#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 -2.49 3.85 2.98 0.00 -1.26 -5.13 105.19 103.14 2k72 n GLY 2 Ca 0.00 0.82 -0.36 0.00 0.00 0.00 0.00 46.02 46.48 2k72 n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k72 n LEU 4 N 1.19 -0.02 -3.48 0.00 -0.00 -1.26 -4.85 117.00 108.58 2k72 n LEU 4 Ca -0.09 0.06 -0.10 0.00 -0.00 0.00 0.00 56.01 55.88 2k72 n LEU 4 Cb 0.52 0.09 -0.02 0.00 -0.00 0.00 0.00 43.42 44.01 2k72 n LEU 4 CO 0.41 -0.02 0.59 1.51 -0.00 0.00 0.00 177.39 179.88 2k72 s ASP 5 N -1.12 -0.44 -0.03 1.45 1.47 -1.26 0.30 116.67 117.04 2k72 s ASP 5 Ca 0.00 0.06 0.08 0.00 1.18 0.00 0.00 52.55 53.87 2k72 s ASP 5 Cb 0.00 0.45 0.14 0.00 -0.34 0.00 0.00 42.92 43.18 2k72 s ASP 5 CO 0.00 -0.71 1.06 0.54 0.68 0.00 0.00 175.17 176.74 2k72 n ARG 6 N -0.18 0.27 -0.19 2.11 1.74 -0.96 -4.99 116.66 114.46 2k72 n ARG 6 Ca -0.12 -1.53 0.00 0.00 -0.77 0.00 0.00 57.85 55.43 2k72 n ARG 6 Cb 0.62 -0.61 0.00 0.00 -1.02 0.00 0.00 32.46 31.45 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 -0.18 0.00 -2.66 0.55 -5.35 -1.26 -5.08 119.36 105.37 2k72 n ILE 7 Ca 0.04 0.00 0.01 0.00 -0.27 0.00 0.00 62.75 62.54 2k72 n ILE 7 Cb 0.77 0.00 0.04 0.00 -1.74 0.00 0.00 39.64 38.71 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 0.57 -0.57 4.28 7.35 -1.26 -4.83 117.46 123.01 2k72 n PHE 8 Ca 0.00 -1.37 0.00 0.00 -0.76 0.00 0.00 57.45 55.32 2k72 n PHE 8 Cb 0.00 -0.11 0.00 0.00 0.35 0.00 0.00 39.48 39.72 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 -0.14 0.37 -0.08 -2.13 3.14 -1.26 -4.80 118.33 113.43 2k72 n VAL 9 Ca 0.05 -0.40 -0.14 0.00 -2.96 0.00 0.00 64.34 60.89 2k72 n VAL 9 Cb 0.95 0.90 -0.05 0.00 -1.06 0.00 0.00 33.84 34.58 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 0.36 0.21 -0.18 0.00 1.03 -1.98 1.26 112.91 113.61 2k72 h THR 11 Ca 0.03 -0.06 -0.15 0.00 -0.01 0.00 0.00 66.41 66.23 2k72 h THR 11 Cb 0.88 0.03 -0.01 0.00 -1.07 0.00 0.00 68.15 67.98 2k72 h THR 11 CO 0.07 0.03 -0.51 -1.28 -0.01 0.00 0.00 175.52 173.83 2k72 h SER 12 N 0.16 0.55 0.89 0.00 0.87 -1.90 -2.52 113.55 111.60 2k72 h SER 12 Ca 0.65 -0.28 -0.04 0.00 -1.23 0.00 0.00 61.79 60.89 2k72 h SER 12 Cb 1.44 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 63.25 2k72 h SER 12 CO -0.71 0.96 -0.43 -0.50 -0.53 0.00 0.00 176.83 175.62 2k72 h TRP 13 N 0.39 -1.11 0.00 2.24 6.55 0.17 -2.05 115.95 122.14 2k72 h TRP 13 Ca 0.02 -0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.83 2k72 h TRP 13 Cb 1.02 0.37 0.00 0.00 -0.86 0.00 0.00 29.16 29.69 2k72 h TRP 13 CO 0.04 -0.69 0.00 0.00 -1.05 0.00 0.00 178.44 176.74 2k72 h ALA 14 N -1.19 1.00 0.00 1.49 0.00 -1.14 -0.61 119.26 118.81 2k72 h ALA 14 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2k72 h ALA 14 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k72 h ALA 14 CO 0.20 0.00 0.00 -2.13 0.00 0.00 0.00 179.25 177.32 2k72 n ARG 15 N -2.33 0.29 0.00 0.00 0.63 -0.77 -3.51 116.66 110.96 2k72 n ARG 15 Ca -0.01 0.07 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 2k72 n ARG 15 Cb 0.06 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.47 2k72 n ARG 15 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 2k72 n LYS 16 N -1.31 3.15 0.00 -0.14 3.00 -0.35 -5.00 118.16 117.51 2k72 n LYS 16 Ca 0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 2k72 n LYS 16 Cb 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 35.03 34.96 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 0.45 1.52 0.23 3.14 0.00 -1.06 -5.02 105.19 104.46 2k72 n GLY 17 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.46 -0.78 1.61 3.04 -1.52 0.19 116.94 119.03 2k72 h PHE 18 Ca 0.00 0.04 0.23 0.00 3.98 0.00 0.00 57.97 62.22 2k72 h PHE 18 Cb 0.00 0.25 -0.03 0.00 2.56 0.00 0.00 35.95 38.73 2k72 h PHE 18 CO 0.00 -0.26 0.60 0.00 -2.02 0.00 0.00 178.31 176.63 2k72 h ASP 20 N 0.00 0.00 0.36 0.00 3.58 -1.07 -2.39 116.42 116.90 2k72 h ASP 20 Ca 0.37 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.70 2k72 h ASP 20 Cb 1.56 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.60 2k72 h ASP 20 CO -0.00 0.32 -0.52 1.62 -2.88 0.00 0.00 179.24 177.77 2k72 h VAL 21 N -0.49 1.36 -0.12 2.25 3.04 -1.16 -3.03 116.25 118.09 2k72 h VAL 21 Ca 0.00 -1.80 0.00 0.00 -1.01 0.00 0.00 66.70 63.89 2k72 h VAL 21 Cb 0.15 1.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 2k72 h VAL 21 CO 0.00 0.53 0.00 0.54 -1.01 0.00 0.00 177.57 177.63 2k72 n ARG 22 N -3.93 2.29 -0.57 4.17 5.12 0.26 -4.55 116.66 119.45 2k72 n ARG 22 Ca -0.02 -1.99 0.43 0.00 -1.93 0.00 0.00 57.85 54.35 2k72 n ARG 22 Cb 0.56 -1.46 0.67 0.00 -1.16 0.00 0.00 32.46 31.06 2k72 n ARG 22 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 2k72 n GLN 23 N 1.35 -0.00 0.19 5.56 0.00 -0.78 0.24 117.38 123.94 2k72 n GLN 23 Ca 0.15 0.89 0.05 0.00 -0.00 0.00 0.00 57.00 58.09 2k72 n GLN 23 Cb 0.59 -2.04 0.37 0.00 0.00 0.00 0.00 30.24 29.16 2k72 n GLN 23 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.06 177.13 2k72 h ARG 24 N 0.00 0.00 0.00 3.69 0.11 -1.84 -2.95 114.38 113.39 2k72 h ARG 24 Ca 0.77 0.00 -0.42 0.00 0.10 0.00 0.00 59.98 60.42 2k72 h ARG 24 Cb 3.06 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 34.07 2k72 h ARG 24 CO -0.03 0.37 -2.50 -0.11 0.10 0.00 0.00 179.97 177.80 2k72 n LEU 25 N -3.75 2.51 0.00 0.08 0.00 0.67 -4.32 117.00 112.20 2k72 n LEU 25 Ca -0.01 0.08 0.05 0.00 0.00 0.00 0.00 56.01 56.12 2k72 n LEU 25 Cb 0.46 -0.86 0.25 0.00 0.00 0.00 0.00 43.42 43.26 2k72 n LEU 25 CO 0.37 0.77 0.56 0.80 0.00 0.00 0.00 177.39 179.90 2k72 n MET 26 N -3.70 0.18 -0.36 1.96 1.56 -0.68 -3.23 117.12 112.85 2k72 n MET 26 Ca -0.50 0.14 -0.03 0.00 -0.27 0.00 0.00 57.70 57.05 2k72 n MET 26 Cb 0.94 -1.50 0.10 0.00 2.15 0.00 0.00 33.22 34.91 2k72 n MET 26 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 2k72 h LYS 27 N 0.00 1.28 0.00 2.12 3.64 -1.71 -2.86 116.57 119.05 2k72 h LYS 27 Ca 0.00 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.14 2k72 h LYS 27 Cb 0.06 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 2k72 h LYS 27 CO 0.00 0.85 -1.49 0.54 -2.27 0.00 0.00 179.45 177.08 2k72 n ARG 28 N -4.40 0.53 0.21 1.90 5.12 -1.20 -3.91 116.66 114.91 2k72 n ARG 28 Ca 0.11 0.22 0.17 0.00 -1.93 0.00 0.00 57.85 56.42 2k72 n ARG 28 Cb 0.02 -1.41 0.84 0.00 -1.16 0.00 0.00 32.46 30.75 2k72 n ARG 28 CO 0.00 0.00 0.00 1.37 -1.93 0.00 0.00 177.63 177.07 2k72 h LEU 29 N -0.96 0.00 -5.04 0.55 8.10 -1.73 -3.35 115.31 112.89 2k72 h LEU 29 Ca -0.24 0.00 -0.22 0.00 0.11 0.00 0.00 57.88 57.53 2k72 h LEU 29 Cb 1.18 0.00 -0.15 0.00 -0.44 0.00 0.00 40.66 41.25 2k72 h LEU 29 CO -0.14 0.00 -0.51 0.00 -4.11 0.00 0.00 178.44 173.67 2k72 n PRO 31 N 1.91 0.35 0.39 0.00 -0.04 -0.65 -3.97 135.00 132.99 2k72 n PRO 31 Ca 0.11 0.05 -0.15 0.00 -0.04 0.00 0.00 63.50 63.47 2k72 n PRO 31 Cb 0.61 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.50 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 0.00 -0.97 0.00 0.54 9.65 0.43 0.28 114.38 124.31 2k72 h ARG 32 Ca 0.00 0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 2k72 h ARG 32 Cb 0.24 0.22 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 2k72 h ARG 32 CO 0.00 -0.64 0.00 0.43 2.80 0.00 0.00 179.97 182.56 2k72 n SER 33 N -4.90 0.00 -0.72 -3.80 7.64 -1.25 -0.47 113.62 110.11 2k72 n SER 33 Ca -0.12 0.38 0.02 0.00 1.01 0.00 0.00 58.87 60.15 2k72 n SER 33 Cb 0.39 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.69 2k72 n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k72 n ASP 35 N 0.12 -1.08 0.05 0.00 9.92 0.69 -4.76 116.55 121.49 2k72 n ASP 35 Ca 0.07 -1.07 0.05 0.00 -0.53 0.00 0.00 54.79 53.30 2k72 n ASP 35 Cb 0.41 -2.79 0.24 0.00 -0.64 0.00 0.00 41.12 38.34 2k72 n ASP 35 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2k72 n PHE 36 N -4.45 0.25 1.21 1.24 3.72 0.45 -4.97 117.46 114.91 2k72 n PHE 36 Ca -0.27 0.12 0.10 0.00 -0.05 0.00 0.00 57.45 57.35 2k72 n PHE 36 Cb 0.67 -0.69 0.58 0.00 -0.94 0.00 0.00 39.48 39.09 2k72 n PHE 36 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71