#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 -0.20 -0.30 0.99 5.85 -1.89 -1.78 115.31 117.98 2kxa h LEU 2 Ca 0.00 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 2kxa h LEU 2 Cb 0.00 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2kxa h LEU 2 CO 0.00 0.06 0.04 -0.26 -0.34 0.00 0.00 178.44 177.95 2kxa h PHE 3 N -0.46 0.54 -0.60 1.25 0.04 -2.00 -2.32 116.94 113.39 2kxa h PHE 3 Ca -0.02 -0.08 0.13 0.00 2.80 0.00 0.00 57.97 60.80 2kxa h PHE 3 Cb 0.36 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 2kxa h PHE 3 CO 0.00 0.60 0.41 0.78 -0.60 0.00 0.00 178.31 179.50 2kxa h GLY 4 N 0.32 0.41 0.67 -1.45 0.00 -1.79 -0.35 103.07 100.89 2kxa h GLY 4 Ca 0.09 -0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 2kxa h GLY 4 CO 0.01 0.05 -0.17 0.00 0.00 0.00 0.00 176.54 176.43 2kxa h ALA 5 N 1.70 0.15 0.27 3.60 0.00 -0.90 0.26 119.26 124.36 2kxa h ALA 5 Ca 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2kxa h ALA 5 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2kxa h ALA 5 CO -0.06 0.07 -0.13 0.82 0.00 0.00 0.00 179.25 179.95 2kxa h ILE 6 N -0.15 0.74 -0.46 0.00 2.04 -0.73 0.65 117.51 119.60 2kxa h ILE 6 Ca 0.01 -0.04 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 2kxa h ILE 6 Cb 0.75 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 2kxa h ILE 6 CO 0.04 0.01 -0.01 0.00 0.00 0.00 0.00 178.15 178.18 2kxa h ALA 7 N 0.35 0.62 -0.36 1.87 0.00 -1.19 -2.23 119.26 118.32 2kxa h ALA 7 Ca -0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 2kxa h ALA 7 Cb 0.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2kxa h ALA 7 CO 0.06 0.43 0.01 0.78 0.00 0.00 0.00 179.25 180.53 2kxa h GLY 8 N 0.66 0.59 0.91 0.00 0.00 -0.33 -1.93 103.07 102.98 2kxa h GLY 8 Ca 0.13 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 2kxa h GLY 8 CO 0.03 0.33 0.10 -2.75 0.00 0.00 0.00 176.54 174.24 2kxa h PHE 9 N 0.53 0.53 0.00 5.60 3.57 0.64 0.69 116.94 128.50 2kxa h PHE 9 Ca 0.12 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 2kxa h PHE 9 Cb 0.32 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2kxa h PHE 9 CO 0.01 0.54 -0.27 0.82 -2.23 0.00 0.00 178.31 177.18 2kxa h ILE 10 N 0.37 0.93 0.04 1.41 2.04 -1.07 0.53 117.51 121.76 2kxa h ILE 10 Ca 0.10 -1.01 -0.27 0.00 1.00 0.00 0.00 64.86 64.69 2kxa h ILE 10 Cb 0.26 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2kxa h ILE 10 CO -0.00 0.26 -1.45 -0.33 0.00 0.00 0.00 178.15 176.63 2kxa h GLU 11 N 0.00 0.09 -0.25 2.37 3.07 -0.98 -3.40 114.58 115.49 2kxa h GLU 11 Ca -0.00 -0.16 -0.12 0.00 -0.50 0.00 0.00 59.36 58.58 2kxa h GLU 11 Cb 0.57 0.06 -0.07 0.00 -0.84 0.00 0.00 28.75 28.46 2kxa h GLU 11 CO 0.03 1.08 -0.19 0.41 -1.40 0.00 0.00 179.01 178.94 2kxa n GLY 12 N 1.61 4.93 7.00 -3.84 0.00 0.24 -5.00 105.19 110.13 2kxa n GLY 12 Ca -0.31 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.11 1.21 0.42 -0.02 0.00 0.18 0.15 105.19 106.03 2kxa n GLY 13 Ca 0.29 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.37 -1.04 1.61 2.91 -1.91 0.12 115.95 116.26 2kxa h TRP 14 Ca 0.00 0.04 0.28 0.00 1.13 0.00 0.00 58.89 60.34 2kxa h TRP 14 Cb 0.00 0.59 -0.07 0.00 -0.51 0.00 0.00 29.16 29.17 2kxa h TRP 14 CO 0.00 -0.51 0.71 1.15 -1.03 0.00 0.00 178.44 178.75 2kxa h THR 15 N -0.62 0.51 -0.30 2.65 2.02 -1.89 0.54 112.91 115.82 2kxa h THR 15 Ca 0.00 -0.08 -0.14 0.00 0.77 0.00 0.00 66.41 66.97 2kxa h THR 15 Cb 0.65 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 2kxa h THR 15 CO -0.29 0.04 -0.38 1.23 0.37 0.00 0.00 175.52 176.49 2kxa h GLY 16 N 0.23 0.76 0.82 2.16 0.00 0.32 -2.71 103.07 104.65 2kxa h GLY 16 Ca 0.55 -0.75 0.03 0.00 0.00 0.00 0.00 47.33 47.16 2kxa h GLY 16 CO -0.17 0.68 0.18 1.98 0.00 0.00 0.00 176.54 179.21 2kxa h MET 17 N 0.58 0.36 0.03 4.80 -1.53 0.17 -1.30 114.93 118.04 2kxa h MET 17 Ca 0.05 -0.02 -0.00 0.00 -3.44 0.00 0.00 59.70 56.29 2kxa h MET 17 Cb 0.91 -0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.88 2kxa h MET 17 CO 0.08 0.24 -0.01 0.82 0.14 0.00 0.00 176.91 178.18 2kxa h ILE 18 N 0.37 1.05 -0.79 1.77 2.04 -1.43 -0.19 117.51 120.34 2kxa h ILE 18 Ca 0.16 -0.24 0.12 0.00 1.00 0.00 0.00 64.86 65.90 2kxa h ILE 18 Cb 0.07 1.21 -0.08 0.00 -0.74 0.00 0.00 36.82 37.27 2kxa h ILE 18 CO -0.11 0.06 0.39 -0.78 0.00 0.00 0.00 178.15 177.71 2kxa h ASP 19 N -0.14 0.49 0.17 1.72 3.58 -1.25 0.58 116.42 121.58 2kxa h ASP 19 Ca -0.00 0.08 -0.13 0.00 0.42 0.00 0.00 57.03 57.39 2kxa h ASP 19 Cb 0.13 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 2kxa h ASP 19 CO 0.01 0.24 -0.49 1.23 -2.88 0.00 0.00 179.24 177.35 2kxa h GLY 20 N 0.61 0.40 0.93 -0.78 0.00 -1.01 -1.22 103.07 102.01 2kxa h GLY 20 Ca 0.41 -0.43 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 2kxa h GLY 20 CO -0.32 0.39 -0.00 -0.25 0.00 0.00 0.00 176.54 176.36 2kxa h TRP 21 N 0.29 0.73 0.00 5.60 2.91 0.64 -1.78 115.95 124.33 2kxa h TRP 21 Ca 0.01 -0.13 -0.07 0.00 1.13 0.00 0.00 58.89 59.84 2kxa h TRP 21 Cb 0.97 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 29.42 2kxa h TRP 21 CO 0.03 0.76 -0.31 1.88 -1.03 0.00 0.00 178.44 179.76 2kxa h TYR 22 N 0.49 0.00 -0.06 2.65 -1.99 -0.91 -3.40 116.97 113.75 2kxa h TYR 22 Ca 0.11 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.75 2kxa h TYR 22 Cb 0.47 0.00 0.02 0.00 2.00 0.00 0.00 36.73 39.22 2kxa h TYR 22 CO 0.04 0.31 0.24 0.41 -0.00 0.00 0.00 178.16 179.16 2kxa n GLY 23 N 0.42 -0.31 0.00 3.88 0.00 -0.47 -4.93 105.19 103.78 2kxa n GLY 23 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2kxa n GLY 23 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06