#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 -2.04 -1.00 -5.12 0.00 -1.26 -5.06 120.51 106.03 2bai n ALA 2 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2bai n ALA 2 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.00 2bai n ALA 2 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2bai n THR 3 N 1.83 0.00 -2.93 0.00 -1.04 -1.26 -5.03 114.28 105.85 2bai n THR 3 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 2bai n THR 3 Cb 0.00 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 2bai n THR 3 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2bai n THR 4 N -0.30 -1.82 -0.04 12.58 -1.04 -1.26 -4.87 114.28 117.53 2bai n THR 4 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 2bai n THR 4 Cb 0.00 -3.28 -0.05 0.00 -1.82 0.00 0.00 70.33 65.18 2bai n THR 4 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 2bai n MET 5 N -3.73 1.52 -1.24 -2.82 2.00 -1.26 -5.10 117.12 106.49 2bai n MET 5 Ca -0.11 0.03 0.00 0.00 0.00 0.00 0.00 57.70 57.61 2bai n MET 5 Cb 0.61 -1.19 0.00 0.00 0.00 0.00 0.00 33.22 32.64 2bai n MET 5 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2bai n GLU 6 N -2.52 0.00 -0.55 0.03 0.00 -1.26 -5.13 120.64 111.21 2bai n GLU 6 Ca -0.14 0.41 0.00 0.00 0.00 0.00 0.00 57.16 57.43 2bai n GLU 6 Cb 0.71 -0.83 0.00 0.00 0.00 0.00 0.00 31.44 31.32 2bai n GLU 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2bai n GLN 7 N 0.02 0.00 -1.77 5.31 10.64 -1.26 -5.05 117.38 125.27 2bai n GLN 7 Ca 0.00 0.00 -0.23 0.00 -1.83 0.00 0.00 57.00 54.94 2bai n GLN 7 Cb 0.00 0.00 -0.09 0.00 -0.86 0.00 0.00 30.24 29.29 2bai n GLN 7 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 2bai n GLU 8 N 0.00 0.88 -3.44 2.61 0.28 -1.26 -4.61 120.64 115.09 2bai n GLU 8 Ca 0.00 -2.07 -0.26 0.00 -0.16 0.00 0.00 57.16 54.67 2bai n GLU 8 Cb 0.00 -3.77 -0.11 0.00 1.43 0.00 0.00 31.44 28.99 2bai n GLU 8 CO 0.00 0.00 0.00 0.96 -0.16 0.00 0.00 177.13 177.93 2bai s ILE 9 N 13.64 -0.02 0.55 3.84 -5.25 0.45 -4.34 121.20 130.07 2bai s ILE 9 Ca 0.74 -1.40 0.05 0.00 -0.99 0.00 0.00 60.65 59.05 2bai s ILE 9 Cb -0.02 -0.99 0.04 0.00 2.95 0.00 0.00 42.46 44.45 2bai s ILE 9 CO 0.17 -0.85 0.40 0.00 -1.79 0.00 0.00 174.94 172.86 2bai n ALA 11 N -1.76 2.32 0.00 0.00 0.00 -1.26 -3.28 120.51 116.52 2bai n ALA 11 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2bai n ALA 11 Cb 0.64 -1.07 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 -0.59 0.00 0.00 0.00 8.25 -1.26 -5.05 115.22 116.57 2bai n HIS 12 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2bai n HIS 12 Cb 0.02 0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.23 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 -2.57 0.00 -0.09 0.41 7.64 -1.21 -5.13 113.62 112.68 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 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 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 0.00 -4.03 1.43 0.00 -1.26 -4.79 117.12 108.47 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 -0.04 0.00 0.00 0.00 0.00 33.22 33.18 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 -2.40 4.87 0.26 2.03 2.01 -1.26 0.39 115.64 121.53 2bai s THR 15 Ca 0.00 -1.09 -0.10 0.00 0.31 0.00 0.00 61.69 60.81 2bai s THR 15 Cb 0.00 -3.59 0.38 0.00 0.01 0.00 0.00 72.50 69.31 2bai s THR 15 CO 0.00 -0.25 1.58 -0.26 -0.69 0.00 0.00 174.62 175.00 2bai h PHE 16 N 1.68 -0.46 0.00 4.92 0.04 -1.84 2.09 116.94 123.37 2bai h PHE 16 Ca -0.49 0.08 -0.06 0.00 2.80 0.00 0.00 57.97 60.29 2bai h PHE 16 Cb 1.22 0.34 -0.01 0.00 2.20 0.00 0.00 35.95 39.70 2bai h PHE 16 CO 0.52 -0.37 -0.29 0.93 -0.60 0.00 0.00 178.31 178.50 2bai h GLU 17 N 0.00 0.00 -0.19 1.51 4.39 -1.98 -1.53 114.58 116.78 2bai h GLU 17 Ca 0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.12 2bai h GLU 17 Cb 0.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 2bai h GLU 17 CO -0.90 0.29 0.00 0.39 -1.16 0.00 0.00 179.01 177.63 2bai n GLU 18 N -3.80 1.97 -0.08 2.33 4.71 0.58 -4.00 120.64 122.35 2bai n GLU 18 Ca -0.01 -1.46 0.01 0.00 -0.01 0.00 0.00 57.16 55.69 2bai n GLU 18 Cb 0.38 -1.44 0.30 0.00 -1.01 0.00 0.00 31.44 29.66 2bai n GLU 18 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2bai n PRO 20 N -4.37 0.52 -0.04 0.00 -0.04 -1.26 -2.24 135.00 127.57 2bai n PRO 20 Ca 0.04 0.04 0.02 0.00 -0.04 0.00 0.00 63.50 63.56 2bai n PRO 20 Cb 0.13 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.93 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 -1.16 0.67 -0.18 0.54 4.76 0.42 -2.84 118.16 120.38 2bai n LYS 21 Ca 0.14 -0.10 -0.02 0.00 -2.87 0.00 0.00 58.31 55.46 2bai n LYS 21 Cb 0.14 -1.53 0.06 0.00 -1.84 0.00 0.00 35.03 31.85 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 0.04 0.32 -0.68 0.00 0.87 -1.76 -3.37 113.55 108.97 2bai h SER 23 Ca 0.27 -0.82 -0.39 0.00 -1.23 0.00 0.00 61.79 59.62 2bai h SER 23 Cb 0.42 -0.10 -0.14 0.00 -0.44 0.00 0.00 62.40 62.14 2bai h SER 23 CO -0.52 1.72 0.12 0.00 -0.53 0.00 0.00 176.83 177.62 2bai n ALA 24 N -3.09 6.37 0.75 6.23 0.00 -1.05 -4.22 120.51 125.50 2bai n ALA 24 Ca -0.30 -2.57 0.12 0.00 0.00 0.00 0.00 53.44 50.69 2bai n ALA 24 Cb 0.93 -2.18 0.22 0.00 0.00 0.00 0.00 19.45 18.43 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 1.42 0.58 -0.20 0.00 7.94 0.77 -4.59 117.00 122.93 2bai n LEU 25 Ca 0.46 0.16 -0.03 0.00 -1.11 0.00 0.00 56.01 55.49 2bai n LEU 25 Cb 0.68 -0.22 -0.01 0.00 0.53 0.00 0.00 43.42 44.39 2bai n LEU 25 CO 0.26 0.02 -0.02 0.00 -1.11 0.00 0.00 177.39 176.53 2bai n GLN 26 N -1.85 -0.90 -4.03 1.96 6.02 -1.26 -4.98 117.38 112.33 2bai n GLN 26 Ca 0.04 0.40 -0.23 0.00 -0.01 0.00 0.00 57.00 57.20 2bai n GLN 26 Cb 0.39 -4.18 -0.06 0.00 1.02 0.00 0.00 30.24 27.42 2bai n GLN 26 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2bai s TYR 27 N -1.74 2.69 0.64 1.08 1.51 -1.26 -4.98 117.35 115.29 2bai s TYR 27 Ca 0.00 -0.44 0.27 0.00 -1.01 0.00 0.00 57.07 55.89 2bai s TYR 27 Cb 0.00 -1.78 1.42 0.00 -0.11 0.00 0.00 41.96 41.49 2bai s TYR 27 CO 0.00 0.25 1.82 -0.09 -1.11 0.00 0.00 175.55 176.41 2bai h ARG 28 N 1.45 0.00 -0.34 -0.62 2.43 -1.98 -1.87 114.38 113.45 2bai h ARG 28 Ca -0.43 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 58.78 2bai h ARG 28 Cb 1.25 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.73 2bai h ARG 28 CO 0.64 0.00 -0.49 -0.91 -1.51 0.00 0.00 179.97 177.70 2bai h ASN 29 N 0.00 -1.63 -3.83 -3.80 2.35 -1.93 -3.40 115.58 103.34 2bai h ASN 29 Ca 0.09 0.21 -0.48 0.00 -0.55 0.00 0.00 56.30 55.57 2bai h ASN 29 Cb 1.02 0.66 -0.02 0.00 0.05 0.00 0.00 38.32 40.03 2bai h ASN 29 CO -0.00 -0.36 0.17 -0.83 -1.65 0.00 0.00 177.43 174.76 2bai s GLY 30 N -2.18 2.34 -0.05 2.83 0.00 -0.71 -5.00 107.32 104.55 2bai s GLY 30 Ca -0.13 0.14 -0.07 0.00 0.00 0.00 0.00 44.72 44.67 2bai s GLY 30 CO 0.54 0.37 0.64 -2.75 0.00 0.00 0.00 173.10 171.90 2bai h PHE 31 N 2.11 0.56 0.00 1.90 3.57 -1.84 -3.45 116.94 119.78 2bai h PHE 31 Ca -0.48 -0.41 0.00 0.00 3.53 0.00 0.00 57.97 60.61 2bai h PHE 31 Cb 1.18 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.89 2bai h PHE 31 CO 0.62 1.59 0.00 0.98 -2.23 0.00 0.00 178.31 179.27