#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 0.00 -2.23 3.04 0.00 -1.26 -4.41 120.51 115.65 2bai n ALA 2 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 2bai n ALA 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2bai n ALA 2 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2bai s THR 3 N 0.00 2.66 0.27 0.00 -4.23 -1.26 -5.15 115.64 107.93 2bai s THR 3 Ca 0.00 -1.36 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 2bai s THR 3 Cb 0.00 -3.00 -0.01 0.00 1.34 0.00 0.00 72.50 70.83 2bai s THR 3 CO 0.00 -0.00 0.11 0.35 -0.54 0.00 0.00 174.62 174.53 2bai n THR 4 N -1.53 0.00 -1.11 3.99 -2.24 -1.26 -5.11 114.28 107.02 2bai n THR 4 Ca 0.03 -1.58 0.14 0.00 -2.27 0.00 0.00 64.05 60.37 2bai n THR 4 Cb 0.62 0.59 -0.06 0.00 -2.10 0.00 0.00 70.33 69.38 2bai n THR 4 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2bai n MET 5 N -0.59 -2.43 -3.58 -0.78 2.81 -1.26 -4.67 117.12 106.62 2bai n MET 5 Ca -0.03 1.84 -0.31 0.00 -1.81 0.00 0.00 57.70 57.39 2bai n MET 5 Cb 0.41 -2.89 -0.08 0.00 -0.71 0.00 0.00 33.22 29.95 2bai n MET 5 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2bai n GLU 6 N -3.88 2.56 -1.39 0.03 4.07 -1.26 -4.98 120.64 115.79 2bai n GLU 6 Ca -0.04 -4.56 0.00 0.00 -0.06 0.00 0.00 57.16 52.51 2bai n GLU 6 Cb 0.52 -2.34 0.00 0.00 -0.06 0.00 0.00 31.44 29.56 2bai n GLU 6 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2bai n GLN 7 N 1.62 0.00 -1.12 5.31 1.13 -1.26 -5.03 117.38 118.03 2bai n GLN 7 Ca 0.24 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.92 2bai n GLN 7 Cb 0.37 0.00 -0.09 0.00 0.11 0.00 0.00 30.24 30.64 2bai n GLN 7 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2bai n GLU 8 N 0.00 0.85 -3.40 -1.09 -0.00 -1.26 -4.50 120.64 111.23 2bai n GLU 8 Ca 0.00 -1.64 -0.22 0.00 -0.00 0.00 0.00 57.16 55.30 2bai n GLU 8 Cb 0.00 -3.02 -0.10 0.00 -0.00 0.00 0.00 31.44 28.32 2bai n GLU 8 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.13 178.09 2bai s ILE 9 N 8.07 -0.17 0.04 3.84 -4.36 0.25 -3.07 121.20 125.81 2bai s ILE 9 Ca 0.66 -1.19 0.00 0.00 -0.26 0.00 0.00 60.65 59.86 2bai s ILE 9 Cb 0.10 -0.86 0.00 0.00 1.25 0.00 0.00 42.46 42.96 2bai s ILE 9 CO 0.21 -0.72 0.02 0.00 0.24 0.00 0.00 174.94 174.69 2bai n ALA 11 N -2.90 2.80 0.22 0.00 0.00 -1.26 -3.35 120.51 116.02 2bai n ALA 11 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2bai n ALA 11 Cb 0.05 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 1.26 -4.41 0.00 0.00 8.25 -1.26 -5.09 115.22 113.96 2bai n HIS 12 Ca 0.00 1.43 0.00 0.00 -0.26 0.00 0.00 57.72 58.89 2bai n HIS 12 Cb 0.34 3.54 0.00 0.00 1.12 0.00 0.00 29.99 34.99 2bai n HIS 12 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2bai n SER 13 N -3.40 0.00 0.00 0.41 7.64 -1.21 -5.12 113.62 111.94 2bai n SER 13 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2bai n SER 13 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2bai n SER 13 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2bai n MET 14 N 0.00 -2.65 -3.92 1.43 0.00 -1.18 -4.85 117.12 105.96 2bai n MET 14 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 57.70 57.47 2bai n MET 14 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 33.22 33.20 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 -2.24 5.27 0.50 2.03 2.01 -1.26 0.85 115.64 122.81 2bai s THR 15 Ca 0.00 -0.82 0.44 0.00 0.31 0.00 0.00 61.69 61.62 2bai s THR 15 Cb 0.00 -3.81 0.65 0.00 0.01 0.00 0.00 72.50 69.35 2bai s THR 15 CO 0.00 -0.25 1.46 0.49 -0.69 0.00 0.00 174.62 175.63 2bai n PHE 16 N -1.08 0.13 0.04 4.92 3.72 -1.26 0.45 117.46 124.38 2bai n PHE 16 Ca -0.08 0.13 -0.20 0.00 -0.05 0.00 0.00 57.45 57.26 2bai n PHE 16 Cb 0.56 -0.59 -0.13 0.00 -0.94 0.00 0.00 39.48 38.37 2bai n PHE 16 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 176.76 177.76 2bai h GLU 17 N 0.00 0.36 -0.69 -1.08 4.11 -1.99 -3.28 114.58 112.01 2bai h GLU 17 Ca 0.87 -0.52 0.00 0.00 0.07 0.00 0.00 59.36 59.78 2bai h GLU 17 Cb 3.36 0.18 0.00 0.00 0.50 0.00 0.00 28.75 32.79 2bai h GLU 17 CO -0.09 1.21 0.00 0.39 0.07 0.00 0.00 179.01 180.59 2bai n GLU 18 N -4.12 2.82 0.07 1.06 1.02 0.73 -4.10 120.64 118.12 2bai n GLU 18 Ca -0.13 -2.56 -0.13 0.00 -0.02 0.00 0.00 57.16 54.33 2bai n GLU 18 Cb 0.79 -1.61 -0.04 0.00 -0.02 0.00 0.00 31.44 30.56 2bai n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bai n PRO 20 N -3.72 0.68 0.01 0.00 -0.04 -1.26 -2.10 135.00 128.57 2bai n PRO 20 Ca -0.06 0.01 0.08 0.00 -0.04 0.00 0.00 63.50 63.49 2bai n PRO 20 Cb 0.84 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.67 2bai n PRO 20 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2bai n LYS 21 N -1.05 0.65 -0.29 0.54 0.00 -1.09 -3.06 118.16 113.86 2bai n LYS 21 Ca 0.17 -0.07 0.07 0.00 0.00 0.00 0.00 58.31 58.48 2bai n LYS 21 Cb 0.10 -1.61 0.23 0.00 0.00 0.00 0.00 35.03 33.74 2bai n LYS 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2bai h SER 23 N 0.54 0.28 0.00 0.00 0.87 -1.74 -3.31 113.55 110.18 2bai h SER 23 Ca 0.46 -0.79 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2bai h SER 23 Cb 0.70 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2bai h SER 23 CO -0.40 1.69 0.04 0.00 -0.53 0.00 0.00 176.83 177.63 2bai h ALA 24 N -0.14 1.03 -0.59 6.23 0.00 -1.37 -1.67 119.26 122.75 2bai h ALA 24 Ca -0.37 0.00 0.17 0.00 0.00 0.00 0.00 54.91 54.71 2bai h ALA 24 Cb 1.74 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.51 2bai h ALA 24 CO -0.01 -0.03 0.75 1.25 0.00 0.00 0.00 179.25 181.20 2bai h LEU 25 N 0.00 0.00 -3.00 0.00 7.12 0.20 -3.45 115.31 116.18 2bai h LEU 25 Ca 0.00 0.00 -0.24 0.00 0.13 0.00 0.00 57.88 57.77 2bai h LEU 25 Cb 0.08 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.22 2bai h LEU 25 CO 0.00 0.00 -0.54 0.00 -0.13 0.00 0.00 178.44 177.77 2bai n GLN 26 N -3.42 -1.41 0.00 1.25 6.02 -0.63 -4.93 117.38 114.27 2bai n GLN 26 Ca 0.12 1.09 0.00 0.00 -0.01 0.00 0.00 57.00 58.21 2bai n GLN 26 Cb 0.96 -4.24 0.00 0.00 1.02 0.00 0.00 30.24 27.98 2bai n GLN 26 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 2bai n TYR 27 N -2.37 0.00 -2.40 1.08 4.11 -1.26 -5.00 117.16 111.31 2bai n TYR 27 Ca -0.14 0.00 -0.02 0.00 -0.00 0.00 0.00 57.90 57.74 2bai n TYR 27 Cb 0.59 0.23 -0.00 0.00 -0.00 0.00 0.00 39.34 40.15 2bai n TYR 27 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.86 179.75 2bai n ARG 28 N -2.13 -2.69 0.05 -3.48 1.85 -1.26 -4.66 116.66 104.34 2bai n ARG 28 Ca 0.00 0.01 0.12 0.00 -1.00 0.00 0.00 57.85 56.98 2bai n ARG 28 Cb 0.07 -4.06 0.16 0.00 -1.05 0.00 0.00 32.46 27.58 2bai n ARG 28 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2bai n ASN 29 N -1.39 0.67 0.00 2.89 3.02 -1.26 -5.02 115.26 114.17 2bai n ASN 29 Ca 0.01 0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2bai n ASN 29 Cb 0.45 0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 2bai n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bai n GLY 30 N 1.35 2.61 2.38 7.41 0.00 -1.26 -4.99 105.19 112.69 2bai n GLY 30 Ca 0.03 -0.31 -0.05 0.00 0.00 0.00 0.00 46.02 45.69 2bai n GLY 30 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2bai n PHE 31 N 12.67 -3.70 0.00 1.61 -0.00 -1.26 -5.18 117.46 121.60 2bai n PHE 31 Ca 0.00 2.16 0.00 0.00 -0.00 0.00 0.00 57.45 59.61 2bai n PHE 31 Cb 0.00 -3.49 0.00 0.00 -0.00 0.00 0.00 39.48 35.99 2bai n PHE 31 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42