#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 2.02 -0.75 3.04 0.00 -1.26 -4.96 120.51 118.60 2bai n ALA 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2bai n ALA 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -3.46 0.00 0.07 0.00 -1.04 -1.26 -3.00 114.28 105.58 2bai n THR 3 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2bai n THR 3 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 0.00 0.68 -3.45 12.58 -1.04 -1.26 -5.12 114.28 116.67 2bai n THR 4 Ca 0.00 0.23 -0.09 0.00 -2.04 0.00 0.00 64.05 62.14 2bai n THR 4 Cb 0.00 -1.14 0.01 0.00 -1.82 0.00 0.00 70.33 67.38 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 -3.30 1.08 0.00 -2.82 0.00 -1.16 -5.12 117.12 105.79 2bai n MET 5 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 57.70 56.43 2bai n MET 5 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 33.22 33.29 2bai n MET 5 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 2bai n GLU 6 N -1.14 0.00 -0.22 0.03 -0.00 -1.26 -4.66 120.64 113.39 2bai n GLU 6 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.17 2bai n GLU 6 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.67 2bai n GLU 6 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2bai n GLN 7 N -0.34 0.00 0.00 3.44 6.02 -1.26 -4.58 117.38 120.66 2bai n GLN 7 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2bai n GLN 7 Cb 0.00 -0.93 0.00 0.00 1.02 0.00 0.00 30.24 30.33 2bai n GLN 7 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2bai n GLU 8 N -2.00 0.00 -3.43 -1.09 0.00 -1.26 -4.88 120.64 107.98 2bai n GLU 8 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 57.16 56.93 2bai n GLU 8 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 31.44 31.33 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 0.00 -0.12 0.47 6.31 -0.00 0.68 -4.48 121.20 124.07 2bai s ILE 9 Ca 0.00 -1.20 0.04 0.00 -0.00 0.00 0.00 60.65 59.49 2bai s ILE 9 Cb 0.00 -0.93 0.04 0.00 -0.00 0.00 0.00 42.46 41.57 2bai s ILE 9 CO 0.00 -0.76 0.29 0.00 -0.00 0.00 0.00 174.94 174.48 2bai n ALA 11 N -1.93 3.17 0.00 0.00 0.00 -1.26 -3.81 120.51 116.68 2bai n ALA 11 Ca -0.16 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.55 2bai n ALA 11 Cb 0.55 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.92 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 0.11 -0.05 0.00 0.00 8.25 -1.26 -5.05 115.22 117.21 2bai n HIS 12 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2bai n HIS 12 Cb 0.69 0.38 0.00 0.00 1.12 0.00 0.00 29.99 32.18 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 -2.27 0.00 0.00 0.41 3.41 -1.25 -5.13 113.62 108.79 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 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2bai n SER 13 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2bai n MET 14 N 0.00 0.00 -4.12 4.33 0.00 -1.26 -4.85 117.12 111.22 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 -0.05 0.00 0.00 0.00 0.00 33.22 33.17 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 -1.52 4.35 0.20 1.12 2.01 -1.26 0.50 115.64 121.03 2bai s THR 15 Ca 0.00 -1.34 -0.22 0.00 0.31 0.00 0.00 61.69 60.44 2bai s THR 15 Cb 0.00 -3.30 0.12 0.00 0.01 0.00 0.00 72.50 69.33 2bai s THR 15 CO 0.00 -0.27 1.56 -0.26 -0.69 0.00 0.00 174.62 174.97 2bai h PHE 16 N 1.86 -1.19 0.00 4.92 0.04 -1.97 1.72 116.94 122.32 2bai h PHE 16 Ca -0.48 0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.38 2bai h PHE 16 Cb 1.23 0.63 -0.00 0.00 2.20 0.00 0.00 35.95 40.01 2bai h PHE 16 CO 0.58 -0.40 -0.03 0.93 -0.60 0.00 0.00 178.31 178.78 2bai h GLU 17 N -0.10 0.00 -0.13 1.51 4.39 -1.98 0.29 114.58 118.55 2bai h GLU 17 Ca 0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.95 2bai h GLU 17 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2bai h GLU 17 CO -0.83 0.03 0.00 0.39 -1.16 0.00 0.00 179.01 177.45 2bai n GLU 18 N -3.89 1.84 -0.06 2.33 4.71 0.53 -3.95 120.64 122.14 2bai n GLU 18 Ca -0.03 -1.24 0.04 0.00 -0.01 0.00 0.00 57.16 55.92 2bai n GLU 18 Cb 0.12 -1.44 0.39 0.00 -1.01 0.00 0.00 31.44 29.50 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 -4.47 0.45 -0.07 0.00 -0.04 -1.25 -2.48 135.00 127.13 2bai n PRO 20 Ca 0.05 0.05 -0.11 0.00 -0.04 0.00 0.00 63.50 63.45 2bai n PRO 20 Cb 0.09 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.90 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 -1.20 0.67 -0.10 0.54 5.02 0.12 -3.23 118.16 119.97 2bai n LYS 21 Ca 0.13 0.11 0.25 0.00 -2.02 0.00 0.00 58.31 56.78 2bai n LYS 21 Cb 0.15 -1.61 0.70 0.00 -0.02 0.00 0.00 35.03 34.26 2bai n LYS 21 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bai h SER 23 N 0.01 0.25 -0.68 0.00 4.64 -1.71 -3.36 113.55 112.70 2bai h SER 23 Ca 0.35 -0.76 0.15 0.00 -0.47 0.00 0.00 61.79 61.05 2bai h SER 23 Cb 1.38 -0.08 -0.11 0.00 -0.31 0.00 0.00 62.40 63.28 2bai h SER 23 CO -0.01 1.65 0.05 0.00 -0.87 0.00 0.00 176.83 177.65 2bai h ALA 24 N -0.17 0.73 -5.12 5.18 0.00 -1.08 -3.36 119.26 115.43 2bai h ALA 24 Ca -0.36 0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.58 2bai h ALA 24 Cb 1.68 0.32 -0.10 0.00 0.00 0.00 0.00 17.79 19.69 2bai h ALA 24 CO -0.03 -0.39 -0.24 -0.11 0.00 0.00 0.00 179.25 178.48 2bai n LEU 25 N -5.26 -0.22 -3.32 0.00 -0.00 0.53 0.07 117.00 108.80 2bai n LEU 25 Ca 0.11 -0.04 -0.26 0.00 -0.00 0.00 0.00 56.01 55.83 2bai n LEU 25 Cb 0.41 -1.02 -0.05 0.00 -0.00 0.00 0.00 43.42 42.76 2bai n LEU 25 CO 0.10 0.03 -0.10 1.67 -0.00 0.00 0.00 177.39 179.09 2bai n GLN 26 N -2.59 -0.85 -0.92 1.96 7.27 -1.26 -4.66 117.38 116.32 2bai n GLN 26 Ca 0.03 0.08 0.05 0.00 0.07 0.00 0.00 57.00 57.23 2bai n GLN 26 Cb 0.42 -2.87 0.09 0.00 2.41 0.00 0.00 30.24 30.30 2bai n GLN 26 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2bai n TYR 27 N -2.64 0.00 -1.85 3.69 4.02 0.11 -4.96 117.16 115.53 2bai n TYR 27 Ca 0.07 -0.83 -0.05 0.00 -0.01 0.00 0.00 57.90 57.08 2bai n TYR 27 Cb 0.27 -0.17 -0.01 0.00 -0.02 0.00 0.00 39.34 39.41 2bai n TYR 27 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 2bai n ARG 28 N -0.31 -1.93 -0.34 -0.72 1.85 -1.24 -4.70 116.66 109.27 2bai n ARG 28 Ca 0.11 0.29 0.06 0.00 -1.00 0.00 0.00 57.85 57.30 2bai n ARG 28 Cb 0.89 -4.62 0.20 0.00 -1.05 0.00 0.00 32.46 27.88 2bai n ARG 28 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 2bai n ASN 29 N -0.68 2.83 -4.71 2.89 2.85 -1.25 -4.90 115.26 112.29 2bai n ASN 29 Ca -0.06 -2.22 -0.42 0.00 -0.11 0.00 0.00 54.58 51.77 2bai n ASN 29 Cb 0.37 -0.42 -0.03 0.00 1.24 0.00 0.00 39.78 40.95 2bai n ASN 29 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 2bai s GLY 30 N -0.76 2.22 0.00 8.20 0.00 -1.26 -4.75 107.32 110.96 2bai s GLY 30 Ca 0.29 0.93 0.00 0.00 0.00 0.00 0.00 44.72 45.94 2bai s GLY 30 CO 0.15 2.18 0.00 0.69 0.00 0.00 0.00 173.10 176.12 2bai n PHE 31 N 4.08 0.00 -0.18 1.90 3.72 -1.26 -5.06 117.46 120.66 2bai n PHE 31 Ca 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.50 2bai n PHE 31 Cb 0.45 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2bai n PHE 31 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69