#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jca n VAL 2 N 0.00 3.18 -0.23 -2.13 3.14 -1.26 -4.93 118.33 116.10 1jca n VAL 2 Ca 0.00 -0.50 -0.03 0.00 -2.96 0.00 0.00 64.34 60.85 1jca n VAL 2 Cb 0.00 -1.68 0.19 0.00 -1.06 0.00 0.00 33.84 31.29 1jca n VAL 2 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1jca n ASN 3 N -0.43 3.71 -4.97 6.55 2.85 -1.26 -4.95 115.26 116.76 1jca n ASN 3 Ca 0.08 -2.73 -0.18 0.00 -0.11 0.00 0.00 54.58 51.64 1jca n ASN 3 Cb 0.42 -0.65 -0.00 0.00 1.24 0.00 0.00 39.78 40.79 1jca n ASN 3 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1jca s GLN 4 N -2.04 2.75 -0.15 1.20 -2.07 -1.26 -5.07 119.66 113.03 1jca s GLN 4 Ca 0.34 -1.32 -0.29 0.00 -1.82 0.00 0.00 55.36 52.27 1jca s GLN 4 Cb 0.27 -2.65 -0.01 0.00 -1.09 0.00 0.00 33.01 29.52 1jca s GLN 4 CO 0.08 -0.24 1.13 -1.01 -1.32 0.00 0.00 175.29 173.93 1jca s HIS 5 N -2.38 3.22 -0.34 9.60 3.76 -1.26 -5.02 115.29 122.86 1jca s HIS 5 Ca 0.53 1.32 -0.12 0.00 -0.15 0.00 0.00 55.06 56.63 1jca s HIS 5 Cb -0.08 -3.35 -0.01 0.00 1.11 0.00 0.00 32.58 30.25 1jca s HIS 5 CO 0.31 -0.93 0.22 -0.51 -0.85 0.00 0.00 174.74 172.99 1jca s LEU 6 N 2.79 4.49 0.35 0.89 1.43 -1.26 -5.05 118.68 122.32 1jca s LEU 6 Ca 0.50 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 53.12 1jca s LEU 6 Cb -0.20 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.87 1jca s LEU 6 CO 0.14 -0.25 0.08 0.00 0.23 0.00 0.00 176.35 176.56 1jca n GLY 8 N -0.74 3.15 0.20 0.00 0.00 -1.26 -1.57 105.19 104.96 1jca n GLY 8 Ca -0.03 -0.12 0.14 0.00 0.00 0.00 0.00 46.02 46.01 1jca n GLY 8 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jca h SER 9 N 1.41 0.00 0.27 1.61 4.64 -2.00 -3.00 113.55 116.48 1jca h SER 9 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 1jca h SER 9 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1jca h SER 9 CO 0.00 0.00 -0.68 0.45 -0.87 0.00 0.00 176.83 175.73 1jca h HIS 10 N 0.00 0.48 -0.52 4.77 -0.00 -1.68 -1.89 115.15 116.31 1jca h HIS 10 Ca 0.00 -0.20 -0.10 0.00 -0.00 0.00 0.00 60.37 60.06 1jca h HIS 10 Cb 0.60 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.92 1jca h HIS 10 CO 0.00 0.93 -0.09 1.25 -0.00 0.00 0.00 177.93 180.02 1jca h LEU 11 N 0.26 0.94 -0.62 2.43 5.85 -1.21 -0.52 115.31 122.45 1jca h LEU 11 Ca -0.02 -0.29 -0.15 0.00 0.84 0.00 0.00 57.88 58.26 1jca h LEU 11 Cb 1.23 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1jca h LEU 11 CO 0.11 1.05 -0.53 0.58 -0.34 0.00 0.00 178.44 179.31 1jca h VAL 12 N 0.85 1.33 0.00 1.05 2.07 -1.52 -2.32 116.25 117.71 1jca h VAL 12 Ca 0.14 -1.79 -0.12 0.00 0.82 0.00 0.00 66.70 65.75 1jca h VAL 12 Cb 0.63 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1jca h VAL 12 CO 0.04 0.55 -0.59 -0.08 0.02 0.00 0.00 177.57 177.51 1jca h GLU 13 N 0.34 0.00 0.17 1.57 4.57 -1.24 -1.95 114.58 118.04 1jca h GLU 13 Ca 0.01 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1jca h GLU 13 Cb 1.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1jca h GLU 13 CO 0.09 0.59 -0.08 0.00 -1.18 0.00 0.00 179.01 178.43 1jca h ALA 14 N 1.41 -0.22 -0.69 2.92 0.00 -0.97 -2.85 119.26 118.86 1jca h ALA 14 Ca -0.01 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 54.87 1jca h ALA 14 Cb 1.28 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1jca h ALA 14 CO 0.08 -0.47 0.46 -0.07 0.00 0.00 0.00 179.25 179.24 1jca h LEU 15 N -0.53 0.36 -0.35 0.00 3.38 -1.37 -1.11 115.31 115.69 1jca h LEU 15 Ca -0.02 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1jca h LEU 15 Cb 0.40 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1jca h LEU 15 CO 0.04 0.20 -0.03 0.22 0.09 0.00 0.00 178.44 178.96 1jca h TYR 16 N 0.39 0.70 0.17 1.13 3.20 -1.29 -2.71 116.97 118.57 1jca h TYR 16 Ca 0.33 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 1jca h TYR 16 Cb 0.75 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.84 1jca h TYR 16 CO -0.00 0.76 -0.08 1.25 -1.64 0.00 0.00 178.16 178.45 1jca h LEU 17 N 0.43 -0.20 -1.29 2.82 5.85 -1.14 -2.41 115.31 119.37 1jca h LEU 17 Ca 0.09 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1jca h LEU 17 Cb 0.50 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 1jca h LEU 17 CO 0.02 0.26 0.51 0.58 -0.34 0.00 0.00 178.44 179.47 1jca h VAL 18 N -0.71 1.08 0.04 1.05 2.07 -1.32 -3.27 116.25 115.19 1jca h VAL 18 Ca -0.02 -0.31 -0.30 0.00 0.82 0.00 0.00 66.70 66.89 1jca h VAL 18 Cb 0.50 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1jca h VAL 18 CO 0.04 0.16 -1.67 0.00 0.02 0.00 0.00 177.57 176.12 1jca n GLY 20 N 1.61 2.53 0.00 0.00 0.00 -0.91 -2.95 105.19 105.47 1jca n GLY 20 Ca -0.35 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 45.70 1jca n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jca n GLU 21 N 7.56 0.52 0.03 1.61 4.71 -1.26 -2.66 120.64 131.14 1jca n GLU 21 Ca 0.00 0.04 -0.15 0.00 -0.01 0.00 0.00 57.16 57.04 1jca n GLU 21 Cb 0.00 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.79 1jca n GLU 21 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1jca h ARG 22 N 0.00 0.17 0.00 3.49 3.08 -1.95 -3.51 114.38 115.66 1jca h ARG 22 Ca 0.00 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1jca h ARG 22 Cb 0.12 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1jca h ARG 22 CO 0.00 0.95 0.00 0.41 -1.07 0.00 0.00 179.97 180.26 1jca n GLY 23 N 1.69 -2.20 3.70 0.04 0.00 -1.09 -5.07 105.19 102.27 1jca n GLY 23 Ca -0.19 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.22 1jca n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1jca s PHE 24 N -0.36 0.43 -0.04 1.61 -0.12 -1.26 -4.80 117.98 113.44 1jca s PHE 24 Ca 0.00 -0.96 0.02 0.00 -0.05 0.00 0.00 56.93 55.93 1jca s PHE 24 Cb 0.00 0.54 0.01 0.00 -0.63 0.00 0.00 43.02 42.94 1jca s PHE 24 CO 0.00 -1.43 -0.07 -0.59 -0.05 0.00 0.00 175.22 173.08 1jca s PHE 25 N -2.55 0.87 -0.28 3.49 -0.12 -1.26 -5.11 117.98 113.01 1jca s PHE 25 Ca 0.20 -0.24 0.01 0.00 -0.05 0.00 0.00 56.93 56.85 1jca s PHE 25 Cb -0.04 -0.69 0.06 0.00 -0.63 0.00 0.00 43.02 41.73 1jca s PHE 25 CO 0.14 -0.16 -0.05 -0.47 -0.05 0.00 0.00 175.22 174.63 1jca s TYR 26 N 0.61 3.31 -0.34 3.49 5.04 -1.26 -5.06 117.35 123.14 1jca s TYR 26 Ca -0.09 -2.21 0.01 0.00 -2.44 0.00 0.00 57.07 52.34 1jca s TYR 26 Cb -0.12 -2.10 0.10 0.00 0.35 0.00 0.00 41.96 40.19 1jca s TYR 26 CO 0.01 -0.86 0.10 0.95 -1.34 0.00 0.00 175.55 174.41 1jca s THR 27 N 1.14 1.47 -2.00 4.34 -4.23 -1.26 -5.03 115.64 110.07 1jca s THR 27 Ca -0.06 -1.89 0.04 0.00 -1.18 0.00 0.00 61.69 58.59 1jca s THR 27 Cb -0.20 -2.09 0.10 0.00 1.34 0.00 0.00 72.50 71.66 1jca s THR 27 CO -0.04 -0.67 1.12 -0.81 -0.54 0.00 0.00 174.62 173.68 1jca n PRO 28 N 4.47 1.12 -3.13 3.99 -0.04 -1.26 -4.95 135.00 135.21 1jca n PRO 28 Ca 0.01 -0.19 -0.34 0.00 -0.04 0.00 0.00 63.50 62.94 1jca n PRO 28 Cb 0.41 -1.07 -0.06 0.00 -0.04 0.00 0.00 33.50 32.74 1jca n PRO 28 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1jca s LYS 29 N -1.93 4.09 0.00 0.54 -0.14 -1.26 -5.27 119.74 115.77 1jca s LYS 29 Ca 0.07 0.74 0.24 0.00 -1.36 0.00 0.00 55.97 55.66 1jca s LYS 29 Cb 0.03 -2.60 0.27 0.00 -1.68 0.00 0.00 37.83 33.86 1jca s LYS 29 CO 0.05 0.24 1.31 2.41 -0.76 0.00 0.00 175.35 178.60