.01 0.00 0.45 0.00 0.00 32.46 32.18 1ce4 n ARG 3 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1ce4 n PRO 4 N 3.36 1.67 -0.60 -0.14 -0.04 -1.26 -4.34 135.00 133.65 1ce4 n PRO 4 Ca 0.26 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 64.31 1ce4 n PRO 4 Cb -0.04 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.18 1ce4 n PRO 4 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ce4 n ASN 5 N 0.30 -1.01 -3.25 3.54 5.03 -1.26 -2.42 115.26 116.18 1ce4 n ASN 5 Ca 0.08 -0.67 -0.16 0.00 0.87 0.00 0.00 54.58 54.70 1ce4 n ASN 5 Cb 0.39 -0.25 0.01 0.00 -1.02 0.00 0.00 39.78 38.92 1ce4 n ASN 5 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1ce4 n ASN 6 N 2.51 -6.75 -3.55 6.41 3.02 -1.26 0.14 115.26 115.79 1ce4 n ASN 6 Ca 0.00 -0.11 -0.22 0.00 -0.03 0.00 0.00 54.58 54.23 1ce4 n ASN 6 Cb 0.25 -3.81 0.08 0.00 -0.61 0.00 0.00 39.78 35.69 1ce4 n ASN 6 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1ce4 n ASN 7 N -1.22 -4.72 0.00 6.41 0.23 -1.20 -3.81 115.26 110.95 1ce4 n ASN 7 Ca -0.05 -0.58 0.00 0.00 -0.53 0.00 0.00 54.58 53.42 1ce4 n ASN 7 Cb 0.57 -5.03 0.00 0.00 -2.08 0.00 0.00 39.78 33.24 1ce4 n ASN 7 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1ce4 n THR 8 N -4.68 0.00 0.00 5.53 -2.24 -1.02 -4.98 114.28 106.89 1ce4 n THR 8 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1ce4 n THR 8 Cb 0.60 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 1ce4 n THR 8 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ce4 n ARG 9 N -1.76 0.00 0.00 -0.78 1.74 0.12 -4.62 116.66 111.36 1ce4 n ARG 9 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1ce4 n ARG 9 Cb 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.53 1ce4 n ARG 9 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1ce4 n LYS 10 N 0.00 0.00 -2.78 5.56 -0.00 -1.22 -4.80 118.16 114.92 1ce4 n LYS 10 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.21 1ce4 n LYS 10 Cb 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 35.03 35.09 1ce4 n LYS 10 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1ce4 n SER 11 N 0.00 -0.32 0.00 -5.58 7.64 -1.26 -4.94 113.62 109.16 1ce4 n SER 11 Ca 0.00 -2.85 0.13 0.00 1.01 0.00 0.00 58.87 57.16 1ce4 n SER 11 Cb 0.00 0.33 0.67 0.00 -1.01 0.00 0.00 64.21 64.20 1ce4 n SER 11 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1ce4 n ILE 12 N -0.10 0.13 0.00 0.44 2.08 -1.26 -4.80 119.36 115.85 1ce4 n ILE 12 Ca 0.08 0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.42 1ce4 n ILE 12 Cb 0.78 -0.58 0.00 0.00 -0.75 0.00 0.00 39.64 39.09 1ce4 n ILE 12 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ce4 n HIS 13 N -1.32 0.00 -0.64 1.39 1.44 -1.26 -4.86 115.22 109.98 1ce4 n HIS 13 Ca 0.12 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.83 1ce4 n HIS 13 Cb 0.23 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.34 1ce4 n HIS 13 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 1ce4 n ILE 14 N 0.00 0.00 0.00 0.61 5.41 -1.26 -4.97 119.36 119.15 1ce4 n ILE 14 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1ce4 n ILE 14 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1ce4 n ILE 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ce4 n GLY 15 N 0.00 1.38 0.26 7.39 0.00 -1.26 -4.94 105.19 108.02 1ce4 n GLY 15 Ca 0.00 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 1ce4 n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ce4 h PRO 16 N 0.00 -0.43 -2.06 1.61 0.13 -2.03 -2.80 132.00 126.42 1ce4 h PRO 16 Ca 0.00 0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 65.11 1ce4 h PRO 16 Cb 0.00 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.21 1ce4 h PRO 16 CO 0.00 -0.28 -0.07 0.41 -0.23 0.00 0.00 178.00 177.83 1ce4 n GLY 17 N -1.35 2.25 0.49 1.56 0.00 -1.26 -4.73 105.19 102.16 1ce4 n GLY 17 Ca -0.07 -0.30 0.31 0.00 0.00 0.00 0.00 46.02 45.95 1ce4 n GLY 17 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ce4 h ARG 18 N 2.24 0.01 -0.19 1.61 9.65 -1.87 -0.27 114.38 125.57 1ce4 h ARG 18 Ca 0.05 -0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.74 1ce4 h ARG 18 Cb 0.93 -0.00 -0.27 0.00 -1.39 0.00 0.00 29.97 29.23 1ce4 h ARG 18 CO 0.09 0.01 -0.85 0.00 2.80 0.00 0.00 179.97 182.02 1ce4 n ALA 19 N -2.73 3.23 -2.79 2.80 0.00 -1.26 -4.77 120.51 115.00 1ce4 n ALA 19 Ca 0.21 -2.95 -0.01 0.00 0.00 0.00 0.00 53.44 50.69 1ce4 n ALA 19 Cb 1.07 -0.57 0.06 0.00 0.00 0.00 0.00 19.45 20.01 1ce4 n ALA 19 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1ce4 n PHE 20 N -0.40 0.54 0.44 0.00 1.16 -0.12 -4.93 117.46 114.15 1ce4 n PHE 20 Ca 0.16 -2.12 0.00 0.00 -1.87 0.00 0.00 57.45 53.63 1ce4 n PHE 20 Cb 0.91 0.14 0.00 0.00 -1.61 0.00 0.00 39.48 38.92 1ce4 n PHE 20 CO 0.00 0.00 0.00 2.48 -1.87 0.00 0.00 176.76 177.37 1ce4 n TYR 21 N -0.73 0.00 -0.76 2.97 0.18 -1.18 -4.87 117.16 112.77 1ce4 n TYR 21 Ca 0.02 -0.23 0.00 0.00 1.88 0.00 0.00 57.90 59.57 1ce4 n TYR 21 Cb 0.82 -0.17 0.00 0.00 -0.38 0.00 0.00 39.34 39.61 1ce4 n TYR 21 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1ce4 n THR 22 N 0.79 -3.91 0.03 -3.48 -2.24 -1.26 -4.39 114.28 99.81 1ce4 n THR 22 Ca 0.00 0.92 -0.12 0.00 -2.27 0.00 0.00 64.05 62.58 1ce4 n THR 22 Cb 0.23 -2.38 -0.05 0.00 -2.10 0.00 0.00 70.33 66.03 1ce4 n THR 22 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1ce4 h THR 23 N 1.10 0.25 -1.14 4.28 1.35 -1.98 0.23 112.91 117.01 1ce4 h THR 23 Ca 0.00 0.00 0.38 0.00 -0.55 0.00 0.00 66.41 66.24 1ce4 h THR 23 Cb 0.00 0.25 -0.10 0.00 -1.73 0.00 0.00 68.15 66.57 1ce4 h THR 23 CO 0.00 0.00 0.75 0.61 -0.25 0.00 0.00 175.52 176.63 1ce4 n GLY 24 N -1.42 -0.66 0.00 5.82 0.00 -1.26 -0.31 105.19 107.35 1ce4 n GLY 24 Ca -0.04 0.57 -0.00 0.00 0.00 0.00 0.00 46.02 46.55 1ce4 n GLY 24 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ce4 h GLU 25 N 0.00 0.00 0.66 1.61 4.22 -0.80 -3.22 114.58 117.06 1ce4 h GLU 25 Ca 0.68 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 60.09 1ce4 h GLU 25 Cb 2.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.55 1ce4 h GLU 25 CO -0.29 0.00 -0.38 -0.84 -2.18 0.00 0.00 179.01 175.32 1ce4 h ILE 26 N -0.03 0.23 -0.41 2.32 3.07 -0.35 0.27 117.51 122.61 1ce4 h ILE 26 Ca 0.00 0.00 -0.08 0.00 1.55 0.00 0.00 64.86 66.33 1ce4 h ILE 26 Cb 0.00 0.23 -0.01 0.00 -0.27 0.00 0.00 36.82 36.77 1ce4 h ILE 26 CO 0.00 0.00 -0.06 0.40 -1.05 0.00 0.00 178.15 177.44 1ce4 h ILE 27 N -0.97 1.27 -0.45 0.16 5.03 -0.90 0.58 117.51 122.22 1ce4 h ILE 27 Ca -0.09 -1.13 0.05 0.00 -0.12 0.00 0.00 64.86 63.57 1ce4 h ILE 27 Cb 0.77 1.16 -0.06 0.00 -3.03 0.00 0.00 36.82 35.67 1ce4 h ILE 27 CO 0.11 0.38 -0.25 0.61 -0.68 0.00 0.00 178.15 178.32 1ce4 n GLY 28 N -0.26 -1.13 0.16 5.37 0.00 -0.23 -1.51 105.19 107.58 1ce4 n GLY 28 Ca -0.01 0.53 -0.08 0.00 0.00 0.00 0.00 46.02 46.47 1ce4 n GLY 28 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1ce4 h ASP 29 N 0.00 -0.25 -1.00 1.61 1.82 -0.41 -3.37 116.42 114.82 1ce4 h ASP 29 Ca 0.09 -0.17 0.19 0.00 -0.39 0.00 0.00 57.03 56.75 1ce4 h ASP 29 Cb 0.21 0.06 -0.11 0.00 0.68 0.00 0.00 39.33 40.17 1ce4 h ASP 29 CO -0.43 0.27 0.61 0.40 -1.61 0.00 0.00 179.24 178.48 1ce4 h ILE 30 N -1.01 0.71 -0.71 2.25 2.04 -0.28 0.25 117.51 120.76 1ce4 h ILE 30 Ca -0.03 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 1ce4 h ILE 30 Cb 0.40 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.33 1ce4 h ILE 30 CO 0.05 0.14 0.30 0.08 0.00 0.00 0.00 178.15 178.71 1ce4 h ARG 31 N 0.77 1.04 -0.30 2.37 0.11 -1.47 -2.58 114.38 114.31 1ce4 h ARG 31 Ca 0.58 -0.17 0.03 0.00 0.10 0.00 0.00 59.98 60.52 1ce4 h ARG 31 Cb 0.90 -0.18 -0.02 0.00 1.11 0.00 0.00 29.97 31.78 1ce4 h ARG 31 CO -0.38 0.83 0.20 1.96 0.10 0.00 0.00 179.97 182.69 1ce4 h GLN 32 N 1.02 0.29 0.00 0.08 4.20 -0.67 -0.77 115.11 119.26 1ce4 h GLN 32 Ca 0.24 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.93 1ce4 h GLN 32 Cb 0.17 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1ce4 h GLN 32 CO -0.02 0.19 0.00 0.00 -0.67 0.00 0.00 178.83 178.33 1ce4 n ALA 33 N -2.52 2.16 -0.25 3.87 0.00 -0.94 -3.48 120.51 119.35 1ce4 n ALA 33 Ca 0.02 -0.11 0.06 0.00 0.00 0.00 0.00 53.44 53.42 1ce4 n ALA 33 Cb 0.15 -1.36 0.29 0.00 0.00 0.00 0.00 19.45 18.53 1ce4 n ALA 33 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ce4 n HIS 34 N -1.26 1.36 1.74 0.00 8.25 -0.29 -5.08 115.22 119.93 1ce4 n HIS 34 Ca 0.11 -0.50 0.15 0.00 -0.26 0.00 0.00 57.72 57.22 1ce4 n HIS 34 Cb 0.17 -0.32 0.73 0.00 1.12 0.00 0.00 29.99 31.69 1ce4 n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98