#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 3.10 3.51 2.72 0.00 -1.26 -4.96 105.19 108.30 2k72 n GLY 2 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 3.35 0.28 0.72 0.00 0.05 -1.26 -4.78 118.68 117.05 2k72 s LEU 4 Ca 0.43 0.67 -0.04 0.00 0.05 0.00 0.00 54.13 55.24 2k72 s LEU 4 Cb -0.01 1.00 0.10 0.00 -2.05 0.00 0.00 46.19 45.24 2k72 s LEU 4 CO -0.04 -0.17 1.01 1.51 -0.55 0.00 0.00 176.35 178.12 2k72 s ASP 5 N 1.16 4.44 -0.02 1.48 -4.77 -1.26 -4.29 116.67 113.40 2k72 s ASP 5 Ca -0.08 0.01 0.03 0.00 -3.30 0.00 0.00 52.55 49.21 2k72 s ASP 5 Cb -0.09 -0.50 0.05 0.00 -1.09 0.00 0.00 42.92 41.30 2k72 s ASP 5 CO -0.09 -1.80 0.92 0.54 0.70 0.00 0.00 175.17 175.44 2k72 n ARG 6 N -2.91 1.86 -0.23 2.11 1.74 0.45 -4.94 116.66 114.73 2k72 n ARG 6 Ca 0.12 -1.44 0.00 0.00 -0.77 0.00 0.00 57.85 55.75 2k72 n ARG 6 Cb 0.60 -0.95 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 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 -0.53 0.00 -2.53 0.55 -5.35 -1.25 -5.08 119.36 105.17 2k72 n ILE 7 Ca 0.03 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.36 2k72 n ILE 7 Cb 0.40 0.00 0.02 0.00 -1.74 0.00 0.00 39.64 38.33 2k72 n ILE 7 CO 0.00 0.00 0.00 2.22 -1.76 0.00 0.00 176.55 177.01 2k72 n PHE 8 N 0.00 2.11 -2.61 4.28 -1.74 -1.26 -4.79 117.46 113.44 2k72 n PHE 8 Ca 0.00 -2.65 0.00 0.00 -0.56 0.00 0.00 57.45 54.24 2k72 n PHE 8 Cb 0.00 -0.26 0.04 0.00 1.52 0.00 0.00 39.48 40.78 2k72 n PHE 8 CO 0.00 0.00 0.00 1.33 -0.56 0.00 0.00 176.76 177.53 2k72 n VAL 9 N -0.41 0.53 -0.05 1.97 0.24 -1.26 -4.91 118.33 114.45 2k72 n VAL 9 Ca 0.23 -1.69 -0.14 0.00 -2.04 0.00 0.00 64.34 60.70 2k72 n VAL 9 Cb 0.80 1.07 -0.12 0.00 -1.47 0.00 0.00 33.84 34.12 2k72 n VAL 9 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k72 h THR 11 N -0.80 0.07 -1.01 0.00 2.02 -1.96 -0.82 112.91 110.42 2k72 h THR 11 Ca -0.01 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.39 2k72 h THR 11 Cb 0.94 0.07 -0.12 0.00 -1.74 0.00 0.00 68.15 67.30 2k72 h THR 11 CO 0.02 0.00 0.60 0.28 0.37 0.00 0.00 175.52 176.79 2k72 h SER 12 N -1.06 0.71 -0.33 4.18 0.02 -1.93 0.47 113.55 115.61 2k72 h SER 12 Ca -0.08 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2k72 h SER 12 Cb 0.88 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 2k72 h SER 12 CO 0.03 0.17 0.14 -0.50 -1.14 0.00 0.00 176.83 175.53 2k72 h TRP 13 N 0.65 0.50 0.00 3.45 6.55 -1.19 -2.40 115.95 123.51 2k72 h TRP 13 Ca 0.62 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 60.41 2k72 h TRP 13 Cb 1.11 -0.15 -0.00 0.00 -0.86 0.00 0.00 29.16 29.26 2k72 h TRP 13 CO -0.01 0.46 -0.06 0.00 -1.05 0.00 0.00 178.44 177.79 2k72 h ALA 14 N 0.99 1.57 0.00 1.49 0.00 0.50 -0.34 119.26 123.47 2k72 h ALA 14 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2k72 h ALA 14 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2k72 h ALA 14 CO -0.01 0.07 0.00 -2.13 0.00 0.00 0.00 179.25 177.18 2k72 n ARG 15 N -3.98 0.29 -0.00 0.00 0.63 -0.79 -2.91 116.66 109.90 2k72 n ARG 15 Ca -0.03 0.10 0.01 0.00 -0.92 0.00 0.00 57.85 57.01 2k72 n ARG 15 Cb 0.14 -1.50 -0.02 0.00 0.45 0.00 0.00 32.46 31.54 2k72 n ARG 15 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2k72 n LYS 16 N -1.27 1.05 0.00 -0.14 5.02 -0.21 -5.00 118.16 117.61 2k72 n LYS 16 Ca 0.09 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2k72 n LYS 16 Cb 0.15 -0.98 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 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 2.17 1.09 0.28 0.72 0.00 -0.87 -4.97 105.19 103.61 2k72 n GLY 17 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 0.42 0.00 1.61 3.57 -1.61 1.75 116.94 122.68 2k72 h PHE 18 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2k72 h PHE 18 Cb 0.00 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.67 2k72 h PHE 18 CO 0.00 -0.03 0.00 0.00 -2.23 0.00 0.00 178.31 176.05 2k72 n ASP 20 N -0.68 4.08 -0.08 0.00 2.03 0.35 -4.29 116.55 117.97 2k72 n ASP 20 Ca 0.08 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.32 2k72 n ASP 20 Cb 0.04 0.37 -0.02 0.00 -0.72 0.00 0.00 41.12 40.78 2k72 n ASP 20 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2k72 n VAL 21 N -1.83 1.39 1.13 5.18 0.31 0.51 -4.46 118.33 120.55 2k72 n VAL 21 Ca 0.00 0.20 0.12 0.00 -0.01 0.00 0.00 64.34 64.65 2k72 n VAL 21 Cb 0.42 -2.33 0.35 0.00 -0.91 0.00 0.00 33.84 31.37 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 -4.44 1.93 -0.02 5.55 5.12 -0.76 -4.65 116.66 119.39 2k72 n ARG 22 Ca -0.10 -1.38 0.02 0.00 -1.93 0.00 0.00 57.85 54.46 2k72 n ARG 22 Cb 0.36 -1.45 0.03 0.00 -1.16 0.00 0.00 32.46 30.24 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 0.64 -0.00 0.15 5.56 -0.00 0.18 0.23 117.38 124.13 2k72 n GLN 23 Ca 0.17 0.09 0.09 0.00 -0.00 0.00 0.00 57.00 57.35 2k72 n GLN 23 Cb 0.43 -0.16 0.47 0.00 -0.00 0.00 0.00 30.24 30.98 2k72 n GLN 23 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2k72 n ARG 24 N -3.33 0.11 -0.13 2.61 1.85 -1.26 -1.92 116.66 114.59 2k72 n ARG 24 Ca 0.02 0.60 -0.28 0.00 -1.00 0.00 0.00 57.85 57.20 2k72 n ARG 24 Cb 0.07 -1.99 -0.10 0.00 -1.05 0.00 0.00 32.46 29.39 2k72 n ARG 24 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 2k72 n LEU 25 N -2.14 2.03 0.13 2.89 7.94 0.63 -4.22 117.00 124.26 2k72 n LEU 25 Ca -0.01 0.32 0.09 0.00 -1.11 0.00 0.00 56.01 55.29 2k72 n LEU 25 Cb 0.14 -0.85 0.48 0.00 0.53 0.00 0.00 43.42 43.71 2k72 n LEU 25 CO 0.08 0.56 0.77 0.80 -1.11 0.00 0.00 177.39 178.49 2k72 n MET 26 N -4.20 0.11 -0.14 1.96 1.56 -0.97 -2.76 117.12 112.69 2k72 n MET 26 Ca -0.50 0.61 -0.09 0.00 -0.27 0.00 0.00 57.70 57.45 2k72 n MET 26 Cb 0.87 -1.88 -0.04 0.00 2.15 0.00 0.00 33.22 34.32 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 -0.29 0.00 2.12 3.64 -1.56 0.57 116.57 121.05 2k72 h LYS 27 Ca 0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2k72 h LYS 27 Cb 0.01 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2k72 h LYS 27 CO 0.00 -0.19 -1.10 0.54 -2.27 0.00 0.00 179.45 176.43 2k72 n ARG 28 N -5.42 0.13 0.05 1.90 1.74 -1.14 -3.79 116.66 110.14 2k72 n ARG 28 Ca 0.00 -0.03 -0.22 0.00 -0.77 0.00 0.00 57.85 56.83 2k72 n ARG 28 Cb 0.35 -1.51 -0.15 0.00 -1.02 0.00 0.00 32.46 30.13 2k72 n ARG 28 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2k72 h LEU 29 N 0.00 0.54 -5.19 0.55 3.38 -1.24 -3.39 115.31 109.96 2k72 h LEU 29 Ca 0.00 -0.89 -0.26 0.00 0.09 0.00 0.00 57.88 56.82 2k72 h LEU 29 Cb 0.60 -0.18 -0.19 0.00 0.09 0.00 0.00 40.66 40.99 2k72 h LEU 29 CO 0.00 1.76 -0.59 0.00 0.09 0.00 0.00 178.44 179.70 2k72 n PRO 31 N 2.01 0.55 0.12 0.00 -0.04 -1.09 -3.54 135.00 133.00 2k72 n PRO 31 Ca 0.14 -0.08 -0.01 0.00 -0.04 0.00 0.00 63.50 63.52 2k72 n PRO 31 Cb 0.59 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2k72 n PRO 31 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k72 h ARG 32 N 0.18 0.00 0.04 0.54 2.47 -1.86 -0.41 114.38 115.35 2k72 h ARG 32 Ca 0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2k72 h ARG 32 Cb 0.29 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.61 2k72 h ARG 32 CO 0.00 0.67 -0.02 0.77 0.56 0.00 0.00 179.97 181.95 2k72 h SER 33 N 0.00 -0.04 0.93 7.04 0.02 -1.90 -3.37 113.55 116.23 2k72 h SER 33 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2k72 h SER 33 Cb 1.48 0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.03 2k72 h SER 33 CO 0.09 0.20 -0.33 0.00 -1.14 0.00 0.00 176.83 175.65 2k72 n ASP 35 N -1.86 -4.26 -0.09 0.00 2.03 -0.18 -4.90 116.55 107.28 2k72 n ASP 35 Ca 0.05 -0.06 0.06 0.00 0.52 0.00 0.00 54.79 55.36 2k72 n ASP 35 Cb 0.39 -2.68 0.33 0.00 -0.72 0.00 0.00 41.12 38.44 2k72 n ASP 35 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2k72 n PHE 36 N -1.43 0.05 0.32 -0.67 3.01 -1.07 -5.03 117.46 112.64 2k72 n PHE 36 Ca -0.00 -0.02 0.03 0.00 1.01 0.00 0.00 57.45 58.46 2k72 n PHE 36 Cb 0.51 0.00 0.15 0.00 -0.01 0.00 0.00 39.48 40.13 2k72 n PHE 36 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77