#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bai n ALA 2 N 0.00 -0.64 -3.60 3.04 0.00 -1.26 -3.50 120.51 114.55 2bai n ALA 2 Ca 0.00 0.18 -0.36 0.00 0.00 0.00 0.00 53.44 53.27 2bai n ALA 2 Cb 0.00 -2.49 0.03 0.00 0.00 0.00 0.00 19.45 16.99 2bai n ALA 2 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2bai n THR 3 N -4.13 -3.65 -3.60 0.00 5.66 -1.26 -4.98 114.28 102.31 2bai n THR 3 Ca -0.17 0.05 -0.03 0.00 -3.05 0.00 0.00 64.05 60.85 2bai n THR 3 Cb 0.64 -3.31 -0.05 0.00 -1.55 0.00 0.00 70.33 66.06 2bai n THR 3 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2bai s THR 4 N -1.90 -0.45 0.00 1.09 -4.23 -1.23 -5.04 115.64 103.88 2bai s THR 4 Ca 0.28 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 2bai s THR 4 Cb -0.03 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.81 2bai s THR 4 CO 0.89 0.00 0.00 0.23 -0.54 0.00 0.00 174.62 175.20 2bai n MET 5 N 4.74 0.00 -2.02 3.99 2.00 -1.26 -5.02 117.12 119.56 2bai n MET 5 Ca -0.15 0.00 -0.00 0.00 0.00 0.00 0.00 57.70 57.55 2bai n MET 5 Cb 0.54 -0.03 -0.00 0.00 0.00 0.00 0.00 33.22 33.73 2bai n MET 5 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2bai n GLU 6 N -2.27 -1.59 0.00 0.03 -0.58 -1.26 -5.03 120.64 109.93 2bai n GLU 6 Ca 0.00 1.54 0.00 0.00 -0.42 0.00 0.00 57.16 58.28 2bai n GLU 6 Cb 0.00 -2.88 0.00 0.00 -0.57 0.00 0.00 31.44 27.99 2bai n GLU 6 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2bai n GLN 7 N 0.36 0.00 -2.98 3.49 10.64 -1.26 -5.05 117.38 122.59 2bai n GLN 7 Ca -0.03 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.07 2bai n GLN 7 Cb 0.04 0.00 0.01 0.00 -0.86 0.00 0.00 30.24 29.43 2bai n GLN 7 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2bai n GLU 8 N 0.00 -2.25 -3.57 2.61 1.02 -1.26 -4.94 120.64 112.25 2bai n GLU 8 Ca 0.00 1.97 -0.29 0.00 -0.02 0.00 0.00 57.16 58.82 2bai n GLU 8 Cb 0.00 -3.92 -0.12 0.00 -0.02 0.00 0.00 31.44 27.37 2bai n GLU 8 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2bai s ILE 9 N -1.68 0.72 0.48 -3.67 -0.00 0.64 -4.12 121.20 113.57 2bai s ILE 9 Ca 0.11 -2.16 0.03 0.00 -0.00 0.00 0.00 60.65 58.63 2bai s ILE 9 Cb -0.02 -1.51 0.03 0.00 -0.00 0.00 0.00 42.46 40.95 2bai s ILE 9 CO 0.61 -0.97 0.24 0.00 -0.00 0.00 0.00 174.94 174.83 2bai n ALA 11 N -1.83 2.52 0.00 0.00 0.00 -1.26 -3.58 120.51 116.36 2bai n ALA 11 Ca -0.17 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2bai n ALA 11 Cb 0.57 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2bai n ALA 11 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bai n HIS 12 N -0.26 0.00 0.00 0.00 8.25 -1.26 -5.05 115.22 116.89 2bai n HIS 12 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2bai n HIS 12 Cb 0.11 0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.37 2bai n HIS 12 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2bai n SER 13 N -2.43 0.00 -0.29 0.41 3.41 -1.23 -5.12 113.62 108.37 2bai n SER 13 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2bai n SER 13 Cb 0.24 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2bai n SER 13 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2bai n MET 14 N 0.00 0.00 -4.03 4.33 0.00 -1.26 -4.82 117.12 111.35 2bai n MET 14 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 57.70 57.48 2bai n MET 14 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.19 2bai n MET 14 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 2bai s THR 15 N -2.72 4.91 0.22 2.03 2.01 -1.26 0.46 115.64 121.29 2bai s THR 15 Ca 0.00 -1.13 -0.19 0.00 0.31 0.00 0.00 61.69 60.68 2bai s THR 15 Cb 0.00 -3.65 0.20 0.00 0.01 0.00 0.00 72.50 69.06 2bai s THR 15 CO 0.00 -0.31 1.56 -0.26 -0.69 0.00 0.00 174.62 174.92 2bai h PHE 16 N 1.43 -1.07 0.00 4.92 -1.00 -1.98 2.07 116.94 121.32 2bai h PHE 16 Ca -0.50 0.10 -0.04 0.00 2.81 0.00 0.00 57.97 60.34 2bai h PHE 16 Cb 1.23 0.60 -0.01 0.00 3.61 0.00 0.00 35.95 41.38 2bai h PHE 16 CO 0.50 -0.40 -0.17 0.93 -1.61 0.00 0.00 178.31 177.56 2bai h GLU 17 N -0.05 0.00 -0.23 1.51 4.39 -2.00 -0.18 114.58 118.02 2bai h GLU 17 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 2bai h GLU 17 Cb 0.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2bai h GLU 17 CO -0.90 0.17 0.00 0.39 -1.16 0.00 0.00 179.01 177.52 2bai n GLU 18 N -3.99 2.00 -0.08 2.33 -0.58 0.55 -4.00 120.64 116.88 2bai n GLU 18 Ca -0.02 -1.51 0.00 0.00 -0.42 0.00 0.00 57.16 55.21 2bai n GLU 18 Cb 0.26 -1.43 0.29 0.00 -0.57 0.00 0.00 31.44 29.98 2bai n GLU 18 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2bai n PRO 20 N -4.35 0.33 0.00 0.00 -0.04 -1.26 -2.14 135.00 127.55 2bai n PRO 20 Ca 0.04 0.07 0.11 0.00 -0.04 0.00 0.00 63.50 63.68 2bai n PRO 20 Cb 0.15 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.97 2bai n PRO 20 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2bai n LYS 21 N -1.28 0.60 -0.21 0.54 4.76 0.30 -3.11 118.16 119.76 2bai n LYS 21 Ca 0.11 -0.14 0.02 0.00 -2.87 0.00 0.00 58.31 55.42 2bai n LYS 21 Cb 0.18 -1.55 0.13 0.00 -1.84 0.00 0.00 35.03 31.94 2bai n LYS 21 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bai h SER 23 N 0.27 0.26 0.00 0.00 0.87 -1.74 -3.39 113.55 109.81 2bai h SER 23 Ca 0.34 -0.78 -0.62 0.00 -1.23 0.00 0.00 61.79 59.50 2bai h SER 23 Cb 0.52 -0.08 0.03 0.00 -0.44 0.00 0.00 62.40 62.42 2bai h SER 23 CO -0.43 1.71 3.63 0.00 -0.53 0.00 0.00 176.83 181.21 2bai n ALA 24 N -3.16 7.03 -0.30 6.23 0.00 -1.06 -2.80 120.51 126.44 2bai n ALA 24 Ca -0.31 -3.26 0.10 0.00 0.00 0.00 0.00 53.44 49.96 2bai n ALA 24 Cb 0.90 -3.32 0.32 0.00 0.00 0.00 0.00 19.45 17.35 2bai n ALA 24 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2bai n LEU 25 N 3.75 4.06 -2.00 0.00 0.00 -1.04 -4.65 117.00 117.13 2bai n LEU 25 Ca 0.72 -2.04 -0.10 0.00 0.00 0.00 0.00 56.01 54.59 2bai n LEU 25 Cb 0.22 -0.51 -0.02 0.00 0.00 0.00 0.00 43.42 43.11 2bai n LEU 25 CO 0.83 0.83 -0.12 0.00 0.00 0.00 0.00 177.39 178.93 2bai n GLN 26 N 1.25 -1.91 -1.77 1.96 3.00 -1.26 -4.86 117.38 113.78 2bai n GLN 26 Ca 0.23 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.76 2bai n GLN 26 Cb 0.71 -4.97 0.00 0.00 0.00 0.00 0.00 30.24 25.98 2bai n GLN 26 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2bai n TYR 27 N -2.63 0.00 1.12 1.08 4.01 -1.26 -5.01 117.16 114.47 2bai n TYR 27 Ca -0.11 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.73 2bai n TYR 27 Cb 0.49 0.00 0.57 0.00 -0.31 0.00 0.00 39.34 40.10 2bai n TYR 27 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2bai n ARG 28 N 0.00 0.41 0.03 -0.72 3.00 -1.26 -3.27 116.66 114.85 2bai n ARG 28 Ca 0.00 0.06 -0.11 0.00 -0.00 0.00 0.00 57.85 57.80 2bai n ARG 28 Cb 0.00 -1.50 -0.06 0.00 0.00 0.00 0.00 32.46 30.90 2bai n ARG 28 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.63 176.66 2bai h ASN 29 N 0.00 -0.10 -5.22 6.15 -0.73 -1.91 -3.47 115.58 110.30 2bai h ASN 29 Ca 0.00 0.02 0.12 0.00 1.87 0.00 0.00 56.30 58.31 2bai h ASN 29 Cb 0.14 0.05 -0.05 0.00 0.27 0.00 0.00 38.32 38.74 2bai h ASN 29 CO 0.00 -0.05 0.41 -0.83 -0.37 0.00 0.00 177.43 176.60 2bai s GLY 30 N -2.33 -0.03 0.00 1.57 0.00 -1.12 -4.91 107.32 100.50 2bai s GLY 30 Ca -0.13 -0.21 0.00 0.00 0.00 0.00 0.00 44.72 44.38 2bai s GLY 30 CO 0.67 0.40 0.00 0.33 0.00 0.00 0.00 173.10 174.50 2bai n PHE 31 N -0.52 0.00 -1.03 1.90 -0.00 -1.16 -4.35 117.46 112.29 2bai n PHE 31 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.40 2bai n PHE 31 Cb 0.60 0.02 0.00 0.00 -0.00 0.00 0.00 39.48 40.10 2bai n PHE 31 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74