#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 1.59 7.00 0.55 0.00 -1.26 -5.04 105.19 108.03 1cr8 n GLY 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1cr8 n GLY 4 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cr8 n GLY 5 N 2.80 0.75 0.00 -0.02 0.00 -1.26 -4.89 105.19 102.57 1cr8 n GLY 5 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1cr8 n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cr8 n HIS 7 N -0.90 -1.74 -1.47 0.00 8.25 -1.26 -5.06 115.22 113.05 1cr8 n HIS 7 Ca 0.00 -1.96 -0.44 0.00 -0.26 0.00 0.00 57.72 55.06 1cr8 n HIS 7 Cb 0.00 0.65 -0.10 0.00 1.12 0.00 0.00 29.99 31.66 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 -0.51 0.02 -0.97 1.59 5.66 -1.26 -0.82 114.28 117.98 1cr8 n THR 8 Ca -0.03 -0.25 -0.06 0.00 -3.05 0.00 0.00 64.05 60.67 1cr8 n THR 8 Cb 0.54 -1.30 -0.02 0.00 -1.55 0.00 0.00 70.33 68.00 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 11.31 -4.06 -4.62 1.09 5.75 -1.26 -4.79 116.55 119.96 1cr8 n ASP 9 Ca 0.52 0.14 -0.30 0.00 -0.01 0.00 0.00 54.79 55.14 1cr8 n ASP 9 Cb 0.19 -2.96 0.19 0.00 -1.03 0.00 0.00 41.12 37.51 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 -2.09 0.46 -0.11 0.11 8.01 -0.00 -4.53 118.70 120.54 1cr8 s GLU 10 Ca 0.00 1.20 -0.05 0.00 0.01 0.00 0.00 54.97 56.12 1cr8 s GLU 10 Cb 0.00 -1.69 -0.04 0.00 -4.31 0.00 0.00 34.13 28.09 1cr8 s GLU 10 CO 0.00 -2.90 0.09 0.12 0.01 0.00 0.00 175.26 172.58 1cr8 s PHE 11 N -2.64 3.43 -0.32 1.61 5.36 0.07 -4.69 117.98 120.80 1cr8 s PHE 11 Ca 0.67 0.39 -0.08 0.00 -0.96 0.00 0.00 56.93 56.94 1cr8 s PHE 11 Cb -0.23 -1.90 0.01 0.00 -0.34 0.00 0.00 43.02 40.56 1cr8 s PHE 11 CO 0.60 0.61 0.13 -1.14 -1.46 0.00 0.00 175.22 173.95 1cr8 s GLN 12 N -0.87 3.11 -0.36 10.12 0.74 -1.26 -0.76 119.66 130.39 1cr8 s GLN 12 Ca 0.14 -0.86 -0.27 0.00 0.05 0.00 0.00 55.36 54.41 1cr8 s GLN 12 Cb -0.12 -3.50 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 1cr8 s GLN 12 CO 0.03 -0.49 2.15 0.00 -0.55 0.00 0.00 175.29 176.43 1cr8 n ARG 14 N 8.80 0.14 -0.03 0.00 0.00 -1.26 -0.07 116.66 124.24 1cr8 n ARG 14 Ca 0.29 0.46 -0.03 0.00 -0.00 0.00 0.00 57.85 58.57 1cr8 n ARG 14 Cb 0.49 -1.81 0.21 0.00 0.00 0.00 0.00 32.46 31.35 1cr8 n ARG 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1cr8 h LEU 15 N 0.00 0.59 0.00 6.15 5.85 -1.97 -3.44 115.31 122.49 1cr8 h LEU 15 Ca 0.00 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1cr8 h LEU 15 Cb 0.23 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1cr8 h LEU 15 CO 0.00 0.72 0.00 -0.67 -0.34 0.00 0.00 178.44 178.15 1cr8 n ASP 16 N -4.20 0.00 0.00 1.25 -0.08 -0.57 -5.09 116.55 107.86 1cr8 n ASP 16 Ca 0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.29 1cr8 n ASP 16 Cb 0.32 0.09 0.00 0.00 2.34 0.00 0.00 41.12 43.87 1cr8 n ASP 16 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cr8 n GLY 17 N 0.03 1.11 3.81 0.27 0.00 0.90 -5.04 105.19 106.27 1cr8 n GLY 17 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 3.09 -0.22 0.99 2.34 -1.26 -4.49 118.68 119.13 1cr8 s LEU 18 Ca 0.00 1.63 -0.03 0.00 0.06 0.00 0.00 54.13 55.78 1cr8 s LEU 18 Cb 0.00 -4.47 -0.00 0.00 -0.56 0.00 0.00 46.19 41.16 1cr8 s LEU 18 CO 0.00 -1.55 -0.06 0.00 -1.06 0.00 0.00 176.35 173.68 1cr8 s ILE 20 N 1.45 1.39 -0.48 0.00 -5.25 0.06 -4.90 121.20 113.48 1cr8 s ILE 20 Ca 0.05 -1.13 -0.28 0.00 -0.99 0.00 0.00 60.65 58.30 1cr8 s ILE 20 Cb -0.14 -1.24 -0.01 0.00 2.95 0.00 0.00 42.46 44.02 1cr8 s ILE 20 CO -0.04 0.08 1.73 -2.16 -1.79 0.00 0.00 174.94 172.75 1cr8 s PRO 21 N -1.23 3.09 0.00 0.37 0.04 -1.26 -0.75 135.00 135.26 1cr8 s PRO 21 Ca 0.04 0.93 0.15 0.00 0.04 0.00 0.00 61.00 62.17 1cr8 s PRO 21 Cb -0.08 -4.24 0.67 0.00 0.04 0.00 0.00 34.50 30.88 1cr8 s PRO 21 CO 0.02 -2.17 1.49 -0.11 0.04 0.00 0.00 177.00 176.27 1cr8 n LEU 22 N 10.96 0.00 0.32 -3.56 0.00 -1.26 -0.75 117.00 122.70 1cr8 n LEU 22 Ca 0.20 0.48 0.06 0.00 0.00 0.00 0.00 56.01 56.75 1cr8 n LEU 22 Cb 0.49 -0.48 0.30 0.00 0.00 0.00 0.00 43.42 43.73 1cr8 n LEU 22 CO 0.70 -0.23 1.05 -0.09 0.00 0.00 0.00 177.39 178.82 1cr8 h ARG 23 N 0.00 0.00 -0.30 1.96 2.43 -1.90 -0.79 114.38 115.78 1cr8 h ARG 23 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1cr8 h ARG 23 Cb 0.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1cr8 h ARG 23 CO 0.00 0.00 0.00 0.91 -1.51 0.00 0.00 179.97 179.37 1cr8 n TRP 24 N -2.65 0.99 0.88 2.20 7.02 0.07 -4.61 117.44 121.33 1cr8 n TRP 24 Ca -0.00 -0.82 -0.01 0.00 -1.02 0.00 0.00 57.50 55.65 1cr8 n TRP 24 Cb 0.79 -0.30 0.01 0.00 -2.42 0.00 0.00 31.31 29.40 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 -0.28 1.12 0.00 -0.99 5.12 -0.30 -4.60 116.66 116.73 1cr8 n ARG 25 Ca 0.21 -0.17 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 1cr8 n ARG 25 Cb 0.87 -1.23 0.00 0.00 -1.16 0.00 0.00 32.46 30.93 1cr8 n ARG 25 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1cr8 n ASP 27 N 0.00 -0.37 0.00 0.00 5.75 -1.26 -5.07 116.55 115.59 1cr8 n ASP 27 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 1cr8 n ASP 27 Cb 0.00 0.67 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 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 -0.65 0.75 3.63 6.12 0.00 -1.26 -5.10 105.19 108.68 1cr8 n GLY 28 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.39 6.85 -1.26 1.61 -1.08 -1.26 -4.95 116.67 116.19 1cr8 s ASP 29 Ca 0.00 0.93 -0.18 0.00 -0.52 0.00 0.00 52.55 52.78 1cr8 s ASP 29 Cb 0.00 -2.54 0.01 0.00 -1.46 0.00 0.00 42.92 38.92 1cr8 s ASP 29 CO 0.00 -0.98 1.90 0.35 0.52 0.00 0.00 175.17 176.97 1cr8 n THR 30 N 6.11 3.21 0.26 1.71 -2.24 -1.26 -4.63 114.28 117.45 1cr8 n THR 30 Ca 0.12 -3.19 0.08 0.00 -2.27 0.00 0.00 64.05 58.79 1cr8 n THR 30 Cb 0.47 -2.37 -0.11 0.00 -2.10 0.00 0.00 70.33 66.23 1cr8 n THR 30 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1cr8 n ASP 31 N 9.03 1.17 -4.78 3.42 5.68 -1.26 -4.66 116.55 125.14 1cr8 n ASP 31 Ca 0.49 -0.32 -0.32 0.00 -0.50 0.00 0.00 54.79 54.14 1cr8 n ASP 31 Cb 0.44 1.45 0.06 0.00 -1.14 0.00 0.00 41.12 41.93 1cr8 n ASP 31 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1cr8 n MET 33 N -2.87 0.00 0.00 0.00 1.56 -1.26 -3.40 117.12 111.15 1cr8 n MET 33 Ca 0.09 0.10 0.00 0.00 -0.27 0.00 0.00 57.70 57.63 1cr8 n MET 33 Cb 0.53 -1.56 0.00 0.00 2.15 0.00 0.00 33.22 34.34 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 -0.99 0.00 0.00 6.12 -0.08 -1.26 -5.05 116.55 115.29 1cr8 n ASP 34 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1cr8 n ASP 34 Cb 0.06 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.52 1cr8 n ASP 34 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1cr8 n SER 35 N -1.69 0.00 0.00 1.67 2.88 -1.22 -4.77 113.62 110.48 1cr8 n SER 35 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 1cr8 n SER 35 Cb 0.00 0.00 0.80 0.00 -0.75 0.00 0.00 64.21 64.26 1cr8 n SER 35 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1cr8 n SER 36 N 0.00 0.00 -0.29 -3.46 2.88 -1.26 -0.45 113.62 111.04 1cr8 n SER 36 Ca 0.00 -1.09 0.10 0.00 -1.33 0.00 0.00 58.87 56.55 1cr8 n SER 36 Cb 0.00 0.00 0.25 0.00 -0.75 0.00 0.00 64.21 63.71 1cr8 n SER 36 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1cr8 h ASP 37 N 0.00 0.26 0.00 -3.46 2.03 -1.90 -3.40 116.42 109.95 1cr8 h ASP 37 Ca 0.00 0.14 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 1cr8 h ASP 37 Cb 0.00 0.13 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 1cr8 h ASP 37 CO 0.00 0.02 0.00 -1.84 -1.03 0.00 0.00 179.24 176.39 1cr8 n GLU 38 N -5.05 -0.02 0.00 4.15 0.00 0.40 -4.14 120.64 115.98 1cr8 n GLU 38 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.33 1cr8 n GLU 38 Cb 0.55 -0.49 0.00 0.00 0.00 0.00 0.00 31.44 31.50 1cr8 n GLU 38 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1cr8 n LYS 39 N -0.00 0.00 -0.60 3.44 3.00 0.06 -2.07 118.16 121.99 1cr8 n LYS 39 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.30 1cr8 n LYS 39 Cb 0.22 -0.99 -0.01 0.00 0.00 0.00 0.00 35.03 34.25 1cr8 n LYS 39 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1cr8 n SER 40 N 0.05 -0.19 -0.46 3.14 7.64 -1.26 -4.98 113.62 117.56 1cr8 n SER 40 Ca 0.00 -1.22 0.05 0.00 1.01 0.00 0.00 58.87 58.72 1cr8 n SER 40 Cb 0.00 0.06 0.06 0.00 -1.01 0.00 0.00 64.21 63.31 1cr8 n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1cr8 s GLU 42 N -0.92 4.13 0.00 0.00 2.12 -1.26 -4.86 118.70 117.90 1cr8 s GLU 42 Ca 0.14 1.71 0.00 0.00 0.36 0.00 0.00 54.97 57.18 1cr8 s GLU 42 Cb 0.09 -3.86 0.00 0.00 0.26 0.00 0.00 34.13 30.63 1cr8 s GLU 42 CO 0.14 -0.86 0.00 0.41 -0.54 0.00 0.00 175.26 174.41 1cr8 n GLY 43 N 3.94 -3.40 0.00 -1.50 0.00 -1.26 -5.22 105.19 97.75 1cr8 n GLY 43 Ca 0.15 -2.15 0.07 0.00 0.00 0.00 0.00 46.02 44.10 1cr8 n GLY 43 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70