#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 4.39 0.22 1.96 1.04 -1.26 -4.88 113.70 115.17 1unc s SER 2 Ca 0.00 0.64 -0.09 0.00 0.48 0.00 0.00 55.95 56.98 1unc s SER 2 Cb 0.00 -1.10 0.24 0.00 0.10 0.00 0.00 66.02 65.26 1unc s SER 2 CO 0.00 -1.95 1.83 0.40 0.98 0.00 0.00 173.24 174.51 1unc h ILE 3 N -1.03 1.04 -0.25 -1.02 1.08 -2.06 -0.90 117.51 114.37 1unc h ILE 3 Ca -0.45 -0.28 -0.06 0.00 -0.39 0.00 0.00 64.86 63.67 1unc h ILE 3 Cb 1.31 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 1unc h ILE 3 CO 0.61 0.15 -0.09 -0.33 -0.69 0.00 0.00 178.15 177.81 1unc h GLU 4 N 0.83 0.50 -0.55 2.37 4.39 -2.00 -2.89 114.58 117.22 1unc h GLU 4 Ca 0.31 -0.20 0.05 0.00 0.34 0.00 0.00 59.36 59.86 1unc h GLU 4 Cb 0.11 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.69 1unc h GLU 4 CO -0.15 0.74 0.28 0.22 -1.16 0.00 0.00 179.01 178.94 1unc h ASP 5 N 0.23 0.40 0.46 1.42 1.82 -1.84 -1.31 116.42 117.60 1unc h ASP 5 Ca 0.06 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.72 1unc h ASP 5 Cb 0.57 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.51 1unc h ASP 5 CO 0.03 0.27 -0.50 0.15 -1.61 0.00 0.00 179.24 177.58 1unc h PHE 6 N 0.54 -1.39 -0.47 0.28 3.57 -1.10 0.03 116.94 118.38 1unc h PHE 6 Ca 0.25 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.77 1unc h PHE 6 Cb 0.16 0.55 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 1unc h PHE 6 CO -0.10 -0.66 0.31 1.79 -2.23 0.00 0.00 178.31 177.42 1unc h THR 7 N -0.97 1.12 -0.69 4.41 1.35 -1.38 -2.62 112.91 114.11 1unc h THR 7 Ca -0.05 -0.22 -0.02 0.00 -0.55 0.00 0.00 66.41 65.56 1unc h THR 7 Cb 0.86 0.42 -0.03 0.00 -1.73 0.00 0.00 68.15 67.67 1unc h THR 7 CO -0.09 0.12 0.35 1.56 -0.25 0.00 0.00 175.52 177.21 1unc h GLN 8 N 0.64 0.99 0.00 4.72 4.20 -1.16 0.16 115.11 124.66 1unc h GLN 8 Ca 0.17 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1unc h GLN 8 Cb -0.07 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.52 1unc h GLN 8 CO -0.04 0.77 -0.04 0.00 -0.67 0.00 0.00 178.83 178.85 1unc h ALA 9 N 1.17 1.00 0.00 3.87 0.00 -0.63 -3.36 119.26 121.32 1unc h ALA 9 Ca 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1unc h ALA 9 Cb 0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1unc h ALA 9 CO -0.03 0.05 -1.11 1.19 0.00 0.00 0.00 179.25 179.35 1unc n PHE 10 N -3.15 0.00 -1.15 0.00 3.72 -1.05 -5.04 117.46 110.79 1unc n PHE 10 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 1unc n PHE 10 Cb 0.35 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 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 3.25 0.88 3.09 1.37 0.00 0.56 -5.09 105.19 109.25 1unc n GLY 11 Ca -0.03 -0.60 -0.07 0.00 0.00 0.00 0.00 46.02 45.32 1unc n GLY 11 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1unc s MET 12 N -2.60 0.62 0.39 1.61 0.23 -1.24 -5.08 119.30 113.23 1unc s MET 12 Ca 0.00 -1.22 -0.25 0.00 -1.03 0.00 0.00 55.69 53.19 1unc s MET 12 Cb 0.00 0.19 -0.09 0.00 -1.53 0.00 0.00 34.83 33.40 1unc s MET 12 CO 0.00 -0.10 1.15 -0.08 -2.03 0.00 0.00 175.02 173.96 1unc s THR 13 N -3.87 3.23 0.03 3.16 -1.32 -1.26 -4.35 115.64 111.26 1unc s THR 13 Ca 0.07 1.04 0.32 0.00 -1.21 0.00 0.00 61.69 61.91 1unc s THR 13 Cb 0.08 -3.59 0.36 0.00 -1.51 0.00 0.00 72.50 67.84 1unc s THR 13 CO -0.10 0.10 1.96 1.55 -2.21 0.00 0.00 174.62 175.93 1unc h PRO 14 N 2.73 0.00 -0.11 7.08 0.13 -1.96 -2.08 132.00 137.79 1unc h PRO 14 Ca -0.49 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 1unc h PRO 14 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1unc h PRO 14 CO 0.63 0.00 -0.23 0.00 -0.23 0.00 0.00 178.00 178.17 1unc h ALA 15 N 2.06 0.18 -0.91 -0.56 0.00 -1.98 0.61 119.26 118.66 1unc h ALA 15 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.56 1unc h ALA 15 Cb 0.39 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1unc h ALA 15 CO 0.00 0.14 0.59 0.00 0.00 0.00 0.00 179.25 179.98 1unc h ALA 16 N 0.52 1.19 -0.00 0.00 0.00 -1.91 -1.65 119.26 117.40 1unc h ALA 16 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1unc h ALA 16 Cb 0.82 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1unc h ALA 16 CO 0.05 0.46 0.00 0.35 0.00 0.00 0.00 179.25 180.12 1unc h PHE 17 N 1.16 0.01 -0.74 0.00 3.57 -1.31 -3.08 116.94 116.53 1unc h PHE 17 Ca 0.36 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.90 1unc h PHE 17 Cb -0.02 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 1unc h PHE 17 CO -0.01 0.01 0.49 1.03 -2.23 0.00 0.00 178.31 177.60 1unc h SER 18 N -0.00 0.76 -0.31 0.41 0.87 -0.40 -2.05 113.55 112.82 1unc h SER 18 Ca 0.00 -0.01 0.09 0.00 -1.23 0.00 0.00 61.79 60.65 1unc h SER 18 Cb 0.01 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 1unc h SER 18 CO -0.00 0.51 0.23 0.00 -0.53 0.00 0.00 176.83 177.04 1unc h ALA 19 N 1.58 2.25 -2.32 6.23 0.00 -1.22 -3.43 119.26 122.35 1unc h ALA 19 Ca 0.30 -0.01 -0.49 0.00 0.00 0.00 0.00 54.91 54.71 1unc h ALA 19 Cb 0.11 0.02 0.06 0.00 0.00 0.00 0.00 17.79 17.98 1unc h ALA 19 CO -0.09 -0.39 0.38 -0.51 0.00 0.00 0.00 179.25 178.63 1unc s LEU 20 N -8.71 3.50 0.33 0.00 1.43 -0.77 -5.00 118.68 109.45 1unc s LEU 20 Ca -0.05 1.76 -0.29 0.00 -1.03 0.00 0.00 54.13 54.52 1unc s LEU 20 Cb 0.18 -4.53 -0.12 0.00 0.03 0.00 0.00 46.19 41.75 1unc s LEU 20 CO 0.69 -1.07 1.34 -0.81 0.23 0.00 0.00 176.35 176.72 1unc n PRO 21 N -2.01 2.20 -0.35 1.29 -0.04 -1.26 -4.76 135.00 130.06 1unc n PRO 21 Ca 0.08 0.77 0.14 0.00 -0.04 0.00 0.00 63.50 64.45 1unc n PRO 21 Cb 0.53 -2.39 0.34 0.00 -0.04 0.00 0.00 33.50 31.94 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 2.91 0.71 -0.42 0.54 2.43 -1.93 -1.29 114.38 117.32 1unc h ARG 22 Ca -0.46 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1unc h ARG 22 Cb 1.28 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.65 1unc h ARG 22 CO 0.65 0.47 0.23 0.11 -1.51 0.00 0.00 179.97 179.92 1unc h TRP 23 N 0.73 0.57 0.37 2.20 5.08 -2.00 -2.25 115.95 120.66 1unc h TRP 23 Ca 0.58 -0.01 -0.02 0.00 1.08 0.00 0.00 58.89 60.52 1unc h TRP 23 Cb 0.96 -0.18 0.00 0.00 -3.00 0.00 0.00 29.16 26.94 1unc h TRP 23 CO -0.00 0.43 -0.18 -0.22 -1.28 0.00 0.00 178.44 177.19 1unc h LYS 24 N 0.54 -0.49 -0.75 0.12 3.64 -1.63 -1.31 116.57 116.69 1unc h LYS 24 Ca 0.15 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.66 1unc h LYS 24 Cb 0.05 0.11 -0.11 0.00 -0.41 0.00 0.00 32.23 31.87 1unc h LYS 24 CO -0.02 -0.17 -0.33 0.94 -2.27 0.00 0.00 179.45 177.60 1unc n GLN 25 N -5.15 -0.22 -0.02 1.90 7.27 -0.77 -0.77 117.38 119.63 1unc n GLN 25 Ca -0.09 1.14 -0.17 0.00 0.07 0.00 0.00 57.00 57.95 1unc n GLN 25 Cb 0.28 -1.69 -0.09 0.00 2.41 0.00 0.00 30.24 31.15 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 0.58 -0.95 3.69 4.20 -1.36 -3.03 115.11 118.24 1unc h GLN 26 Ca 0.22 -0.50 0.20 0.00 0.06 0.00 0.00 58.65 58.63 1unc h GLN 26 Cb 0.41 0.11 -0.08 0.00 0.30 0.00 0.00 27.48 28.22 1unc h GLN 26 CO -0.73 1.12 0.61 -0.97 -0.67 0.00 0.00 178.83 178.20 1unc h ASN 27 N 0.20 0.55 0.25 1.46 -0.73 0.06 -0.08 115.58 117.30 1unc h ASN 27 Ca -0.05 0.06 0.01 0.00 1.87 0.00 0.00 56.30 58.19 1unc h ASN 27 Cb 1.26 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 39.78 1unc h ASN 27 CO 0.13 0.21 -0.36 -0.07 -0.37 0.00 0.00 177.43 176.96 1unc h LEU 28 N 0.54 -1.01 -0.86 0.34 3.38 -0.82 -0.46 115.31 116.42 1unc h LEU 28 Ca 0.52 0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.49 1unc h LEU 28 Cb 1.09 0.36 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 1unc h LEU 28 CO -0.25 -0.48 -0.22 0.50 0.09 0.00 0.00 178.44 178.08 1unc h LYS 29 N -0.68 0.60 -0.04 1.13 3.64 -1.39 -2.14 116.57 117.70 1unc h LYS 29 Ca -0.00 -0.22 -0.11 0.00 -1.27 0.00 0.00 60.65 59.05 1unc h LYS 29 Cb 0.65 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1unc h LYS 29 CO -0.13 0.78 -0.40 0.87 -2.27 0.00 0.00 179.45 178.30 1unc h LYS 30 N 0.53 0.34 -0.68 1.90 1.57 -0.94 -1.11 116.57 118.18 1unc h LYS 30 Ca 0.08 -0.31 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1unc h LYS 30 Cb 0.67 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1unc h LYS 30 CO 0.05 0.98 0.25 0.93 -0.57 0.00 0.00 179.45 181.09 1unc h GLU 31 N -0.18 1.01 0.00 3.15 5.08 -1.07 -0.51 114.58 122.06 1unc h GLU 31 Ca -0.04 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1unc h GLU 31 Cb 1.09 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1unc h GLU 31 CO 0.08 0.84 0.00 0.87 -1.00 0.00 0.00 179.01 179.80 1unc h LYS 32 N 0.99 0.00 0.00 2.33 1.57 -1.40 -3.46 116.57 116.59 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 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 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 -0.62 0.43 0.03 3.86 0.00 -0.20 -4.98 105.19 103.71 1unc n GLY 33 Ca -0.01 -0.79 -0.01 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.05 0.00 0.99 3.38 -1.44 -3.49 115.31 114.70 1unc h LEU 34 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1unc h LEU 34 Cb 0.00 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1unc h LEU 34 CO 0.00 0.01 0.00 0.49 0.09 0.00 0.00 178.44 179.03