#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucy s PHE 1 N 0.00 0.43 -0.19 4.78 0.08 -1.26 -5.16 117.98 116.67 1ucy s PHE 1 Ca 0.00 -0.90 -0.04 0.00 0.12 0.00 0.00 56.93 56.11 1ucy s PHE 1 Cb 0.00 -0.32 0.06 0.00 -0.57 0.00 0.00 43.02 42.19 1ucy s PHE 1 CO 0.00 -0.32 0.08 0.20 -0.10 0.00 0.00 175.22 175.08 1ucy s GLY 1 N -2.47 0.46 0.00 4.36 0.00 -1.26 -4.78 107.32 103.63 1ucy s GLY 1 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 44.72 44.24 1ucy s GLY 1 CO -0.07 1.67 0.00 0.00 0.00 0.00 0.00 173.10 174.70 1ucy n ALA 1 N 5.21 0.00 0.00 3.20 0.00 -1.26 -5.06 120.51 122.60 1ucy n ALA 1 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ucy n ALA 1 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1ucy n ALA 1 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ucy n GLY 1 N 0.00 0.14 0.82 0.00 0.00 -1.26 -5.02 105.19 99.87 1ucy n GLY 1 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1ucy n GLY 1 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ucy n GLU 1 N 0.00 0.93 -0.56 1.61 -0.58 -1.26 -4.71 120.64 116.06 1ucy n GLU 1 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1ucy n GLU 1 Cb 0.00 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 1ucy n GLU 1 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ucy n ALA 1 N 0.35 0.00 0.00 0.62 0.00 -1.26 -4.13 120.51 116.10 1ucy n ALA 1 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ucy n ALA 1 Cb 0.38 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1ucy n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ucy n ASP 1 N -0.01 0.00 -4.75 0.00 2.03 -1.26 -5.05 116.55 107.50 1ucy n ASP 1 Ca 0.00 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.93 1ucy n ASP 1 Cb 0.01 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.44 1ucy n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ucy n GLY 2 N 0.69 3.00 3.47 0.00 0.00 -1.26 -4.73 105.19 106.36 1ucy n GLY 2 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1ucy n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ucy s LEU 3 N 0.00 4.94 0.03 0.99 1.43 -1.16 -5.01 118.68 119.90 1ucy s LEU 3 Ca 0.00 -0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 52.05 1ucy s LEU 3 Cb 0.00 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 1ucy s LEU 3 CO 0.00 -0.59 1.08 -0.13 0.23 0.00 0.00 176.35 176.94 1ucy s ARG 4 N 2.09 4.50 0.15 1.70 0.52 -1.26 -4.80 118.95 121.85 1ucy s ARG 4 Ca 0.11 1.58 -0.20 0.00 -0.52 0.00 0.00 55.73 56.70 1ucy s ARG 4 Cb -0.18 -3.41 0.03 0.00 0.52 0.00 0.00 34.95 31.92 1ucy s ARG 4 CO 0.13 -0.14 1.67 -1.35 0.02 0.00 0.00 175.30 175.62 1ucy h PRO 5 N 6.78 -0.10 0.00 3.54 0.11 -1.96 -1.63 132.00 138.74 1ucy h PRO 5 Ca -0.41 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1ucy h PRO 5 Cb 1.22 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ucy h PRO 5 CO 0.78 -0.07 0.00 1.28 -0.21 0.00 0.00 178.00 179.78 1ucy n LEU 6 N -5.30 0.00 0.00 2.35 4.32 -1.26 -3.65 117.00 113.46 1ucy n LEU 6 Ca -0.01 0.29 0.00 0.00 -0.02 0.00 0.00 56.01 56.27 1ucy n LEU 6 Cb 0.22 -0.29 0.00 0.00 -1.62 0.00 0.00 43.42 41.73 1ucy n LEU 6 CO 0.18 -0.07 0.00 0.49 -1.22 0.00 0.00 177.39 176.77 1ucy n PHE 7 N -1.29 0.00 0.00 -1.77 3.01 -0.87 -4.73 117.46 111.81 1ucy n PHE 7 Ca 0.11 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.47 1ucy n PHE 7 Cb 0.18 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.62 1ucy n PHE 7 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1ucy h GLU 8 N 0.00 -0.16 0.00 -1.08 3.07 -1.41 0.40 114.58 115.40 1ucy h GLU 8 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1ucy h GLU 8 Cb 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1ucy h GLU 8 CO 0.00 -0.11 0.00 1.63 -1.40 0.00 0.00 179.01 179.13 1ucy n LYS 9 N -5.28 0.07 0.00 2.33 5.02 -0.72 -1.63 118.16 117.94 1ucy n LYS 9 Ca -0.03 0.35 0.08 0.00 -2.02 0.00 0.00 58.31 56.69 1ucy n LYS 9 Cb 0.20 -1.64 -0.00 0.00 -0.02 0.00 0.00 35.03 33.57 1ucy n LYS 9 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1ucy n LYS 10 N -1.76 1.69 -1.79 1.97 3.00 0.01 -4.97 118.16 116.30 1ucy n LYS 10 Ca 0.02 -0.80 -0.13 0.00 -0.00 0.00 0.00 58.31 57.41 1ucy n LYS 10 Cb 0.16 -1.26 -0.03 0.00 0.00 0.00 0.00 35.03 33.90 1ucy n LYS 10 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1ucy n GLN 11 N -0.12 -0.94 -4.44 1.64 3.00 0.11 -4.97 117.38 111.66 1ucy n GLN 11 Ca 0.07 0.78 -0.35 0.00 -0.01 0.00 0.00 57.00 57.49 1ucy n GLN 11 Cb 0.33 -4.90 -0.10 0.00 0.00 0.00 0.00 30.24 25.57 1ucy n GLN 11 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1ucy s VAL 12 N -2.55 4.13 -0.00 5.09 1.01 0.76 -4.98 120.40 123.86 1ucy s VAL 12 Ca 0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1ucy s VAL 12 Cb 0.00 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 1ucy s VAL 12 CO 0.00 0.60 0.29 -1.10 0.00 0.00 0.00 175.10 174.89 1ucy s GLN 13 N -0.79 3.65 0.82 2.72 -0.21 -1.26 -3.73 119.66 120.86 1ucy s GLN 13 Ca 0.12 0.05 -0.11 0.00 0.02 0.00 0.00 55.36 55.44 1ucy s GLN 13 Cb -0.11 -3.11 0.12 0.00 1.00 0.00 0.00 33.01 30.90 1ucy s GLN 13 CO 0.02 0.66 1.17 0.16 -2.12 0.00 0.00 175.29 175.18 1ucy s ASP 14 N -1.48 4.13 0.00 5.90 1.47 -1.26 -4.98 116.67 120.46 1ucy s ASP 14 Ca 0.26 0.45 0.19 0.00 1.18 0.00 0.00 52.55 54.62 1ucy s ASP 14 Cb -0.14 -0.83 0.87 0.00 -0.34 0.00 0.00 42.92 42.48 1ucy s ASP 14 CO 0.14 -2.09 1.58 0.00 0.68 0.00 0.00 175.17 175.48 1ucy n GLN 14 N -3.33 0.15 0.00 2.11 1.13 -1.26 -3.55 117.38 112.63 1ucy n GLN 14 Ca 0.11 0.14 0.00 0.00 -1.94 0.00 0.00 57.00 55.31 1ucy n GLN 14 Cb 0.60 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.45 1ucy n GLN 14 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1ucy n THR 14 N -1.38 0.00 -0.32 5.09 -2.24 -1.26 -4.88 114.28 109.29 1ucy n THR 14 Ca 0.07 -0.15 0.13 0.00 -2.27 0.00 0.00 64.05 61.83 1ucy n THR 14 Cb 0.18 1.61 0.31 0.00 -2.10 0.00 0.00 70.33 70.33 1ucy n THR 14 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ucy h GLU 14 N 0.00 0.51 0.00 -0.78 4.81 -1.96 0.16 114.58 117.33 1ucy h GLU 14 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1ucy h GLU 14 Cb 0.30 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1ucy h GLU 14 CO 0.00 0.34 0.00 1.57 -0.73 0.00 0.00 179.01 180.19 1ucy h LYS 14 N 0.53 0.00 0.00 1.92 -0.00 -1.90 -1.76 116.57 115.36 1ucy h LYS 14 Ca 0.56 0.00 -0.05 0.00 -0.00 0.00 0.00 60.65 61.16 1ucy h LYS 14 Cb 0.99 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.22 1ucy h LYS 14 CO -0.46 0.00 -0.23 1.49 -0.00 0.00 0.00 179.45 180.25 1ucy h GLU 14 N 0.00 0.00 0.23 0.07 4.81 -1.04 -1.55 114.58 117.10 1ucy h GLU 14 Ca 0.00 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 58.92 1ucy h GLU 14 Cb 0.44 0.00 0.04 0.00 0.63 0.00 0.00 28.75 29.86 1ucy h GLU 14 CO 0.00 0.23 -1.36 -0.07 -0.73 0.00 0.00 179.01 177.08 1ucy h LEU 14 N 0.00 0.79 -0.84 1.64 3.38 -1.40 -3.24 115.31 115.64 1ucy h LEU 14 Ca -0.00 -0.92 -0.12 0.00 0.09 0.00 0.00 57.88 56.93 1ucy h LEU 14 Cb 0.44 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1ucy h LEU 14 CO 0.03 1.66 -0.44 -0.26 0.09 0.00 0.00 178.44 179.52 1ucy h PHE 14 N 0.06 0.36 -0.48 1.13 -1.00 -1.37 -2.75 116.94 112.88 1ucy h PHE 14 Ca -0.24 -0.11 -0.03 0.00 2.81 0.00 0.00 57.97 60.41 1ucy h PHE 14 Cb 2.07 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 41.53 1ucy h PHE 14 CO 0.14 0.70 0.18 0.93 -1.61 0.00 0.00 178.31 178.64 1ucy h GLU 14 N 0.25 0.70 0.00 1.51 5.08 -1.39 -0.79 114.58 119.94 1ucy h GLU 14 Ca 0.02 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 1ucy h GLU 14 Cb 0.88 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1ucy h GLU 14 CO 0.07 0.59 -0.42 0.66 -1.00 0.00 0.00 179.01 178.92 1ucy h SER 14 N 0.69 0.00 -0.13 1.42 4.64 -1.52 -0.45 113.55 118.20 1ucy h SER 14 Ca 0.16 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.27 1ucy h SER 14 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1ucy h SER 14 CO -0.01 0.42 -0.74 1.88 -0.87 0.00 0.00 176.83 177.50 1ucy h TYR 14 N 0.00 1.01 0.02 4.77 0.05 -0.93 -2.44 116.97 119.45 1ucy h TYR 14 Ca -0.00 -0.45 -0.24 0.00 0.05 0.00 0.00 58.73 58.08 1ucy h TYR 14 Cb 0.80 -0.15 0.01 0.00 1.01 0.00 0.00 36.73 38.39 1ucy h TYR 14 CO 0.00 1.28 -1.00 -0.84 -1.05 0.00 0.00 178.16 176.55 1ucy h ILE 14 N 0.45 1.38 0.00 -2.88 3.07 -1.27 -3.08 117.51 115.19 1ucy h ILE 14 Ca -0.06 -2.45 0.00 0.00 1.55 0.00 0.00 64.86 63.90 1ucy h ILE 14 Cb 1.38 2.46 0.00 0.00 -0.27 0.00 0.00 36.82 40.39 1ucy h ILE 14 CO 0.15 0.74 0.00 -0.33 -1.05 0.00 0.00 178.15 177.66 1ucy h GLU 14 N 0.25 0.00 -0.00 0.16 5.08 -1.17 -2.32 114.58 116.58 1ucy h GLU 14 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1ucy h GLU 14 Cb 1.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.89 1ucy h GLU 14 CO 0.18 0.00 -0.04 0.41 -1.00 0.00 0.00 179.01 178.56 1ucy n GLY 14 N 0.43 -0.90 3.22 -3.84 0.00 -0.92 -5.07 105.19 98.11 1ucy n GLY 14 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1ucy n GLY 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19