#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fjn n PHE 2 N 0.00 -1.61 -2.62 1.61 3.72 -1.26 -2.39 117.46 114.91 1fjn n PHE 2 Ca 0.00 0.29 -0.08 0.00 -0.05 0.00 0.00 57.45 57.61 1fjn n PHE 2 Cb 0.00 -3.75 0.04 0.00 -0.94 0.00 0.00 39.48 34.83 1fjn n PHE 2 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fjn n GLY 3 N -1.20 0.03 3.79 1.37 0.00 -1.26 -2.73 105.19 105.18 1fjn n GLY 3 Ca -0.13 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 1fjn n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fjn n PRO 5 N -1.12 1.00 -1.69 0.00 -0.04 -1.26 -4.68 135.00 127.21 1fjn n PRO 5 Ca -0.07 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.94 1fjn n PRO 5 Cb 0.58 -1.15 -0.04 0.00 -0.04 0.00 0.00 33.50 32.86 1fjn n PRO 5 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1fjn n ASN 6 N -0.35 3.41 0.18 3.54 2.85 -0.93 -4.58 115.26 119.38 1fjn n ASN 6 Ca 0.00 1.08 0.11 0.00 -0.11 0.00 0.00 54.58 55.67 1fjn n ASN 6 Cb 0.07 -1.49 0.10 0.00 1.24 0.00 0.00 39.78 39.71 1fjn n ASN 6 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 1fjn h ASN 7 N 6.00 0.00 0.37 1.20 2.35 -1.96 -2.87 115.58 120.67 1fjn h ASN 7 Ca -0.44 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.29 1fjn h ASN 7 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 1fjn h ASN 7 CO 0.90 0.02 -0.18 0.22 -1.65 0.00 0.00 177.43 176.73 1fjn h TYR 8 N 0.00 -0.47 -0.63 1.19 3.20 -1.89 0.42 116.97 118.79 1fjn h TYR 8 Ca -0.00 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.78 1fjn h TYR 8 Cb 1.01 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 39.41 1fjn h TYR 8 CO 0.00 -0.13 0.10 1.96 -1.64 0.00 0.00 178.16 178.45 1fjn h GLN 9 N -0.88 1.04 -0.68 1.82 1.08 -1.78 -1.29 115.11 114.42 1fjn h GLN 9 Ca -0.05 -0.28 -0.02 0.00 -1.45 0.00 0.00 58.65 56.85 1fjn h GLN 9 Cb 0.54 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.82 1fjn h GLN 9 CO 0.08 0.97 0.36 0.00 -0.95 0.00 0.00 178.83 179.30 1fjn h HIS 11 N 0.94 1.22 -0.82 0.00 -0.00 0.20 -2.27 115.15 114.42 1fjn h HIS 11 Ca 0.24 -0.10 0.04 0.00 -0.00 0.00 0.00 60.37 60.55 1fjn h HIS 11 Cb 0.06 -0.36 -0.05 0.00 -0.00 0.00 0.00 27.41 27.06 1fjn h HIS 11 CO -0.00 0.92 0.52 -0.09 -0.00 0.00 0.00 177.93 179.28 1fjn h ARG 12 N 1.16 0.98 -0.45 5.26 2.43 -0.68 0.28 114.38 123.36 1fjn h ARG 12 Ca 0.26 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1fjn h ARG 12 Cb 0.23 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1fjn h ARG 12 CO -0.02 0.65 0.19 1.25 -1.51 0.00 0.00 179.97 180.53 1fjn h HIS 13 N 1.01 0.68 -0.14 2.20 2.76 -0.99 -2.18 115.15 118.49 1fjn h HIS 13 Ca 0.33 -0.05 -0.09 0.00 -2.20 0.00 0.00 60.37 58.37 1fjn h HIS 13 Cb 0.03 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.77 1fjn h HIS 13 CO -0.03 0.58 -0.29 0.00 -1.30 0.00 0.00 177.93 176.88 1fjn h LYS 15 N 0.24 0.71 0.00 0.00 1.79 0.08 -2.11 116.57 117.28 1fjn h LYS 15 Ca 0.03 -0.11 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 1fjn h LYS 15 Cb 0.65 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.16 1fjn h LYS 15 CO 0.05 0.59 -0.12 0.66 -1.08 0.00 0.00 179.45 179.55 1fjn h SER 16 N 0.65 0.00 -3.19 0.86 4.64 -1.23 -3.42 113.55 111.85 1fjn h SER 16 Ca 0.17 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.94 1fjn h SER 16 Cb 0.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 1fjn h SER 16 CO -0.02 0.12 0.59 -0.63 -0.87 0.00 0.00 176.83 176.02 1fjn s ILE 17 N -3.92 4.37 0.35 0.95 1.01 -0.79 -5.01 121.20 118.15 1fjn s ILE 17 Ca -0.01 1.69 -0.25 0.00 0.00 0.00 0.00 60.65 62.08 1fjn s ILE 17 Cb 0.11 -4.08 -0.10 0.00 0.01 0.00 0.00 42.46 38.40 1fjn s ILE 17 CO 0.58 0.06 0.97 -2.16 0.00 0.00 0.00 174.94 174.39 1fjn s PRO 18 N 1.67 4.45 0.00 2.79 0.04 -1.26 -3.65 135.00 139.05 1fjn s PRO 18 Ca 0.55 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.94 1fjn s PRO 18 Cb -0.25 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.62 1fjn s PRO 18 CO 0.24 0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.85 1fjn n GLY 19 N 0.37 1.82 3.80 0.56 0.00 -1.26 -5.03 105.19 105.44 1fjn n GLY 19 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1fjn n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fjn s ARG 20 N -0.62 2.20 0.06 1.61 3.00 -1.24 -2.94 118.95 121.02 1fjn s ARG 20 Ca 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 55.73 53.49 1fjn s ARG 20 Cb 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 34.95 33.22 1fjn s ARG 20 CO 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 175.30 174.90 1fjn n GLY 22 N 2.65 3.00 1.54 0.00 0.00 -1.26 -4.44 105.19 106.68 1fjn n GLY 22 Ca 0.00 -1.76 -0.03 0.00 0.00 0.00 0.00 46.02 44.23 1fjn n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fjn n GLY 23 N -0.45 1.41 3.61 -0.02 0.00 -1.26 -1.54 105.19 106.94 1fjn n GLY 23 Ca 0.04 -1.08 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 1fjn n GLY 23 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fjn s TYR 24 N -5.69 0.07 -0.48 1.61 1.13 -0.45 -4.59 117.35 108.95 1fjn s TYR 24 Ca 0.07 -0.44 -0.21 0.00 -1.41 0.00 0.00 57.07 55.08 1fjn s TYR 24 Cb -0.02 0.37 0.04 0.00 -1.10 0.00 0.00 41.96 41.25 1fjn s TYR 24 CO 0.04 -1.01 0.68 0.00 -2.51 0.00 0.00 175.55 172.76 1fjn s GLY 26 N 2.34 -0.04 0.00 0.00 0.00 0.65 -4.65 107.32 105.61 1fjn s GLY 26 Ca 0.21 2.67 0.00 0.00 0.00 0.00 0.00 44.72 47.60 1fjn s GLY 26 CO 0.17 1.47 0.00 0.61 0.00 0.00 0.00 173.10 175.35 1fjn n GLY 27 N 1.32 3.25 2.90 0.20 0.00 -1.26 -4.40 105.19 107.19 1fjn n GLY 27 Ca -0.09 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 1fjn n GLY 27 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1fjn s TRP 28 N 0.00 2.94 -1.50 1.61 -0.00 -1.26 -4.77 118.94 115.95 1fjn s TRP 28 Ca 0.00 -2.78 -0.02 0.00 -0.00 0.00 0.00 56.10 53.30 1fjn s TRP 28 Cb 0.00 -2.53 0.01 0.00 -0.00 0.00 0.00 33.47 30.95 1fjn s TRP 28 CO 0.00 -0.84 0.20 0.72 -0.00 0.00 0.00 176.95 177.03 1fjn n HIS 29 N 3.81 -1.43 -2.09 5.86 8.25 -1.26 -0.88 115.22 127.49 1fjn n HIS 29 Ca 0.04 0.18 -0.19 0.00 -0.26 0.00 0.00 57.72 57.49 1fjn n HIS 29 Cb 0.37 -3.72 -0.04 0.00 1.12 0.00 0.00 29.99 27.73 1fjn n HIS 29 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1fjn n ARG 30 N -3.29 -1.65 0.00 -0.41 0.63 -1.26 -4.81 116.66 105.87 1fjn n ARG 30 Ca -0.17 1.02 0.02 0.00 -0.92 0.00 0.00 57.85 57.80 1fjn n ARG 30 Cb 0.64 -5.56 -0.02 0.00 0.45 0.00 0.00 32.46 27.97 1fjn n ARG 30 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1fjn n LEU 31 N -2.72 0.27 -4.77 6.15 4.77 -0.06 -4.03 117.00 116.61 1fjn n LEU 31 Ca -0.22 -0.54 -0.39 0.00 -0.03 0.00 0.00 56.01 54.83 1fjn n LEU 31 Cb 0.66 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.69 1fjn n LEU 31 CO 0.28 0.06 0.36 -0.60 -1.33 0.00 0.00 177.39 176.16 1fjn s ARG 32 N -1.26 4.38 -0.45 3.23 6.06 -1.23 -0.90 118.95 128.78 1fjn s ARG 32 Ca 0.02 0.89 -0.22 0.00 -2.50 0.00 0.00 55.73 53.91 1fjn s ARG 32 Cb 0.03 -3.31 0.03 0.00 0.06 0.00 0.00 34.95 31.76 1fjn s ARG 32 CO 0.14 0.45 0.73 0.00 -2.50 0.00 0.00 175.30 174.13 1fjn s THR 34 N 3.12 4.77 -0.06 0.00 2.01 0.35 -4.91 115.64 120.92 1fjn s THR 34 Ca 0.27 -0.61 -0.08 0.00 0.31 0.00 0.00 61.69 61.58 1fjn s THR 34 Cb -0.13 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1fjn s THR 34 CO 0.21 -0.12 0.22 0.00 -0.69 0.00 0.00 174.62 174.24 1fjn s TYR 36 N -1.11 3.15 0.63 0.00 -0.85 -0.59 -4.97 117.35 113.61 1fjn s TYR 36 Ca 0.20 0.04 -0.18 0.00 -0.52 0.00 0.00 57.07 56.60 1fjn s TYR 36 Cb -0.13 -1.58 -0.02 0.00 0.38 0.00 0.00 41.96 40.61 1fjn s TYR 36 CO 0.09 0.52 1.26 1.03 -1.52 0.00 0.00 175.55 176.93 1fjn s ARG 37 N -2.57 2.70 -0.23 -3.49 0.52 -1.26 -2.91 118.95 111.71 1fjn s ARG 37 Ca 0.29 1.98 -0.18 0.00 -0.52 0.00 0.00 55.73 57.30 1fjn s ARG 37 Cb -0.12 -1.87 -0.03 0.00 0.52 0.00 0.00 34.95 33.45 1fjn s ARG 37 CO 0.22 -1.46 0.50 0.00 0.02 0.00 0.00 175.30 174.58