#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 7.13 0.44 1.96 1.04 -1.26 -4.94 113.70 118.07 1unc s SER 2 Ca 0.00 2.18 0.14 0.00 0.48 0.00 0.00 55.95 58.75 1unc s SER 2 Cb 0.00 -2.61 1.03 0.00 0.10 0.00 0.00 66.02 64.53 1unc s SER 2 CO 0.00 -0.23 1.99 0.40 0.98 0.00 0.00 173.24 176.38 1unc h ILE 3 N 2.83 0.91 -0.21 -1.02 2.04 -2.05 -0.82 117.51 119.18 1unc h ILE 3 Ca -0.47 -0.14 -0.05 0.00 1.00 0.00 0.00 64.86 65.20 1unc h ILE 3 Cb 1.21 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1unc h ILE 3 CO 0.66 0.07 -0.05 -0.33 0.00 0.00 0.00 178.15 178.49 1unc h GLU 4 N 0.40 0.41 -0.47 2.37 4.39 -2.00 -1.38 114.58 118.31 1unc h GLU 4 Ca 0.26 -0.16 -0.06 0.00 0.34 0.00 0.00 59.36 59.74 1unc h GLU 4 Cb 0.49 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1unc h GLU 4 CO -0.07 0.66 0.05 0.22 -1.16 0.00 0.00 179.01 178.71 1unc h ASP 5 N 0.14 0.70 0.44 1.42 3.58 -1.75 -2.22 116.42 118.73 1unc h ASP 5 Ca 0.05 -0.14 -0.02 0.00 0.42 0.00 0.00 57.03 57.34 1unc h ASP 5 Cb 0.51 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1unc h ASP 5 CO 0.02 0.74 -0.32 0.15 -2.88 0.00 0.00 179.24 176.95 1unc h PHE 6 N 0.71 -0.88 -0.24 0.28 3.57 -1.00 -2.84 116.94 116.54 1unc h PHE 6 Ca 0.15 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.69 1unc h PHE 6 Cb 0.37 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 1unc h PHE 6 CO 0.02 -0.46 -0.02 1.79 -2.23 0.00 0.00 178.31 177.41 1unc h THR 7 N -0.73 0.81 0.00 4.41 1.35 -1.15 -1.74 112.91 115.86 1unc h THR 7 Ca -0.06 -0.02 -0.03 0.00 -0.55 0.00 0.00 66.41 65.76 1unc h THR 7 Cb 0.60 0.75 -0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1unc h THR 7 CO 0.02 0.01 -0.12 0.06 -0.25 0.00 0.00 175.52 175.24 1unc h GLN 8 N 0.05 0.00 -0.63 4.72 3.07 -1.49 0.43 115.11 121.26 1unc h GLN 8 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.85 1unc h GLN 8 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.71 1unc h GLN 8 CO -0.21 0.12 0.00 0.00 0.09 0.00 0.00 178.83 178.84 1unc n ALA 9 N -2.35 2.97 0.00 0.06 0.00 -0.66 -4.46 120.51 116.07 1unc n ALA 9 Ca -0.02 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1unc n ALA 9 Cb 0.22 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1unc n ALA 9 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1unc n PHE 10 N 0.56 -0.29 -1.82 0.00 3.72 -0.90 -5.03 117.46 113.69 1unc n PHE 10 Ca 0.16 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.51 1unc n PHE 10 Cb 0.64 0.16 -0.01 0.00 -0.94 0.00 0.00 39.48 39.33 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 0.37 0.34 3.24 1.37 0.00 0.09 -5.05 105.19 105.55 1unc n GLY 11 Ca 0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.72 1.12 0.30 1.61 0.00 -1.26 -5.12 119.30 112.23 1unc s MET 12 Ca 0.00 -1.54 -0.21 0.00 0.00 0.00 0.00 55.69 53.94 1unc s MET 12 Cb 0.00 -0.26 -0.09 0.00 0.00 0.00 0.00 34.83 34.48 1unc s MET 12 CO 0.00 -0.14 0.83 -0.08 0.00 0.00 0.00 175.02 175.63 1unc s THR 13 N -3.66 4.44 0.33 10.11 -1.32 -1.26 -4.48 115.64 119.79 1unc s THR 13 Ca 0.24 1.45 0.33 0.00 -1.21 0.00 0.00 61.69 62.51 1unc s THR 13 Cb 0.06 -3.84 0.36 0.00 -1.51 0.00 0.00 72.50 67.57 1unc s THR 13 CO 0.04 0.06 2.09 1.55 -2.21 0.00 0.00 174.62 176.15 1unc h PRO 14 N 2.97 0.00 -0.08 7.08 0.13 -1.97 -1.56 132.00 138.57 1unc h PRO 14 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 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 0.06 -0.15 0.00 -0.23 0.00 0.00 178.00 178.32 1unc h ALA 15 N 1.94 0.12 -0.86 -0.56 0.00 -1.98 0.50 119.26 118.41 1unc h ALA 15 Ca -0.00 -0.35 0.07 0.00 0.00 0.00 0.00 54.91 54.63 1unc h ALA 15 Cb 0.36 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1unc h ALA 15 CO 0.01 0.03 0.53 0.00 0.00 0.00 0.00 179.25 179.82 1unc h ALA 16 N 0.49 1.20 0.08 0.00 0.00 -1.92 -1.30 119.26 117.81 1unc h ALA 16 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1unc h ALA 16 Cb 0.74 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1unc h ALA 16 CO 0.03 0.25 -0.04 0.35 0.00 0.00 0.00 179.25 179.84 1unc h PHE 17 N 0.95 -0.11 0.00 0.00 3.57 -1.20 -3.05 116.94 117.09 1unc h PHE 17 Ca 0.38 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 1unc h PHE 17 Cb 0.22 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 1unc h PHE 17 CO -0.04 -0.07 -0.09 0.77 -2.23 0.00 0.00 178.31 176.66 1unc h SER 18 N -0.11 0.00 -0.45 0.41 0.02 -0.30 -2.03 113.55 111.08 1unc h SER 18 Ca -0.01 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.02 1unc h SER 18 Cb 0.09 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1unc h SER 18 CO 0.01 0.09 0.31 0.00 -1.14 0.00 0.00 176.83 176.10 1unc h ALA 19 N 1.91 2.07 -2.27 3.77 0.00 -1.14 -3.43 119.26 120.17 1unc h ALA 19 Ca -0.00 -0.01 -0.49 0.00 0.00 0.00 0.00 54.91 54.41 1unc h ALA 19 Cb 0.16 -0.06 0.04 0.00 0.00 0.00 0.00 17.79 17.93 1unc h ALA 19 CO 0.01 -0.16 0.39 -0.51 0.00 0.00 0.00 179.25 178.98 1unc s LEU 20 N -9.20 3.45 0.33 0.00 1.43 -0.76 -5.01 118.68 108.92 1unc s LEU 20 Ca -0.07 1.56 -0.28 0.00 -1.03 0.00 0.00 54.13 54.31 1unc s LEU 20 Cb 0.19 -4.50 -0.12 0.00 0.03 0.00 0.00 46.19 41.79 1unc s LEU 20 CO 0.73 -0.82 1.32 -0.81 0.23 0.00 0.00 176.35 177.00 1unc n PRO 21 N -2.11 2.17 -0.19 1.29 -0.04 -1.26 -4.78 135.00 130.08 1unc n PRO 21 Ca 0.07 0.76 0.12 0.00 -0.04 0.00 0.00 63.50 64.41 1unc n PRO 21 Cb 0.54 -2.37 0.43 0.00 -0.04 0.00 0.00 33.50 32.06 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 2.79 0.57 -0.30 0.54 9.65 -1.92 -1.55 114.38 124.14 1unc h ARG 22 Ca -0.46 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.36 1unc h ARG 22 Cb 1.28 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.72 1unc h ARG 22 CO 0.64 0.38 0.10 0.11 2.80 0.00 0.00 179.97 184.00 1unc h TRP 23 N 0.58 0.49 0.25 2.20 5.08 -2.00 -2.23 115.95 120.33 1unc h TRP 23 Ca 0.37 -0.05 -0.01 0.00 1.08 0.00 0.00 58.89 60.28 1unc h TRP 23 Cb 0.63 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 26.65 1unc h TRP 23 CO -0.00 0.50 -0.12 -0.22 -1.28 0.00 0.00 178.44 177.32 1unc h LYS 24 N 0.33 -0.32 -0.85 0.12 3.64 -1.68 -0.70 116.57 117.11 1unc h LYS 24 Ca 0.10 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.61 1unc h LYS 24 Cb 0.24 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 32.01 1unc h LYS 24 CO -0.00 0.02 -0.40 0.94 -2.27 0.00 0.00 179.45 177.74 1unc n GLN 25 N -5.07 -0.27 -0.07 1.90 7.27 -0.81 -0.92 117.38 119.41 1unc n GLN 25 Ca -0.09 1.30 -0.14 0.00 0.07 0.00 0.00 57.00 58.14 1unc n GLN 25 Cb 0.26 -1.92 -0.02 0.00 2.41 0.00 0.00 30.24 30.97 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 0.84 -0.84 3.69 1.08 -1.30 -2.97 115.11 115.61 1unc h GLN 26 Ca 0.23 -0.51 0.13 0.00 -1.45 0.00 0.00 58.65 57.05 1unc h GLN 26 Cb 0.44 0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 27.86 1unc h GLN 26 CO -0.83 1.15 0.54 -0.97 -0.95 0.00 0.00 178.83 177.77 1unc h ASN 27 N 0.65 0.61 0.25 1.46 -0.73 0.47 0.25 115.58 118.54 1unc h ASN 27 Ca 0.02 0.03 0.01 0.00 1.87 0.00 0.00 56.30 58.23 1unc h ASN 27 Cb 1.11 -0.09 -0.03 0.00 0.27 0.00 0.00 38.32 39.58 1unc h ASN 27 CO 0.11 0.33 -0.35 -0.07 -0.37 0.00 0.00 177.43 177.08 1unc h LEU 28 N 0.66 -0.98 -0.89 0.34 3.38 -0.86 -0.55 115.31 116.40 1unc h LEU 28 Ca 0.41 0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.37 1unc h LEU 28 Cb 0.65 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1unc h LEU 28 CO -0.17 -0.47 -0.28 0.50 0.09 0.00 0.00 178.44 178.12 1unc h LYS 29 N -0.66 0.50 -0.09 1.13 3.64 -1.44 -1.91 116.57 117.73 1unc h LYS 29 Ca -0.00 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 1unc h LYS 29 Cb 0.64 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1unc h LYS 29 CO -0.13 0.73 -0.18 -0.22 -2.27 0.00 0.00 179.45 177.38 1unc h LYS 30 N 0.43 0.29 -0.66 1.90 3.64 -0.86 -1.21 116.57 120.11 1unc h LYS 30 Ca 0.06 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1unc h LYS 30 Cb 0.71 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 1unc h LYS 30 CO 0.05 0.77 0.28 0.93 -2.27 0.00 0.00 179.45 179.22 1unc h GLU 31 N -0.17 0.96 0.00 1.90 5.08 -1.04 -0.51 114.58 120.80 1unc h GLU 31 Ca 0.00 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1unc h GLU 31 Cb 0.76 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1unc h GLU 31 CO 0.04 0.77 0.00 0.87 -1.00 0.00 0.00 179.01 179.69 1unc h LYS 32 N 0.94 0.00 0.00 2.33 1.57 -1.31 -3.46 116.57 116.64 1unc h LYS 32 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1unc h LYS 32 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1unc h LYS 32 CO -0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.27 1unc n GLY 33 N -0.65 0.78 0.01 3.86 0.00 -0.20 -5.00 105.19 104.00 1unc n GLY 33 Ca -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 0.00 0.99 4.07 -1.42 -3.49 115.31 115.46 1unc h LEU 34 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1unc h LEU 34 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1unc h LEU 34 CO 0.00 0.13 0.00 0.33 -1.08 0.00 0.00 178.44 177.82