#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ut3 n PHE 2 N 0.00 0.00 -0.01 7.33 3.01 0.03 -4.46 117.46 123.37 1ut3 n PHE 2 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.43 1ut3 n PHE 2 Cb 0.00 0.00 0.22 0.00 -0.01 0.00 0.00 39.48 39.69 1ut3 n PHE 2 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1ut3 h GLY 3 N 0.00 0.58 1.24 1.37 0.00 -1.98 -2.42 103.07 101.86 1ut3 h GLY 3 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1ut3 h GLY 3 CO 0.00 0.39 0.00 1.04 0.00 0.00 0.00 176.54 177.97 1ut3 n LEU 4 N -4.18 0.00 0.00 3.11 4.77 -1.26 -4.80 117.00 114.64 1ut3 n LEU 4 Ca 0.01 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1ut3 n LEU 4 Cb 0.35 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1ut3 n LEU 4 CO 0.41 -0.04 0.00 0.00 -1.33 0.00 0.00 177.39 176.43 1ut3 n ARG 6 N 0.00 -2.04 -0.00 0.00 0.63 -1.25 -4.88 116.66 109.12 1ut3 n ARG 6 Ca 0.00 0.81 -0.11 0.00 -0.92 0.00 0.00 57.85 57.63 1ut3 n ARG 6 Cb 0.00 -5.46 -0.09 0.00 0.45 0.00 0.00 32.46 27.36 1ut3 n ARG 6 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1ut3 h LEU 7 N -0.05 -0.08 0.00 6.15 3.38 -1.90 -3.42 115.31 119.40 1ut3 h LEU 7 Ca -0.40 -0.54 -0.17 0.00 0.09 0.00 0.00 57.88 56.86 1ut3 h LEU 7 Cb 1.30 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 42.04 1ut3 h LEU 7 CO 0.48 0.58 -1.37 0.54 0.09 0.00 0.00 178.44 178.76 1ut3 n ARG 8 N -4.81 0.54 -1.76 1.13 1.74 -1.26 -4.93 116.66 107.30 1ut3 n ARG 8 Ca -0.08 0.36 -0.01 0.00 -0.77 0.00 0.00 57.85 57.36 1ut3 n ARG 8 Cb 0.30 -1.56 0.03 0.00 -1.02 0.00 0.00 32.46 30.21 1ut3 n ARG 8 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1ut3 n ARG 9 N -4.43 0.37 -2.75 5.56 0.63 -1.26 -5.13 116.66 109.66 1ut3 n ARG 9 Ca -0.27 -0.35 -0.42 0.00 -0.92 0.00 0.00 57.85 55.89 1ut3 n ARG 9 Cb 0.60 0.15 -0.03 0.00 0.45 0.00 0.00 32.46 33.63 1ut3 n ARG 9 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1ut3 s GLY 10 N -0.33 1.85 -0.11 5.14 0.00 -1.26 -4.61 107.32 108.00 1ut3 s GLY 10 Ca 0.02 0.11 -0.04 0.00 0.00 0.00 0.00 44.72 44.82 1ut3 s GLY 10 CO -0.04 2.00 0.06 -0.11 0.00 0.00 0.00 173.10 175.01 1ut3 s PHE 11 N 2.83 3.33 -0.04 1.90 -0.12 -0.60 -3.84 117.98 121.44 1ut3 s PHE 11 Ca 0.42 0.31 -0.30 0.00 -0.05 0.00 0.00 56.93 57.31 1ut3 s PHE 11 Cb -0.16 -1.87 -0.03 0.00 -0.63 0.00 0.00 43.02 40.33 1ut3 s PHE 11 CO 0.09 0.55 1.16 0.00 -0.05 0.00 0.00 175.22 176.96 1ut3 s ALA 13 N 1.91 1.76 -0.09 0.00 0.00 0.53 -4.94 121.76 120.93 1ut3 s ALA 13 Ca 0.55 -0.85 -0.30 0.00 0.00 0.00 0.00 51.96 51.36 1ut3 s ALA 13 Cb -0.24 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 1ut3 s ALA 13 CO 0.23 0.36 1.50 0.50 0.00 0.00 0.00 175.76 178.35 1ut3 s ARG 14 N -0.18 4.21 6.80 0.00 3.52 -1.26 -1.28 118.95 130.76 1ut3 s ARG 14 Ca -0.00 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 57.59 1ut3 s ARG 14 Cb -0.11 -3.87 0.00 0.00 -1.56 0.00 0.00 34.95 29.41 1ut3 s ARG 14 CO 0.02 -0.78 0.00 0.41 -0.81 0.00 0.00 175.30 174.14 1ut3 n GLY 15 N 3.91 1.64 3.79 8.12 0.00 -1.23 -4.79 105.19 116.63 1ut3 n GLY 15 Ca 0.16 -0.46 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1ut3 n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ut3 s ARG 16 N 0.00 4.19 0.58 1.61 0.52 -1.26 -3.86 118.95 120.73 1ut3 s ARG 16 Ca 0.00 1.39 -0.19 0.00 -0.52 0.00 0.00 55.73 56.41 1ut3 s ARG 16 Cb 0.00 -2.46 -0.04 0.00 0.52 0.00 0.00 34.95 32.97 1ut3 s ARG 16 CO 0.00 -0.09 1.17 0.00 0.02 0.00 0.00 175.30 176.40 1ut3 s ARG 18 N -3.35 1.38 0.13 0.00 3.00 -1.26 -4.91 118.95 113.95 1ut3 s ARG 18 Ca 0.75 0.98 -0.32 0.00 0.00 0.00 0.00 55.73 57.14 1ut3 s ARG 18 Cb -0.27 -1.81 -0.09 0.00 0.00 0.00 0.00 34.95 32.78 1ut3 s ARG 18 CO 0.31 -2.20 1.56 0.35 0.00 0.00 0.00 175.30 175.32 1ut3 h PHE 19 N -1.53 -1.57 -0.55 -0.53 3.57 -2.03 -1.95 116.94 112.35 1ut3 h PHE 19 Ca -0.48 0.07 -0.33 0.00 3.53 0.00 0.00 57.97 60.76 1ut3 h PHE 19 Cb 1.27 0.73 -0.12 0.00 2.79 0.00 0.00 35.95 40.62 1ut3 h PHE 19 CO 0.46 -0.49 0.15 -0.35 -2.23 0.00 0.00 178.31 175.85 1ut3 n PRO 20 N -5.40 2.03 -3.70 6.41 -0.05 -1.26 -4.80 135.00 128.23 1ut3 n PRO 20 Ca -0.03 -1.59 -0.11 0.00 -0.05 0.00 0.00 63.50 61.72 1ut3 n PRO 20 Cb 0.35 -1.88 -0.11 0.00 -0.05 0.00 0.00 33.50 31.82 1ut3 n PRO 20 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 175.50 174.33 1ut3 s SER 21 N 0.92 -0.50 -0.10 3.54 0.01 -0.74 -3.47 113.70 113.36 1ut3 s SER 21 Ca 0.49 0.88 -0.04 0.00 1.31 0.00 0.00 55.95 58.59 1ut3 s SER 21 Cb 0.30 0.76 -0.04 0.00 0.21 0.00 0.00 66.02 67.25 1ut3 s SER 21 CO -0.10 -0.19 0.05 0.27 0.41 0.00 0.00 173.24 173.68 1ut3 s ILE 22 N 1.34 4.70 -1.35 1.44 -4.36 0.51 -4.41 121.20 119.06 1ut3 s ILE 22 Ca -0.09 -0.10 -0.17 0.00 -0.26 0.00 0.00 60.65 60.04 1ut3 s ILE 22 Cb -0.08 -3.01 0.05 0.00 1.25 0.00 0.00 42.46 40.67 1ut3 s ILE 22 CO -0.12 0.60 1.96 -0.81 0.24 0.00 0.00 174.94 176.81 1ut3 n PRO 23 N 2.21 2.98 0.22 0.37 -0.04 -1.26 -0.04 135.00 139.43 1ut3 n PRO 23 Ca -0.19 -2.94 0.05 0.00 -0.04 0.00 0.00 63.50 60.38 1ut3 n PRO 23 Cb 0.54 -3.40 0.49 0.00 -0.04 0.00 0.00 33.50 31.09 1ut3 n PRO 23 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 1ut3 h ILE 24 N 4.89 1.14 -2.15 0.52 3.07 -1.92 -3.47 117.51 119.60 1ut3 h ILE 24 Ca 0.49 -0.65 0.01 0.00 1.55 0.00 0.00 64.86 66.27 1ut3 h ILE 24 Cb 0.77 1.33 -0.00 0.00 -0.27 0.00 0.00 36.82 38.65 1ut3 h ILE 24 CO 1.65 0.19 0.12 0.61 -1.05 0.00 0.00 178.15 179.66 1ut3 n GLY 25 N -1.00 1.48 3.45 0.16 0.00 -1.25 -5.06 105.19 102.99 1ut3 n GLY 25 Ca -0.02 -1.05 -0.33 0.00 0.00 0.00 0.00 46.02 44.61 1ut3 n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ut3 s ARG 26 N -2.02 3.30 0.11 1.61 0.52 -1.26 -0.24 118.95 120.97 1ut3 s ARG 26 Ca 0.06 -0.61 -0.03 0.00 -0.52 0.00 0.00 55.73 54.63 1ut3 s ARG 26 Cb -0.01 -2.69 -0.16 0.00 0.52 0.00 0.00 34.95 32.61 1ut3 s ARG 26 CO 0.03 0.33 1.25 0.00 0.02 0.00 0.00 175.30 176.93 1ut3 n SER 28 N -3.63 1.35 -0.06 0.00 2.88 0.85 -0.79 113.62 114.22 1ut3 n SER 28 Ca -0.07 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.42 1ut3 n SER 28 Cb 0.91 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.34 1ut3 n SER 28 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1ut3 h ARG 29 N 0.00 0.00 0.07 -1.46 9.65 -2.01 -3.41 114.38 117.22 1ut3 h ARG 29 Ca 0.00 0.00 -0.36 0.00 -1.10 0.00 0.00 59.98 58.52 1ut3 h ARG 29 Cb 0.00 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.54 1ut3 h ARG 29 CO 0.00 0.25 -2.11 1.19 2.80 0.00 0.00 179.97 182.09 1ut3 n PHE 30 N -4.68 0.85 -2.07 2.20 3.01 -1.26 -4.85 117.46 110.66 1ut3 n PHE 30 Ca -0.06 0.19 -0.43 0.00 1.01 0.00 0.00 57.45 58.16 1ut3 n PHE 30 Cb 0.21 -1.12 -0.03 0.00 -0.01 0.00 0.00 39.48 38.54 1ut3 n PHE 30 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1ut3 s VAL 31 N -2.55 3.66 0.46 -4.37 1.01 -1.26 -3.57 120.40 113.78 1ut3 s VAL 31 Ca -0.23 0.77 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 1ut3 s VAL 31 Cb 0.07 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1ut3 s VAL 31 CO 0.73 -0.18 0.74 -1.10 0.00 0.00 0.00 175.10 175.29 1ut3 s GLN 32 N 4.41 3.47 -0.99 2.72 -0.21 -0.40 -0.11 119.66 128.56 1ut3 s GLN 32 Ca 0.72 0.04 -0.02 0.00 0.02 0.00 0.00 55.36 56.13 1ut3 s GLN 32 Cb -0.28 -2.44 0.30 0.00 1.00 0.00 0.00 33.01 31.59 1ut3 s GLN 32 CO 0.29 -0.16 1.37 0.00 -2.12 0.00 0.00 175.29 174.66 1ut3 s ARG 35 N 0.82 3.05 0.63 0.00 6.06 0.95 -1.56 118.95 128.91 1ut3 s ARG 35 Ca 0.69 -0.44 -0.18 0.00 -2.50 0.00 0.00 55.73 53.29 1ut3 s ARG 35 Cb -0.44 -2.78 -0.02 0.00 0.06 0.00 0.00 34.95 31.77 1ut3 s ARG 35 CO 0.34 0.63 1.26 1.03 -2.50 0.00 0.00 175.30 176.06 1ut3 s ARG 36 N -0.69 2.67 -0.21 5.12 1.81 -1.26 -0.36 118.95 126.03 1ut3 s ARG 36 Ca 0.11 1.97 0.23 0.00 -1.72 0.00 0.00 55.73 56.32 1ut3 s ARG 36 Cb -0.12 -1.87 0.49 0.00 -0.45 0.00 0.00 34.95 33.00 1ut3 s ARG 36 CO 0.02 -1.48 1.13 1.55 -0.68 0.00 0.00 175.30 175.83 1ut3 n VAL 37 N -1.85 1.05 1.39 3.52 3.14 -1.23 -4.76 118.33 119.60 1ut3 n VAL 37 Ca 0.15 -2.56 0.11 0.00 -2.96 0.00 0.00 64.34 59.08 1ut3 n VAL 37 Cb 0.49 1.16 0.66 0.00 -1.06 0.00 0.00 33.84 35.09 1ut3 n VAL 37 CO 0.00 0.00 0.00 0.79 -6.46 0.00 0.00 176.83 171.16