#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d0r n ALA 2 N 0.00 1.01 -0.01 1.57 0.00 -1.26 -5.01 120.51 116.81 1d0r n ALA 2 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1d0r n ALA 2 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1d0r n ALA 2 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1d0r n GLU 3 N -0.01 0.61 0.00 0.00 0.00 -1.26 -5.03 120.64 114.95 1d0r n GLU 3 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 57.16 57.10 1d0r n GLU 3 Cb 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 31.44 30.25 1d0r n GLU 3 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1d0r n GLY 4 N 2.13 1.00 2.68 -1.84 0.00 -1.26 -4.97 105.19 102.93 1d0r n GLY 4 Ca -0.03 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1d0r n GLY 4 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1d0r n THR 5 N 0.00 0.76 -1.42 2.61 -1.04 -1.26 -5.14 114.28 108.79 1d0r n THR 5 Ca 0.00 -2.63 -0.38 0.00 -2.04 0.00 0.00 64.05 58.99 1d0r n THR 5 Cb 0.00 0.80 0.03 0.00 -1.82 0.00 0.00 70.33 69.34 1d0r n THR 5 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1d0r n PHE 6 N -0.26 -1.18 0.09 -1.42 -1.74 -1.26 -4.97 117.46 106.73 1d0r n PHE 6 Ca 0.05 0.45 0.00 0.00 -0.56 0.00 0.00 57.45 57.39 1d0r n PHE 6 Cb 0.83 -1.89 0.00 0.00 1.52 0.00 0.00 39.48 39.93 1d0r n PHE 6 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 1d0r n THR 7 N -1.65 0.28 -0.37 1.97 5.66 -1.26 -4.65 114.28 114.28 1d0r n THR 7 Ca 0.11 0.09 0.27 0.00 -3.05 0.00 0.00 64.05 61.48 1d0r n THR 7 Cb 0.47 -0.82 0.54 0.00 -1.55 0.00 0.00 70.33 68.97 1d0r n THR 7 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 1d0r h SER 8 N 0.00 0.41 0.04 1.09 4.64 -2.01 -1.18 113.55 116.54 1d0r h SER 8 Ca 0.00 0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1d0r h SER 8 Cb 0.07 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1d0r h SER 8 CO 0.00 -0.07 -0.02 -0.78 -0.87 0.00 0.00 176.83 175.09 1d0r h ASP 9 N 0.28 -0.05 -0.38 4.97 1.82 -2.00 -3.19 116.42 117.87 1d0r h ASP 9 Ca 0.71 0.00 0.05 0.00 -0.39 0.00 0.00 57.03 57.41 1d0r h ASP 9 Cb 1.88 0.01 -0.06 0.00 0.68 0.00 0.00 39.33 41.85 1d0r h ASP 9 CO -0.44 0.01 -0.17 0.52 -1.61 0.00 0.00 179.24 177.55 1d0r n VAL 10 N -2.38 -0.22 0.41 2.25 0.31 -0.53 0.05 118.33 118.22 1d0r n VAL 10 Ca -0.01 0.90 -0.18 0.00 -0.01 0.00 0.00 64.34 65.04 1d0r n VAL 10 Cb 0.02 -1.17 -0.09 0.00 -0.91 0.00 0.00 33.84 31.69 1d0r n VAL 10 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1d0r h SER 11 N 0.00 -1.13 -0.56 4.52 4.64 -1.46 -0.71 113.55 118.85 1d0r h SER 11 Ca 0.11 0.06 0.10 0.00 -0.47 0.00 0.00 61.79 61.60 1d0r h SER 11 Cb 0.21 0.33 -0.11 0.00 -0.31 0.00 0.00 62.40 62.52 1d0r h SER 11 CO -0.37 -0.70 -0.29 0.28 -0.87 0.00 0.00 176.83 174.88 1d0r h SER 12 N -1.12 -0.99 -0.18 4.97 0.02 -0.37 0.10 113.55 115.98 1d0r h SER 12 Ca -0.10 0.21 0.04 0.00 -0.84 0.00 0.00 61.79 61.10 1d0r h SER 12 Cb 0.89 0.51 -0.07 0.00 0.14 0.00 0.00 62.40 63.88 1d0r h SER 12 CO 0.11 -0.29 -0.48 0.22 -1.14 0.00 0.00 176.83 175.26 1d0r h TYR 13 N -0.14 -1.40 0.17 3.45 5.03 -0.49 0.01 116.97 123.61 1d0r h TYR 13 Ca 0.24 0.06 0.01 0.00 2.58 0.00 0.00 58.73 61.61 1d0r h TYR 13 Cb 0.53 0.63 -0.02 0.00 1.55 0.00 0.00 36.73 39.43 1d0r h TYR 13 CO -0.58 -0.50 -0.18 1.25 -1.32 0.00 0.00 178.16 176.82 1d0r h LEU 14 N -0.51 -0.49 -0.64 2.82 5.85 -0.28 -2.93 115.31 119.13 1d0r h LEU 14 Ca 0.07 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.93 1d0r h LEU 14 Cb 0.65 0.17 -0.11 0.00 0.37 0.00 0.00 40.66 41.74 1d0r h LEU 14 CO -0.45 -0.27 -0.44 -0.08 -0.34 0.00 0.00 178.44 176.86 1d0r h GLU 15 N -0.39 -0.19 -1.42 1.25 4.81 -0.30 0.17 114.58 118.51 1d0r h GLU 15 Ca 0.00 0.01 0.44 0.00 -0.13 0.00 0.00 59.36 59.69 1d0r h GLU 15 Cb 0.38 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.71 1d0r h GLU 15 CO -0.05 -0.13 0.98 0.41 -0.73 0.00 0.00 179.01 179.49 1d0r n GLY 16 N -1.40 -0.76 0.25 1.92 0.00 -0.06 -0.70 105.19 104.43 1d0r n GLY 16 Ca 0.02 0.60 -0.24 0.00 0.00 0.00 0.00 46.02 46.40 1d0r n GLY 16 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1d0r n GLN 17 N -3.91 0.51 -0.34 1.61 -0.06 -0.15 -4.37 117.38 110.66 1d0r n GLN 17 Ca 0.35 0.22 0.07 0.00 -2.00 0.00 0.00 57.00 55.65 1d0r n GLN 17 Cb 1.50 -1.36 0.16 0.00 -4.06 0.00 0.00 30.24 26.49 1d0r n GLN 17 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1d0r h ALA 18 N -0.87 0.75 -0.19 1.69 0.00 0.15 0.34 119.26 121.12 1d0r h ALA 18 Ca -0.55 0.36 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1d0r h ALA 18 Cb 1.47 0.70 -0.05 0.00 0.00 0.00 0.00 17.79 19.90 1d0r h ALA 18 CO -0.34 -0.42 -0.14 0.00 0.00 0.00 0.00 179.25 178.35 1d0r h ALA 19 N 1.96 -0.00 0.31 0.00 0.00 -1.29 0.25 119.26 120.49 1d0r h ALA 19 Ca 0.49 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.46 1d0r h ALA 19 Cb 0.81 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1d0r h ALA 19 CO -0.97 -0.57 -0.19 -0.22 0.00 0.00 0.00 179.25 177.30 1d0r h LYS 20 N -0.15 -0.46 0.00 0.00 3.64 -0.68 -0.90 116.57 118.03 1d0r h LYS 20 Ca 0.12 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1d0r h LYS 20 Cb 0.32 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1d0r h LYS 20 CO -0.28 -0.31 0.00 0.93 -2.27 0.00 0.00 179.45 177.52 1d0r h GLU 21 N -0.48 0.00 0.03 1.90 4.39 -0.35 -0.14 114.58 119.94 1d0r h GLU 21 Ca -0.03 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 1d0r h GLU 21 Cb 0.40 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1d0r h GLU 21 CO 0.03 0.00 -0.02 0.35 -1.16 0.00 0.00 179.01 178.22 1d0r h PHE 22 N 0.00 -0.04 -0.78 4.33 3.04 0.54 1.23 116.94 125.25 1d0r h PHE 22 Ca 0.00 -0.00 0.18 0.00 3.98 0.00 0.00 57.97 62.13 1d0r h PHE 22 Cb 0.04 0.01 -0.12 0.00 2.56 0.00 0.00 35.95 38.45 1d0r h PHE 22 CO 0.00 0.64 0.20 0.82 -2.02 0.00 0.00 178.31 177.95 1d0r h ILE 23 N -0.91 0.46 0.00 1.41 2.04 -0.01 0.38 117.51 120.88 1d0r h ILE 23 Ca -0.00 -0.09 -0.12 0.00 1.00 0.00 0.00 64.86 65.65 1d0r h ILE 23 Cb 0.70 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1d0r h ILE 23 CO 0.01 0.05 -0.55 0.00 0.00 0.00 0.00 178.15 177.66 1d0r h ALA 24 N 1.66 0.84 -0.86 1.87 0.00 -1.02 -3.30 119.26 118.45 1d0r h ALA 24 Ca 0.46 -0.50 0.19 0.00 0.00 0.00 0.00 54.91 55.06 1d0r h ALA 24 Cb 0.82 -0.09 -0.16 0.00 0.00 0.00 0.00 17.79 18.36 1d0r h ALA 24 CO -0.55 0.69 -0.10 2.35 0.00 0.00 0.00 179.25 181.64 1d0r h TRP 25 N 0.00 -0.25 0.88 0.00 7.01 0.59 0.33 115.95 124.52 1d0r h TRP 25 Ca -0.01 0.07 -0.04 0.00 2.11 0.00 0.00 58.89 61.02 1d0r h TRP 25 Cb 1.16 0.25 0.00 0.00 -2.10 0.00 0.00 29.16 28.47 1d0r h TRP 25 CO 0.00 -0.35 -0.48 -0.07 -2.79 0.00 0.00 178.44 174.76 1d0r h LEU 26 N 0.03 -1.17 -1.21 0.65 -0.00 -1.63 -2.37 115.31 109.62 1d0r h LEU 26 Ca 0.45 0.05 0.14 0.00 -0.00 0.00 0.00 57.88 58.52 1d0r h LEU 26 Cb 0.79 0.32 -0.02 0.00 -0.00 0.00 0.00 40.66 41.75 1d0r h LEU 26 CO -0.83 -0.77 0.82 0.58 -0.00 0.00 0.00 178.44 178.24 1d0r h VAL 27 N -1.25 0.09 -0.35 1.22 2.07 -0.57 -0.66 116.25 116.81 1d0r h VAL 27 Ca -0.12 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.50 1d0r h VAL 27 Cb 0.98 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1d0r h VAL 27 CO 0.16 0.00 0.29 0.11 0.02 0.00 0.00 177.57 178.15 1d0r h LYS 28 N 0.00 0.00 0.15 1.57 1.79 -0.44 0.20 116.57 119.84 1d0r h LYS 28 Ca 0.22 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.36 1d0r h LYS 28 Cb 1.87 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.51 1d0r h LYS 28 CO -0.00 0.00 -1.66 0.78 -1.08 0.00 0.00 179.45 177.49 1d0r h GLY 29 N 0.00 0.35 0.00 3.86 0.00 -1.29 -3.52 103.07 102.47 1d0r h GLY 29 Ca 0.16 -0.91 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1d0r h GLY 29 CO -0.00 0.79 0.00 0.54 0.00 0.00 0.00 176.54 177.87