#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k72 s GLY 2 N 0.00 1.57 -0.35 2.72 0.00 -1.26 -4.95 107.32 105.04 2k72 s GLY 2 Ca 0.00 -2.20 0.01 0.00 0.00 0.00 0.00 44.72 42.53 2k72 s GLY 2 CO 0.00 2.07 0.11 0.00 0.00 0.00 0.00 173.10 175.28 2k72 s LEU 4 N 1.08 -0.27 0.00 0.00 2.34 -1.26 -4.88 118.68 115.68 2k72 s LEU 4 Ca 0.12 -0.34 0.08 0.00 0.06 0.00 0.00 54.13 54.05 2k72 s LEU 4 Cb -0.19 2.31 0.08 0.00 -0.56 0.00 0.00 46.19 47.83 2k72 s LEU 4 CO -0.14 -0.96 0.65 -0.90 -1.06 0.00 0.00 176.35 173.94 2k72 n ASP 5 N -0.42 1.79 -0.13 1.48 5.68 -1.26 -4.08 116.55 119.61 2k72 n ASP 5 Ca -0.07 -2.29 0.00 0.00 -0.50 0.00 0.00 54.79 51.93 2k72 n ASP 5 Cb 0.61 -0.34 0.01 0.00 -1.14 0.00 0.00 41.12 40.25 2k72 n ASP 5 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 2k72 n ARG 6 N -2.03 0.33 -3.65 0.11 1.85 0.25 -4.87 116.66 108.65 2k72 n ARG 6 Ca 0.13 -0.81 -0.10 0.00 -1.00 0.00 0.00 57.85 56.08 2k72 n ARG 6 Cb 0.50 -0.59 -0.02 0.00 -1.05 0.00 0.00 32.46 31.30 2k72 n ARG 6 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 2k72 s ILE 7 N -0.21 0.00 -0.56 8.89 -4.36 -1.26 -5.04 121.20 118.67 2k72 s ILE 7 Ca 0.01 -0.53 -0.02 0.00 -0.26 0.00 0.00 60.65 59.85 2k72 s ILE 7 Cb 0.01 -1.50 0.30 0.00 1.25 0.00 0.00 42.46 42.52 2k72 s ILE 7 CO 0.00 -0.01 2.14 0.33 0.24 0.00 0.00 174.94 177.64 2k72 n PHE 8 N -0.41 2.42 -0.67 1.37 7.35 -1.26 -4.13 117.46 122.14 2k72 n PHE 8 Ca -0.11 -2.43 0.01 0.00 -0.76 0.00 0.00 57.45 54.16 2k72 n PHE 8 Cb 0.62 -1.25 0.02 0.00 0.35 0.00 0.00 39.48 39.22 2k72 n PHE 8 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2k72 n VAL 9 N -0.20 0.65 0.31 -2.13 0.31 -1.26 -4.83 118.33 111.18 2k72 n VAL 9 Ca 0.49 -0.69 -0.15 0.00 -0.01 0.00 0.00 64.34 63.98 2k72 n VAL 9 Cb 0.55 0.59 -0.08 0.00 -0.91 0.00 0.00 33.84 34.00 2k72 n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k72 h THR 11 N -1.04 0.21 -1.01 0.00 2.02 -1.91 0.32 112.91 111.50 2k72 h THR 11 Ca -0.08 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.32 2k72 h THR 11 Cb 0.67 0.21 -0.11 0.00 -1.74 0.00 0.00 68.15 67.17 2k72 h THR 11 CO 0.13 0.00 0.61 -1.28 0.37 0.00 0.00 175.52 175.35 2k72 h SER 12 N -0.20 0.69 -0.29 4.18 0.87 -1.89 0.51 113.55 117.42 2k72 h SER 12 Ca 0.21 0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.81 2k72 h SER 12 Cb 0.54 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2k72 h SER 12 CO -0.61 0.17 -0.09 -0.50 -0.53 0.00 0.00 176.83 175.28 2k72 h TRP 13 N 0.63 0.65 -0.85 2.24 6.55 -0.05 -1.45 115.95 123.68 2k72 h TRP 13 Ca 0.61 -0.15 0.19 0.00 0.95 0.00 0.00 58.89 60.49 2k72 h TRP 13 Cb 1.13 -0.16 -0.11 0.00 -0.86 0.00 0.00 29.16 29.16 2k72 h TRP 13 CO -0.00 0.78 0.35 0.00 -1.05 0.00 0.00 178.44 178.52 2k72 h ALA 14 N 0.78 1.29 0.00 1.49 0.00 0.55 0.50 119.26 123.86 2k72 h ALA 14 Ca 0.07 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2k72 h ALA 14 Cb 0.58 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2k72 h ALA 14 CO 0.03 -0.29 -0.24 0.54 0.00 0.00 0.00 179.25 179.30 2k72 n ARG 15 N -5.03 0.21 -0.15 0.00 5.12 -1.01 -3.32 116.66 112.48 2k72 n ARG 15 Ca 0.19 0.13 0.07 0.00 -1.93 0.00 0.00 57.85 56.31 2k72 n ARG 15 Cb 0.56 -1.70 0.23 0.00 -1.16 0.00 0.00 32.46 30.39 2k72 n ARG 15 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2k72 n LYS 16 N -2.04 1.81 -2.69 5.56 3.00 0.17 -4.89 118.16 119.07 2k72 n LYS 16 Ca 0.05 -1.25 -0.07 0.00 -0.00 0.00 0.00 58.31 57.04 2k72 n LYS 16 Cb 0.41 -1.32 0.03 0.00 0.00 0.00 0.00 35.03 34.15 2k72 n LYS 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2k72 n GLY 17 N 1.10 0.29 0.04 3.14 0.00 -0.86 -4.96 105.19 103.94 2k72 n GLY 17 Ca 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 2k72 n GLY 17 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2k72 n PHE 18 N -2.72 0.00 0.22 1.61 7.35 -0.64 -3.61 117.46 119.67 2k72 n PHE 18 Ca -0.05 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.76 2k72 n PHE 18 Cb 0.54 -0.48 0.17 0.00 0.35 0.00 0.00 39.48 40.06 2k72 n PHE 18 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k72 n ASP 20 N -3.10 3.41 -0.08 0.00 9.92 -1.26 -3.97 116.55 121.48 2k72 n ASP 20 Ca 0.04 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.07 2k72 n ASP 20 Cb 0.53 0.69 -0.12 0.00 -0.64 0.00 0.00 41.12 41.58 2k72 n ASP 20 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2k72 n VAL 21 N -2.21 1.60 1.06 2.53 0.31 -1.24 -4.31 118.33 116.08 2k72 n VAL 21 Ca -0.10 -0.36 0.12 0.00 -0.01 0.00 0.00 64.34 63.99 2k72 n VAL 21 Cb 0.68 -1.83 0.29 0.00 -0.91 0.00 0.00 33.84 32.07 2k72 n VAL 21 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2k72 n ARG 22 N -3.94 2.08 0.00 5.55 5.12 -0.96 -4.67 116.66 119.83 2k72 n ARG 22 Ca -0.38 -1.58 0.00 0.00 -1.93 0.00 0.00 57.85 53.96 2k72 n ARG 22 Cb 0.88 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.71 2k72 n ARG 22 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2k72 n GLN 23 N 0.87 0.00 -0.35 5.56 10.64 -0.39 0.22 117.38 133.93 2k72 n GLN 23 Ca 0.17 0.00 0.37 0.00 -1.83 0.00 0.00 57.00 55.70 2k72 n GLN 23 Cb 0.49 0.00 0.75 0.00 -0.86 0.00 0.00 30.24 30.62 2k72 n GLN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k72 h ARG 24 N 0.00 0.00 0.00 2.61 3.08 -1.87 -1.35 114.38 116.85 2k72 h ARG 24 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.68 2k72 h ARG 24 Cb 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.98 2k72 h ARG 24 CO 0.00 0.00 -2.41 -0.11 -1.07 0.00 0.00 179.97 176.38 2k72 n LEU 25 N -4.12 0.71 -1.55 3.04 7.94 0.61 -4.44 117.00 119.19 2k72 n LEU 25 Ca 0.27 -0.03 -0.00 0.00 -1.11 0.00 0.00 56.01 55.14 2k72 n LEU 25 Cb 1.32 0.16 -0.00 0.00 0.53 0.00 0.00 43.42 45.43 2k72 n LEU 25 CO 0.40 0.60 0.92 0.23 -1.11 0.00 0.00 177.39 178.44 2k72 n MET 26 N -2.87 0.93 -0.05 1.96 2.81 -0.51 -3.86 117.12 115.52 2k72 n MET 26 Ca -0.36 -0.01 -0.08 0.00 -1.81 0.00 0.00 57.70 55.44 2k72 n MET 26 Cb 1.12 -1.06 -0.04 0.00 -0.71 0.00 0.00 33.22 32.53 2k72 n MET 26 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 2k72 n LYS 27 N 1.56 0.24 -0.01 0.03 4.81 -1.23 -4.04 118.16 119.52 2k72 n LYS 27 Ca 0.01 0.07 0.10 0.00 -0.87 0.00 0.00 58.31 57.61 2k72 n LYS 27 Cb 0.46 -1.13 -0.15 0.00 0.02 0.00 0.00 35.03 34.23 2k72 n LYS 27 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2k72 n ARG 28 N -2.92 0.58 -0.02 1.64 5.12 -1.25 -4.17 116.66 115.63 2k72 n ARG 28 Ca -0.18 -0.14 0.04 0.00 -1.93 0.00 0.00 57.85 55.64 2k72 n ARG 28 Cb 0.68 -1.47 -0.11 0.00 -1.16 0.00 0.00 32.46 30.40 2k72 n ARG 28 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 2k72 n LEU 29 N -2.02 0.00 -2.74 0.55 -0.00 -1.26 -4.70 117.00 106.83 2k72 n LEU 29 Ca -0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.90 2k72 n LEU 29 Cb 0.47 0.08 0.07 0.00 -0.00 0.00 0.00 43.42 44.04 2k72 n LEU 29 CO 0.42 0.08 0.19 0.00 -0.00 0.00 0.00 177.39 178.08 2k72 n PRO 31 N -0.19 0.45 -0.01 0.00 -0.04 -1.26 -3.81 135.00 130.14 2k72 n PRO 31 Ca 0.05 -0.01 -0.16 0.00 -0.04 0.00 0.00 63.50 63.34 2k72 n PRO 31 Cb 0.80 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.64 2k72 n PRO 31 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2k72 h ARG 32 N 0.03 0.22 0.00 0.54 9.65 -1.90 1.00 114.38 123.92 2k72 h ARG 32 Ca 0.00 -0.26 -0.00 0.00 -1.10 0.00 0.00 59.98 58.61 2k72 h ARG 32 Cb 0.29 0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 28.95 2k72 h ARG 32 CO 0.00 1.02 -0.02 0.77 2.80 0.00 0.00 179.97 184.54 2k72 h SER 33 N -0.46 0.00 0.00 -3.80 0.02 -1.93 -3.10 113.55 104.28 2k72 h SER 33 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2k72 h SER 33 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2k72 h SER 33 CO 0.07 0.02 0.00 0.00 -1.14 0.00 0.00 176.83 175.78 2k72 n ASP 35 N -0.15 -6.02 -0.24 0.00 2.03 0.34 -4.84 116.55 107.68 2k72 n ASP 35 Ca 0.00 -0.49 0.30 0.00 0.52 0.00 0.00 54.79 55.12 2k72 n ASP 35 Cb 0.06 -4.64 0.71 0.00 -0.72 0.00 0.00 41.12 36.53 2k72 n ASP 35 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 2k72 h PHE 36 N -2.46 0.07 -0.01 -0.67 -1.00 -1.61 -3.49 116.94 107.77 2k72 h PHE 36 Ca -0.52 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.26 2k72 h PHE 36 Cb 1.34 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.88 2k72 h PHE 36 CO 0.46 0.01 0.00 0.00 -1.61 0.00 0.00 178.31 177.17