#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 4.33 3.73 -7.48 0.00 -1.26 -5.10 105.19 99.41 2k72 n GLY 2 Ca 0.00 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 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 0.29 -0.32 0.25 0.00 0.05 -1.26 -5.00 118.68 112.68 2k72 s LEU 4 Ca 0.47 0.30 -0.30 0.00 0.05 0.00 0.00 54.13 54.66 2k72 s LEU 4 Cb -0.22 1.77 -0.09 0.00 -2.05 0.00 0.00 46.19 45.59 2k72 s LEU 4 CO 0.28 -0.33 1.20 1.51 -0.55 0.00 0.00 176.35 178.46 2k72 s ASP 5 N -1.28 7.06 0.00 1.48 -4.77 -1.26 -4.43 116.67 113.46 2k72 s ASP 5 Ca 0.01 2.36 0.23 0.00 -3.30 0.00 0.00 52.55 51.84 2k72 s ASP 5 Cb -0.01 -2.62 0.05 0.00 -1.09 0.00 0.00 42.92 39.25 2k72 s ASP 5 CO -0.01 -0.34 1.10 0.54 0.70 0.00 0.00 175.17 177.16 2k72 n ARG 6 N 1.73 0.33 0.00 2.11 1.74 0.46 -4.88 116.66 118.15 2k72 n ARG 6 Ca 0.02 -0.26 0.00 0.00 -0.77 0.00 0.00 57.85 56.84 2k72 n ARG 6 Cb 0.44 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 2k72 n ARG 6 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2k72 n ILE 7 N -1.11 0.00 -0.00 0.55 -5.35 -1.18 -5.08 119.36 107.18 2k72 n ILE 7 Ca 0.06 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 2k72 n ILE 7 Cb 0.36 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 38.25 2k72 n ILE 7 CO 0.00 0.00 0.00 0.33 -1.76 0.00 0.00 176.55 175.12 2k72 n PHE 8 N 0.00 0.00 -0.85 4.28 7.35 -1.26 -4.77 117.46 122.20 2k72 n PHE 8 Ca 0.00 0.00 -0.20 0.00 -0.76 0.00 0.00 57.45 56.49 2k72 n PHE 8 Cb 0.00 -0.06 -0.06 0.00 0.35 0.00 0.00 39.48 39.71 2k72 n PHE 8 CO 0.00 0.00 0.00 1.55 -0.76 0.00 0.00 176.76 177.55 2k72 n VAL 9 N -1.81 2.74 -0.05 -2.13 3.14 -1.26 -4.29 118.33 114.67 2k72 n VAL 9 Ca -0.01 -1.55 -0.04 0.00 -2.96 0.00 0.00 64.34 59.77 2k72 n VAL 9 Cb 0.30 -2.13 -0.01 0.00 -1.06 0.00 0.00 33.84 30.94 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 -0.55 0.83 -0.81 0.00 2.02 -1.91 0.14 112.91 112.63 2k72 h THR 11 Ca 0.00 -0.29 0.02 0.00 0.77 0.00 0.00 66.41 66.90 2k72 h THR 11 Cb 0.48 -0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 2k72 h THR 11 CO 0.00 0.16 0.53 -1.28 0.37 0.00 0.00 175.52 175.30 2k72 h SER 12 N 0.85 0.90 -0.04 4.18 0.87 -1.85 -2.65 113.55 115.82 2k72 h SER 12 Ca 0.52 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 61.04 2k72 h SER 12 Cb 0.68 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.42 2k72 h SER 12 CO -0.29 0.64 -0.04 -0.50 -0.53 0.00 0.00 176.83 176.11 2k72 h TRP 13 N 1.06 0.10 -1.22 2.24 6.55 -0.87 -3.07 115.95 120.74 2k72 h TRP 13 Ca 0.31 -0.03 0.36 0.00 0.95 0.00 0.00 58.89 60.47 2k72 h TRP 13 Cb -0.07 -0.02 -0.10 0.00 -0.86 0.00 0.00 29.16 28.11 2k72 h TRP 13 CO -0.00 0.55 0.81 0.00 -1.05 0.00 0.00 178.44 178.75 2k72 h ALA 14 N 0.54 2.66 0.00 1.49 0.00 -0.93 1.45 119.26 124.47 2k72 h ALA 14 Ca 0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2k72 h ALA 14 Cb 0.53 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2k72 h ALA 14 CO 0.01 -1.15 0.00 -0.09 0.00 0.00 0.00 179.25 178.02 2k72 h ARG 15 N 0.19 0.00 -0.02 0.00 2.43 -1.41 -1.89 114.38 113.68 2k72 h ARG 15 Ca 0.70 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.87 2k72 h ARG 15 Cb 2.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.72 2k72 h ARG 15 CO -0.28 0.00 -0.39 1.63 -1.51 0.00 0.00 179.97 179.42 2k72 n LYS 16 N -2.66 1.37 -0.15 0.20 5.02 0.49 -4.93 118.16 117.51 2k72 n LYS 16 Ca 0.00 -1.13 0.00 0.00 -2.02 0.00 0.00 58.31 55.17 2k72 n LYS 16 Cb 0.19 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 2k72 n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k72 n GLY 17 N 1.40 0.93 0.39 0.72 0.00 -0.71 -4.95 105.19 102.96 2k72 n GLY 17 Ca 0.10 -0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.28 2k72 n GLY 17 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2k72 h PHE 18 N 0.00 0.59 0.00 1.61 3.04 -1.70 0.73 116.94 121.20 2k72 h PHE 18 Ca 0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 2k72 h PHE 18 Cb 0.00 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.33 2k72 h PHE 18 CO 0.00 0.20 0.00 0.00 -2.02 0.00 0.00 178.31 176.49 2k72 n ASP 20 N -0.92 1.04 0.08 0.00 -0.08 0.23 -4.20 116.55 112.71 2k72 n ASP 20 Ca 0.18 0.14 -0.21 0.00 -1.51 0.00 0.00 54.79 53.39 2k72 n ASP 20 Cb 0.08 -0.34 -0.15 0.00 2.34 0.00 0.00 41.12 43.06 2k72 n ASP 20 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 2k72 h VAL 21 N -0.11 1.06 -0.13 5.18 3.04 -1.13 -3.34 116.25 120.81 2k72 h VAL 21 Ca -0.01 -2.64 0.00 0.00 -1.01 0.00 0.00 66.70 63.04 2k72 h VAL 21 Cb 0.28 2.80 0.00 0.00 -2.01 0.00 0.00 31.29 32.36 2k72 h VAL 21 CO -0.01 0.84 0.00 -1.14 -1.01 0.00 0.00 177.57 176.25 2k72 n ARG 22 N -3.56 2.37 -0.52 4.17 3.00 -0.80 -4.54 116.66 116.77 2k72 n ARG 22 Ca -0.21 -2.03 0.43 0.00 -0.00 0.00 0.00 57.85 56.04 2k72 n ARG 22 Cb 1.07 -1.47 0.66 0.00 0.00 0.00 0.00 32.46 32.72 2k72 n ARG 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k72 n GLN 23 N 1.39 0.00 0.25 -0.14 0.00 0.70 0.20 117.38 119.80 2k72 n GLN 23 Ca 0.15 1.02 0.17 0.00 0.00 0.00 0.00 57.00 58.35 2k72 n GLN 23 Cb 0.60 -2.42 0.80 0.00 0.00 0.00 0.00 30.24 29.23 2k72 n GLN 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2k72 h ARG 24 N 0.00 0.00 0.00 2.61 3.08 -1.82 -3.06 114.38 115.19 2k72 h ARG 24 Ca 0.76 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.81 2k72 h ARG 24 Cb 3.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 33.42 2k72 h ARG 24 CO -0.01 0.00 -0.13 -0.11 -1.07 0.00 0.00 179.97 178.65 2k72 n LEU 25 N -2.82 0.25 -0.61 3.04 7.94 0.54 -4.47 117.00 120.88 2k72 n LEU 25 Ca -0.01 0.04 0.47 0.00 -1.11 0.00 0.00 56.01 55.40 2k72 n LEU 25 Cb 0.18 -0.52 0.72 0.00 0.53 0.00 0.00 43.42 44.33 2k72 n LEU 25 CO 0.21 -0.47 1.34 0.23 -1.11 0.00 0.00 177.39 177.59 2k72 n MET 26 N -2.75 0.00 -0.34 1.96 2.81 -1.21 -1.57 117.12 116.03 2k72 n MET 26 Ca -0.02 0.99 0.16 0.00 -1.81 0.00 0.00 57.70 57.02 2k72 n MET 26 Cb 0.07 -2.30 0.31 0.00 -0.71 0.00 0.00 33.22 30.59 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 -3.68 -0.08 -0.00 0.03 3.00 -1.15 0.53 118.16 116.81 2k72 n LYS 27 Ca 0.39 1.45 0.10 0.00 -0.00 0.00 0.00 58.31 60.25 2k72 n LYS 27 Cb 1.81 -2.33 -0.14 0.00 0.00 0.00 0.00 35.03 34.36 2k72 n LYS 27 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2k72 n ARG 28 N -5.44 0.50 -0.00 1.64 1.85 -0.61 -4.14 116.66 110.46 2k72 n ARG 28 Ca 0.24 -0.10 0.06 0.00 -1.00 0.00 0.00 57.85 57.05 2k72 n ARG 28 Cb 0.80 -1.47 -0.09 0.00 -1.05 0.00 0.00 32.46 30.65 2k72 n ARG 28 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 2k72 n LEU 29 N -1.86 0.04 -2.74 2.89 -0.00 -0.47 -4.32 117.00 110.54 2k72 n LEU 29 Ca -0.00 -0.04 -0.09 0.00 -0.00 0.00 0.00 56.01 55.88 2k72 n LEU 29 Cb 0.43 0.00 0.09 0.00 -0.00 0.00 0.00 43.42 43.94 2k72 n LEU 29 CO 0.42 0.01 0.35 0.00 -0.00 0.00 0.00 177.39 178.18 2k72 h PRO 31 N 2.78 0.00 -1.02 0.00 0.13 -1.62 -3.28 132.00 129.00 2k72 h PRO 31 Ca -0.13 0.00 0.25 0.00 -0.87 0.00 0.00 66.00 65.25 2k72 h PRO 31 Cb 1.14 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.18 2k72 h PRO 31 CO 0.10 0.34 0.65 0.00 -0.23 0.00 0.00 178.00 178.87 2k72 h ARG 32 N 0.00 0.44 0.00 0.86 3.08 -1.90 0.48 114.38 117.34 2k72 h ARG 32 Ca -0.00 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 2k72 h ARG 32 Cb 1.12 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.06 2k72 h ARG 32 CO 0.04 0.29 -0.53 0.77 -1.07 0.00 0.00 179.97 179.47 2k72 h SER 33 N 0.45 0.00 0.18 7.04 0.02 -1.91 -3.32 113.55 116.00 2k72 h SER 33 Ca 0.58 -0.65 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2k72 h SER 33 Cb 1.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.91 2k72 h SER 33 CO -0.31 1.13 0.00 0.00 -1.14 0.00 0.00 176.83 176.51 2k72 n ASP 35 N -1.32 -4.59 0.17 0.00 -0.08 0.13 -4.83 116.55 106.04 2k72 n ASP 35 Ca 0.04 0.31 0.09 0.00 -1.51 0.00 0.00 54.79 53.72 2k72 n ASP 35 Cb 0.07 -3.18 0.49 0.00 2.34 0.00 0.00 41.12 40.84 2k72 n ASP 35 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2k72 n PHE 36 N -2.61 0.61 -0.16 -0.67 3.72 -1.09 -5.03 117.46 112.22 2k72 n PHE 36 Ca -0.12 0.32 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 2k72 n PHE 36 Cb 0.42 -0.91 0.00 0.00 -0.94 0.00 0.00 39.48 38.05 2k72 n PHE 36 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71