#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dx7 s ASP 2 N 0.00 0.00 0.00 0.00 1.47 -1.26 -5.14 116.67 111.75 1dx7 s ASP 2 Ca 0.00 -0.96 0.00 0.00 1.18 0.00 0.00 52.55 52.77 1dx7 s ASP 2 Cb 0.00 0.72 0.00 0.00 -0.34 0.00 0.00 42.92 43.30 1dx7 s ASP 2 CO 0.00 -1.43 0.00 0.29 0.68 0.00 0.00 175.17 174.71 1dx7 n LYS 3 N -0.59 0.00 -1.80 2.11 4.01 -1.26 -4.78 118.16 115.85 1dx7 n LYS 3 Ca -0.06 0.00 -0.17 0.00 -0.51 0.00 0.00 58.31 57.57 1dx7 n LYS 3 Cb 0.60 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 35.07 1dx7 n LYS 3 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1dx7 n SER 4 N 0.00 -4.66 -1.38 4.39 3.41 -1.26 -2.62 113.62 111.50 1dx7 n SER 4 Ca 0.00 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 1dx7 n SER 4 Cb 0.00 -4.10 0.00 0.00 -0.26 0.00 0.00 64.21 59.85 1dx7 n SER 4 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1dx7 n ASP 5 N -1.26 0.00 -2.38 4.04 2.03 -1.26 0.92 116.55 118.65 1dx7 n ASP 5 Ca -0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.13 1dx7 n ASP 5 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1dx7 n ASP 5 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1dx7 n LEU 6 N -0.50 0.00 0.00 -2.67 4.32 -1.08 -1.33 117.00 115.75 1dx7 n LEU 6 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1dx7 n LEU 6 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1dx7 n LEU 6 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1dx7 n GLY 7 N -0.85 0.85 0.28 -0.72 0.00 0.11 -4.85 105.19 100.00 1dx7 n GLY 7 Ca 0.00 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.12 1dx7 n GLY 7 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1dx7 h TYR 8 N 0.00 0.00 -0.75 1.61 3.20 -0.68 -1.63 116.97 118.72 1dx7 h TYR 8 Ca 0.00 0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.99 1dx7 h TYR 8 Cb 0.00 0.00 -0.13 0.00 1.54 0.00 0.00 36.73 38.14 1dx7 h TYR 8 CO 0.00 0.04 -0.38 1.15 -1.64 0.00 0.00 178.16 177.33 1dx7 h THR 9 N 0.00 0.09 0.00 1.81 2.02 0.33 0.43 112.91 117.59 1dx7 h THR 9 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1dx7 h THR 9 Cb 0.09 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 1dx7 h THR 9 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 1dx7 n GLY 10 N -1.44 -0.90 0.62 2.16 0.00 -0.62 -3.34 105.19 101.67 1dx7 n GLY 10 Ca 0.06 0.00 0.45 0.00 0.00 0.00 0.00 46.02 46.53 1dx7 n GLY 10 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1dx7 n LEU 11 N -1.18 0.00 0.00 0.99 -0.00 -1.21 0.35 117.00 115.95 1dx7 n LEU 11 Ca 0.00 0.86 0.00 0.00 -0.00 0.00 0.00 56.01 56.87 1dx7 n LEU 11 Cb 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 43.42 43.01 1dx7 n LEU 11 CO 0.00 -0.86 0.50 0.41 -0.00 0.00 0.00 177.39 177.44 1dx7 n THR 12 N -3.62 0.00 -0.35 1.47 -1.04 0.15 -0.21 114.28 110.68 1dx7 n THR 12 Ca 0.37 1.50 0.28 0.00 -2.04 0.00 0.00 64.05 64.15 1dx7 n THR 12 Cb 1.76 -2.26 0.44 0.00 -1.82 0.00 0.00 70.33 68.44 1dx7 n THR 12 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1dx7 n ASP 13 N -2.45 0.05 -0.08 8.00 8.00 0.16 0.27 116.55 130.49 1dx7 n ASP 13 Ca 0.00 0.67 -0.15 0.00 0.71 0.00 0.00 54.79 56.02 1dx7 n ASP 13 Cb 0.00 -0.33 -0.11 0.00 -0.02 0.00 0.00 41.12 40.65 1dx7 n ASP 13 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1dx7 h GLU 14 N 0.00 0.00 -0.04 -1.24 4.57 -0.62 -2.83 114.58 114.43 1dx7 h GLU 14 Ca 0.53 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.70 1dx7 h GLU 14 Cb 1.95 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.54 1dx7 h GLU 14 CO -0.12 0.91 0.00 1.96 -1.18 0.00 0.00 179.01 180.59 1dx7 h GLN 15 N -1.00 0.07 -0.74 1.92 1.08 0.64 0.25 115.11 117.33 1dx7 h GLN 15 Ca -0.10 -0.02 0.21 0.00 -1.45 0.00 0.00 58.65 57.29 1dx7 h GLN 15 Cb 1.01 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.41 1dx7 h GLN 15 CO -0.06 0.33 0.76 0.00 -0.95 0.00 0.00 178.83 178.91 1dx7 h ALA 16 N 0.74 2.54 0.04 3.87 0.00 0.28 1.74 119.26 128.48 1dx7 h ALA 16 Ca 0.01 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 1dx7 h ALA 16 Cb 0.30 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1dx7 h ALA 16 CO 0.00 -1.14 -1.55 -0.56 0.00 0.00 0.00 179.25 176.00 1dx7 h GLN 17 N 0.00 0.09 -0.54 0.00 3.07 -0.55 -1.74 115.11 115.43 1dx7 h GLN 17 Ca 0.35 -0.15 0.16 0.00 0.09 0.00 0.00 58.65 59.10 1dx7 h GLN 17 Cb 1.87 0.06 -0.02 0.00 0.08 0.00 0.00 27.48 29.46 1dx7 h GLN 17 CO -0.00 0.81 0.86 0.93 0.09 0.00 0.00 178.83 181.52 1dx7 h GLU 18 N 0.02 0.00 0.00 0.06 3.07 0.58 0.62 114.58 118.93 1dx7 h GLU 18 Ca -0.23 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 58.50 1dx7 h GLU 18 Cb 1.97 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.85 1dx7 h GLU 18 CO 0.11 0.00 -1.54 1.47 -1.40 0.00 0.00 179.01 177.65 1dx7 n LEU 19 N -3.18 0.00 0.00 1.33 -0.00 -1.11 -4.65 117.00 109.39 1dx7 n LEU 19 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.12 1dx7 n LEU 19 Cb 1.04 0.17 0.00 0.00 -0.00 0.00 0.00 43.42 44.63 1dx7 n LEU 19 CO 0.19 0.17 0.00 1.41 -0.00 0.00 0.00 177.39 179.16 1dx7 n HIS 20 N -2.23 0.00 0.00 1.47 8.25 0.20 -3.47 115.22 119.44 1dx7 n HIS 20 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.34 1dx7 n HIS 20 Cb 0.69 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.72 1dx7 n HIS 20 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1dx7 n SER 21 N -1.26 0.00 -0.31 0.41 7.64 -0.45 0.17 113.62 119.82 1dx7 n SER 21 Ca 0.00 0.76 0.05 0.00 1.01 0.00 0.00 58.87 60.69 1dx7 n SER 21 Cb 0.00 -0.37 0.12 0.00 -1.01 0.00 0.00 64.21 62.95 1dx7 n SER 21 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1dx7 n VAL 22 N -2.67 -0.37 0.01 0.44 3.14 -1.16 -0.18 118.33 117.54 1dx7 n VAL 22 Ca 0.00 1.99 -0.03 0.00 -2.96 0.00 0.00 64.34 63.34 1dx7 n VAL 22 Cb 0.00 -2.74 -0.02 0.00 -1.06 0.00 0.00 33.84 30.02 1dx7 n VAL 22 CO 0.00 0.00 0.00 0.22 -6.46 0.00 0.00 176.83 170.59 1dx7 h TYR 23 N 0.00 -0.26 0.00 1.45 5.03 0.16 0.82 116.97 124.17 1dx7 h TYR 23 Ca 0.41 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.73 1dx7 h TYR 23 Cb 0.63 0.11 0.00 0.00 1.55 0.00 0.00 36.73 39.02 1dx7 h TYR 23 CO -0.67 -0.10 0.00 -0.12 -1.32 0.00 0.00 178.16 175.95 1dx7 n MET 24 N -2.98 0.00 0.00 1.82 1.56 0.10 -1.45 117.12 116.18 1dx7 n MET 24 Ca -0.01 0.45 0.00 0.00 -0.27 0.00 0.00 57.70 57.86 1dx7 n MET 24 Cb 0.07 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 33.94 1dx7 n MET 24 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 1dx7 n SER 25 N -1.47 0.00 0.14 6.12 2.88 0.75 -3.30 113.62 118.74 1dx7 n SER 25 Ca 0.00 0.41 0.17 0.00 -1.33 0.00 0.00 58.87 58.12 1dx7 n SER 25 Cb 0.02 -0.45 0.76 0.00 -0.75 0.00 0.00 64.21 63.79 1dx7 n SER 25 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1dx7 h GLY 26 N 0.00 0.00 0.44 0.46 0.00 -1.20 -2.18 103.07 100.59 1dx7 h GLY 26 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1dx7 h GLY 26 CO 0.00 0.00 -0.46 1.41 0.00 0.00 0.00 176.54 177.49 1dx7 h LEU 27 N 0.00 -1.27 0.00 3.11 4.07 -1.38 -0.66 115.31 119.18 1dx7 h LEU 27 Ca 0.14 0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.20 1dx7 h LEU 27 Cb 0.66 0.42 0.00 0.00 1.08 0.00 0.00 40.66 42.82 1dx7 h LEU 27 CO -0.00 -0.60 0.00 1.87 -1.08 0.00 0.00 178.44 178.63 1dx7 n TRP 28 N -5.20 0.00 -0.07 1.13 -0.00 -0.85 -2.61 117.44 109.84 1dx7 n TRP 28 Ca -0.11 0.00 -0.04 0.00 -0.00 0.00 0.00 57.50 57.35 1dx7 n TRP 28 Cb 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 31.31 31.71 1dx7 n TRP 28 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1dx7 h LEU 29 N 0.00 0.00 0.00 5.87 5.85 -0.75 -3.19 115.31 123.08 1dx7 h LEU 29 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1dx7 h LEU 29 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1dx7 h LEU 29 CO 0.00 0.70 0.00 0.49 -0.34 0.00 0.00 178.44 179.29 1dx7 n PHE 30 N -4.47 0.00 0.87 1.25 3.01 -0.75 -1.07 117.46 116.30 1dx7 n PHE 30 Ca -0.07 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.50 1dx7 n PHE 30 Cb 0.24 -0.24 -0.01 0.00 -0.01 0.00 0.00 39.48 39.47 1dx7 n PHE 30 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1dx7 n SER 31 N -1.24 0.76 -0.05 4.37 2.88 -1.07 -3.37 113.62 115.89 1dx7 n SER 31 Ca 0.10 -0.62 -0.11 0.00 -1.33 0.00 0.00 58.87 56.91 1dx7 n SER 31 Cb 0.14 0.83 -0.04 0.00 -0.75 0.00 0.00 64.21 64.40 1dx7 n SER 31 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1dx7 n ALA 32 N -1.60 1.93 -0.22 -1.46 0.00 -0.78 -4.11 120.51 114.27 1dx7 n ALA 32 Ca 0.04 -0.54 0.02 0.00 0.00 0.00 0.00 53.44 52.96 1dx7 n ALA 32 Cb 0.36 0.22 0.13 0.00 0.00 0.00 0.00 19.45 20.17 1dx7 n ALA 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1dx7 h VAL 33 N -0.55 0.66 0.06 0.00 2.07 -1.32 -0.06 116.25 117.11 1dx7 h VAL 33 Ca -0.21 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.21 1dx7 h VAL 33 Cb 0.98 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 1dx7 h VAL 33 CO -0.13 0.06 -0.49 0.00 0.02 0.00 0.00 177.57 177.03 1dx7 h ALA 34 N 1.49 -0.86 -1.49 1.67 0.00 -1.74 0.82 119.26 119.15 1dx7 h ALA 34 Ca 0.34 -0.08 0.47 0.00 0.00 0.00 0.00 54.91 55.64 1dx7 h ALA 34 Cb 0.50 0.84 -0.11 0.00 0.00 0.00 0.00 17.79 19.02 1dx7 h ALA 34 CO -0.39 -1.06 1.00 0.82 0.00 0.00 0.00 179.25 179.62 1dx7 h ILE 35 N -0.68 0.09 -0.00 0.00 2.04 -1.21 1.95 117.51 119.70 1dx7 h ILE 35 Ca 0.02 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1dx7 h ILE 35 Cb 0.72 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1dx7 h ILE 35 CO -0.31 0.01 -0.01 0.58 0.00 0.00 0.00 178.15 178.42 1dx7 h VAL 36 N 0.05 1.45 -1.26 1.67 2.07 0.17 -0.69 116.25 119.71 1dx7 h VAL 36 Ca 0.84 -1.35 0.36 0.00 0.82 0.00 0.00 66.70 67.38 1dx7 h VAL 36 Cb 2.90 2.36 -0.07 0.00 -1.52 0.00 0.00 31.29 34.96 1dx7 h VAL 36 CO -0.30 0.35 0.88 0.00 0.02 0.00 0.00 177.57 178.52 1dx7 h ALA 37 N 0.43 2.98 0.18 1.67 0.00 0.55 2.16 119.26 127.23 1dx7 h ALA 37 Ca 0.00 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 1dx7 h ALA 37 Cb 0.58 0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.50 1dx7 h ALA 37 CO 0.00 -1.39 -1.22 0.45 0.00 0.00 0.00 179.25 177.10 1dx7 h HIS 38 N 0.09 0.88 0.00 0.00 -0.00 -0.60 -3.19 115.15 112.34 1dx7 h HIS 38 Ca 0.64 -0.61 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 1dx7 h HIS 38 Cb 2.31 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 29.67 1dx7 h HIS 38 CO -0.00 1.46 -0.08 -0.07 -0.00 0.00 0.00 177.93 179.24 1dx7 h LEU 39 N 0.06 0.00 -1.08 2.43 3.38 0.19 -3.18 115.31 117.11 1dx7 h LEU 39 Ca -0.20 0.00 0.35 0.00 0.09 0.00 0.00 57.88 58.12 1dx7 h LEU 39 Cb 1.93 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.60 1dx7 h LEU 39 CO 0.23 0.13 0.72 0.00 0.09 0.00 0.00 178.44 179.61 1dx7 n ALA 40 N -2.44 1.05 -0.03 1.53 0.00 0.67 0.17 120.51 121.46 1dx7 n ALA 40 Ca -0.01 0.56 -0.13 0.00 0.00 0.00 0.00 53.44 53.87 1dx7 n ALA 40 Cb 0.04 -0.75 -0.11 0.00 0.00 0.00 0.00 19.45 18.63 1dx7 n ALA 40 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1dx7 h VAL 41 N 0.00 1.43 -0.20 0.00 2.07 -1.53 -2.84 116.25 115.18 1dx7 h VAL 41 Ca 0.62 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1dx7 h VAL 41 Cb 2.16 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 34.44 1dx7 h VAL 41 CO -0.24 0.41 0.00 -1.22 0.02 0.00 0.00 177.57 176.55 1dx7 n TYR 42 N -4.76 0.38 -0.04 1.57 4.01 0.46 -3.44 117.16 115.34 1dx7 n TYR 42 Ca -0.09 -0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.49 1dx7 n TYR 42 Cb 0.34 -0.06 -0.11 0.00 -0.31 0.00 0.00 39.34 39.20 1dx7 n TYR 42 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1dx7 n ILE 43 N 0.14 0.45 1.56 -0.72 5.41 0.39 -4.33 119.36 122.27 1dx7 n ILE 43 Ca 0.07 -0.45 0.07 0.00 1.00 0.00 0.00 62.75 63.45 1dx7 n ILE 43 Cb 0.28 -0.23 0.32 0.00 -0.71 0.00 0.00 39.64 39.29 1dx7 n ILE 43 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1dx7 n TRP 44 N -2.24 0.15 -0.08 1.39 7.02 -1.08 -3.90 117.44 118.70 1dx7 n TRP 44 Ca -0.12 -0.08 -0.14 0.00 -1.02 0.00 0.00 57.50 56.14 1dx7 n TRP 44 Cb 0.65 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.44 1dx7 n TRP 44 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1dx7 h ARG 45 N 1.05 0.00 -6.81 -0.99 -0.00 -1.75 -3.46 114.38 102.42 1dx7 h ARG 45 Ca 0.00 0.00 -0.48 0.00 -0.50 0.00 0.00 59.98 59.00 1dx7 h ARG 45 Cb 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 30.18 1dx7 h ARG 45 CO 0.00 0.80 0.31 -1.25 0.00 0.00 0.00 179.97 179.83 1dx7 s PRO 46 N -2.20 4.57 0.01 0.04 0.04 -1.25 -4.92 135.00 131.28 1dx7 s PRO 46 Ca -0.20 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.11 1dx7 s PRO 46 Cb 0.01 -2.88 0.00 0.00 0.04 0.00 0.00 34.50 31.67 1dx7 s PRO 46 CO 0.54 0.33 0.00 0.91 0.04 0.00 0.00 177.00 178.82 1dx7 n TRP 47 N 0.72 -1.45 -0.29 0.56 7.02 -1.26 -5.01 117.44 117.73 1dx7 n TRP 47 Ca 0.01 0.02 0.00 0.00 -1.02 0.00 0.00 57.50 56.50 1dx7 n TRP 47 Cb 0.50 0.53 0.00 0.00 -2.42 0.00 0.00 31.31 29.92 1dx7 n TRP 47 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01