#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 -3.36 0.00 5.66 -1.21 -4.16 114.28 111.21 1ce4 n THR 2 Ca 0.00 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.55 1ce4 n THR 2 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1ce4 n THR 2 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1ce4 s ARG 3 N 0.00 4.07 0.00 1.09 3.00 -1.26 -4.91 118.95 120.94 1ce4 s ARG 3 Ca 0.00 -3.15 0.00 0.00 -1.00 0.00 0.00 55.73 51.58 1ce4 s ARG 3 Cb 0.00 -4.50 0.00 0.00 0.00 0.00 0.00 34.95 30.45 1ce4 s ARG 3 CO 0.00 -1.25 0.00 -0.35 0.00 0.00 0.00 175.30 173.70 1ce4 n PRO 4 N 2.80 0.00 0.00 5.12 -0.04 -1.26 -5.06 135.00 136.56 1ce4 n PRO 4 Ca 0.23 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.69 1ce4 n PRO 4 Cb 0.40 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.86 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 0.00 0.00 -3.73 3.54 3.02 -1.26 -5.08 115.26 111.75 1ce4 n ASN 5 Ca 0.00 -1.00 -0.12 0.00 -0.03 0.00 0.00 54.58 53.43 1ce4 n ASN 5 Cb 0.00 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.05 1ce4 n ASN 5 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ce4 s ASN 6 N 0.00 -0.32 0.00 6.41 4.22 -1.26 -4.90 114.94 119.09 1ce4 s ASN 6 Ca 0.00 0.61 0.00 0.00 -2.14 0.00 0.00 52.86 51.33 1ce4 s ASN 6 Cb 0.00 0.51 0.00 0.00 1.28 0.00 0.00 41.25 43.04 1ce4 s ASN 6 CO 0.00 -0.16 0.00 0.59 -2.04 0.00 0.00 177.10 175.49 1ce4 n ASN 7 N 4.03 0.00 -3.41 3.54 5.03 -1.26 -4.81 115.26 118.38 1ce4 n ASN 7 Ca -0.23 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 54.89 1ce4 n ASN 7 Cb 0.54 -0.05 -0.03 0.00 -1.02 0.00 0.00 39.78 39.22 1ce4 n ASN 7 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 1ce4 n THR 8 N -0.28 2.34 -3.80 3.41 5.66 -1.26 -4.85 114.28 115.52 1ce4 n THR 8 Ca 0.00 -1.68 -0.22 0.00 -3.05 0.00 0.00 64.05 59.10 1ce4 n THR 8 Cb 0.00 -2.27 -0.05 0.00 -1.55 0.00 0.00 70.33 66.46 1ce4 n THR 8 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1ce4 s ARG 9 N 4.00 2.48 -0.94 1.09 1.81 -1.26 -4.97 118.95 121.16 1ce4 s ARG 9 Ca 0.49 -1.56 -0.17 0.00 -1.72 0.00 0.00 55.73 52.77 1ce4 s ARG 9 Cb 0.13 -2.28 0.16 0.00 -0.45 0.00 0.00 34.95 32.51 1ce4 s ARG 9 CO 0.02 -0.09 1.06 0.15 -0.68 0.00 0.00 175.30 175.77 1ce4 s LYS 10 N -4.02 3.67 -0.42 3.54 1.02 -1.26 -4.82 119.74 117.45 1ce4 s LYS 10 Ca 0.44 -2.07 0.10 0.00 0.02 0.00 0.00 55.97 54.46 1ce4 s LYS 10 Cb -0.02 -4.80 0.41 0.00 -0.52 0.00 0.00 37.83 32.91 1ce4 s LYS 10 CO 0.26 -1.63 1.00 0.43 -0.92 0.00 0.00 175.35 174.48 1ce4 n SER 11 N 5.67 3.28 0.09 2.83 7.64 -1.26 -4.92 113.62 126.95 1ce4 n SER 11 Ca 0.23 -3.34 0.02 0.00 1.01 0.00 0.00 58.87 56.79 1ce4 n SER 11 Cb 0.48 -0.51 -0.03 0.00 -1.01 0.00 0.00 64.21 63.14 1ce4 n SER 11 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1ce4 h ILE 12 N 2.60 0.65 0.00 0.44 2.04 -1.87 -3.42 117.51 117.95 1ce4 h ILE 12 Ca 0.13 -2.05 0.00 0.00 1.00 0.00 0.00 64.86 63.94 1ce4 h ILE 12 Cb 0.94 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1ce4 h ILE 12 CO 0.70 0.37 0.00 0.00 0.00 0.00 0.00 178.15 179.22 1ce4 n HIS 13 N -3.04 0.00 0.00 1.37 1.44 -1.26 -4.80 115.22 108.93 1ce4 n HIS 13 Ca -0.04 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.67 1ce4 n HIS 13 Cb 0.77 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.88 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 -0.00 -1.26 -4.85 119.36 113.86 1ce4 n ILE 14 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1ce4 n ILE 14 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 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 1.74 0.20 7.39 0.00 -1.26 -4.71 105.19 108.54 1ce4 n GLY 15 Ca 0.00 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.40 -1.68 1.61 0.13 -2.03 -3.29 132.00 126.34 1ce4 h PRO 16 Ca 0.00 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1ce4 h PRO 16 Cb 0.00 0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.22 1ce4 h PRO 16 CO 0.00 -0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.10 1ce4 n GLY 17 N -0.34 1.38 0.36 1.56 0.00 -1.26 -4.60 105.19 102.30 1ce4 n GLY 17 Ca -0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 1.49 0.72 0.00 1.61 9.65 -1.89 -1.41 114.38 124.55 1ce4 h ARG 18 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1ce4 h ARG 18 Cb 0.58 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 1ce4 h ARG 18 CO 0.00 0.48 0.00 0.00 2.80 0.00 0.00 179.97 183.25 1ce4 n ALA 19 N -2.44 2.04 1.05 2.80 0.00 -1.26 -0.64 120.51 122.07 1ce4 n ALA 19 Ca 0.14 -0.09 0.11 0.00 0.00 0.00 0.00 53.44 53.60 1ce4 n ALA 19 Cb 0.35 -1.31 0.07 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.26 0.00 -0.04 0.00 -1.74 -0.53 -4.98 117.46 108.91 1ce4 n PHE 20 Ca 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.99 1ce4 n PHE 20 Cb 0.14 -0.03 0.00 0.00 1.52 0.00 0.00 39.48 41.11 1ce4 n PHE 20 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 1ce4 n TYR 21 N -0.27 -0.04 -1.75 2.97 4.01 0.19 -3.88 117.16 118.40 1ce4 n TYR 21 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1ce4 n TYR 21 Cb 0.43 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 1ce4 n TYR 21 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1ce4 n THR 22 N -0.04 -9.50 0.05 -0.72 -2.24 -1.26 -4.34 114.28 96.23 1ce4 n THR 22 Ca 0.00 2.71 -0.13 0.00 -2.27 0.00 0.00 64.05 64.36 1ce4 n THR 22 Cb 0.00 -4.35 -0.07 0.00 -2.10 0.00 0.00 70.33 63.81 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 3.30 0.15 -0.70 4.28 1.35 -1.97 0.22 112.91 119.55 1ce4 h THR 23 Ca 0.00 0.00 0.28 0.00 -0.55 0.00 0.00 66.41 66.14 1ce4 h THR 23 Cb 0.00 0.15 -0.13 0.00 -1.73 0.00 0.00 68.15 66.44 1ce4 h THR 23 CO 0.00 0.00 0.33 0.61 -0.25 0.00 0.00 175.52 176.21 1ce4 n GLY 24 N -1.45 -0.58 0.12 5.82 0.00 -1.26 -0.33 105.19 107.51 1ce4 n GLY 24 Ca -0.06 0.58 -0.03 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.22 -0.55 1.61 4.57 -0.77 -1.36 114.58 117.86 1ce4 h GLU 25 Ca 0.57 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.84 1ce4 h GLU 25 Cb 1.47 0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 30.05 1ce4 h GLU 25 CO -0.55 -0.15 0.20 -0.84 -1.18 0.00 0.00 179.01 176.50 1ce4 h ILE 26 N -0.77 0.81 -0.04 2.32 3.07 -0.94 0.24 117.51 122.20 1ce4 h ILE 26 Ca -0.02 -0.13 -0.17 0.00 1.55 0.00 0.00 64.86 66.09 1ce4 h ILE 26 Cb 0.17 0.39 -0.01 0.00 -0.27 0.00 0.00 36.82 37.10 1ce4 h ILE 26 CO 0.04 0.07 -0.72 0.40 -1.05 0.00 0.00 178.15 176.89 1ce4 h ILE 27 N 0.39 1.43 0.11 0.16 5.03 -0.86 0.24 117.51 124.00 1ce4 h ILE 27 Ca 0.27 -2.24 0.02 0.00 -0.12 0.00 0.00 64.86 62.79 1ce4 h ILE 27 Cb 0.30 2.19 -0.05 0.00 -3.03 0.00 0.00 36.82 36.23 1ce4 h ILE 27 CO -0.27 0.66 -0.44 1.23 -0.68 0.00 0.00 178.15 178.65 1ce4 h GLY 28 N 1.61 -0.89 0.36 5.37 0.00 0.04 -0.27 103.07 109.29 1ce4 h GLY 28 Ca -0.02 0.53 0.03 0.00 0.00 0.00 0.00 47.33 47.87 1ce4 h GLY 28 CO 0.11 -0.27 -0.28 -1.80 0.00 0.00 0.00 176.54 174.30 1ce4 h ASP 29 N -0.66 -0.84 -0.44 0.19 3.58 -0.43 0.44 116.42 118.26 1ce4 h ASP 29 Ca 0.02 0.11 0.07 0.00 0.42 0.00 0.00 57.03 57.65 1ce4 h ASP 29 Cb 0.69 0.34 -0.06 0.00 1.72 0.00 0.00 39.33 42.03 1ce4 h ASP 29 CO -0.26 -0.34 0.10 0.40 -2.88 0.00 0.00 179.24 176.26 1ce4 h ILE 30 N -0.42 0.79 -0.65 2.25 1.08 -0.97 -2.27 117.51 117.32 1ce4 h ILE 30 Ca 0.07 -0.08 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1ce4 h ILE 30 Cb 0.51 0.52 -0.04 0.00 -3.07 0.00 0.00 36.82 34.74 1ce4 h ILE 30 CO -0.25 0.04 0.42 0.03 -0.69 0.00 0.00 178.15 177.70 1ce4 h ARG 31 N 0.24 0.82 -0.19 2.37 3.08 -0.11 0.11 114.38 120.71 1ce4 h ARG 31 Ca 0.21 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.27 1ce4 h ARG 31 Cb 0.26 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1ce4 h ARG 31 CO -0.27 0.55 0.72 1.96 -1.07 0.00 0.00 179.97 181.86 1ce4 h GLN 32 N 0.85 0.00 0.00 0.04 4.20 -0.35 0.10 115.11 119.95 1ce4 h GLN 32 Ca 0.25 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.95 1ce4 h GLN 32 Cb -0.06 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1ce4 h GLN 32 CO -0.07 0.00 -0.26 0.00 -0.67 0.00 0.00 178.83 177.83 1ce4 n ALA 33 N -1.84 2.33 -0.64 3.87 0.00 0.19 -3.33 120.51 121.09 1ce4 n ALA 33 Ca 0.03 -2.20 0.00 0.00 0.00 0.00 0.00 53.44 51.28 1ce4 n ALA 33 Cb 0.80 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 -0.87 0.00 0.00 0.00 8.25 -0.12 -5.04 115.22 117.44 1ce4 n HIS 34 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 1ce4 n HIS 34 Cb 0.69 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.81 1ce4 n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98