#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kht n TYR 3 N 3.31 2.72 -3.97 0.00 4.01 -1.26 -4.49 117.16 117.49 2kht n TYR 3 Ca -0.16 -3.98 -0.10 0.00 -0.16 0.00 0.00 57.90 53.49 2kht n TYR 3 Cb 0.56 -0.49 -0.03 0.00 -0.31 0.00 0.00 39.34 39.07 2kht n TYR 3 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2kht s ARG 5 N -3.46 3.11 0.24 0.00 3.52 -1.09 -3.58 118.95 117.69 2kht s ARG 5 Ca 0.22 -0.92 0.08 0.00 -0.13 0.00 0.00 55.73 54.97 2kht s ARG 5 Cb -0.02 -3.93 -0.04 0.00 -1.56 0.00 0.00 34.95 29.40 2kht s ARG 5 CO 0.12 -0.67 0.11 0.96 -0.81 0.00 0.00 175.30 175.01 2kht s ILE 6 N 1.69 4.09 -0.61 4.11 -0.00 -1.26 -4.87 121.20 124.35 2kht s ILE 6 Ca 0.05 -1.51 0.00 0.00 -0.00 0.00 0.00 60.65 59.19 2kht s ILE 6 Cb -0.19 -3.17 0.00 0.00 -0.00 0.00 0.00 42.46 39.10 2kht s ILE 6 CO 0.10 -0.30 0.53 -2.65 -0.00 0.00 0.00 174.94 172.62 2kht n PRO 7 N -0.88 0.00 -3.88 0.37 -0.02 -1.26 -3.80 135.00 125.54 2kht n PRO 7 Ca -0.08 0.14 -0.30 0.00 -2.02 0.00 0.00 63.50 61.24 2kht n PRO 7 Cb 0.57 -1.67 -0.15 0.00 -0.02 0.00 0.00 33.50 32.23 2kht n PRO 7 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kht s ALA 8 N -2.06 1.89 0.00 3.55 0.00 -1.26 -4.73 121.76 119.15 2kht s ALA 8 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.41 2kht s ALA 8 Cb 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.58 2kht s ALA 8 CO 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 175.76 174.37 2kht h ILE 10 N 0.00 1.27 -2.64 0.00 1.08 -1.85 -3.41 117.51 111.96 2kht h ILE 10 Ca 0.00 -1.11 -0.56 0.00 -0.39 0.00 0.00 64.86 62.80 2kht h ILE 10 Cb 0.00 1.11 -0.04 0.00 -3.07 0.00 0.00 36.82 34.82 2kht h ILE 10 CO 0.00 0.38 -0.50 0.00 -0.69 0.00 0.00 178.15 177.34 2kht s ALA 11 N -4.91 3.85 0.00 1.87 0.00 -1.26 -4.40 121.76 116.91 2kht s ALA 11 Ca -0.12 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.77 2kht s ALA 11 Cb 0.11 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.57 2kht s ALA 11 CO 0.82 0.56 0.00 0.41 0.00 0.00 0.00 175.76 177.54 2kht n GLY 12 N -0.40 0.72 2.61 0.00 0.00 -1.26 -4.98 105.19 101.88 2kht n GLY 12 Ca -0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.90 2kht n GLY 12 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2kht n GLU 13 N -2.47 0.66 -4.17 1.61 -0.00 -1.26 -4.98 120.64 110.02 2kht n GLU 13 Ca 0.00 -1.34 -0.16 0.00 -0.00 0.00 0.00 57.16 55.66 2kht n GLU 13 Cb 0.00 1.71 -0.11 0.00 -0.00 0.00 0.00 31.44 33.04 2kht n GLU 13 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2kht s ARG 14 N -2.05 0.83 -0.67 3.44 0.52 -1.26 -4.95 118.95 114.81 2kht s ARG 14 Ca 0.13 -1.05 -0.24 0.00 -0.52 0.00 0.00 55.73 54.05 2kht s ARG 14 Cb -0.03 -0.68 0.06 0.00 0.52 0.00 0.00 34.95 34.82 2kht s ARG 14 CO 0.07 0.13 1.03 0.50 0.02 0.00 0.00 175.30 177.05 2kht s ARG 15 N -2.25 3.14 0.00 3.54 3.52 -1.26 -2.32 118.95 123.32 2kht s ARG 15 Ca 0.02 -0.66 0.00 0.00 -0.13 0.00 0.00 55.73 54.95 2kht s ARG 15 Cb -0.07 -4.21 0.00 0.00 -1.56 0.00 0.00 34.95 29.12 2kht s ARG 15 CO 0.01 -1.87 0.00 0.66 -0.81 0.00 0.00 175.30 173.30 2kht n TYR 16 N 8.05 0.00 -1.60 5.12 4.01 -1.26 -4.93 117.16 126.55 2kht n TYR 16 Ca -0.02 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.29 2kht n TYR 16 Cb 0.46 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.46 2kht n TYR 16 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kht n GLY 17 N 4.26 1.17 3.58 2.72 0.00 -1.26 -4.94 105.19 110.72 2kht n GLY 17 Ca 0.00 0.80 -0.36 0.00 0.00 0.00 0.00 46.02 46.46 2kht n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2kht s THR 18 N 7.40 4.95 -0.18 2.61 -1.32 -1.25 -3.98 115.64 123.88 2kht s THR 18 Ca 0.99 0.04 -0.08 0.00 -1.21 0.00 0.00 61.69 61.42 2kht s THR 18 Cb -0.40 -3.30 -0.04 0.00 -1.51 0.00 0.00 72.50 67.24 2kht s THR 18 CO 0.38 0.35 0.10 0.00 -2.21 0.00 0.00 174.62 173.24 2kht s ILE 20 N 0.13 4.59 -0.19 0.00 -1.09 -1.26 -3.53 121.20 119.85 2kht s ILE 20 Ca 0.07 1.09 -0.04 0.00 -2.23 0.00 0.00 60.65 59.54 2kht s ILE 20 Cb -0.12 -4.33 0.10 0.00 -1.58 0.00 0.00 42.46 36.53 2kht s ILE 20 CO -0.00 -0.56 0.33 -0.47 -1.23 0.00 0.00 174.94 173.00 2kht s TYR 21 N 3.46 -0.61 -0.99 3.97 5.04 -1.09 -4.86 117.35 122.27 2kht s TYR 21 Ca 0.37 0.91 0.00 0.00 -2.44 0.00 0.00 57.07 55.91 2kht s TYR 21 Cb -0.12 -0.01 0.00 0.00 0.35 0.00 0.00 41.96 42.19 2kht s TYR 21 CO 0.19 -0.55 0.00 1.04 -1.34 0.00 0.00 175.55 174.90 2kht n GLN 22 N 5.36 -1.38 -1.38 4.97 6.02 -1.26 0.11 117.38 129.82 2kht n GLN 22 Ca -0.06 0.55 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 2kht n GLN 22 Cb 0.50 -4.78 0.00 0.00 1.02 0.00 0.00 30.24 26.97 2kht n GLN 22 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kht n GLY 23 N -0.26 0.83 3.03 1.08 0.00 -1.26 -5.07 105.19 103.55 2kht n GLY 23 Ca -0.10 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 2kht n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kht s ARG 24 N -3.05 2.25 0.66 1.61 0.52 0.31 -5.13 118.95 116.13 2kht s ARG 24 Ca 0.00 -0.55 -0.11 0.00 -0.52 0.00 0.00 55.73 54.55 2kht s ARG 24 Cb 0.00 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.45 2kht s ARG 24 CO 0.00 -0.16 1.06 -0.51 0.02 0.00 0.00 175.30 175.71 2kht s LEU 25 N 1.28 3.06 -0.32 2.53 1.43 -1.23 -2.68 118.68 122.75 2kht s LEU 25 Ca 0.00 1.24 -0.15 0.00 -1.03 0.00 0.00 54.13 54.19 2kht s LEU 25 Cb -0.14 -4.14 -0.02 0.00 0.03 0.00 0.00 46.19 41.92 2kht s LEU 25 CO -0.07 -1.12 0.35 0.86 0.23 0.00 0.00 176.35 176.60 2kht s TRP 26 N -3.27 3.22 0.16 0.29 -0.00 -1.23 -2.66 118.94 115.44 2kht s TRP 26 Ca 0.57 0.07 -0.03 0.00 -0.00 0.00 0.00 56.10 56.71 2kht s TRP 26 Cb -0.11 -2.64 -0.05 0.00 -0.00 0.00 0.00 33.47 30.67 2kht s TRP 26 CO 0.52 -0.38 0.36 0.00 -0.00 0.00 0.00 176.95 177.46 2kht s ALA 27 N 2.02 3.83 -0.66 5.86 0.00 -1.24 -3.80 121.76 127.78 2kht s ALA 27 Ca 0.12 -0.70 -0.27 0.00 0.00 0.00 0.00 51.96 51.12 2kht s ALA 27 Cb -0.16 -2.04 0.01 0.00 0.00 0.00 0.00 23.12 20.92 2kht s ALA 27 CO 0.11 0.60 1.50 0.12 0.00 0.00 0.00 175.76 178.09 2kht s PHE 28 N -1.72 2.08 0.02 0.00 2.19 -0.98 -4.07 117.98 115.49 2kht s PHE 28 Ca 0.39 0.33 -0.08 0.00 0.33 0.00 0.00 56.93 57.89 2kht s PHE 28 Cb -0.12 -4.41 -0.05 0.00 -1.31 0.00 0.00 43.02 37.13 2kht s PHE 28 CO 0.27 -2.14 0.32 0.00 1.83 0.00 0.00 175.22 175.50