#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k72 n GLY 2 N 0.00 1.11 3.35 2.72 0.00 -1.26 -4.87 105.19 106.24 2k72 n GLY 2 Ca 0.00 -0.93 -0.18 0.00 0.00 0.00 0.00 46.02 44.90 2k72 n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k72 s LEU 4 N -5.67 1.11 1.29 0.00 2.96 -1.26 -4.42 118.68 112.69 2k72 s LEU 4 Ca 0.43 -0.15 -0.20 0.00 -0.22 0.00 0.00 54.13 54.00 2k72 s LEU 4 Cb -0.08 -0.52 0.30 0.00 0.50 0.00 0.00 46.19 46.39 2k72 s LEU 4 CO 0.76 -0.10 0.69 -0.90 -1.32 0.00 0.00 176.35 175.48 2k72 n ASP 5 N 4.48 -3.50 0.00 3.68 5.68 -1.26 -4.70 116.55 120.94 2k72 n ASP 5 Ca -0.18 -0.62 0.00 0.00 -0.50 0.00 0.00 54.79 53.49 2k72 n ASP 5 Cb 0.51 -0.96 0.00 0.00 -1.14 0.00 0.00 41.12 39.53 2k72 n ASP 5 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2k72 n ARG 6 N -4.34 1.84 -4.23 0.11 1.74 0.26 -4.86 116.66 107.18 2k72 n ARG 6 Ca 0.09 -0.21 -0.18 0.00 -0.77 0.00 0.00 57.85 56.79 2k72 n ARG 6 Cb 0.52 -0.65 -0.07 0.00 -1.02 0.00 0.00 32.46 31.23 2k72 n ARG 6 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2k72 s ILE 7 N -0.32 0.00 -0.24 0.55 -4.36 -1.26 -5.06 121.20 110.51 2k72 s ILE 7 Ca 0.00 -1.91 0.22 0.00 -0.26 0.00 0.00 60.65 58.70 2k72 s ILE 7 Cb 0.00 -2.53 -0.30 0.00 1.25 0.00 0.00 42.46 40.88 2k72 s ILE 7 CO 0.00 0.00 0.60 2.22 0.24 0.00 0.00 174.94 178.00 2k72 n PHE 8 N -0.57 0.04 1.66 1.37 1.16 -1.26 -4.15 117.46 115.71 2k72 n PHE 8 Ca 0.05 0.01 0.10 0.00 -1.87 0.00 0.00 57.45 55.74 2k72 n PHE 8 Cb 0.63 -0.42 0.57 0.00 -1.61 0.00 0.00 39.48 38.65 2k72 n PHE 8 CO 0.00 0.00 0.00 1.55 -1.87 0.00 0.00 176.76 176.44 2k72 n VAL 9 N -2.12 0.00 0.64 1.97 3.14 -1.26 -3.06 118.33 117.64 2k72 n VAL 9 Ca -0.02 0.00 0.13 0.00 -2.96 0.00 0.00 64.34 61.49 2k72 n VAL 9 Cb 0.52 -0.45 0.43 0.00 -1.06 0.00 0.00 33.84 33.28 2k72 n VAL 9 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k72 h THR 11 N 0.00 1.27 -0.13 0.00 2.02 -1.85 -2.88 112.91 111.35 2k72 h THR 11 Ca 0.00 -1.94 -0.14 0.00 0.77 0.00 0.00 66.41 65.10 2k72 h THR 11 Cb 0.68 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 2k72 h THR 11 CO 0.00 0.62 -0.54 0.28 0.37 0.00 0.00 175.52 176.25 2k72 h SER 12 N 0.56 0.41 0.39 4.18 0.02 -1.80 -3.06 113.55 114.26 2k72 h SER 12 Ca -0.05 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.68 2k72 h SER 12 Cb 1.38 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 2k72 h SER 12 CO 0.16 0.87 -0.26 -0.50 -1.14 0.00 0.00 176.83 175.96 2k72 h TRP 13 N 0.29 -0.69 -0.81 3.45 6.55 -1.54 0.03 115.95 123.23 2k72 h TRP 13 Ca 0.01 -0.01 0.12 0.00 0.95 0.00 0.00 58.89 59.96 2k72 h TRP 13 Cb 1.05 0.25 -0.08 0.00 -0.86 0.00 0.00 29.16 29.51 2k72 h TRP 13 CO 0.03 -0.40 0.41 0.00 -1.05 0.00 0.00 178.44 177.43 2k72 h ALA 14 N -0.08 1.17 -0.01 1.49 0.00 -1.51 0.32 119.26 120.64 2k72 h ALA 14 Ca -0.04 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2k72 h ALA 14 Cb 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2k72 h ALA 14 CO 0.03 -0.05 0.00 -2.13 0.00 0.00 0.00 179.25 177.10 2k72 n ARG 15 N -4.85 1.09 -0.58 0.00 3.00 -1.02 -3.48 116.66 110.83 2k72 n ARG 15 Ca 0.15 -0.14 0.05 0.00 -0.00 0.00 0.00 57.85 57.91 2k72 n ARG 15 Cb 0.36 -1.46 0.20 0.00 0.00 0.00 0.00 32.46 31.57 2k72 n ARG 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2k72 n LYS 16 N -0.80 1.60 -3.71 -0.14 3.00 0.99 -4.95 118.16 114.15 2k72 n LYS 16 Ca 0.22 -3.22 -0.23 0.00 -0.00 0.00 0.00 58.31 55.07 2k72 n LYS 16 Cb 0.14 -1.64 0.04 0.00 0.00 0.00 0.00 35.03 33.57 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 -1.14 -0.38 0.09 3.14 0.00 -1.10 -4.88 105.19 100.92 2k72 n GLY 17 Ca 0.20 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.29 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 -4.44 0.00 0.02 1.61 7.35 -0.36 -3.93 117.46 117.71 2k72 n PHE 18 Ca -0.18 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.40 2k72 n PHE 18 Cb 0.63 -0.93 -0.07 0.00 0.35 0.00 0.00 39.48 39.46 2k72 n PHE 18 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k72 h ASP 20 N -0.45 0.62 0.01 0.00 3.32 -1.96 2.23 116.42 120.18 2k72 h ASP 20 Ca 0.01 -0.28 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 2k72 h ASP 20 Cb 0.50 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2k72 h ASP 20 CO -0.28 0.95 -0.00 0.58 -1.72 0.00 0.00 179.24 178.77 2k72 h VAL 21 N 0.48 1.34 -0.16 -1.35 2.07 -1.57 -3.26 116.25 113.80 2k72 h VAL 21 Ca 0.04 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2k72 h VAL 21 Cb 0.91 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.74 2k72 h VAL 21 CO 0.08 0.27 0.00 -1.14 0.02 0.00 0.00 177.57 176.80 2k72 n ARG 22 N -4.88 2.38 -0.03 1.57 3.00 0.47 -4.73 116.66 114.44 2k72 n ARG 22 Ca -0.08 -2.05 -0.01 0.00 -0.00 0.00 0.00 57.85 55.70 2k72 n ARG 22 Cb 0.24 -1.48 -0.01 0.00 0.00 0.00 0.00 32.46 31.21 2k72 n ARG 22 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2k72 n GLN 23 N 1.40 -0.04 -0.30 -0.14 0.00 0.75 0.26 117.38 119.31 2k72 n GLN 23 Ca 0.16 0.13 0.14 0.00 -0.00 0.00 0.00 57.00 57.43 2k72 n GLN 23 Cb 0.60 -0.19 0.32 0.00 0.00 0.00 0.00 30.24 30.97 2k72 n GLN 23 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2k72 h ARG 24 N 0.00 0.27 0.02 3.69 9.65 -1.85 0.19 114.38 126.35 2k72 h ARG 24 Ca 0.01 -0.02 -0.33 0.00 -1.10 0.00 0.00 59.98 58.54 2k72 h ARG 24 Cb 0.03 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.50 2k72 h ARG 24 CO -0.08 0.18 -2.00 -0.11 2.80 0.00 0.00 179.97 180.76 2k72 n LEU 25 N -5.15 1.21 -0.24 3.80 0.00 0.72 -4.06 117.00 113.28 2k72 n LEU 25 Ca 0.23 0.23 0.01 0.00 0.00 0.00 0.00 56.01 56.47 2k72 n LEU 25 Cb 0.71 -0.11 0.03 0.00 0.00 0.00 0.00 43.42 44.06 2k72 n LEU 25 CO 0.09 0.56 0.47 0.80 0.00 0.00 0.00 177.39 179.30 2k72 n MET 26 N -3.08 1.19 -0.02 1.96 1.56 0.15 -3.54 117.12 115.34 2k72 n MET 26 Ca -0.26 -0.23 -0.03 0.00 -0.27 0.00 0.00 57.70 56.90 2k72 n MET 26 Cb 1.07 -1.18 -0.12 0.00 2.15 0.00 0.00 33.22 35.14 2k72 n MET 26 CO 0.00 0.00 0.00 0.36 -0.73 0.00 0.00 175.97 175.60 2k72 n LYS 27 N -0.22 0.64 0.00 2.12 -0.00 0.57 -3.11 118.16 118.16 2k72 n LYS 27 Ca 0.02 0.15 0.11 0.00 -0.00 0.00 0.00 58.31 58.59 2k72 n LYS 27 Cb 0.12 -1.71 -0.04 0.00 -0.00 0.00 0.00 35.03 33.40 2k72 n LYS 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2k72 n ARG 28 N -2.83 0.90 0.00 -1.58 5.12 -1.23 -4.10 116.66 112.93 2k72 n ARG 28 Ca -0.16 -0.72 0.00 0.00 -1.93 0.00 0.00 57.85 55.04 2k72 n ARG 28 Cb 0.94 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.76 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 -0.43 0.53 -2.71 0.55 -0.00 -1.26 -4.62 117.00 109.07 2k72 n LEU 29 Ca 0.08 -0.64 -0.07 0.00 -0.00 0.00 0.00 56.01 55.37 2k72 n LEU 29 Cb 0.43 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 43.96 2k72 n LEU 29 CO 0.32 0.13 0.48 0.00 -0.00 0.00 0.00 177.39 178.33 2k72 n PRO 31 N -0.43 0.78 0.02 0.00 -0.04 -1.25 -2.95 135.00 131.13 2k72 n PRO 31 Ca -0.01 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.50 2k72 n PRO 31 Cb 0.82 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.68 2k72 n PRO 31 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2k72 n ARG 32 N -1.01 0.64 0.00 0.54 0.63 -1.26 -2.83 116.66 113.37 2k72 n ARG 32 Ca 0.19 0.02 0.11 0.00 -0.92 0.00 0.00 57.85 57.25 2k72 n ARG 32 Cb 0.09 -1.68 0.00 0.00 0.45 0.00 0.00 32.46 31.33 2k72 n ARG 32 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2k72 n SER 33 N -2.60 2.11 0.00 6.15 2.88 -1.15 -4.32 113.62 116.68 2k72 n SER 33 Ca -0.08 -1.55 0.00 0.00 -1.33 0.00 0.00 58.87 55.90 2k72 n SER 33 Cb 0.71 0.43 0.00 0.00 -0.75 0.00 0.00 64.21 64.61 2k72 n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k72 n ASP 35 N -0.24 -5.63 -0.32 0.00 2.03 -1.20 -4.85 116.55 106.34 2k72 n ASP 35 Ca 0.00 0.35 -0.04 0.00 0.52 0.00 0.00 54.79 55.62 2k72 n ASP 35 Cb 0.27 -4.86 0.08 0.00 -0.72 0.00 0.00 41.12 35.89 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 0.00 1.22 0.00 -0.67 0.04 -1.83 -3.50 116.94 112.21 2k72 h PHE 36 Ca -0.45 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2k72 h PHE 36 Cb 1.36 -0.38 0.00 0.00 2.20 0.00 0.00 35.95 39.12 2k72 h PHE 36 CO 0.57 0.86 0.00 0.00 -0.60 0.00 0.00 178.31 179.15