#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1unc s SER 2 N 0.00 3.47 0.30 1.96 1.04 -1.26 -4.84 113.70 114.37 1unc s SER 2 Ca 0.00 0.76 -0.02 0.00 0.48 0.00 0.00 55.95 57.17 1unc s SER 2 Cb 0.00 -1.19 0.45 0.00 0.10 0.00 0.00 66.02 65.38 1unc s SER 2 CO 0.00 -2.55 1.96 0.40 0.98 0.00 0.00 173.24 174.03 1unc h ILE 3 N -1.50 1.21 0.18 -1.02 2.04 -2.05 0.41 117.51 116.78 1unc h ILE 3 Ca -0.48 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 1unc h ILE 3 Cb 1.31 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1unc h ILE 3 CO 0.56 0.21 -0.09 -0.33 0.00 0.00 0.00 178.15 178.50 1unc h GLU 4 N 1.10 -0.24 -0.89 2.37 5.08 -2.00 -1.69 114.58 118.32 1unc h GLU 4 Ca 0.29 0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.72 1unc h GLU 4 Cb -0.11 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.14 1unc h GLU 4 CO -0.06 0.04 0.58 -0.44 -1.00 0.00 0.00 179.01 178.13 1unc h ASP 5 N -0.50 0.93 0.66 1.42 3.32 -1.86 -1.48 116.42 118.90 1unc h ASP 5 Ca -0.03 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 1unc h ASP 5 Cb 0.38 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1unc h ASP 5 CO 0.04 0.61 -0.43 0.15 -1.72 0.00 0.00 179.24 177.89 1unc h PHE 6 N 1.06 -1.16 -0.49 4.55 3.57 -0.80 -0.93 116.94 122.74 1unc h PHE 6 Ca 0.37 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.91 1unc h PHE 6 Cb 0.12 0.42 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 1unc h PHE 6 CO -0.00 -0.64 0.23 1.79 -2.23 0.00 0.00 178.31 177.46 1unc h THR 7 N -1.03 0.92 -0.54 4.41 1.35 -0.90 -0.07 112.91 117.06 1unc h THR 7 Ca -0.09 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 1unc h THR 7 Cb 0.84 0.43 -0.02 0.00 -1.73 0.00 0.00 68.15 67.66 1unc h THR 7 CO 0.07 0.08 0.28 1.56 -0.25 0.00 0.00 175.52 177.26 1unc h GLN 8 N 0.45 0.76 -0.20 4.72 7.50 -1.32 0.53 115.11 127.55 1unc h GLN 8 Ca 0.22 -0.10 -0.13 0.00 0.50 0.00 0.00 58.65 59.14 1unc h GLN 8 Cb 0.16 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.54 1unc h GLN 8 CO -0.18 0.60 -0.42 0.00 -1.50 0.00 0.00 178.83 177.33 1unc h ALA 9 N 1.11 0.89 0.03 3.87 0.00 -0.39 -3.35 119.26 121.43 1unc h ALA 9 Ca 0.19 -0.44 -0.38 0.00 0.00 0.00 0.00 54.91 54.28 1unc h ALA 9 Cb 0.08 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 1unc h ALA 9 CO -0.03 0.64 -2.32 1.19 0.00 0.00 0.00 179.25 178.73 1unc n PHE 10 N -4.02 0.34 -1.85 0.00 3.72 -0.11 -5.00 117.46 110.54 1unc n PHE 10 Ca -0.02 0.08 -0.05 0.00 -0.05 0.00 0.00 57.45 57.41 1unc n PHE 10 Cb 0.52 -1.05 -0.01 0.00 -0.94 0.00 0.00 39.48 38.00 1unc n PHE 10 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1unc n GLY 11 N 2.11 0.32 3.19 1.37 0.00 0.17 -5.04 105.19 107.31 1unc n GLY 11 Ca -0.40 -0.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 1unc n GLY 11 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1unc s MET 12 N -3.77 0.92 0.24 1.61 0.00 -1.25 -5.09 119.30 111.96 1unc s MET 12 Ca 0.00 -1.29 -0.20 0.00 0.00 0.00 0.00 55.69 54.20 1unc s MET 12 Cb 0.00 0.28 -0.08 0.00 0.00 0.00 0.00 34.83 35.03 1unc s MET 12 CO 0.00 -0.28 0.75 -0.08 0.00 0.00 0.00 175.02 175.41 1unc s THR 13 N -3.99 4.54 0.43 10.11 -1.32 -1.26 -4.33 115.64 119.82 1unc s THR 13 Ca 0.18 1.31 0.32 0.00 -1.21 0.00 0.00 61.69 62.28 1unc s THR 13 Cb 0.06 -3.85 0.34 0.00 -1.51 0.00 0.00 72.50 67.55 1unc s THR 13 CO -0.02 0.15 2.13 1.55 -2.21 0.00 0.00 174.62 176.23 1unc h PRO 14 N 3.26 0.00 -0.15 7.08 0.13 -1.97 -1.73 132.00 138.62 1unc h PRO 14 Ca -0.48 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 1unc h PRO 14 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1unc h PRO 14 CO 0.65 0.07 -0.16 0.00 -0.23 0.00 0.00 178.00 178.33 1unc h ALA 15 N 1.93 0.22 -0.90 -0.56 0.00 -1.99 -0.10 119.26 117.86 1unc h ALA 15 Ca -0.00 -0.33 0.07 0.00 0.00 0.00 0.00 54.91 54.65 1unc h ALA 15 Cb 0.27 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 1unc h ALA 15 CO 0.01 0.12 0.56 0.00 0.00 0.00 0.00 179.25 179.93 1unc h ALA 16 N 0.60 1.25 -0.13 0.00 0.00 -1.90 -2.54 119.26 116.54 1unc h ALA 16 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1unc h ALA 16 Cb 0.70 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1unc h ALA 16 CO 0.04 0.28 0.07 0.35 0.00 0.00 0.00 179.25 180.00 1unc h PHE 17 N 0.99 0.14 -0.45 0.00 3.57 -1.11 -2.98 116.94 117.10 1unc h PHE 17 Ca 0.40 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.96 1unc h PHE 17 Cb 0.22 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 1unc h PHE 17 CO -0.03 0.08 0.30 0.77 -2.23 0.00 0.00 178.31 177.21 1unc h SER 18 N 0.15 0.34 -0.15 0.41 0.02 -0.60 -1.76 113.55 111.96 1unc h SER 18 Ca 0.05 -0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.04 1unc h SER 18 Cb -0.01 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1unc h SER 18 CO -0.02 0.23 0.11 0.00 -1.14 0.00 0.00 176.83 176.01 1unc h ALA 19 N 1.75 2.09 -2.26 3.77 0.00 -1.33 -3.43 119.26 119.86 1unc h ALA 19 Ca 0.19 -0.01 -0.48 0.00 0.00 0.00 0.00 54.91 54.62 1unc h ALA 19 Cb 0.28 0.01 0.04 0.00 0.00 0.00 0.00 17.79 18.11 1unc h ALA 19 CO -0.05 -0.19 0.38 -0.51 0.00 0.00 0.00 179.25 178.88 1unc s LEU 20 N -8.82 3.55 0.40 0.00 1.43 -0.66 -5.01 118.68 109.56 1unc s LEU 20 Ca -0.05 1.65 -0.26 0.00 -1.03 0.00 0.00 54.13 54.43 1unc s LEU 20 Cb 0.17 -4.51 -0.11 0.00 0.03 0.00 0.00 46.19 41.77 1unc s LEU 20 CO 0.67 -0.82 1.27 -0.81 0.23 0.00 0.00 176.35 176.89 1unc n PRO 21 N -1.83 1.98 -0.32 1.29 -0.04 -1.26 -4.77 135.00 130.04 1unc n PRO 21 Ca 0.07 0.70 0.06 0.00 -0.04 0.00 0.00 63.50 64.29 1unc n PRO 21 Cb 0.54 -2.36 0.21 0.00 -0.04 0.00 0.00 33.50 31.85 1unc n PRO 21 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1unc h ARG 22 N 2.21 0.80 -0.54 0.54 2.43 -1.94 -1.75 114.38 116.13 1unc h ARG 22 Ca -0.47 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.67 1unc h ARG 22 Cb 1.29 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 1unc h ARG 22 CO 0.61 0.53 0.33 0.11 -1.51 0.00 0.00 179.97 180.04 1unc h TRP 23 N 0.82 0.63 0.55 2.20 5.08 -2.00 -1.82 115.95 121.42 1unc h TRP 23 Ca 0.45 0.02 -0.03 0.00 1.08 0.00 0.00 58.89 60.41 1unc h TRP 23 Cb 0.49 -0.21 0.01 0.00 -3.00 0.00 0.00 29.16 26.45 1unc h TRP 23 CO -0.05 0.37 -0.27 -0.22 -1.28 0.00 0.00 178.44 177.00 1unc h LYS 24 N 0.67 -0.72 -0.76 0.12 3.64 -1.71 -2.21 116.57 115.60 1unc h LYS 24 Ca 0.21 0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.74 1unc h LYS 24 Cb -0.00 0.16 -0.11 0.00 -0.41 0.00 0.00 32.23 31.87 1unc h LYS 24 CO -0.08 -0.45 -0.37 0.94 -2.27 0.00 0.00 179.45 177.22 1unc n GLN 25 N -5.27 -0.25 0.09 1.90 7.27 -0.79 -0.90 117.38 119.43 1unc n GLN 25 Ca -0.10 1.16 -0.07 0.00 0.07 0.00 0.00 57.00 58.06 1unc n GLN 25 Cb 0.30 -1.71 0.03 0.00 2.41 0.00 0.00 30.24 31.27 1unc n GLN 25 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1unc h GLN 26 N 0.00 0.20 -0.68 3.69 4.20 -1.35 -2.78 115.11 118.39 1unc h GLN 26 Ca 0.20 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1unc h GLN 26 Cb 0.39 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1unc h GLN 26 CO -0.74 0.89 0.35 -0.97 -0.67 0.00 0.00 178.83 177.70 1unc h ASN 27 N 0.12 0.85 -0.17 1.46 -1.24 -0.35 -0.12 115.58 116.13 1unc h ASN 27 Ca -0.03 -0.07 0.04 0.00 0.71 0.00 0.00 56.30 56.95 1unc h ASN 27 Cb 1.39 -0.22 -0.05 0.00 0.73 0.00 0.00 38.32 40.18 1unc h ASN 27 CO 0.12 0.70 -0.12 -0.07 -1.29 0.00 0.00 177.43 176.77 1unc h LEU 28 N 0.95 -0.37 -0.77 0.34 3.38 -0.85 -0.30 115.31 117.68 1unc h LEU 28 Ca 0.24 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.20 1unc h LEU 28 Cb 0.05 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1unc h LEU 28 CO -0.04 -0.15 -0.02 0.50 0.09 0.00 0.00 178.44 178.82 1unc h LYS 29 N -0.12 0.91 -0.13 1.13 3.64 -1.42 -1.88 116.57 118.71 1unc h LYS 29 Ca 0.10 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 1unc h LYS 29 Cb 0.27 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1unc h LYS 29 CO -0.24 0.92 0.01 -0.22 -2.27 0.00 0.00 179.45 177.64 1unc h LYS 30 N 0.84 0.23 -0.28 1.90 3.64 -0.72 -0.34 116.57 121.83 1unc h LYS 30 Ca 0.15 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1unc h LYS 30 Cb 0.52 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1unc h LYS 30 CO 0.03 0.45 0.18 0.93 -2.27 0.00 0.00 179.45 178.77 1unc h GLU 31 N -0.02 0.38 0.00 1.90 5.08 -0.99 -1.55 114.58 119.39 1unc h GLU 31 Ca 0.04 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1unc h GLU 31 Cb 0.34 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1unc h GLU 31 CO 0.01 0.26 -0.04 0.87 -1.00 0.00 0.00 179.01 179.11 1unc h LYS 32 N 0.38 0.00 0.00 2.33 1.57 -1.31 -3.47 116.57 116.07 1unc h LYS 32 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1unc h LYS 32 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1unc h LYS 32 CO -0.02 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.31 1unc n GLY 33 N -0.58 0.52 0.11 3.86 0.00 -0.19 -4.96 105.19 103.95 1unc n GLY 33 Ca -0.01 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 1unc n GLY 33 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1unc h LEU 34 N 0.00 -0.13 0.00 0.99 3.38 -1.68 -3.49 115.31 114.38 1unc h LEU 34 Ca 0.00 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1unc h LEU 34 Cb 0.00 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1unc h LEU 34 CO 0.00 0.49 0.00 0.49 0.09 0.00 0.00 178.44 179.51