#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jo6 n PHE 2 N 0.00 -3.42 -1.43 2.03 7.35 -1.26 -4.52 117.46 116.22 1jo6 n PHE 2 Ca 0.00 1.88 -0.59 0.00 -0.76 0.00 0.00 57.45 57.99 1jo6 n PHE 2 Cb 0.00 -3.05 -0.10 0.00 0.35 0.00 0.00 39.48 36.68 1jo6 n PHE 2 CO 0.00 0.00 0.00 1.51 -0.76 0.00 0.00 176.76 177.51 1jo6 n ILE 3 N -3.80 0.09 -0.04 -2.13 0.13 -1.26 -4.73 119.36 107.62 1jo6 n ILE 3 Ca -0.06 -0.07 -0.05 0.00 -1.10 0.00 0.00 62.75 61.47 1jo6 n ILE 3 Cb 0.55 -0.87 -0.03 0.00 -0.84 0.00 0.00 39.64 38.44 1jo6 n ILE 3 CO 0.00 0.00 0.00 -2.67 2.80 0.00 0.00 176.55 176.68 1jo6 n TRP 4 N 7.32 0.00 0.00 9.51 4.27 -1.26 -4.89 117.44 132.39 1jo6 n TRP 4 Ca 0.45 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 54.06 1jo6 n TRP 4 Cb 0.04 -0.27 0.00 0.00 -1.36 0.00 0.00 31.31 29.72 1jo6 n TRP 4 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 1jo6 n THR 5 N -2.72 0.00 -2.70 -1.67 -2.24 -1.26 -4.84 114.28 98.86 1jo6 n THR 5 Ca -0.13 0.25 -0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1jo6 n THR 5 Cb 0.63 -0.87 0.08 0.00 -2.10 0.00 0.00 70.33 68.07 1jo6 n THR 5 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1jo6 n SER 6 N 0.00 -1.88 -3.25 3.42 2.88 -1.26 -5.06 113.62 108.47 1jo6 n SER 6 Ca 0.00 -2.51 -0.07 0.00 -1.33 0.00 0.00 58.87 54.96 1jo6 n SER 6 Cb 0.00 1.30 0.01 0.00 -0.75 0.00 0.00 64.21 64.76 1jo6 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jo6 n GLY 7 N 1.17 0.01 3.29 0.46 0.00 -1.26 -4.76 105.19 104.09 1jo6 n GLY 7 Ca 0.03 0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 1jo6 n GLY 7 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1jo6 n ARG 8 N 1.02 0.14 -1.05 1.61 1.85 -1.26 -4.99 116.66 113.97 1jo6 n ARG 8 Ca -0.02 0.06 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 1jo6 n ARG 8 Cb 0.53 -1.25 0.00 0.00 -1.05 0.00 0.00 32.46 30.69 1jo6 n ARG 8 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1jo6 n THR 9 N -1.81 0.00 -1.18 8.89 -2.24 -1.26 -5.13 114.28 111.55 1jo6 n THR 9 Ca 0.08 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.66 1jo6 n THR 9 Cb 0.49 -0.64 0.15 0.00 -2.10 0.00 0.00 70.33 68.23 1jo6 n THR 9 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1jo6 n SER 10 N -1.76 -0.97 -0.12 3.42 7.64 -1.26 -4.94 113.62 115.62 1jo6 n SER 10 Ca 0.00 -1.10 0.14 0.00 1.01 0.00 0.00 58.87 58.92 1jo6 n SER 10 Cb 0.00 -0.67 0.58 0.00 -1.01 0.00 0.00 64.21 63.11 1jo6 n SER 10 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1jo6 n SER 11 N -3.96 0.51 -1.95 6.43 7.64 -1.26 -3.92 113.62 117.12 1jo6 n SER 11 Ca 0.11 -0.58 -0.16 0.00 1.01 0.00 0.00 58.87 59.25 1jo6 n SER 11 Cb 0.39 -0.06 0.01 0.00 -1.01 0.00 0.00 64.21 63.54 1jo6 n SER 11 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1jo6 n SER 12 N -0.94 6.32 -0.02 6.43 7.64 -1.26 -3.34 113.62 128.44 1jo6 n SER 12 Ca 0.14 -3.00 -0.05 0.00 1.01 0.00 0.00 58.87 56.97 1jo6 n SER 12 Cb 0.29 -1.11 -0.02 0.00 -1.01 0.00 0.00 64.21 62.36 1jo6 n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jo6 n TYR 13 N 0.63 0.00 -0.10 1.43 4.11 -1.25 -4.77 117.16 117.21 1jo6 n TYR 13 Ca 0.30 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 58.10 1jo6 n TYR 13 Cb 0.58 -0.18 -0.16 0.00 -0.00 0.00 0.00 39.34 39.58 1jo6 n TYR 13 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1jo6 n ARG 14 N -3.00 0.75 0.00 -3.48 5.12 -1.25 -4.83 116.66 109.98 1jo6 n ARG 14 Ca -0.09 -0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.82 1jo6 n ARG 14 Cb 0.58 -1.51 0.00 0.00 -1.16 0.00 0.00 32.46 30.37 1jo6 n ARG 14 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1jo6 n HIS 15 N -2.74 0.00 -1.17 -1.55 8.25 -1.21 -4.73 115.22 112.06 1jo6 n HIS 15 Ca -0.33 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.27 1jo6 n HIS 15 Cb 1.15 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 32.21 1jo6 n HIS 15 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1jo6 n ASP 16 N 0.00 -6.25 0.33 0.41 -0.08 -1.26 -3.19 116.55 106.51 1jo6 n ASP 16 Ca 0.00 0.70 0.11 0.00 -1.51 0.00 0.00 54.79 54.08 1jo6 n ASP 16 Cb 0.00 -3.74 0.56 0.00 2.34 0.00 0.00 41.12 40.28 1jo6 n ASP 16 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1jo6 h GLU 17 N -1.25 0.00 -2.03 -0.67 4.22 -2.00 -1.46 114.58 111.39 1jo6 h GLU 17 Ca -0.05 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 59.34 1jo6 h GLU 17 Cb 1.27 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 1jo6 h GLU 17 CO 0.03 0.00 -0.08 1.63 -2.18 0.00 0.00 179.01 178.41 1jo6 n LYS 18 N -2.77 1.14 -0.00 1.92 5.02 -1.19 -3.08 118.16 119.20 1jo6 n LYS 18 Ca -0.01 -0.25 0.03 0.00 -2.02 0.00 0.00 58.31 56.05 1jo6 n LYS 18 Cb 0.57 -1.31 -0.04 0.00 -0.02 0.00 0.00 35.03 34.24 1jo6 n LYS 18 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1jo6 n ARG 19 N 1.84 1.85 -0.84 1.97 1.74 -0.55 -4.53 116.66 118.14 1jo6 n ARG 19 Ca 0.11 -0.03 -0.06 0.00 -0.77 0.00 0.00 57.85 57.10 1jo6 n ARG 19 Cb 0.55 -1.01 0.21 0.00 -1.02 0.00 0.00 32.46 31.19 1jo6 n ARG 19 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1jo6 n ASN 20 N -1.51 3.04 -0.06 0.55 2.85 -1.18 -4.34 115.26 114.62 1jo6 n ASN 20 Ca -0.00 -3.60 -0.06 0.00 -0.11 0.00 0.00 54.58 50.81 1jo6 n ASN 20 Cb 0.13 -0.66 -0.10 0.00 1.24 0.00 0.00 39.78 40.39 1jo6 n ASN 20 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 1jo6 n ILE 21 N -0.98 0.80 -0.33 -1.44 -6.64 -1.26 -4.45 119.36 105.06 1jo6 n ILE 21 Ca 0.36 -0.50 0.17 0.00 -1.77 0.00 0.00 62.75 61.01 1jo6 n ILE 21 Cb 1.15 -0.65 0.37 0.00 -1.44 0.00 0.00 39.64 39.06 1jo6 n ILE 21 CO 0.00 0.00 0.00 0.10 -1.77 0.00 0.00 176.55 174.88 1jo6 h TYR 22 N 0.00 0.83 0.00 4.28 -0.00 -1.85 1.51 116.97 121.74 1jo6 h TYR 22 Ca -0.32 0.04 -0.03 0.00 -0.00 0.00 0.00 58.73 58.42 1jo6 h TYR 22 Cb 1.71 -0.22 -0.00 0.00 -0.00 0.00 0.00 36.73 38.22 1jo6 h TYR 22 CO 0.00 -0.03 -0.14 0.37 -0.00 0.00 0.00 178.16 178.36 1jo6 h GLN 23 N 0.46 0.00 0.17 0.10 -0.00 -1.88 -2.60 115.11 111.36 1jo6 h GLN 23 Ca 0.62 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 59.26 1jo6 h GLN 23 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.71 1jo6 h GLN 23 CO -0.52 0.14 -0.08 -0.22 0.00 0.00 0.00 178.83 178.14 1jo6 h LYS 24 N 0.00 -0.22 -0.66 1.69 3.64 0.19 -2.54 116.57 118.66 1jo6 h LYS 24 Ca -0.00 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.53 1jo6 h LYS 24 Cb 0.77 0.05 -0.13 0.00 -0.41 0.00 0.00 32.23 32.52 1jo6 h LYS 24 CO 0.02 -0.15 -0.16 0.82 -2.27 0.00 0.00 179.45 177.71 1jo6 h ILE 25 N -0.49 0.34 -0.39 2.00 5.03 -1.22 1.47 117.51 124.25 1jo6 h ILE 25 Ca -0.02 -0.00 0.11 0.00 -0.12 0.00 0.00 64.86 64.83 1jo6 h ILE 25 Cb 0.18 0.34 -0.02 0.00 -3.03 0.00 0.00 36.82 34.29 1jo6 h ILE 25 CO 0.04 0.00 0.36 0.03 -0.68 0.00 0.00 178.15 177.90 1jo6 h ARG 26 N 0.00 0.00 0.00 2.37 3.08 -1.55 1.33 114.38 119.61 1jo6 h ARG 26 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1jo6 h ARG 26 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1jo6 h ARG 26 CO -0.68 0.00 0.00 0.22 -1.07 0.00 0.00 179.97 178.44 1jo6 h ASP 27 N 0.00 0.00 0.11 7.04 1.82 0.25 -3.20 116.42 122.44 1jo6 h ASP 27 Ca 0.18 0.00 -0.33 0.00 -0.39 0.00 0.00 57.03 56.50 1jo6 h ASP 27 Cb 0.90 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.90 1jo6 h ASP 27 CO -0.00 0.00 -1.75 -0.74 -1.61 0.00 0.00 179.24 175.14 1jo6 h HIS 28 N 0.00 0.41 -0.61 0.28 2.76 0.23 -3.32 115.15 114.90 1jo6 h HIS 28 Ca 0.00 -0.30 0.18 0.00 -2.20 0.00 0.00 60.37 58.05 1jo6 h HIS 28 Cb 0.78 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.70 1jo6 h HIS 28 CO 0.00 1.69 0.65 0.22 -1.30 0.00 0.00 177.93 179.19 1jo6 h ASP 29 N -0.19 0.00 0.00 3.26 1.82 -0.95 1.12 116.42 121.48 1jo6 h ASP 29 Ca -0.39 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.25 1jo6 h ASP 29 Cb 1.86 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.87 1jo6 h ASP 29 CO 0.03 0.00 0.19 -0.07 -1.61 0.00 0.00 179.24 177.78 1jo6 h LEU 30 N 0.00 0.00 -6.01 2.28 3.38 -1.66 -3.24 115.31 110.06 1jo6 h LEU 30 Ca 0.29 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.65 1jo6 h LEU 30 Cb 1.59 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.36 1jo6 h LEU 30 CO -0.00 0.00 2.71 0.18 0.09 0.00 0.00 178.44 181.42 1jo6 n LEU 31 N -2.79 5.37 -0.01 1.67 4.32 0.39 -4.07 117.00 121.88 1jo6 n LEU 31 Ca -0.02 -3.33 0.05 0.00 -0.02 0.00 0.00 56.01 52.70 1jo6 n LEU 31 Cb 0.24 -1.28 -0.09 0.00 -1.62 0.00 0.00 43.42 40.67 1jo6 n LEU 31 CO 0.14 0.42 -0.65 0.47 -1.22 0.00 0.00 177.39 176.55 1jo6 n ASP 32 N 6.09 2.30 -0.56 -1.43 8.00 -1.23 -3.85 116.55 125.88 1jo6 n ASP 32 Ca 0.52 0.00 0.46 0.00 0.71 0.00 0.00 54.79 56.47 1jo6 n ASP 32 Cb 0.33 1.50 0.77 0.00 -0.02 0.00 0.00 41.12 43.70 1jo6 n ASP 32 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1jo6 h LYS 33 N 0.00 0.02 0.00 -1.24 1.79 -1.89 0.31 116.57 115.56 1jo6 h LYS 33 Ca -0.02 -0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.28 1jo6 h LYS 33 Cb 0.60 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.21 1jo6 h LYS 33 CO 0.00 0.01 -1.68 0.54 -1.08 0.00 0.00 179.45 177.25 1jo6 n ARG 34 N -4.16 2.20 -0.56 3.15 1.74 -1.26 -5.02 116.66 112.76 1jo6 n ARG 34 Ca 0.38 -0.01 -0.14 0.00 -0.77 0.00 0.00 57.85 57.32 1jo6 n ARG 34 Cb 1.71 -1.26 0.11 0.00 -1.02 0.00 0.00 32.46 32.00 1jo6 n ARG 34 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1jo6 n LYS 35 N -2.34 -1.68 -0.50 5.56 4.81 0.11 -5.01 118.16 119.11 1jo6 n LYS 35 Ca -0.15 -0.82 -0.28 0.00 -0.87 0.00 0.00 58.31 56.18 1jo6 n LYS 35 Cb 0.79 -0.72 0.25 0.00 0.02 0.00 0.00 35.03 35.38 1jo6 n LYS 35 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1jo6 s THR 36 N -1.99 2.01 0.23 3.15 2.01 -1.26 -4.86 115.64 114.92 1jo6 s THR 36 Ca 0.33 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.33 1jo6 s THR 36 Cb -0.03 -2.02 0.05 0.00 0.01 0.00 0.00 72.50 70.51 1jo6 s THR 36 CO 0.25 -0.00 0.32 0.55 -0.69 0.00 0.00 174.62 175.04 1jo6 n VAL 37 N -4.95 0.00 -0.85 3.82 3.14 -1.26 -4.83 118.33 113.40 1jo6 n VAL 37 Ca 0.03 -0.51 -0.35 0.00 -2.96 0.00 0.00 64.34 60.56 1jo6 n VAL 37 Cb 0.54 -1.21 0.09 0.00 -1.06 0.00 0.00 33.84 32.20 1jo6 n VAL 37 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1jo6 n THR 38 N -1.84 0.00 -3.68 1.55 -1.04 -1.26 -5.02 114.28 102.98 1jo6 n THR 38 Ca 0.05 -0.13 -0.01 0.00 -2.04 0.00 0.00 64.05 61.92 1jo6 n THR 38 Cb 0.19 -0.26 -0.01 0.00 -1.82 0.00 0.00 70.33 68.43 1jo6 n THR 38 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1jo6 s ALA 39 N -2.10 -1.92 -0.08 2.41 0.00 -1.26 -5.08 121.76 113.74 1jo6 s ALA 39 Ca 0.44 0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.83 1jo6 s ALA 39 Cb 0.01 0.49 0.00 0.00 0.00 0.00 0.00 23.12 23.62 1jo6 s ALA 39 CO 0.64 -1.02 0.01 1.28 0.00 0.00 0.00 175.76 176.67 1jo6 n LEU 40 N -0.46 -4.80 -4.06 0.00 4.77 -1.26 -4.89 117.00 106.29 1jo6 n LEU 40 Ca -0.07 0.79 -0.21 0.00 -0.03 0.00 0.00 56.01 56.49 1jo6 n LEU 40 Cb 0.62 -2.04 0.17 0.00 -2.33 0.00 0.00 43.42 39.84 1jo6 n LEU 40 CO 0.13 -2.11 0.07 2.29 -1.33 0.00 0.00 177.39 176.44 1jo6 n LYS 41 N 1.34 -2.70 -3.53 3.23 2.85 -1.26 -5.05 118.16 113.05 1jo6 n LYS 41 Ca -0.02 -0.80 -0.00 0.00 -1.05 0.00 0.00 58.31 56.44 1jo6 n LYS 41 Cb 0.34 -1.57 -0.05 0.00 -0.65 0.00 0.00 35.03 33.10 1jo6 n LYS 41 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1jo6 s ALA 42 N -2.09 -2.52 0.00 0.58 0.00 -1.26 -5.14 121.76 111.33 1jo6 s ALA 42 Ca 0.42 2.11 0.00 0.00 0.00 0.00 0.00 51.96 54.49 1jo6 s ALA 42 Cb -0.08 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.15 1jo6 s ALA 42 CO 0.39 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1jo6 n GLY 43 N 4.21 2.32 0.44 0.00 0.00 -1.26 -5.09 105.19 105.81 1jo6 n GLY 43 Ca -0.14 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1jo6 n GLY 43 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1jo6 n GLU 44 N 0.00 0.00 -0.52 1.61 0.28 -1.26 -5.37 120.64 115.38 1jo6 n GLU 44 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1jo6 n GLU 44 Cb 0.00 -0.67 0.00 0.00 1.43 0.00 0.00 31.44 32.20 1jo6 n GLU 44 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50