#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kxa h LEU 2 N 0.00 -0.14 -0.17 0.99 5.85 -1.88 -1.54 115.31 118.42 2kxa h LEU 2 Ca 0.00 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 2kxa h LEU 2 Cb 0.00 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2kxa h LEU 2 CO 0.00 0.18 0.07 -0.26 -0.34 0.00 0.00 178.44 178.09 2kxa h PHE 3 N -0.46 0.26 -0.60 1.25 0.04 -2.00 -2.13 116.94 113.30 2kxa h PHE 3 Ca -0.02 -0.02 0.07 0.00 2.80 0.00 0.00 57.97 60.81 2kxa h PHE 3 Cb 0.38 -0.08 -0.04 0.00 2.20 0.00 0.00 35.95 38.41 2kxa h PHE 3 CO 0.02 0.32 0.40 0.78 -0.60 0.00 0.00 178.31 179.23 2kxa h GLY 4 N 0.13 0.68 0.74 -1.45 0.00 -1.80 -1.26 103.07 100.11 2kxa h GLY 4 Ca 0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 2kxa h GLY 4 CO -0.00 0.15 -0.03 0.00 0.00 0.00 0.00 176.54 176.66 2kxa h ALA 5 N 1.68 0.17 0.29 3.60 0.00 -0.90 0.36 119.26 124.48 2kxa h ALA 5 Ca 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2kxa h ALA 5 Cb 0.37 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2kxa h ALA 5 CO -0.08 -0.09 -0.16 0.82 0.00 0.00 0.00 179.25 179.74 2kxa h ILE 6 N -0.07 0.67 -0.57 0.00 2.04 -0.73 0.35 117.51 119.20 2kxa h ILE 6 Ca 0.03 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 2kxa h ILE 6 Cb 0.44 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 2kxa h ILE 6 CO 0.01 0.00 0.07 0.00 0.00 0.00 0.00 178.15 178.23 2kxa h ALA 7 N 0.28 0.76 -0.42 1.87 0.00 -1.29 -2.28 119.26 118.17 2kxa h ALA 7 Ca -0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2kxa h ALA 7 Cb 0.34 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2kxa h ALA 7 CO 0.05 0.52 0.10 0.78 0.00 0.00 0.00 179.25 180.70 2kxa h GLY 8 N 0.85 0.67 0.95 0.00 0.00 -0.07 -1.97 103.07 103.50 2kxa h GLY 8 Ca 0.17 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 2kxa h GLY 8 CO 0.02 0.34 0.05 -2.75 0.00 0.00 0.00 176.54 174.20 2kxa h PHE 9 N 0.61 0.77 0.00 5.60 3.57 0.06 0.81 116.94 128.36 2kxa h PHE 9 Ca 0.14 -0.11 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 2kxa h PHE 9 Cb 0.24 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 2kxa h PHE 9 CO 0.01 0.75 -0.23 0.82 -2.23 0.00 0.00 178.31 177.43 2kxa h ILE 10 N 0.57 0.85 0.01 1.41 2.04 -0.99 0.43 117.51 121.84 2kxa h ILE 10 Ca 0.13 -0.87 -0.30 0.00 1.00 0.00 0.00 64.86 64.81 2kxa h ILE 10 Cb 0.40 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 2kxa h ILE 10 CO 0.01 0.22 -1.67 -0.62 0.00 0.00 0.00 178.15 176.10 2kxa n GLU 11 N -3.82 0.59 -0.95 2.37 1.02 -0.78 -4.54 120.64 114.52 2kxa n GLU 11 Ca -0.02 0.47 -0.07 0.00 -0.02 0.00 0.00 57.16 57.52 2kxa n GLU 11 Cb 0.32 -1.68 0.18 0.00 -0.02 0.00 0.00 31.44 30.24 2kxa n GLU 11 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kxa n GLY 12 N 1.44 5.11 7.00 0.62 0.00 0.28 -5.00 105.19 114.64 2kxa n GLY 12 Ca -0.38 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.22 2kxa n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kxa n GLY 13 N -1.08 1.23 0.32 -0.02 0.00 0.15 0.18 105.19 105.97 2kxa n GLY 13 Ca 0.35 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 2kxa n GLY 13 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2kxa h TRP 14 N 0.00 -1.01 -1.19 1.61 2.91 -1.91 -0.21 115.95 116.15 2kxa h TRP 14 Ca 0.00 0.03 0.34 0.00 1.13 0.00 0.00 58.89 60.38 2kxa h TRP 14 Cb 0.00 0.43 -0.07 0.00 -0.51 0.00 0.00 29.16 29.00 2kxa h TRP 14 CO 0.00 -0.39 0.82 1.15 -1.03 0.00 0.00 178.44 178.98 2kxa h THR 15 N -0.50 0.40 -0.25 2.65 2.02 -1.89 0.76 112.91 116.10 2kxa h THR 15 Ca -0.00 -0.05 -0.16 0.00 0.77 0.00 0.00 66.41 66.97 2kxa h THR 15 Cb 0.50 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2kxa h THR 15 CO -0.19 0.03 -0.49 1.23 0.37 0.00 0.00 175.52 176.47 2kxa h GLY 16 N 0.14 0.74 0.71 2.16 0.00 0.34 -2.75 103.07 104.41 2kxa h GLY 16 Ca 0.62 -0.81 0.04 0.00 0.00 0.00 0.00 47.33 47.18 2kxa h GLY 16 CO -0.15 0.73 0.15 1.98 0.00 0.00 0.00 176.54 179.25 2kxa h MET 17 N 0.53 0.31 0.17 4.80 -1.53 0.22 -1.12 114.93 118.32 2kxa h MET 17 Ca 0.03 -0.02 -0.01 0.00 -3.44 0.00 0.00 59.70 56.26 2kxa h MET 17 Cb 1.04 -0.07 0.00 0.00 -0.55 0.00 0.00 31.60 32.02 2kxa h MET 17 CO 0.10 0.20 -0.08 0.82 0.14 0.00 0.00 176.91 178.09 2kxa h ILE 18 N 0.32 0.88 -0.63 1.77 2.04 -1.46 -0.64 117.51 119.78 2kxa h ILE 18 Ca 0.17 -0.23 0.13 0.00 1.00 0.00 0.00 64.86 65.93 2kxa h ILE 18 Cb 0.13 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 37.13 2kxa h ILE 18 CO -0.16 0.05 0.10 -0.78 0.00 0.00 0.00 178.15 177.36 2kxa h ASP 19 N -0.34 -0.09 -0.06 1.72 1.82 -1.22 0.64 116.42 118.90 2kxa h ASP 19 Ca -0.02 0.13 -0.09 0.00 -0.39 0.00 0.00 57.03 56.66 2kxa h ASP 19 Cb 0.27 0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.46 2kxa h ASP 19 CO 0.04 -0.04 -0.24 1.23 -1.61 0.00 0.00 179.24 178.61 2kxa h GLY 20 N 0.21 0.51 0.96 -0.78 0.00 -1.05 0.45 103.07 103.37 2kxa h GLY 20 Ca 0.34 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 2kxa h GLY 20 CO -0.47 0.38 -0.15 -0.25 0.00 0.00 0.00 176.54 176.05 2kxa h TRP 21 N 0.42 -0.40 -0.00 5.60 2.91 0.69 -1.42 115.95 123.76 2kxa h TRP 21 Ca 0.06 -0.01 -0.19 0.00 1.13 0.00 0.00 58.89 59.89 2kxa h TRP 21 Cb 0.65 0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 29.42 2kxa h TRP 21 CO 0.02 -0.21 -0.84 1.88 -1.03 0.00 0.00 178.44 178.25 2kxa h TYR 22 N -0.48 0.25 0.00 2.65 0.05 -1.18 -3.34 116.97 114.92 2kxa h TYR 22 Ca -0.04 -0.13 0.00 0.00 0.05 0.00 0.00 58.73 58.60 2kxa h TYR 22 Cb 0.36 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.07 2kxa h TYR 22 CO -0.04 0.93 0.00 0.41 -1.05 0.00 0.00 178.16 178.41 2kxa n GLY 23 N 0.81 1.71 0.00 3.88 0.00 0.16 -4.87 105.19 106.88 2kxa n GLY 23 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2kxa n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76