#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bai s ALA 2 N 0.00 -0.08 -0.40 3.17 0.00 -1.26 -5.13 121.76 118.07 2bai s ALA 2 Ca 0.00 -1.09 -0.18 0.00 0.00 0.00 0.00 51.96 50.68 2bai s ALA 2 Cb 0.00 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.01 2bai s ALA 2 CO 0.00 -0.90 0.50 0.99 0.00 0.00 0.00 175.76 176.34 2bai s THR 3 N -2.57 5.02 -0.26 0.00 2.01 -1.26 -5.04 115.64 113.54 2bai s THR 3 Ca 0.22 -0.00 -0.10 0.00 0.31 0.00 0.00 61.69 62.11 2bai s THR 3 Cb -0.03 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 2bai s THR 3 CO 0.16 -0.37 0.16 -0.89 -0.69 0.00 0.00 174.62 172.99 2bai s THR 4 N 2.35 5.23 -0.08 -0.82 2.01 -1.26 -4.97 115.64 118.11 2bai s THR 4 Ca 0.16 0.14 -0.17 0.00 0.31 0.00 0.00 61.69 62.13 2bai s THR 4 Cb -0.16 -3.46 -0.29 0.00 0.01 0.00 0.00 72.50 68.60 2bai s THR 4 CO 0.15 0.31 0.67 0.24 -0.69 0.00 0.00 174.62 175.29 2bai h MET 5 N 7.90 0.29 -4.27 4.92 2.07 -1.99 -3.50 114.93 120.36 2bai h MET 5 Ca -0.37 -0.49 0.00 0.00 -2.07 0.00 0.00 59.70 56.77 2bai h MET 5 Cb 1.18 0.18 0.00 0.00 -1.87 0.00 0.00 31.60 31.09 2bai h MET 5 CO 0.61 1.24 -0.13 -1.91 1.07 0.00 0.00 176.91 177.78 2bai n GLU 6 N -3.92 -1.00 0.00 1.72 0.00 -1.26 -5.00 120.64 111.18 2bai n GLU 6 Ca -0.22 1.21 0.00 0.00 0.00 0.00 0.00 57.16 58.15 2bai n GLU 6 Cb 0.91 -3.82 0.00 0.00 0.00 0.00 0.00 31.44 28.54 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 -0.94 0.00 -0.99 5.31 10.64 -1.26 -5.06 117.38 125.08 2bai n GLN 7 Ca 0.03 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.20 2bai n GLN 7 Cb 0.38 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.76 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 0.00 -3.39 2.61 1.02 -1.26 -4.94 120.64 114.67 2bai n GLU 8 Ca 0.00 0.33 -0.24 0.00 -0.02 0.00 0.00 57.16 57.23 2bai n GLU 8 Cb 0.00 -0.85 -0.10 0.00 -0.02 0.00 0.00 31.44 30.48 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 -0.37 -0.00 0.55 -3.67 -5.25 0.58 -4.33 121.20 108.70 2bai s ILE 9 Ca 0.00 -1.66 0.03 0.00 -0.99 0.00 0.00 60.65 58.04 2bai s ILE 9 Cb 0.00 -0.97 0.03 0.00 2.95 0.00 0.00 42.46 44.47 2bai s ILE 9 CO 0.00 -0.89 0.26 0.00 -1.79 0.00 0.00 174.94 172.53 2bai n ALA 11 N -1.63 2.38 0.00 0.00 0.00 -1.26 -3.40 120.51 116.60 2bai n ALA 11 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2bai n ALA 11 Cb 0.65 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.08 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 -0.53 0.00 0.00 0.00 8.25 -1.26 -5.05 115.22 116.63 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 0.00 0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.24 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 -2.56 0.00 -0.74 0.41 7.64 -1.22 -5.12 113.62 112.03 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 0.30 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 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 -4.80 117.12 108.46 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 -0.03 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 -2.68 4.91 0.37 2.03 2.01 -1.26 0.45 115.64 121.47 2bai s THR 15 Ca 0.00 -1.10 0.20 0.00 0.31 0.00 0.00 61.69 61.11 2bai s THR 15 Cb 0.00 -3.63 0.37 0.00 0.01 0.00 0.00 72.50 69.25 2bai s THR 15 CO 0.00 -0.28 1.62 -0.26 -0.69 0.00 0.00 174.62 175.01 2bai h PHE 16 N 1.54 0.81 0.02 4.92 0.04 -1.98 2.45 116.94 124.73 2bai h PHE 16 Ca -0.50 0.04 -0.20 0.00 2.80 0.00 0.00 57.97 60.10 2bai h PHE 16 Cb 1.22 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 39.16 2bai h PHE 16 CO 0.51 -0.30 -0.92 0.93 -0.60 0.00 0.00 178.31 177.92 2bai h GLU 17 N 0.14 0.13 -0.43 1.51 4.39 -2.00 -3.04 114.58 115.29 2bai h GLU 17 Ca 0.80 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 60.33 2bai h GLU 17 Cb 2.09 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.79 2bai h GLU 17 CO -0.63 0.96 0.00 0.39 -1.16 0.00 0.00 179.01 178.57 2bai n GLU 18 N -3.58 2.16 0.10 2.33 4.71 0.66 -3.98 120.64 123.04 2bai n GLU 18 Ca -0.03 -1.79 -0.00 0.00 -0.01 0.00 0.00 57.16 55.33 2bai n GLU 18 Cb 0.85 -1.42 0.29 0.00 -1.01 0.00 0.00 31.44 30.14 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 -4.12 0.75 -0.07 0.00 -0.04 -1.26 -2.22 135.00 128.05 2bai n PRO 20 Ca -0.01 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.42 2bai n PRO 20 Cb 0.40 -1.44 -0.16 0.00 -0.04 0.00 0.00 33.50 32.25 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 -0.94 0.74 -0.18 0.54 3.00 -0.45 -2.77 118.16 118.09 2bai n LYS 21 Ca 0.16 -0.07 -0.01 0.00 -0.00 0.00 0.00 58.31 58.38 2bai n LYS 21 Cb 0.07 -1.50 0.06 0.00 0.00 0.00 0.00 35.03 33.66 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 0.03 0.29 -0.50 0.00 0.87 -1.76 -3.37 113.55 109.10 2bai h SER 23 Ca 0.28 -0.80 -0.34 0.00 -1.23 0.00 0.00 61.79 59.69 2bai h SER 23 Cb 0.43 -0.10 -0.12 0.00 -0.44 0.00 0.00 62.40 62.17 2bai h SER 23 CO -0.55 1.72 0.06 0.00 -0.53 0.00 0.00 176.83 177.53 2bai n ALA 24 N -3.12 6.44 1.31 6.23 0.00 -1.05 -3.96 120.51 126.35 2bai n ALA 24 Ca -0.31 -2.44 0.13 0.00 0.00 0.00 0.00 53.44 50.82 2bai n ALA 24 Cb 0.92 -2.26 0.40 0.00 0.00 0.00 0.00 19.45 18.51 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 1.76 1.26 -2.27 0.00 7.94 0.33 -4.58 117.00 121.44 2bai n LEU 25 Ca 0.46 -0.37 -0.10 0.00 -1.11 0.00 0.00 56.01 54.89 2bai n LEU 25 Cb 0.73 -0.08 -0.01 0.00 0.53 0.00 0.00 43.42 44.60 2bai n LEU 25 CO 0.23 0.22 -0.12 1.67 -1.11 0.00 0.00 177.39 178.29 2bai n GLN 26 N -0.32 -2.21 -0.85 1.96 -0.06 -1.26 -4.77 117.38 109.87 2bai n GLN 26 Ca 0.14 0.49 0.04 0.00 -2.00 0.00 0.00 57.00 55.66 2bai n GLN 26 Cb 0.36 -5.00 0.17 0.00 -4.06 0.00 0.00 30.24 21.71 2bai n GLN 26 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2bai n TYR 27 N -2.96 0.21 -1.90 3.69 4.01 -1.26 -4.94 117.16 114.01 2bai n TYR 27 Ca -0.11 -1.42 -0.08 0.00 -0.16 0.00 0.00 57.90 56.13 2bai n TYR 27 Cb 0.55 -0.24 -0.02 0.00 -0.31 0.00 0.00 39.34 39.32 2bai n TYR 27 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2bai n ARG 28 N -0.86 -1.88 -0.05 -0.72 1.74 -1.26 -4.79 116.66 108.84 2bai n ARG 28 Ca 0.19 0.44 -0.00 0.00 -0.77 0.00 0.00 57.85 57.71 2bai n ARG 28 Cb 0.77 -4.82 -0.00 0.00 -1.02 0.00 0.00 32.46 27.39 2bai n ARG 28 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 2bai h ASN 29 N 0.00 0.00 0.00 0.55 -0.73 -1.90 -3.48 115.58 110.02 2bai h ASN 29 Ca -0.19 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.98 2bai h ASN 29 Cb 0.87 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.46 2bai h ASN 29 CO 0.24 0.48 0.00 0.61 -0.37 0.00 0.00 177.43 178.39 2bai n GLY 30 N 1.79 3.05 3.80 1.57 0.00 -1.25 -4.65 105.19 109.49 2bai n GLY 30 Ca -0.00 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 2bai n GLY 30 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bai s PHE 31 N 0.00 2.55 -2.71 1.61 5.36 -1.26 -4.61 117.98 118.93 2bai s PHE 31 Ca 0.00 -0.58 0.26 0.00 -0.96 0.00 0.00 56.93 55.65 2bai s PHE 31 Cb 0.00 -2.03 0.69 0.00 -0.34 0.00 0.00 43.02 41.34 2bai s PHE 31 CO 0.00 0.02 1.54 0.98 -1.46 0.00 0.00 175.22 176.31