#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cr8 n GLY 4 N 0.00 0.76 3.59 0.55 0.00 -1.26 -4.72 105.19 104.11 1cr8 n GLY 4 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1cr8 n GLY 4 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cr8 s GLY 5 N -0.49 -0.33 0.00 -0.02 0.00 -1.26 -4.97 107.32 100.25 1cr8 s GLY 5 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 44.72 46.07 1cr8 s GLY 5 CO 0.00 0.43 0.00 0.00 0.00 0.00 0.00 173.10 173.53 1cr8 n HIS 7 N -2.27 -1.09 -1.48 0.00 8.25 -1.26 -5.05 115.22 112.32 1cr8 n HIS 7 Ca 0.00 -1.30 -0.42 0.00 -0.26 0.00 0.00 57.72 55.73 1cr8 n HIS 7 Cb 0.00 0.34 -0.12 0.00 1.12 0.00 0.00 29.99 31.32 1cr8 n HIS 7 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1cr8 n THR 8 N -0.33 -0.01 -0.77 1.59 5.66 -1.26 -0.78 114.28 118.39 1cr8 n THR 8 Ca -0.00 -0.14 -0.03 0.00 -3.05 0.00 0.00 64.05 60.83 1cr8 n THR 8 Cb 0.33 -0.92 -0.01 0.00 -1.55 0.00 0.00 70.33 68.18 1cr8 n THR 8 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1cr8 n ASP 9 N 11.09 -3.53 -4.73 1.09 5.75 -1.26 -4.81 116.55 120.15 1cr8 n ASP 9 Ca 0.59 0.07 -0.31 0.00 -0.01 0.00 0.00 54.79 55.13 1cr8 n ASP 9 Cb 0.12 -2.48 0.12 0.00 -1.03 0.00 0.00 41.12 37.85 1cr8 n ASP 9 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1cr8 s GLU 10 N -1.61 1.70 -0.12 0.11 8.01 0.04 -4.51 118.70 122.32 1cr8 s GLU 10 Ca 0.00 1.34 -0.05 0.00 0.01 0.00 0.00 54.97 56.27 1cr8 s GLU 10 Cb 0.00 -1.82 -0.04 0.00 -4.31 0.00 0.00 34.13 27.96 1cr8 s GLU 10 CO 0.00 -2.09 0.06 0.12 0.01 0.00 0.00 175.26 173.37 1cr8 s PHE 11 N -2.79 3.33 -0.16 1.61 5.36 -0.02 -4.34 117.98 120.98 1cr8 s PHE 11 Ca 0.64 0.28 -0.03 0.00 -0.96 0.00 0.00 56.93 56.86 1cr8 s PHE 11 Cb -0.20 -1.91 -0.02 0.00 -0.34 0.00 0.00 43.02 40.55 1cr8 s PHE 11 CO 0.57 0.49 -0.05 -1.14 -1.46 0.00 0.00 175.22 173.63 1cr8 s GLN 12 N -0.65 3.59 0.88 10.12 0.74 -1.26 -0.82 119.66 132.26 1cr8 s GLN 12 Ca 0.12 -0.56 -0.13 0.00 0.05 0.00 0.00 55.36 54.83 1cr8 s GLN 12 Cb -0.12 -2.89 0.13 0.00 1.10 0.00 0.00 33.01 31.23 1cr8 s GLN 12 CO 0.02 0.17 1.21 0.00 -0.55 0.00 0.00 175.29 176.15 1cr8 n ARG 14 N -3.57 2.19 -0.10 0.00 1.85 -1.26 -3.97 116.66 111.81 1cr8 n ARG 14 Ca 0.10 -0.03 -0.12 0.00 -1.00 0.00 0.00 57.85 56.81 1cr8 n ARG 14 Cb 0.60 -1.16 0.01 0.00 -1.05 0.00 0.00 32.46 30.87 1cr8 n ARG 14 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 1cr8 h LEU 15 N 0.00 0.91 0.00 2.89 7.12 -1.96 -3.44 115.31 120.83 1cr8 h LEU 15 Ca 0.00 -0.41 0.00 0.00 0.13 0.00 0.00 57.88 57.60 1cr8 h LEU 15 Cb 0.37 -0.26 0.00 0.00 -0.53 0.00 0.00 40.66 40.25 1cr8 h LEU 15 CO 0.00 1.18 0.00 -0.67 -0.13 0.00 0.00 178.44 178.82 1cr8 n ASP 16 N -4.06 0.00 0.00 1.25 2.03 -1.26 -5.10 116.55 109.41 1cr8 n ASP 16 Ca -0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1cr8 n ASP 16 Cb 0.53 0.07 0.00 0.00 -0.72 0.00 0.00 41.12 41.00 1cr8 n ASP 16 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cr8 n GLY 17 N 0.91 -0.22 3.79 0.27 0.00 -1.25 -5.03 105.19 103.65 1cr8 n GLY 17 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1cr8 n GLY 17 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1cr8 s LEU 18 N 0.00 3.21 -0.20 0.99 2.34 -1.26 -4.58 118.68 119.18 1cr8 s LEU 18 Ca 0.00 1.80 -0.04 0.00 0.06 0.00 0.00 54.13 55.95 1cr8 s LEU 18 Cb 0.00 -4.52 -0.01 0.00 -0.56 0.00 0.00 46.19 41.09 1cr8 s LEU 18 CO 0.00 -1.64 -0.04 0.00 -1.06 0.00 0.00 176.35 173.61 1cr8 s ILE 20 N 1.20 1.00 -0.67 0.00 -5.25 0.00 -4.89 121.20 112.60 1cr8 s ILE 20 Ca 0.03 -1.26 -0.27 0.00 -0.99 0.00 0.00 60.65 58.16 1cr8 s ILE 20 Cb -0.14 -0.98 0.01 0.00 2.95 0.00 0.00 42.46 44.30 1cr8 s ILE 20 CO -0.01 -0.25 1.47 -2.16 -1.79 0.00 0.00 174.94 172.20 1cr8 s PRO 21 N -1.70 3.05 0.45 0.37 0.04 -1.26 -0.84 135.00 135.10 1cr8 s PRO 21 Ca -0.04 0.14 0.31 0.00 0.04 0.00 0.00 61.00 61.46 1cr8 s PRO 21 Cb -0.10 -4.23 1.30 0.00 0.04 0.00 0.00 34.50 31.51 1cr8 s PRO 21 CO 0.02 -2.28 1.91 1.25 0.04 0.00 0.00 177.00 177.94 1cr8 h LEU 22 N 14.03 0.00 -1.18 -3.56 6.46 -1.87 -0.18 115.31 129.00 1cr8 h LEU 22 Ca -0.27 0.00 0.18 0.00 -0.12 0.00 0.00 57.88 57.67 1cr8 h LEU 22 Cb 1.09 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.00 1cr8 h LEU 22 CO 1.24 0.00 0.93 0.03 -0.62 0.00 0.00 178.44 180.02 1cr8 h ARG 23 N 0.00 0.00 -0.48 1.25 -0.00 -1.89 -1.00 114.38 112.27 1cr8 h ARG 23 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1cr8 h ARG 23 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.39 1cr8 h ARG 23 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 179.97 180.88 1cr8 n TRP 24 N -3.20 0.65 -0.88 3.04 7.02 -0.08 -4.61 117.44 119.37 1cr8 n TRP 24 Ca 0.14 -0.51 -0.11 0.00 -1.02 0.00 0.00 57.50 56.00 1cr8 n TRP 24 Cb 1.14 -0.02 -0.06 0.00 -2.42 0.00 0.00 31.31 29.94 1cr8 n TRP 24 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1cr8 n ARG 25 N 0.88 1.68 -0.23 -0.99 1.74 -0.38 -3.99 116.66 115.37 1cr8 n ARG 25 Ca 0.16 -0.97 -0.00 0.00 -0.77 0.00 0.00 57.85 56.27 1cr8 n ARG 25 Cb 0.50 -1.61 -0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1cr8 n ARG 25 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1cr8 n ASP 27 N 0.00 0.60 0.00 0.00 5.75 -1.26 -4.98 116.55 116.67 1cr8 n ASP 27 Ca -0.01 -0.13 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 1cr8 n ASP 27 Cb 0.17 0.81 0.00 0.00 -1.03 0.00 0.00 41.12 41.07 1cr8 n ASP 27 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cr8 n GLY 28 N 1.34 0.62 3.25 6.12 0.00 -1.26 -5.08 105.19 110.18 1cr8 n GLY 28 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1cr8 n GLY 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1cr8 s ASP 29 N -1.94 0.76 -0.30 1.61 -1.08 -1.26 -5.16 116.67 109.29 1cr8 s ASP 29 Ca 0.00 -1.53 0.02 0.00 -0.52 0.00 0.00 52.55 50.53 1cr8 s ASP 29 Cb 0.00 0.46 0.09 0.00 -1.46 0.00 0.00 42.92 42.01 1cr8 s ASP 29 CO 0.00 -0.95 0.01 0.42 0.52 0.00 0.00 175.17 175.18 1cr8 s THR 30 N -3.85 1.84 0.12 1.71 -4.23 -1.26 -4.76 115.64 105.21 1cr8 s THR 30 Ca 0.39 -1.82 -0.13 0.00 -1.18 0.00 0.00 61.69 58.95 1cr8 s THR 30 Cb 0.05 -2.24 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 1cr8 s THR 30 CO 0.18 -0.42 1.49 0.44 -0.54 0.00 0.00 174.62 175.77 1cr8 h ASP 31 N 7.80 0.81 -4.20 3.99 5.19 -1.95 -3.45 116.42 124.61 1cr8 h ASP 31 Ca -0.11 -0.41 -0.53 0.00 -0.62 0.00 0.00 57.03 55.36 1cr8 h ASP 31 Cb 1.03 -0.23 0.15 0.00 0.18 0.00 0.00 39.33 40.47 1cr8 h ASP 31 CO 0.48 1.05 0.36 0.00 -3.12 0.00 0.00 179.24 178.01 1cr8 n MET 33 N -2.92 0.00 0.00 0.00 1.56 -1.26 -4.17 117.12 110.33 1cr8 n MET 33 Ca 0.12 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.55 1cr8 n MET 33 Cb 0.51 -0.96 0.00 0.00 2.15 0.00 0.00 33.22 34.92 1cr8 n MET 33 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1cr8 n ASP 34 N -0.14 0.00 0.00 6.12 2.03 -1.26 -4.99 116.55 118.30 1cr8 n ASP 34 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1cr8 n ASP 34 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1cr8 n ASP 34 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1cr8 n SER 35 N 0.00 0.00 -0.40 1.67 3.41 -1.26 -4.99 113.62 112.05 1cr8 n SER 35 Ca 0.00 -0.05 0.14 0.00 -0.26 0.00 0.00 58.87 58.70 1cr8 n SER 35 Cb 0.00 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 64.47 1cr8 n SER 35 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1cr8 n SER 36 N 0.00 1.31 -0.03 4.04 7.64 -1.26 -1.35 113.62 123.97 1cr8 n SER 36 Ca 0.00 -1.33 -0.01 0.00 1.01 0.00 0.00 58.87 58.54 1cr8 n SER 36 Cb 0.01 0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.23 1cr8 n SER 36 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1cr8 n ASP 37 N -0.07 -0.08 0.00 6.43 9.92 -1.26 -4.69 116.55 126.81 1cr8 n ASP 37 Ca 0.18 0.86 0.00 0.00 -0.53 0.00 0.00 54.79 55.29 1cr8 n ASP 37 Cb 0.34 -0.38 0.00 0.00 -0.64 0.00 0.00 41.12 40.44 1cr8 n ASP 37 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1cr8 n GLU 38 N -3.00 0.00 0.00 -1.24 0.28 -0.45 -4.65 120.64 111.57 1cr8 n GLU 38 Ca 0.00 -0.20 0.00 0.00 -0.16 0.00 0.00 57.16 56.80 1cr8 n GLU 38 Cb 0.02 -0.39 0.00 0.00 1.43 0.00 0.00 31.44 32.50 1cr8 n GLU 38 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1cr8 n LYS 39 N 0.00 0.00 -0.02 3.44 4.76 -0.51 -1.45 118.16 124.37 1cr8 n LYS 39 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1cr8 n LYS 39 Cb 0.38 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.19 1cr8 n LYS 39 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1cr8 n SER 40 N -0.65 0.00 -2.31 4.39 2.88 -1.26 -4.97 113.62 111.71 1cr8 n SER 40 Ca 0.00 -1.03 -0.23 0.00 -1.33 0.00 0.00 58.87 56.28 1cr8 n SER 40 Cb 0.00 -0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 1cr8 n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1cr8 n GLU 42 N 1.01 -1.95 -3.65 0.00 4.07 -1.26 -5.00 120.64 113.86 1cr8 n GLU 42 Ca 0.44 1.54 -0.04 0.00 -0.06 0.00 0.00 57.16 59.04 1cr8 n GLU 42 Cb 0.60 -3.55 0.02 0.00 -0.06 0.00 0.00 31.44 28.46 1cr8 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1cr8 n GLY 43 N -0.60 0.78 1.70 8.31 0.00 -1.26 -5.18 105.19 108.93 1cr8 n GLY 43 Ca -0.05 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1cr8 n GLY 43 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87