#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 2.13 0.00 0.55 0.00 -1.26 -5.09 105.19 101.51 1cr8 n GLY 4 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.16 -2.34 0.58 -0.02 0.00 -1.26 -5.10 105.19 96.89 1cr8 n GLY 5 Ca 0.03 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1cr8 n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cr8 s HIS 7 N -0.60 0.66 -0.64 0.00 3.76 -1.26 -5.06 115.29 112.15 1cr8 s HIS 7 Ca 0.00 -1.08 -0.35 0.00 -0.15 0.00 0.00 55.06 53.47 1cr8 s HIS 7 Cb 0.00 0.31 -0.18 0.00 1.11 0.00 0.00 32.58 33.82 1cr8 s HIS 7 CO 0.00 -1.33 2.16 -2.37 -0.85 0.00 0.00 174.74 172.36 1cr8 n THR 8 N -0.55 0.00 -0.51 1.30 5.66 -1.26 -0.77 114.28 118.14 1cr8 n THR 8 Ca -0.03 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 1cr8 n THR 8 Cb 0.61 -0.46 0.00 0.00 -1.55 0.00 0.00 70.33 68.93 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 7.97 -1.54 -4.73 1.09 5.75 -1.26 -4.83 116.55 118.99 1cr8 n ASP 9 Ca 0.54 0.00 -0.32 0.00 -0.01 0.00 0.00 54.79 55.00 1cr8 n ASP 9 Cb -0.01 -2.21 0.10 0.00 -1.03 0.00 0.00 41.12 37.97 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 -1.02 2.01 -0.04 0.11 8.01 0.05 -4.54 118.70 123.28 1cr8 s GLU 10 Ca 0.00 1.45 -0.00 0.00 0.01 0.00 0.00 54.97 56.43 1cr8 s GLU 10 Cb 0.00 -1.85 -0.03 0.00 -4.31 0.00 0.00 34.13 27.94 1cr8 s GLU 10 CO 0.00 -1.87 0.00 0.12 0.01 0.00 0.00 175.26 173.53 1cr8 s PHE 11 N -2.51 3.12 -0.24 1.61 5.36 0.18 -4.40 117.98 121.10 1cr8 s PHE 11 Ca 0.67 0.14 -0.03 0.00 -0.96 0.00 0.00 56.93 56.74 1cr8 s PHE 11 Cb -0.22 -1.73 0.00 0.00 -0.34 0.00 0.00 43.02 40.74 1cr8 s PHE 11 CO 0.51 0.47 -0.04 -1.14 -1.46 0.00 0.00 175.22 173.56 1cr8 s GLN 12 N -1.24 3.18 0.29 10.12 0.74 -1.26 -0.74 119.66 130.75 1cr8 s GLN 12 Ca 0.17 -0.76 -0.30 0.00 0.05 0.00 0.00 55.36 54.52 1cr8 s GLN 12 Cb -0.11 -3.03 -0.12 0.00 1.10 0.00 0.00 33.01 30.84 1cr8 s GLN 12 CO 0.07 -0.29 1.59 0.00 -0.55 0.00 0.00 175.29 176.11 1cr8 h ARG 14 N 4.75 0.00 0.17 0.00 1.12 -1.95 -2.72 114.38 115.74 1cr8 h ARG 14 Ca -0.47 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.39 1cr8 h ARG 14 Cb 1.23 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.19 1cr8 h ARG 14 CO 0.79 0.00 -0.08 1.25 -3.11 0.00 0.00 179.97 178.82 1cr8 h LEU 15 N 0.00 -0.19 0.00 3.80 6.46 -1.96 -3.43 115.31 119.99 1cr8 h LEU 15 Ca 0.00 -0.09 -0.18 0.00 -0.12 0.00 0.00 57.88 57.48 1cr8 h LEU 15 Cb 0.78 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 1cr8 h LEU 15 CO 0.00 0.32 -1.70 -0.90 -0.62 0.00 0.00 178.44 175.54 1cr8 n ASP 16 N -4.92 3.02 0.00 1.25 5.75 -1.26 -5.05 116.55 115.34 1cr8 n ASP 16 Ca -0.04 -0.06 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 1cr8 n ASP 16 Cb 0.14 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 1cr8 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cr8 n GLY 17 N 2.88 1.33 3.74 6.12 0.00 -1.03 -5.07 105.19 113.17 1cr8 n GLY 17 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 1cr8 n GLY 17 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1cr8 s LEU 18 N 0.00 3.28 -0.16 0.99 0.20 -1.26 -4.54 118.68 117.19 1cr8 s LEU 18 Ca 0.00 2.14 0.02 0.00 0.69 0.00 0.00 54.13 56.98 1cr8 s LEU 18 Cb 0.00 -4.56 0.02 0.00 -0.43 0.00 0.00 46.19 41.21 1cr8 s LEU 18 CO 0.00 -2.06 -0.20 0.00 -0.29 0.00 0.00 176.35 173.80 1cr8 s ILE 20 N 1.12 0.80 -0.51 0.00 -5.25 0.08 -4.88 121.20 112.56 1cr8 s ILE 20 Ca 0.00 -1.03 -0.28 0.00 -0.99 0.00 0.00 60.65 58.35 1cr8 s ILE 20 Cb -0.14 -0.79 -0.00 0.00 2.95 0.00 0.00 42.46 44.48 1cr8 s ILE 20 CO -0.09 -0.21 1.62 -2.16 -1.79 0.00 0.00 174.94 172.31 1cr8 s PRO 21 N -1.38 3.15 0.51 0.37 0.04 -1.26 -0.65 135.00 135.79 1cr8 s PRO 21 Ca -0.04 0.76 0.20 0.00 0.04 0.00 0.00 61.00 61.96 1cr8 s PRO 21 Cb -0.09 -4.20 1.30 0.00 0.04 0.00 0.00 34.50 31.55 1cr8 s PRO 21 CO 0.01 -2.10 2.05 1.25 0.04 0.00 0.00 177.00 178.25 1cr8 h LEU 22 N 14.03 0.05 -0.24 -3.56 5.85 -1.88 0.64 115.31 130.20 1cr8 h LEU 22 Ca -0.28 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1cr8 h LEU 22 Cb 1.13 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1cr8 h LEU 22 CO 1.15 0.03 0.50 -2.11 -0.34 0.00 0.00 178.44 177.67 1cr8 n ARG 23 N -4.45 0.03 -0.00 1.25 0.00 -1.26 -1.01 116.66 111.21 1cr8 n ARG 23 Ca 0.05 0.38 0.00 0.00 -0.00 0.00 0.00 57.85 58.28 1cr8 n ARG 23 Cb 0.39 -2.09 0.00 0.00 -0.00 0.00 0.00 32.46 30.77 1cr8 n ARG 23 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 1cr8 n TRP 24 N -1.61 0.01 0.52 2.89 7.02 0.22 -4.72 117.44 121.76 1cr8 n TRP 24 Ca -0.00 -0.36 0.00 0.00 -1.02 0.00 0.00 57.50 56.12 1cr8 n TRP 24 Cb 0.50 -0.04 0.00 0.00 -2.42 0.00 0.00 31.31 29.36 1cr8 n TRP 24 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 1cr8 n ARG 25 N -0.33 0.52 -2.66 -0.99 1.85 -0.18 -4.10 116.66 110.77 1cr8 n ARG 25 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.82 1cr8 n ARG 25 Cb 0.19 -1.25 0.06 0.00 -1.05 0.00 0.00 32.46 30.40 1cr8 n ARG 25 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1cr8 n ASP 27 N 0.06 0.04 0.00 0.00 5.75 -1.26 -5.04 116.55 116.10 1cr8 n ASP 27 Ca -0.16 -0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.60 1cr8 n ASP 27 Cb 0.71 0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.86 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 0.07 0.53 3.28 6.12 0.00 -1.26 -5.08 105.19 108.86 1cr8 n GLY 28 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.27 0.10 -0.23 1.61 -1.08 -1.26 -5.17 116.67 108.37 1cr8 s ASP 29 Ca 0.00 -1.28 -0.00 0.00 -0.52 0.00 0.00 52.55 50.74 1cr8 s ASP 29 Cb 0.00 0.42 0.06 0.00 -1.46 0.00 0.00 42.92 41.95 1cr8 s ASP 29 CO 0.00 -0.90 -0.01 0.42 0.52 0.00 0.00 175.17 175.19 1cr8 s THR 30 N -4.13 1.20 0.05 1.71 -4.23 -1.26 -4.71 115.64 104.27 1cr8 s THR 30 Ca 0.35 -1.05 -0.09 0.00 -1.18 0.00 0.00 61.69 59.72 1cr8 s THR 30 Cb 0.05 -1.57 -0.32 0.00 1.34 0.00 0.00 72.50 72.01 1cr8 s THR 30 CO 0.11 -0.18 1.07 0.44 -0.54 0.00 0.00 174.62 175.52 1cr8 h ASP 31 N 8.04 0.61 -3.97 3.99 5.19 -1.92 -3.45 116.42 124.91 1cr8 h ASP 31 Ca -0.17 -0.66 -0.54 0.00 -0.62 0.00 0.00 57.03 55.04 1cr8 h ASP 31 Cb 1.08 -0.20 0.11 0.00 0.18 0.00 0.00 39.33 40.51 1cr8 h ASP 31 CO 0.39 1.52 0.72 0.00 -3.12 0.00 0.00 179.24 178.75 1cr8 h MET 33 N 2.54 0.00 0.00 0.00 4.05 -1.95 -3.30 114.93 116.27 1cr8 h MET 33 Ca -0.51 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.91 1cr8 h MET 33 Cb 1.26 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.06 1cr8 h MET 33 CO 0.62 0.00 0.00 -3.47 0.23 0.00 0.00 176.91 174.29 1cr8 n ASP 34 N -2.58 0.00 0.00 1.39 -0.08 -1.26 -5.03 116.55 108.98 1cr8 n ASP 34 Ca -0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 1cr8 n ASP 34 Cb 0.28 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.74 1cr8 n ASP 34 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1cr8 n SER 35 N 0.00 0.00 0.00 1.67 3.41 -1.24 -4.95 113.62 112.51 1cr8 n SER 35 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1cr8 n SER 35 Cb 0.00 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.39 1cr8 n SER 35 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1cr8 n SER 36 N 0.00 0.00 -0.27 4.04 3.41 -1.26 -1.55 113.62 117.99 1cr8 n SER 36 Ca 0.00 0.49 -0.07 0.00 -0.26 0.00 0.00 58.87 59.03 1cr8 n SER 36 Cb 0.00 -0.50 -0.06 0.00 -0.26 0.00 0.00 64.21 63.39 1cr8 n SER 36 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1cr8 n ASP 37 N -1.50 -0.68 0.00 4.04 9.92 -1.26 -4.55 116.55 122.52 1cr8 n ASP 37 Ca 0.05 1.32 0.00 0.00 -0.53 0.00 0.00 54.79 55.63 1cr8 n ASP 37 Cb 0.24 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 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 -4.54 0.00 0.02 -1.24 0.28 -0.63 -4.66 120.64 109.87 1cr8 n GLU 38 Ca 0.01 -0.20 0.01 0.00 -0.16 0.00 0.00 57.16 56.82 1cr8 n GLU 38 Cb 0.17 -0.29 0.05 0.00 1.43 0.00 0.00 31.44 32.80 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 0.01 -3.15 3.44 4.76 -0.59 -1.76 118.16 120.86 1cr8 n LYS 39 Ca 0.00 0.32 -0.21 0.00 -2.87 0.00 0.00 58.31 55.55 1cr8 n LYS 39 Cb 0.43 -1.77 -0.06 0.00 -1.84 0.00 0.00 35.03 31.79 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 -1.38 -0.68 -3.29 4.39 2.88 -1.26 -4.95 113.62 109.32 1cr8 n SER 40 Ca -0.00 -2.71 -0.25 0.00 -1.33 0.00 0.00 58.87 54.58 1cr8 n SER 40 Cb 0.23 -0.11 -0.08 0.00 -0.75 0.00 0.00 64.21 63.51 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 -1.49 3.11 0.00 0.00 1.03 -1.26 -5.02 118.70 115.06 1cr8 s GLU 42 Ca 0.36 -0.46 0.00 0.00 0.03 0.00 0.00 54.97 54.90 1cr8 s GLU 42 Cb 0.15 -2.56 0.00 0.00 -0.80 0.00 0.00 34.13 30.92 1cr8 s GLU 42 CO -0.09 -0.24 0.00 0.41 -1.33 0.00 0.00 175.26 174.01 1cr8 n GLY 43 N -2.06 -1.25 0.00 -3.83 0.00 -1.26 -5.26 105.19 91.53 1cr8 n GLY 43 Ca 0.01 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1cr8 n GLY 43 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70