#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k72 s GLY 2 N 0.00 0.39 0.16 -7.48 0.00 -1.26 -4.96 107.32 94.17 2k72 s GLY 2 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 44.72 44.81 2k72 s GLY 2 CO 0.00 3.50 -0.21 0.00 0.00 0.00 0.00 173.10 176.39 2k72 s LEU 4 N -2.44 -0.05 -0.06 0.00 0.05 -1.26 -5.02 118.68 109.90 2k72 s LEU 4 Ca 0.19 -0.22 -0.20 0.00 0.05 0.00 0.00 54.13 53.95 2k72 s LEU 4 Cb -0.09 1.49 -0.05 0.00 -2.05 0.00 0.00 46.19 45.49 2k72 s LEU 4 CO 0.10 -0.41 0.55 1.51 -0.55 0.00 0.00 176.35 177.55 2k72 s ASP 5 N -3.22 6.85 0.02 1.48 1.47 -1.26 -4.19 116.67 117.82 2k72 s ASP 5 Ca 0.18 1.02 0.23 0.00 1.18 0.00 0.00 52.55 55.17 2k72 s ASP 5 Cb 0.02 -2.33 0.19 0.00 -0.34 0.00 0.00 42.92 40.46 2k72 s ASP 5 CO -0.02 0.05 1.17 0.54 0.68 0.00 0.00 175.17 177.59 2k72 n ARG 6 N 3.19 0.08 0.00 2.11 1.74 0.15 -4.87 116.66 119.06 2k72 n ARG 6 Ca -0.07 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 2k72 n ARG 6 Cb 0.51 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 2k72 n ARG 6 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2k72 n ILE 7 N -1.64 0.00 -0.80 0.55 5.41 -1.13 -5.08 119.36 116.67 2k72 n ILE 7 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.79 2k72 n ILE 7 Cb 0.36 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.29 2k72 n ILE 7 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 2k72 n PHE 8 N 0.00 0.00 0.00 1.39 -1.74 -1.26 -4.77 117.46 111.08 2k72 n PHE 8 Ca 0.00 -0.00 0.01 0.00 -0.56 0.00 0.00 57.45 56.90 2k72 n PHE 8 Cb 0.00 -0.00 0.19 0.00 1.52 0.00 0.00 39.48 41.19 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 -0.00 1.53 -0.30 1.97 0.24 -1.26 -4.34 118.33 116.16 2k72 n VAL 9 Ca 0.00 -0.76 0.01 0.00 -2.04 0.00 0.00 64.34 61.55 2k72 n VAL 9 Cb 0.21 -0.44 0.14 0.00 -1.47 0.00 0.00 33.84 32.28 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 0.91 1.58 -0.03 0.00 2.02 -1.93 -2.13 112.91 113.33 2k72 h THR 11 Ca 0.37 -1.96 0.01 0.00 0.77 0.00 0.00 66.41 65.60 2k72 h THR 11 Cb 0.21 2.83 -0.00 0.00 -1.74 0.00 0.00 68.15 69.45 2k72 h THR 11 CO -0.19 0.53 0.25 0.28 0.37 0.00 0.00 175.52 176.76 2k72 h SER 12 N -0.58 0.00 0.00 4.18 0.02 -1.77 -1.73 113.55 113.67 2k72 h SER 12 Ca -0.03 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.72 2k72 h SER 12 Cb 0.97 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.48 2k72 h SER 12 CO 0.04 0.00 -1.13 -0.50 -1.14 0.00 0.00 176.83 174.10 2k72 h TRP 13 N 0.00 0.00 0.00 3.45 6.55 -0.91 -3.34 115.95 121.70 2k72 h TRP 13 Ca 0.01 -0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.85 2k72 h TRP 13 Cb 0.52 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.82 2k72 h TRP 13 CO 0.00 1.44 0.00 0.00 -1.05 0.00 0.00 178.44 178.83 2k72 n ALA 14 N -3.33 1.03 1.17 1.49 0.00 -0.75 -0.51 120.51 119.62 2k72 n ALA 14 Ca -0.30 0.17 0.14 0.00 0.00 0.00 0.00 53.44 53.45 2k72 n ALA 14 Cb 0.66 -1.27 0.54 0.00 0.00 0.00 0.00 19.45 19.38 2k72 n ALA 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k72 n ARG 15 N -2.15 0.28 -0.01 0.00 5.12 -0.73 -3.52 116.66 115.66 2k72 n ARG 15 Ca -0.01 -0.09 0.01 0.00 -1.93 0.00 0.00 57.85 55.83 2k72 n ARG 15 Cb 0.03 -1.50 0.01 0.00 -1.16 0.00 0.00 32.46 29.84 2k72 n ARG 15 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2k72 n LYS 16 N -1.29 0.50 -0.81 5.56 4.76 0.33 -4.98 118.16 122.23 2k72 n LYS 16 Ca 0.10 -0.93 0.00 0.00 -2.87 0.00 0.00 58.31 54.61 2k72 n LYS 16 Cb 0.31 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.47 2k72 n LYS 16 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k72 n GLY 17 N -0.07 0.97 0.07 0.72 0.00 -1.11 -5.00 105.19 100.77 2k72 n GLY 17 Ca 0.01 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.80 0.55 0.23 1.61 -0.00 -0.85 -3.11 117.46 115.09 2k72 n PHE 18 Ca 0.00 0.16 0.09 0.00 -0.00 0.00 0.00 57.45 57.70 2k72 n PHE 18 Cb 0.16 -0.69 0.24 0.00 -0.00 0.00 0.00 39.48 39.19 2k72 n PHE 18 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2k72 n ASP 20 N 1.07 2.38 -0.10 0.00 8.00 -1.25 -4.53 116.55 122.12 2k72 n ASP 20 Ca 0.18 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.54 2k72 n ASP 20 Cb 0.48 0.18 -0.09 0.00 -0.02 0.00 0.00 41.12 41.67 2k72 n ASP 20 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2k72 n VAL 21 N -1.48 1.11 0.73 2.53 3.14 -1.18 -4.53 118.33 118.65 2k72 n VAL 21 Ca 0.00 -0.42 0.12 0.00 -2.96 0.00 0.00 64.34 61.08 2k72 n VAL 21 Cb 0.25 -1.22 0.14 0.00 -1.06 0.00 0.00 33.84 31.95 2k72 n VAL 21 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 2k72 n ARG 22 N -3.12 2.37 -0.42 1.45 3.00 -1.17 -4.57 116.66 114.20 2k72 n ARG 22 Ca -0.35 -2.06 0.33 0.00 -0.00 0.00 0.00 57.85 55.78 2k72 n ARG 22 Cb 0.86 -1.48 0.52 0.00 0.00 0.00 0.00 32.46 32.36 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 1.40 -0.01 -0.28 -0.14 10.64 -0.27 0.12 117.38 128.84 2k72 n GLN 23 Ca 0.16 0.78 0.32 0.00 -1.83 0.00 0.00 57.00 56.44 2k72 n GLN 23 Cb 0.60 -1.70 0.72 0.00 -0.86 0.00 0.00 30.24 29.01 2k72 n GLN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k72 h ARG 24 N 0.00 0.03 0.00 2.61 3.08 -1.86 -1.63 114.38 116.61 2k72 h ARG 24 Ca 0.63 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.58 2k72 h ARG 24 Cb 2.32 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 32.35 2k72 h ARG 24 CO -0.13 0.02 -1.30 -0.11 -1.07 0.00 0.00 179.97 177.38 2k72 n LEU 25 N -4.24 1.93 -0.32 3.04 0.00 0.33 -4.51 117.00 113.22 2k72 n LEU 25 Ca 0.24 0.33 0.21 0.00 0.00 0.00 0.00 56.01 56.79 2k72 n LEU 25 Cb 1.14 -0.75 0.42 0.00 0.00 0.00 0.00 43.42 44.23 2k72 n LEU 25 CO 0.39 -0.10 1.00 -0.03 0.00 0.00 0.00 177.39 178.64 2k72 h MET 26 N -0.98 0.16 0.00 1.96 4.05 -1.56 1.60 114.93 120.15 2k72 h MET 26 Ca -0.14 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 2k72 h MET 26 Cb 1.11 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.88 2k72 h MET 26 CO -0.09 0.10 0.15 -0.22 0.23 0.00 0.00 176.91 177.09 2k72 h LYS 27 N 0.16 0.00 0.00 0.39 1.63 -1.53 0.77 116.57 118.00 2k72 h LYS 27 Ca 0.69 0.00 -0.38 0.00 -0.85 0.00 0.00 60.65 60.11 2k72 h LYS 27 Cb 1.58 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 33.14 2k72 h LYS 27 CO -0.71 0.00 -2.44 0.54 -3.45 0.00 0.00 179.45 173.39 2k72 n ARG 28 N -2.27 0.63 -0.02 1.90 1.74 0.54 -4.60 116.66 114.58 2k72 n ARG 28 Ca -0.01 0.15 0.01 0.00 -0.77 0.00 0.00 57.85 57.23 2k72 n ARG 28 Cb 0.18 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.14 2k72 n ARG 28 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 2k72 n LEU 29 N -3.29 1.66 -2.70 0.55 -0.00 -0.95 -4.57 117.00 107.71 2k72 n LEU 29 Ca -0.45 -1.75 -0.07 0.00 -0.00 0.00 0.00 56.01 53.74 2k72 n LEU 29 Cb 0.97 -0.04 0.12 0.00 -0.00 0.00 0.00 43.42 44.47 2k72 n LEU 29 CO 0.24 0.43 0.51 0.00 -0.00 0.00 0.00 177.39 178.57 2k72 h PRO 31 N 2.01 0.36 -0.91 0.00 0.13 -1.64 -3.36 132.00 128.59 2k72 h PRO 31 Ca -0.28 -0.62 0.18 0.00 -0.87 0.00 0.00 66.00 64.41 2k72 h PRO 31 Cb 1.30 0.23 -0.17 0.00 0.13 0.00 0.00 31.00 32.49 2k72 h PRO 31 CO -0.07 1.27 -0.25 0.54 -0.23 0.00 0.00 178.00 179.26 2k72 n ARG 32 N -3.57 -0.10 0.27 0.86 1.74 -1.26 -0.58 116.66 114.02 2k72 n ARG 32 Ca -0.16 1.42 -0.15 0.00 -0.77 0.00 0.00 57.85 58.19 2k72 n ARG 32 Cb 1.06 -2.11 -0.08 0.00 -1.02 0.00 0.00 32.46 30.31 2k72 n ARG 32 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2k72 h SER 33 N 0.00 -1.04 -0.19 0.55 0.02 -1.91 -2.57 113.55 108.42 2k72 h SER 33 Ca 0.42 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 61.37 2k72 h SER 33 Cb 0.65 0.33 -0.04 0.00 0.14 0.00 0.00 62.40 63.47 2k72 h SER 33 CO -0.93 -0.55 0.09 0.00 -1.14 0.00 0.00 176.83 174.30 2k72 n ASP 35 N 0.13 -1.96 0.11 0.00 8.00 0.26 -4.71 116.55 118.38 2k72 n ASP 35 Ca 0.11 0.22 0.20 0.00 0.71 0.00 0.00 54.79 56.03 2k72 n ASP 35 Cb 0.65 -1.96 0.74 0.00 -0.02 0.00 0.00 41.12 40.53 2k72 n ASP 35 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2k72 h PHE 36 N 0.00 0.00 0.00 1.24 -1.00 -1.60 -3.48 116.94 112.10 2k72 h PHE 36 Ca -0.14 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.64 2k72 h PHE 36 Cb 0.65 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.21 2k72 h PHE 36 CO 0.38 0.00 0.00 0.00 -1.61 0.00 0.00 178.31 177.08