#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 0.40 3.43 2.72 0.00 -1.26 -5.08 105.19 105.40 2k72 n GLY 2 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 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 8.12 -0.68 0.67 0.00 2.96 -1.26 -4.87 118.68 123.61 2k72 s LEU 4 Ca 1.31 1.08 0.04 0.00 -0.22 0.00 0.00 54.13 56.34 2k72 s LEU 4 Cb -1.32 1.52 0.12 0.00 0.50 0.00 0.00 46.19 47.00 2k72 s LEU 4 CO 0.54 -0.23 0.92 1.51 -1.32 0.00 0.00 176.35 177.77 2k72 s ASP 5 N 2.54 4.63 0.00 3.68 -4.77 -1.26 -4.67 116.67 116.81 2k72 s ASP 5 Ca -0.03 -0.62 0.00 0.00 -3.30 0.00 0.00 52.55 48.60 2k72 s ASP 5 Cb -0.12 0.19 0.00 0.00 -1.09 0.00 0.00 42.92 41.91 2k72 s ASP 5 CO -0.14 -1.68 0.87 -2.11 0.70 0.00 0.00 175.17 172.81 2k72 n ARG 6 N -2.60 0.00 -4.09 2.11 1.85 -1.14 -5.01 116.66 107.78 2k72 n ARG 6 Ca 0.16 -0.78 -0.10 0.00 -1.00 0.00 0.00 57.85 56.13 2k72 n ARG 6 Cb 0.61 -0.40 -0.08 0.00 -1.05 0.00 0.00 32.46 31.54 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 0.00 0.02 -0.90 8.89 -4.36 -1.26 -5.05 121.20 118.54 2k72 s ILE 7 Ca 0.00 -1.70 0.10 0.00 -0.26 0.00 0.00 60.65 58.78 2k72 s ILE 7 Cb 0.00 -2.26 0.24 0.00 1.25 0.00 0.00 42.46 41.69 2k72 s ILE 7 CO 0.00 -0.09 1.15 0.33 0.24 0.00 0.00 174.94 176.57 2k72 n PHE 8 N -0.28 0.33 -0.05 1.37 -0.00 -1.26 -4.56 117.46 113.01 2k72 n PHE 8 Ca -0.01 -0.41 -0.09 0.00 -0.00 0.00 0.00 57.45 56.94 2k72 n PHE 8 Cb 0.64 -0.02 0.10 0.00 -0.00 0.00 0.00 39.48 40.20 2k72 n PHE 8 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.76 178.31 2k72 n VAL 9 N 0.43 1.96 -0.06 -2.13 3.14 -1.26 -4.27 118.33 116.14 2k72 n VAL 9 Ca 0.09 -0.89 -0.19 0.00 -2.96 0.00 0.00 64.34 60.40 2k72 n VAL 9 Cb 0.38 -0.69 -0.13 0.00 -1.06 0.00 0.00 33.84 32.34 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 -0.85 0.28 -0.21 0.00 2.02 -1.96 0.86 112.91 113.04 2k72 h THR 11 Ca -0.19 -0.10 -0.18 0.00 0.77 0.00 0.00 66.41 66.71 2k72 h THR 11 Cb 1.28 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.66 2k72 h THR 11 CO -0.06 0.05 -0.60 0.28 0.37 0.00 0.00 175.52 175.56 2k72 h SER 12 N 0.28 0.80 -0.23 4.18 0.02 -1.87 -3.08 113.55 113.65 2k72 h SER 12 Ca 0.71 -0.45 -0.12 0.00 -0.84 0.00 0.00 61.79 61.08 2k72 h SER 12 Cb 1.60 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.91 2k72 h SER 12 CO -0.63 1.22 -0.34 -0.50 -1.14 0.00 0.00 176.83 175.44 2k72 h TRP 13 N 0.53 0.78 -0.94 3.45 6.55 0.38 -2.33 115.95 124.36 2k72 h TRP 13 Ca -0.00 -0.26 0.17 0.00 0.95 0.00 0.00 58.89 59.74 2k72 h TRP 13 Cb 1.19 -0.15 -0.10 0.00 -0.86 0.00 0.00 29.16 29.24 2k72 h TRP 13 CO 0.06 1.00 0.54 0.00 -1.05 0.00 0.00 178.44 178.99 2k72 h ALA 14 N 0.64 1.49 -0.02 1.49 0.00 0.35 0.43 119.26 123.64 2k72 h ALA 14 Ca 0.02 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2k72 h ALA 14 Cb 0.92 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2k72 h ALA 14 CO 0.08 -0.04 0.00 2.89 0.00 0.00 0.00 179.25 182.18 2k72 n ARG 15 N -4.80 1.58 0.00 0.00 1.85 -1.17 -3.62 116.66 110.50 2k72 n ARG 15 Ca 0.20 -0.85 0.11 0.00 -1.00 0.00 0.00 57.85 56.32 2k72 n ARG 15 Cb 0.49 -1.47 0.08 0.00 -1.05 0.00 0.00 32.46 30.51 2k72 n ARG 15 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 2k72 n LYS 16 N 0.03 2.00 -0.52 2.89 3.00 0.14 -4.93 118.16 120.78 2k72 n LYS 16 Ca 0.19 -1.70 0.00 0.00 -0.00 0.00 0.00 58.31 56.81 2k72 n LYS 16 Cb 0.32 -1.44 0.00 0.00 0.00 0.00 0.00 35.03 33.92 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 1.29 0.74 0.34 3.14 0.00 -0.93 -4.92 105.19 104.84 2k72 n GLY 17 Ca 0.12 -0.05 0.22 0.00 0.00 0.00 0.00 46.02 46.32 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 0.00 -0.39 1.61 3.04 -1.58 0.34 116.94 119.97 2k72 h PHE 18 Ca 0.00 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.90 2k72 h PHE 18 Cb 0.00 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.48 2k72 h PHE 18 CO 0.00 0.00 0.07 0.00 -2.02 0.00 0.00 178.31 176.36 2k72 n ASP 20 N 0.23 0.00 -0.10 0.00 9.92 -0.02 -4.77 116.55 121.81 2k72 n ASP 20 Ca 0.20 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 54.31 2k72 n ASP 20 Cb 0.89 0.01 -0.09 0.00 -0.64 0.00 0.00 41.12 41.29 2k72 n ASP 20 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 2k72 n VAL 21 N -1.54 1.11 0.94 2.53 0.24 -0.46 -4.55 118.33 116.60 2k72 n VAL 21 Ca 0.00 -0.40 0.12 0.00 -2.04 0.00 0.00 64.34 62.02 2k72 n VAL 21 Cb 0.00 -1.30 0.11 0.00 -1.47 0.00 0.00 33.84 31.17 2k72 n VAL 21 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2k72 n ARG 22 N -3.23 2.29 -0.35 7.34 3.00 -1.23 -4.48 116.66 119.99 2k72 n ARG 22 Ca -0.35 -1.93 0.31 0.00 -0.01 0.00 0.00 57.85 55.86 2k72 n ARG 22 Cb 0.85 -1.46 0.57 0.00 0.00 0.00 0.00 32.46 32.42 2k72 n ARG 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.63 177.07 2k72 h GLN 23 N 4.62 0.12 -1.53 5.56 3.07 0.48 0.63 115.11 128.07 2k72 h GLN 23 Ca 0.00 -0.01 0.46 0.00 0.09 0.00 0.00 58.65 59.19 2k72 h GLN 23 Cb 0.98 -0.03 -0.08 0.00 0.08 0.00 0.00 27.48 28.43 2k72 h GLN 23 CO 0.00 0.08 1.07 -0.09 0.09 0.00 0.00 178.83 179.97 2k72 h ARG 24 N 0.12 0.05 0.00 0.06 1.12 -1.83 0.64 114.38 114.53 2k72 h ARG 24 Ca 0.81 -0.00 -0.37 0.00 -1.11 0.00 0.00 59.98 59.30 2k72 h ARG 24 Cb 2.15 -0.01 -0.07 0.00 -0.01 0.00 0.00 29.97 32.03 2k72 h ARG 24 CO -0.64 0.03 -2.40 -0.11 -3.11 0.00 0.00 179.97 173.74 2k72 n LEU 25 N -4.25 0.64 0.24 3.80 7.94 0.22 -4.28 117.00 121.31 2k72 n LEU 25 Ca 0.36 -0.03 0.13 0.00 -1.11 0.00 0.00 56.01 55.36 2k72 n LEU 25 Cb 1.58 0.20 0.50 0.00 0.53 0.00 0.00 43.42 46.23 2k72 n LEU 25 CO 0.36 0.59 0.87 -0.03 -1.11 0.00 0.00 177.39 178.07 2k72 h MET 26 N 0.00 0.00 -0.66 1.96 4.05 -0.20 -2.69 114.93 117.39 2k72 h MET 26 Ca -0.55 0.00 0.13 0.00 -0.28 0.00 0.00 59.70 58.99 2k72 h MET 26 Cb 2.17 0.00 -0.13 0.00 -0.80 0.00 0.00 31.60 32.85 2k72 h MET 26 CO 0.01 0.12 -0.25 0.87 0.23 0.00 0.00 176.91 177.89 2k72 h LYS 27 N 0.00 -0.07 0.00 0.39 1.79 -0.08 -0.55 116.57 118.05 2k72 h LYS 27 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k72 h LYS 27 Cb 0.71 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.38 2k72 h LYS 27 CO 0.02 -0.05 -1.65 2.89 -1.08 0.00 0.00 179.45 179.58 2k72 n ARG 28 N -5.46 0.48 -0.00 3.15 1.85 -1.23 -3.90 116.66 111.55 2k72 n ARG 28 Ca 0.07 -0.13 -0.08 0.00 -1.00 0.00 0.00 57.85 56.71 2k72 n ARG 28 Cb 0.36 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.21 2k72 n ARG 28 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 2k72 h LEU 29 N 0.00 -0.09 -5.94 2.89 3.38 -1.07 -3.43 115.31 111.04 2k72 h LEU 29 Ca 0.00 -0.40 -0.52 0.00 0.09 0.00 0.00 57.88 57.05 2k72 h LEU 29 Cb 0.82 0.02 -0.36 0.00 0.09 0.00 0.00 40.66 41.24 2k72 h LEU 29 CO 0.00 0.56 -1.00 0.00 0.09 0.00 0.00 178.44 178.09 2k72 n PRO 31 N 1.79 0.20 -0.10 0.00 -0.04 -1.16 -3.18 135.00 132.50 2k72 n PRO 31 Ca 0.22 0.35 -0.11 0.00 -0.04 0.00 0.00 63.50 63.91 2k72 n PRO 31 Cb 0.53 -1.83 -0.03 0.00 -0.04 0.00 0.00 33.50 32.13 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 0.00 0.57 0.09 0.54 3.08 -1.90 0.42 114.38 117.17 2k72 h ARG 32 Ca 0.00 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 2k72 h ARG 32 Cb 0.46 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.47 2k72 h ARG 32 CO 0.00 0.74 -0.04 1.03 -1.07 0.00 0.00 179.97 180.63 2k72 h SER 33 N 0.35 -0.10 0.11 7.04 0.87 -1.96 -3.23 113.55 116.63 2k72 h SER 33 Ca 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2k72 h SER 33 Cb 0.51 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2k72 h SER 33 CO 0.02 0.01 0.00 0.00 -0.53 0.00 0.00 176.83 176.33 2k72 n ASP 35 N -2.03 -3.32 -1.58 0.00 -0.08 0.11 -4.93 116.55 104.72 2k72 n ASP 35 Ca -0.00 -0.35 0.06 0.00 -1.51 0.00 0.00 54.79 52.98 2k72 n ASP 35 Cb 0.05 -2.95 0.32 0.00 2.34 0.00 0.00 41.12 40.89 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 -2.51 1.61 0.00 -0.67 3.72 0.85 -4.99 117.46 115.48 2k72 n PHE 36 Ca -0.09 -0.57 0.00 0.00 -0.05 0.00 0.00 57.45 56.74 2k72 n PHE 36 Cb 0.57 -0.40 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 2k72 n PHE 36 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71