#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucy n PHE 1 N 0.00 0.00 0.48 -1.42 3.72 -1.26 -4.95 117.46 114.03 1ucy n PHE 1 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 1ucy n PHE 1 Cb 0.00 0.00 0.46 0.00 -0.94 0.00 0.00 39.48 39.00 1ucy n PHE 1 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ucy n GLY 1 N 0.00 -1.43 0.17 1.37 0.00 -1.26 -2.66 105.19 101.38 1ucy n GLY 1 Ca 0.00 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.19 1ucy n GLY 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucy h ALA 1 N 2.36 1.00 -0.16 4.61 0.00 -1.96 -3.03 119.26 122.07 1ucy h ALA 1 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ucy h ALA 1 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1ucy h ALA 1 CO 0.00 0.00 -0.17 0.78 0.00 0.00 0.00 179.25 179.86 1ucy h GLY 1 N 0.32 -0.09 -7.59 0.00 0.00 -1.89 -3.26 103.07 90.57 1ucy h GLY 1 Ca 0.00 0.21 -0.73 0.00 0.00 0.00 0.00 47.33 46.81 1ucy h GLY 1 CO 0.00 -0.17 -0.13 1.85 0.00 0.00 0.00 176.54 178.09 1ucy s GLU 1 N -6.13 3.10 0.28 4.80 -6.30 -1.15 -4.98 118.70 108.31 1ucy s GLU 1 Ca -0.14 -2.70 0.23 0.00 -2.50 0.00 0.00 54.97 49.85 1ucy s GLU 1 Cb 0.11 -4.02 0.91 0.00 0.00 0.00 0.00 34.13 31.13 1ucy s GLU 1 CO 0.68 -1.23 0.89 0.00 0.02 0.00 0.00 175.26 175.62 1ucy n ALA 1 N 3.34 0.90 -1.33 6.30 0.00 -1.23 0.13 120.51 128.62 1ucy n ALA 1 Ca 0.13 0.45 0.07 0.00 0.00 0.00 0.00 53.44 54.09 1ucy n ALA 1 Cb 0.40 -0.63 0.18 0.00 0.00 0.00 0.00 19.45 19.41 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 -3.53 2.11 -4.77 0.00 2.03 -1.26 -5.03 116.55 106.10 1ucy n ASP 1 Ca 0.24 -3.51 -0.37 0.00 0.52 0.00 0.00 54.79 51.68 1ucy n ASP 1 Cb 1.00 -0.49 -0.01 0.00 -0.72 0.00 0.00 41.12 40.90 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 0.40 1.19 3.30 0.00 0.00 -1.26 -4.97 105.19 103.85 1ucy n GLY 2 Ca 0.07 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.64 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 6.32 -0.02 0.99 1.43 -1.24 -5.00 118.68 121.16 1ucy s LEU 3 Ca 0.00 -2.16 -0.30 0.00 -1.03 0.00 0.00 54.13 50.65 1ucy s LEU 3 Cb 0.00 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.97 1ucy s LEU 3 CO 0.00 -0.73 1.82 -0.13 0.23 0.00 0.00 176.35 177.55 1ucy s ARG 4 N 1.02 4.11 0.30 1.70 0.52 -1.26 -4.73 118.95 120.61 1ucy s ARG 4 Ca 0.09 2.37 0.04 0.00 -0.52 0.00 0.00 55.73 57.71 1ucy s ARG 4 Cb -0.22 -4.09 0.76 0.00 0.52 0.00 0.00 34.95 31.92 1ucy s ARG 4 CO -0.02 -0.96 1.65 -1.35 0.02 0.00 0.00 175.30 174.65 1ucy h PRO 5 N 10.27 0.22 -0.01 3.54 0.11 -1.96 -0.40 132.00 143.76 1ucy h PRO 5 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ucy h PRO 5 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ucy h PRO 5 CO 0.95 0.14 -0.13 1.28 -0.21 0.00 0.00 178.00 180.03 1ucy n LEU 6 N -5.21 1.41 0.00 2.35 4.32 -1.26 -3.91 117.00 114.70 1ucy n LEU 6 Ca 0.23 -0.44 0.00 0.00 -0.02 0.00 0.00 56.01 55.78 1ucy n LEU 6 Cb 0.73 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 42.47 1ucy n LEU 6 CO 0.06 0.25 0.00 0.49 -1.22 0.00 0.00 177.39 176.97 1ucy n PHE 7 N -0.12 0.00 -0.25 -1.77 3.72 -0.24 -4.64 117.46 114.16 1ucy n PHE 7 Ca 0.15 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.59 1ucy n PHE 7 Cb 0.37 0.00 0.17 0.00 -0.94 0.00 0.00 39.48 39.08 1ucy n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1ucy h GLU 8 N 0.00 0.41 -0.41 -1.08 3.07 -1.48 0.17 114.58 115.26 1ucy h GLU 8 Ca 0.00 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 58.77 1ucy h GLU 8 Cb 0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 1ucy h GLU 8 CO 0.00 0.27 -0.01 0.87 -1.40 0.00 0.00 179.01 178.75 1ucy h LYS 9 N 0.43 0.67 -0.66 2.33 1.79 -1.51 -2.87 116.57 116.75 1ucy h LYS 9 Ca 0.39 -0.17 -0.17 0.00 -2.18 0.00 0.00 60.65 58.53 1ucy h LYS 9 Cb 0.58 -0.09 -0.10 0.00 -1.58 0.00 0.00 32.23 31.04 1ucy h LYS 9 CO -0.39 0.69 0.19 1.63 -1.08 0.00 0.00 179.45 180.50 1ucy n LYS 10 N -4.24 3.72 -3.29 3.15 5.02 -0.22 -4.92 118.16 117.38 1ucy n LYS 10 Ca 0.02 -3.09 -0.23 0.00 -2.02 0.00 0.00 58.31 52.99 1ucy n LYS 10 Cb 0.28 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 1ucy n LYS 10 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1ucy n GLN 11 N -0.14 -3.56 -4.29 1.97 1.13 -0.26 -4.93 117.38 107.30 1ucy n GLN 11 Ca 0.37 0.53 -0.33 0.00 -1.94 0.00 0.00 57.00 55.63 1ucy n GLN 11 Cb 1.31 -5.26 -0.09 0.00 0.11 0.00 0.00 30.24 26.31 1ucy n GLN 11 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1ucy s VAL 12 N -2.95 4.24 -0.06 5.09 1.01 0.43 -5.01 120.40 123.14 1ucy s VAL 12 Ca 0.38 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 1ucy s VAL 12 Cb -0.20 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.29 1ucy s VAL 12 CO 0.46 0.43 -0.01 -1.10 0.00 0.00 0.00 175.10 174.88 1ucy s GLN 13 N -1.40 2.89 0.41 2.72 -0.21 -1.26 -3.98 119.66 118.84 1ucy s GLN 13 Ca 0.18 -0.48 -0.14 0.00 0.02 0.00 0.00 55.36 54.95 1ucy s GLN 13 Cb -0.11 -2.73 -0.08 0.00 1.00 0.00 0.00 33.01 31.09 1ucy s GLN 13 CO 0.08 0.68 0.82 0.16 -2.12 0.00 0.00 175.29 174.92 1ucy s ASP 14 N -1.01 6.64 0.43 5.90 1.47 -1.26 -4.94 116.67 123.89 1ucy s ASP 14 Ca 0.14 1.31 0.35 0.00 1.18 0.00 0.00 52.55 55.54 1ucy s ASP 14 Cb -0.11 -2.39 1.38 0.00 -0.34 0.00 0.00 42.92 41.46 1ucy s ASP 14 CO 0.04 -0.39 1.33 0.00 0.68 0.00 0.00 175.17 176.83 1ucy n GLN 14 N -1.09 -0.02 0.00 2.11 6.02 -1.26 -1.88 117.38 121.27 1ucy n GLN 14 Ca 0.04 1.00 0.00 0.00 -0.01 0.00 0.00 57.00 58.03 1ucy n GLN 14 Cb 0.54 -2.13 0.00 0.00 1.02 0.00 0.00 30.24 29.67 1ucy n GLN 14 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1ucy n THR 14 N -4.03 0.75 0.27 5.09 -2.24 -1.26 -4.73 114.28 108.13 1ucy n THR 14 Ca 0.36 -0.77 0.11 0.00 -2.27 0.00 0.00 64.05 61.48 1ucy n THR 14 Cb 1.54 0.64 0.76 0.00 -2.10 0.00 0.00 70.33 71.16 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 0.00 -0.56 -0.78 4.81 -1.76 -2.48 114.58 113.81 1ucy h GLU 14 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1ucy h GLU 14 Cb 0.57 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1ucy h GLU 14 CO 0.00 0.04 0.16 -0.22 -0.73 0.00 0.00 179.01 178.27 1ucy h LYS 14 N 0.00 0.84 -0.83 1.92 3.64 -1.85 -2.75 116.57 117.54 1ucy h LYS 14 Ca -0.00 -0.16 0.03 0.00 -1.27 0.00 0.00 60.65 59.25 1ucy h LYS 14 Cb 0.09 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.73 1ucy h LYS 14 CO 0.01 0.73 0.54 1.49 -2.27 0.00 0.00 179.45 179.94 1ucy h GLU 14 N 0.82 1.02 -0.06 1.90 4.81 -1.81 0.49 114.58 121.75 1ucy h GLU 14 Ca 0.18 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.28 1ucy h GLU 14 Cb 0.25 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1ucy h GLU 14 CO -0.01 0.68 -0.31 -0.07 -0.73 0.00 0.00 179.01 178.57 1ucy h LEU 14 N 1.06 0.11 -0.08 1.64 3.38 -1.60 -2.36 115.31 117.47 1ucy h LEU 14 Ca 0.32 -0.03 -0.22 0.00 0.09 0.00 0.00 57.88 58.04 1ucy h LEU 14 Cb -0.03 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.71 1ucy h LEU 14 CO -0.10 0.42 -0.81 0.15 0.09 0.00 0.00 178.44 178.19 1ucy h PHE 14 N 0.10 0.96 -0.15 1.13 3.57 -1.11 -3.28 116.94 118.16 1ucy h PHE 14 Ca 0.01 -0.47 0.04 0.00 3.53 0.00 0.00 57.97 61.09 1ucy h PHE 14 Cb 0.60 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 39.16 1ucy h PHE 14 CO 0.00 1.29 -0.15 0.93 -2.23 0.00 0.00 178.31 178.16 1ucy h GLU 14 N 0.35 -0.17 -0.17 1.11 5.08 -0.59 -1.74 114.58 118.45 1ucy h GLU 14 Ca -0.08 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1ucy h GLU 14 Cb 1.46 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.74 1ucy h GLU 14 CO 0.16 -0.11 0.42 0.66 -1.00 0.00 0.00 179.01 179.14 1ucy h SER 14 N -0.18 0.00 0.71 1.42 4.64 -1.49 0.64 113.55 119.30 1ucy h SER 14 Ca 0.10 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.18 1ucy h SER 14 Cb 0.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1ucy h SER 14 CO -0.25 0.00 -1.09 1.88 -0.87 0.00 0.00 176.83 176.49 1ucy h TYR 14 N 0.00 0.32 0.00 4.77 0.05 -1.40 -3.36 116.97 117.35 1ucy h TYR 14 Ca 0.08 -0.22 0.00 0.00 0.05 0.00 0.00 58.73 58.64 1ucy h TYR 14 Cb 0.91 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.64 1ucy h TYR 14 CO 0.00 1.14 -1.55 0.44 -1.05 0.00 0.00 178.16 177.14 1ucy n ILE 14 N -3.52 0.01 -1.71 -2.88 -5.35 0.09 -4.93 119.36 101.07 1ucy n ILE 14 Ca -0.05 -0.28 -0.42 0.00 -0.27 0.00 0.00 62.75 61.72 1ucy n ILE 14 Cb 0.95 0.42 -0.03 0.00 -1.74 0.00 0.00 39.64 39.24 1ucy n ILE 14 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1ucy s GLU 14 N -3.29 3.85 0.00 6.28 2.02 -0.46 -4.93 118.70 122.17 1ucy s GLU 14 Ca -0.01 2.36 -0.00 0.00 0.02 0.00 0.00 54.97 57.34 1ucy s GLU 14 Cb 0.15 -4.20 -0.00 0.00 0.10 0.00 0.00 34.13 30.18 1ucy s GLU 14 CO 0.89 -1.28 0.91 0.41 0.02 0.00 0.00 175.26 176.21 1ucy n GLY 14 N 4.84 -2.83 0.00 -1.39 0.00 -1.26 -5.01 105.19 99.55 1ucy n GLY 14 Ca 0.22 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.78 1ucy n GLY 14 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36