#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ins s VAL 2 N 0.00 2.44 0.48 -4.37 -7.23 -1.26 -5.13 120.40 105.33 3ins s VAL 2 Ca 0.00 -2.15 -0.19 0.00 -1.81 0.00 0.00 61.98 57.82 3ins s VAL 2 Cb 0.00 -2.65 -0.09 0.00 0.56 0.00 0.00 36.38 34.20 3ins s VAL 2 CO 0.00 -0.24 0.99 0.20 -0.31 0.00 0.00 175.10 175.74 3ins s ASN 3 N -3.63 6.61 0.10 4.85 0.01 -1.26 -5.05 114.94 116.57 3ins s ASN 3 Ca 0.33 1.74 0.02 0.00 -0.71 0.00 0.00 52.86 54.24 3ins s ASN 3 Cb 0.00 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.08 3ins s ASN 3 CO 0.17 -0.60 -0.08 -1.10 -1.51 0.00 0.00 177.10 173.99 3ins s GLN 4 N -3.47 0.86 -0.23 -0.60 -1.52 -1.26 -5.12 119.66 108.32 3ins s GLN 4 Ca 0.63 -1.31 -0.01 0.00 -1.95 0.00 0.00 55.36 52.72 3ins s GLN 4 Cb -0.12 -0.31 0.02 0.00 -0.22 0.00 0.00 33.01 32.39 3ins s GLN 4 CO 0.21 0.01 -0.10 -1.58 -0.25 0.00 0.00 175.29 173.58 3ins s HIS 5 N -3.35 3.01 -0.13 0.91 5.65 -1.26 -5.08 115.29 115.04 3ins s HIS 5 Ca 0.11 -1.58 -0.00 0.00 0.25 0.00 0.00 55.06 53.83 3ins s HIS 5 Cb 0.03 -2.02 0.03 0.00 -1.18 0.00 0.00 32.58 29.44 3ins s HIS 5 CO -0.03 -0.74 -0.07 -0.51 -0.65 0.00 0.00 174.74 172.74 3ins s LEU 6 N 1.31 1.31 0.17 8.88 1.43 -1.26 -5.05 118.68 125.48 3ins s LEU 6 Ca 0.01 -0.42 0.10 0.00 -1.03 0.00 0.00 54.13 52.79 3ins s LEU 6 Cb -0.16 -0.86 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 3ins s LEU 6 CO -0.06 -0.14 -0.22 0.00 0.23 0.00 0.00 176.35 176.15 3ins n GLY 8 N 0.41 2.96 0.26 0.00 0.00 -1.26 -1.52 105.19 106.04 3ins n GLY 8 Ca -0.14 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3ins n GLY 8 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ins h SER 9 N 0.00 0.00 0.30 1.61 4.64 -2.01 -2.24 113.55 115.85 3ins h SER 9 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3ins h SER 9 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3ins h SER 9 CO 0.00 0.11 -0.20 0.45 -0.87 0.00 0.00 176.83 176.32 3ins h HIS 10 N 0.00 0.00 -0.31 4.77 -0.00 -1.66 -2.06 115.15 115.89 3ins h HIS 10 Ca -0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 60.37 60.22 3ins h HIS 10 Cb 0.30 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.70 3ins h HIS 10 CO 0.00 0.20 -0.38 1.25 -0.00 0.00 0.00 177.93 179.00 3ins h LEU 11 N 0.00 0.87 -1.05 2.43 5.85 -1.47 -2.71 115.31 119.24 3ins h LEU 11 Ca -0.00 -0.49 -0.07 0.00 0.84 0.00 0.00 57.88 58.16 3ins h LEU 11 Cb 0.40 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3ins h LEU 11 CO 0.03 1.19 -0.08 -0.37 -0.34 0.00 0.00 178.44 178.86 3ins h VAL 12 N 0.58 1.23 -0.02 1.05 -1.51 -1.47 -2.17 116.25 113.94 3ins h VAL 12 Ca 0.04 -1.00 -0.00 0.00 -1.23 0.00 0.00 66.70 64.51 3ins h VAL 12 Cb 0.97 1.05 -0.00 0.00 -2.13 0.00 0.00 31.29 31.18 3ins h VAL 12 CO 0.09 0.33 0.01 -0.33 -1.23 0.00 0.00 177.57 176.45 3ins h GLU 13 N 0.55 0.03 -0.19 5.19 4.39 -1.38 -2.24 114.58 120.93 3ins h GLU 13 Ca 0.10 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.85 3ins h GLU 13 Cb 0.47 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.07 3ins h GLU 13 CO 0.03 0.06 -0.09 0.00 -1.16 0.00 0.00 179.01 177.85 3ins h ALA 14 N 0.96 0.08 -0.60 3.43 0.00 -1.25 -1.72 119.26 120.16 3ins h ALA 14 Ca 0.01 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.03 3ins h ALA 14 Cb 0.04 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3ins h ALA 14 CO -0.00 -0.51 0.35 -0.07 0.00 0.00 0.00 179.25 179.02 3ins h LEU 15 N -0.06 0.55 -0.68 0.00 3.38 -1.35 -1.50 115.31 115.66 3ins h LEU 15 Ca 0.10 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.10 3ins h LEU 15 Cb 0.21 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 3ins h LEU 15 CO -0.23 0.38 0.45 0.22 0.09 0.00 0.00 178.44 179.34 3ins h TYR 16 N 0.68 0.84 -0.11 1.13 3.20 -1.16 0.98 116.97 122.53 3ins h TYR 16 Ca 0.25 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 3ins h TYR 16 Cb 0.08 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.06 3ins h TYR 16 CO -0.07 0.52 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.90 3ins h LEU 17 N 0.90 0.20 -0.11 2.82 3.38 -0.83 0.16 115.31 121.83 3ins h LEU 17 Ca 0.25 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3ins h LEU 17 Cb -0.08 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 3ins h LEU 17 CO -0.07 0.47 0.02 0.58 0.09 0.00 0.00 178.44 179.53 3ins h VAL 18 N -0.08 1.22 0.03 1.22 2.07 -1.24 -3.34 116.25 116.13 3ins h VAL 18 Ca 0.03 -0.70 -0.32 0.00 0.82 0.00 0.00 66.70 66.54 3ins h VAL 18 Cb 0.38 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 3ins h VAL 18 CO 0.01 0.20 -1.82 0.00 0.02 0.00 0.00 177.57 175.98 3ins n GLY 20 N 1.68 2.81 0.08 0.00 0.00 0.04 -1.45 105.19 108.36 3ins n GLY 20 Ca -0.22 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 45.63 3ins n GLY 20 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ins n GLU 21 N 14.00 0.09 0.08 1.61 2.13 -1.26 -1.17 120.64 136.12 3ins n GLU 21 Ca 0.00 0.47 -0.04 0.00 0.66 0.00 0.00 57.16 58.25 3ins n GLU 21 Cb 0.00 -1.73 0.15 0.00 0.27 0.00 0.00 31.44 30.12 3ins n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3ins h ARG 22 N 0.00 0.25 0.00 5.31 3.08 -1.66 -3.49 114.38 117.86 3ins h ARG 22 Ca 0.00 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.90 3ins h ARG 22 Cb 0.15 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3ins h ARG 22 CO 0.00 0.73 0.00 0.41 -1.07 0.00 0.00 179.97 180.04 3ins n GLY 23 N 0.13 -1.49 3.49 0.04 0.00 -0.32 -5.09 105.19 101.96 3ins n GLY 23 Ca -0.02 -1.57 -0.11 0.00 0.00 0.00 0.00 46.02 44.32 3ins n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ins s PHE 24 N -2.25 0.67 -0.08 1.61 -0.71 -1.26 -4.84 117.98 111.13 3ins s PHE 24 Ca 0.00 -0.98 0.05 0.00 -1.04 0.00 0.00 56.93 54.96 3ins s PHE 24 Cb 0.00 -0.01 -0.00 0.00 -1.21 0.00 0.00 43.02 41.80 3ins s PHE 24 CO 0.00 -0.96 -0.24 -0.06 -1.34 0.00 0.00 175.22 172.62 3ins s PHE 25 N -3.81 2.45 -0.30 3.49 0.40 -1.26 -5.10 117.98 113.84 3ins s PHE 25 Ca 0.27 -0.88 -0.03 0.00 -0.60 0.00 0.00 56.93 55.70 3ins s PHE 25 Cb 0.01 -1.62 0.04 0.00 0.51 0.00 0.00 43.02 41.96 3ins s PHE 25 CO 0.12 -0.32 0.02 -0.47 0.70 0.00 0.00 175.22 175.27 3ins s TYR 26 N 0.13 3.23 -0.42 0.36 6.14 -1.26 -5.05 117.35 120.48 3ins s TYR 26 Ca -0.12 -1.69 0.02 0.00 0.64 0.00 0.00 57.07 55.91 3ins s TYR 26 Cb -0.16 -2.14 0.14 0.00 0.42 0.00 0.00 41.96 40.21 3ins s TYR 26 CO 0.06 -0.77 0.23 0.99 0.64 0.00 0.00 175.55 176.71 3ins s THR 27 N 1.31 1.08 0.86 4.34 2.01 -1.26 -5.11 115.64 118.86 3ins s THR 27 Ca -0.04 -2.34 -0.12 0.00 0.31 0.00 0.00 61.69 59.51 3ins s THR 27 Cb -0.19 -1.76 0.11 0.00 0.01 0.00 0.00 72.50 70.66 3ins s THR 27 CO -0.00 -0.92 1.10 -2.16 -0.69 0.00 0.00 174.62 171.94 3ins s PRO 28 N 0.53 1.58 0.25 4.92 0.04 -1.26 -5.03 135.00 136.03 3ins s PRO 28 Ca 0.18 0.65 -0.21 0.00 0.04 0.00 0.00 61.00 61.66 3ins s PRO 28 Cb -0.24 -1.86 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 3ins s PRO 28 CO 0.00 -1.98 0.77 0.21 0.04 0.00 0.00 177.00 176.05 3ins s LYS 29 N -5.08 4.32 0.00 4.56 2.20 -1.26 -5.33 119.74 119.14 3ins s LYS 29 Ca 0.62 0.97 0.21 0.00 -0.36 0.00 0.00 55.97 57.41 3ins s LYS 29 Cb -0.16 -2.84 1.26 0.00 -1.51 0.00 0.00 37.83 34.58 3ins s LYS 29 CO 0.55 0.36 1.64 0.00 -0.36 0.00 0.00 175.35 177.55