#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 1.18 0.00 0.55 0.00 -1.26 -4.78 105.19 100.88 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 1.24 1.42 0.48 -0.02 0.00 -1.26 -5.11 105.19 101.94 1cr8 n GLY 5 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.06 -1.45 -1.45 0.00 8.25 -1.26 -5.05 115.22 112.20 1cr8 n HIS 7 Ca 0.00 -2.01 -0.46 0.00 -0.26 0.00 0.00 57.72 54.99 1cr8 n HIS 7 Cb 0.00 0.53 -0.10 0.00 1.12 0.00 0.00 29.99 31.53 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 -0.50 0.03 -0.91 1.59 5.66 -1.26 -0.84 114.28 118.05 1cr8 n THR 8 Ca -0.01 -0.20 -0.04 0.00 -3.05 0.00 0.00 64.05 60.75 1cr8 n THR 8 Cb 0.52 -1.17 -0.02 0.00 -1.55 0.00 0.00 70.33 68.11 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 10.75 -4.12 -4.65 1.09 5.75 -1.26 -4.78 116.55 119.32 1cr8 n ASP 9 Ca 0.53 0.10 -0.30 0.00 -0.01 0.00 0.00 54.79 55.12 1cr8 n ASP 9 Cb 0.15 -2.88 0.17 0.00 -1.03 0.00 0.00 41.12 37.53 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 -1.93 0.67 -0.05 0.11 8.01 -0.02 -4.50 118.70 121.00 1cr8 s GLU 10 Ca 0.00 1.07 0.02 0.00 0.01 0.00 0.00 54.97 56.06 1cr8 s GLU 10 Cb 0.00 -1.72 -0.03 0.00 -4.31 0.00 0.00 34.13 28.07 1cr8 s GLU 10 CO 0.00 -2.71 -0.07 0.12 0.01 0.00 0.00 175.26 172.60 1cr8 s PHE 11 N -2.72 2.91 -0.11 1.61 5.36 -0.01 -4.59 117.98 120.43 1cr8 s PHE 11 Ca 0.66 -0.00 0.03 0.00 -0.96 0.00 0.00 56.93 56.66 1cr8 s PHE 11 Cb -0.21 -1.68 -0.00 0.00 -0.34 0.00 0.00 43.02 40.79 1cr8 s PHE 11 CO 0.59 0.34 -0.23 -1.14 -1.46 0.00 0.00 175.22 173.32 1cr8 s GLN 12 N -0.98 3.08 -0.29 10.12 0.74 -1.26 -0.70 119.66 130.37 1cr8 s GLN 12 Ca 0.14 -0.86 -0.14 0.00 0.05 0.00 0.00 55.36 54.55 1cr8 s GLN 12 Cb -0.11 -2.34 -0.03 0.00 1.10 0.00 0.00 33.01 31.63 1cr8 s GLN 12 CO 0.03 0.17 0.32 0.00 -0.55 0.00 0.00 175.29 175.26 1cr8 n ARG 14 N 5.27 0.49 0.06 0.00 3.00 -1.26 -0.10 116.66 124.12 1cr8 n ARG 14 Ca -0.10 0.03 -0.01 0.00 -0.01 0.00 0.00 57.85 57.77 1cr8 n ARG 14 Cb 0.51 -1.50 0.29 0.00 0.00 0.00 0.00 32.46 31.75 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 0.36 0.00 0.55 6.46 -1.98 -3.43 115.31 117.26 1cr8 h LEU 15 Ca 0.00 -0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.66 1cr8 h LEU 15 Cb 0.17 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.00 1cr8 h LEU 15 CO 0.00 0.57 0.00 -0.67 -0.62 0.00 0.00 178.44 177.72 1cr8 n ASP 16 N -4.19 0.00 0.00 1.25 -0.08 -0.99 -5.09 116.55 107.45 1cr8 n ASP 16 Ca -0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1cr8 n ASP 16 Cb 0.34 0.07 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 -0.17 0.90 3.72 0.27 0.00 0.86 -5.06 105.19 105.71 1cr8 n GLY 17 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 2.25 -0.13 0.99 2.34 -1.26 -4.61 118.68 118.26 1cr8 s LEU 18 Ca 0.00 1.48 0.03 0.00 0.06 0.00 0.00 54.13 55.69 1cr8 s LEU 18 Cb 0.00 -3.89 0.01 0.00 -0.56 0.00 0.00 46.19 41.74 1cr8 s LEU 18 CO 0.00 -2.64 -0.22 0.00 -1.06 0.00 0.00 176.35 172.43 1cr8 s ILE 20 N 0.70 1.33 -0.52 0.00 -5.25 0.13 -4.89 121.20 112.70 1cr8 s ILE 20 Ca -0.10 -1.24 -0.28 0.00 -0.99 0.00 0.00 60.65 58.05 1cr8 s ILE 20 Cb -0.16 -1.22 -0.00 0.00 2.95 0.00 0.00 42.46 44.03 1cr8 s ILE 20 CO 0.01 -0.04 1.61 -2.16 -1.79 0.00 0.00 174.94 172.56 1cr8 s PRO 21 N -1.48 3.14 0.14 0.37 0.04 -1.26 -0.83 135.00 135.12 1cr8 s PRO 21 Ca 0.03 0.71 0.18 0.00 0.04 0.00 0.00 61.00 61.95 1cr8 s PRO 21 Cb -0.09 -4.20 0.78 0.00 0.04 0.00 0.00 34.50 31.02 1cr8 s PRO 21 CO 0.02 -2.11 1.55 -0.11 0.04 0.00 0.00 177.00 176.39 1cr8 n LEU 22 N 10.51 0.35 0.28 -3.56 0.00 -1.26 -0.88 117.00 122.43 1cr8 n LEU 22 Ca 0.17 0.60 0.10 0.00 0.00 0.00 0.00 56.01 56.88 1cr8 n LEU 22 Cb 0.49 -0.56 0.55 0.00 0.00 0.00 0.00 43.42 43.90 1cr8 n LEU 22 CO 0.70 -0.47 1.00 -0.09 0.00 0.00 0.00 177.39 178.53 1cr8 h ARG 23 N 0.00 0.00 -0.50 1.96 2.43 -1.89 -0.93 114.38 115.45 1cr8 h ARG 23 Ca 0.00 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1cr8 h ARG 23 Cb 0.26 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.72 1cr8 h ARG 23 CO 0.00 0.00 0.11 0.91 -1.51 0.00 0.00 179.97 179.48 1cr8 n TRP 24 N -2.54 1.67 0.08 2.20 7.02 -0.06 -4.59 117.44 121.23 1cr8 n TRP 24 Ca -0.01 -1.18 -0.07 0.00 -1.02 0.00 0.00 57.50 55.22 1cr8 n TRP 24 Cb 0.45 -0.53 0.11 0.00 -2.42 0.00 0.00 31.31 28.92 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 -0.48 1.87 -2.68 -0.99 1.74 -0.36 -4.60 116.66 111.15 1cr8 n ARG 25 Ca 0.33 -1.31 -0.05 0.00 -0.77 0.00 0.00 57.85 56.05 1cr8 n ARG 25 Cb 1.15 -1.60 0.08 0.00 -1.02 0.00 0.00 32.46 31.08 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 0.14 1.59 0.00 0.00 5.75 -1.26 -5.06 116.55 117.71 1cr8 n ASP 27 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.72 1cr8 n ASP 27 Cb 0.73 0.20 0.00 0.00 -1.03 0.00 0.00 41.12 41.02 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 1.17 0.65 3.10 6.12 0.00 -1.26 -5.08 105.19 109.90 1cr8 n GLY 28 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.53 0.69 -0.30 1.61 -1.08 -1.26 -5.15 116.67 108.65 1cr8 s ASP 29 Ca 0.00 -0.90 0.01 0.00 -0.52 0.00 0.00 52.55 51.14 1cr8 s ASP 29 Cb 0.00 0.14 0.09 0.00 -1.46 0.00 0.00 42.92 41.69 1cr8 s ASP 29 CO 0.00 -0.49 0.04 0.42 0.52 0.00 0.00 175.17 175.66 1cr8 s THR 30 N -3.30 1.55 0.17 1.71 -4.23 -1.26 -4.94 115.64 105.34 1cr8 s THR 30 Ca 0.04 -1.68 -0.03 0.00 -1.18 0.00 0.00 61.69 58.84 1cr8 s THR 30 Cb 0.03 -2.06 -0.11 0.00 1.34 0.00 0.00 72.50 71.70 1cr8 s THR 30 CO -0.06 -0.49 1.42 0.44 -0.54 0.00 0.00 174.62 175.39 1cr8 h ASP 31 N 7.88 0.54 -4.20 3.99 5.19 -1.96 -3.45 116.42 124.41 1cr8 h ASP 31 Ca -0.11 -0.35 -0.53 0.00 -0.62 0.00 0.00 57.03 55.42 1cr8 h ASP 31 Cb 1.03 -0.16 0.16 0.00 0.18 0.00 0.00 39.33 40.54 1cr8 h ASP 31 CO 0.47 1.10 0.36 0.00 -3.12 0.00 0.00 179.24 178.05 1cr8 n MET 33 N -2.97 0.00 0.01 0.00 1.56 -1.26 -3.94 117.12 110.51 1cr8 n MET 33 Ca 0.13 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.56 1cr8 n MET 33 Cb 0.51 -1.41 0.00 0.00 2.15 0.00 0.00 33.22 34.46 1cr8 n MET 33 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 1cr8 n ASP 34 N -0.80 -0.01 0.00 6.12 5.68 -1.26 -5.07 116.55 121.21 1cr8 n ASP 34 Ca 0.00 0.04 0.00 0.00 -0.50 0.00 0.00 54.79 54.33 1cr8 n ASP 34 Cb 0.00 0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 1cr8 n ASP 34 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1cr8 n SER 35 N -2.57 0.00 0.00 -1.12 3.41 -1.25 -5.03 113.62 107.05 1cr8 n SER 35 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 1cr8 n SER 35 Cb 0.00 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.34 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 0.00 -0.36 4.04 7.64 -1.26 -0.49 113.62 123.18 1cr8 n SER 36 Ca 0.00 0.16 -0.01 0.00 1.01 0.00 0.00 58.87 60.03 1cr8 n SER 36 Cb 0.00 -0.34 0.04 0.00 -1.01 0.00 0.00 64.21 62.91 1cr8 n SER 36 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1cr8 h ASP 37 N 0.00 -1.38 0.00 6.43 5.19 -1.93 -3.41 116.42 121.32 1cr8 h ASP 37 Ca 0.00 0.30 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 1cr8 h ASP 37 Cb 0.18 0.73 0.00 0.00 0.18 0.00 0.00 39.33 40.42 1cr8 h ASP 37 CO 0.00 -0.29 0.00 -1.84 -3.12 0.00 0.00 179.24 173.99 1cr8 n GLU 38 N -5.48 0.00 0.00 3.56 0.28 0.35 -4.47 120.64 114.89 1cr8 n GLU 38 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.10 1cr8 n GLU 38 Cb 0.40 -0.25 0.00 0.00 1.43 0.00 0.00 31.44 33.02 1cr8 n GLU 38 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1cr8 n LYS 39 N 0.00 0.00 -0.53 3.44 0.00 -0.32 -1.11 118.16 119.64 1cr8 n LYS 39 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.31 58.31 1cr8 n LYS 39 Cb 0.24 -0.99 -0.00 0.00 0.00 0.00 0.00 35.03 34.28 1cr8 n LYS 39 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1cr8 n SER 40 N -0.35 -0.01 -3.20 3.14 2.88 -1.26 -5.00 113.62 109.81 1cr8 n SER 40 Ca 0.00 -1.44 -0.25 0.00 -1.33 0.00 0.00 58.87 55.85 1cr8 n SER 40 Cb 0.00 -0.08 -0.06 0.00 -0.75 0.00 0.00 64.21 63.33 1cr8 n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1cr8 s GLU 42 N -2.54 0.33 -0.13 0.00 4.04 -1.26 -4.89 118.70 114.25 1cr8 s GLU 42 Ca 0.42 0.57 -0.30 0.00 0.04 0.00 0.00 54.97 55.69 1cr8 s GLU 42 Cb 0.22 -1.72 0.12 0.00 0.02 0.00 0.00 34.13 32.77 1cr8 s GLU 42 CO -0.08 -2.81 0.94 0.20 -1.84 0.00 0.00 175.26 171.67 1cr8 s GLY 43 N -3.36 -0.33 0.00 -3.83 0.00 -1.26 -5.17 107.32 93.37 1cr8 s GLY 43 Ca 0.66 1.82 0.00 0.00 0.00 0.00 0.00 44.72 47.19 1cr8 s GLY 43 CO 0.58 0.94 0.00 -0.62 0.00 0.00 0.00 173.10 174.00