#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwx h VAL 2 N 0.00 1.33 -0.56 0.44 -1.51 -2.12 -3.46 116.25 110.37 1bwx h VAL 2 Ca 0.00 -1.85 -0.61 0.00 -1.23 0.00 0.00 66.70 63.01 1bwx h VAL 2 Cb 0.00 1.83 -0.08 0.00 -2.13 0.00 0.00 31.29 30.91 1bwx h VAL 2 CO 0.00 0.57 -0.39 -0.55 -1.23 0.00 0.00 177.57 175.97 1bwx s SER 3 N -6.93 4.45 0.36 4.19 0.15 -1.26 -5.04 113.70 109.64 1bwx s SER 3 Ca -0.07 -1.37 0.26 0.00 0.70 0.00 0.00 55.95 55.47 1bwx s SER 3 Cb 0.11 0.39 0.74 0.00 -1.71 0.00 0.00 66.02 65.56 1bwx s SER 3 CO 0.84 -0.98 1.74 -0.08 1.20 0.00 0.00 173.24 175.95 1bwx h GLU 4 N 0.99 0.00 0.00 5.44 4.81 -2.08 -3.47 114.58 120.27 1bwx h GLU 4 Ca -0.40 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1bwx h GLU 4 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1bwx h GLU 4 CO 0.64 0.00 0.00 -0.89 -0.73 0.00 0.00 179.01 178.03 1bwx n ILE 5 N -2.72 0.00 0.00 2.32 2.08 -1.26 -4.68 119.36 115.09 1bwx n ILE 5 Ca 0.04 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.35 1bwx n ILE 5 Cb 0.42 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.31 1bwx n ILE 5 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1bwx n GLN 6 N 0.00 0.00 0.29 0.38 1.13 -1.26 -4.20 117.38 113.72 1bwx n GLN 6 Ca 0.00 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.94 1bwx n GLN 6 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.29 1bwx n GLN 6 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1bwx h LEU 7 N 0.00 -0.65 -1.60 1.08 -0.00 -1.90 0.17 115.31 112.41 1bwx h LEU 7 Ca 0.00 0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 57.88 1bwx h LEU 7 Cb 0.00 0.17 -0.00 0.00 -0.00 0.00 0.00 40.66 40.82 1bwx h LEU 7 CO 0.00 -0.34 -0.12 0.24 -0.00 0.00 0.00 178.44 178.23 1bwx h MET 8 N -1.02 0.00 0.01 1.13 2.86 -1.95 -3.15 114.93 112.80 1bwx h MET 8 Ca -0.08 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1bwx h MET 8 Cb 0.59 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1bwx h MET 8 CO 0.13 0.12 -0.00 1.25 1.06 0.00 0.00 176.91 179.46 1bwx h HIS 9 N 0.00 -0.01 -3.54 -0.22 -0.00 -1.81 -3.42 115.15 106.15 1bwx h HIS 9 Ca -0.00 -0.00 -0.64 0.00 -0.00 0.00 0.00 60.37 59.72 1bwx h HIS 9 Cb 0.50 0.00 -0.40 0.00 -0.00 0.00 0.00 27.41 27.51 1bwx h HIS 9 CO 0.00 0.83 -0.71 -0.80 -0.00 0.00 0.00 177.93 177.25 1bwx s ASN 10 N -6.05 4.55 -0.11 3.26 0.01 0.60 -4.97 114.94 112.22 1bwx s ASN 10 Ca -0.18 -2.26 -0.01 0.00 -0.71 0.00 0.00 52.86 49.71 1bwx s ASN 10 Cb -0.02 -1.50 0.03 0.00 0.41 0.00 0.00 41.25 40.17 1bwx s ASN 10 CO 0.66 -0.35 -0.04 -1.48 -1.51 0.00 0.00 177.10 174.38 1bwx s LEU 11 N 0.77 1.04 -1.37 0.60 0.05 -1.23 -4.57 118.68 113.96 1bwx s LEU 11 Ca 0.12 -0.32 -0.05 0.00 0.05 0.00 0.00 54.13 53.93 1bwx s LEU 11 Cb -0.20 -0.69 0.03 0.00 -2.05 0.00 0.00 46.19 43.28 1bwx s LEU 11 CO -0.09 -0.17 0.86 0.61 -0.55 0.00 0.00 176.35 177.01 1bwx n GLY 12 N 5.02 -0.38 1.15 -3.48 0.00 -1.26 -4.90 105.19 101.33 1bwx n GLY 12 Ca -0.10 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1bwx n GLY 12 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bwx n LYS 13 N -4.45 0.00 0.12 1.61 4.81 -1.26 -4.85 118.16 114.14 1bwx n LYS 13 Ca -0.17 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.34 1bwx n LYS 13 Cb 0.62 -0.44 0.02 0.00 0.02 0.00 0.00 35.03 35.25 1bwx n LYS 13 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1bwx h HIS 14 N 0.00 0.00 -5.12 5.64 3.86 -1.93 -3.49 115.15 114.10 1bwx h HIS 14 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1bwx h HIS 14 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1bwx h HIS 14 CO 0.00 0.26 -0.38 1.28 0.86 0.00 0.00 177.93 179.95 1bwx n LEU 15 N -2.95 -7.32 0.04 2.43 4.77 -1.26 -4.99 117.00 107.72 1bwx n LEU 15 Ca -0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1bwx n LEU 15 Cb 0.66 -3.21 0.00 0.00 -2.33 0.00 0.00 43.42 38.54 1bwx n LEU 15 CO 0.40 -1.99 0.00 0.59 -1.33 0.00 0.00 177.39 175.06 1bwx n ASN 16 N -0.56 0.73 0.03 -1.43 5.03 -1.26 -4.63 115.26 113.18 1bwx n ASN 16 Ca 0.09 0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.66 1bwx n ASN 16 Cb 0.44 -0.21 0.00 0.00 -1.02 0.00 0.00 39.78 38.99 1bwx n ASN 16 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1bwx n SER 17 N -3.21 0.01 0.15 6.41 7.64 -1.26 -4.55 113.62 118.82 1bwx n SER 17 Ca 0.00 0.11 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1bwx n SER 17 Cb 0.00 0.07 0.27 0.00 -1.01 0.00 0.00 64.21 63.55 1bwx n SER 17 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1bwx h MET 18 N 0.00 0.04 0.19 1.43 1.85 -2.00 -1.76 114.93 114.69 1bwx h MET 18 Ca 0.00 -0.02 -0.29 0.00 -0.61 0.00 0.00 59.70 58.78 1bwx h MET 18 Cb 0.00 0.00 0.03 0.00 0.43 0.00 0.00 31.60 32.06 1bwx h MET 18 CO 0.00 0.50 -1.24 0.93 -0.40 0.00 0.00 176.91 176.70 1bwx h GLU 19 N 0.04 0.49 0.45 0.39 5.08 -1.94 -3.29 114.58 115.81 1bwx h GLU 19 Ca -0.00 -0.79 -0.02 0.00 -1.00 0.00 0.00 59.36 57.55 1bwx h GLU 19 Cb 0.83 0.29 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1bwx h GLU 19 CO 0.06 1.37 -0.22 0.00 -1.00 0.00 0.00 179.01 179.23 1bwx h ARG 20 N 0.03 -0.59 -1.03 2.33 3.08 -1.77 -1.98 114.38 114.46 1bwx h ARG 20 Ca -0.21 0.04 0.28 0.00 0.07 0.00 0.00 59.98 60.16 1bwx h ARG 20 Cb 1.96 0.13 -0.12 0.00 0.08 0.00 0.00 29.97 32.02 1bwx h ARG 20 CO 0.23 -0.34 0.62 -0.24 -1.07 0.00 0.00 179.97 179.17 1bwx h VAL 21 N -0.70 0.45 -0.28 2.04 3.04 -1.48 0.25 116.25 119.58 1bwx h VAL 21 Ca -0.06 -0.16 -0.09 0.00 -1.01 0.00 0.00 66.70 65.38 1bwx h VAL 21 Cb 0.51 -0.04 -0.01 0.00 -2.01 0.00 0.00 31.29 29.75 1bwx h VAL 21 CO 0.10 0.08 -0.18 -0.08 -1.01 0.00 0.00 177.57 176.49 1bwx h GLU 22 N 0.46 0.61 -0.46 4.17 4.22 -1.58 -2.87 114.58 119.13 1bwx h GLU 22 Ca 0.67 -0.29 0.05 0.00 0.08 0.00 0.00 59.36 59.87 1bwx h GLU 22 Cb 1.46 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.66 1bwx h GLU 22 CO -0.47 0.87 0.19 2.35 -2.18 0.00 0.00 179.01 179.77 1bwx h TRP 23 N 0.34 0.34 -0.79 0.92 7.01 0.19 -2.12 115.95 121.84 1bwx h TRP 23 Ca 0.06 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.15 1bwx h TRP 23 Cb 0.71 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.63 1bwx h TRP 23 CO 0.07 0.14 0.47 -0.07 -2.79 0.00 0.00 178.44 176.26 1bwx h LEU 24 N 0.38 0.72 -0.62 0.65 -0.00 -1.00 0.26 115.31 115.70 1bwx h LEU 24 Ca 0.21 0.03 0.01 0.00 -0.00 0.00 0.00 57.88 58.13 1bwx h LEU 24 Cb 0.19 -0.12 -0.03 0.00 -0.00 0.00 0.00 40.66 40.69 1bwx h LEU 24 CO -0.20 0.45 0.41 0.03 -0.00 0.00 0.00 178.44 179.13 1bwx h ARG 25 N 0.85 0.80 -0.25 1.13 3.08 -1.17 0.11 114.38 118.92 1bwx h ARG 25 Ca 0.36 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 60.19 1bwx h ARG 25 Cb 0.22 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1bwx h ARG 25 CO -0.19 0.53 -0.50 0.87 -1.07 0.00 0.00 179.97 179.60 1bwx h LYS 26 N 0.82 0.79 -0.59 0.04 6.56 -0.91 -2.72 116.57 120.56 1bwx h LYS 26 Ca 0.23 -0.51 -0.05 0.00 -1.06 0.00 0.00 60.65 59.27 1bwx h LYS 26 Cb -0.07 0.06 -0.03 0.00 -0.57 0.00 0.00 32.23 31.63 1bwx h LYS 26 CO -0.06 1.14 0.18 -0.22 -2.06 0.00 0.00 179.45 178.43 1bwx h LYS 27 N 0.54 0.89 -0.29 3.15 1.63 -0.19 0.59 116.57 122.90 1bwx h LYS 27 Ca 0.01 -0.17 -0.06 0.00 -0.85 0.00 0.00 60.65 59.58 1bwx h LYS 27 Cb 1.11 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.59 1bwx h LYS 27 CO 0.11 0.77 -0.07 -0.07 -3.45 0.00 0.00 179.45 176.75 1bwx h LEU 28 N 0.87 0.56 -0.01 5.20 3.38 -0.77 -2.88 115.31 121.65 1bwx h LEU 28 Ca 0.20 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1bwx h LEU 28 Cb 0.25 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1bwx h LEU 28 CO -0.01 0.79 -0.01 0.00 0.09 0.00 0.00 178.44 179.30 1bwx n GLN 29 N -4.50 0.40 0.35 1.13 10.64 -1.03 -3.85 117.38 120.52 1bwx n GLN 29 Ca -0.03 -0.01 -0.18 0.00 -1.83 0.00 0.00 57.00 54.95 1bwx n GLN 29 Cb 0.31 -1.50 -0.09 0.00 -0.86 0.00 0.00 30.24 28.10 1bwx n GLN 29 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 1bwx h ASP 30 N 0.02 -0.73 0.43 2.61 3.32 -0.65 0.28 116.42 121.70 1bwx h ASP 30 Ca 0.00 0.02 -0.13 0.00 0.02 0.00 0.00 57.03 56.94 1bwx h ASP 30 Cb 0.31 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1bwx h ASP 30 CO 0.00 -0.52 -0.58 1.62 -1.72 0.00 0.00 179.24 178.04 1bwx h VAL 31 N -0.86 1.39 -0.09 -1.35 3.04 -1.72 0.60 116.25 117.26 1bwx h VAL 31 Ca -0.09 -1.94 -0.00 0.00 -1.01 0.00 0.00 66.70 63.66 1bwx h VAL 31 Cb 0.66 2.00 -0.00 0.00 -2.01 0.00 0.00 31.29 31.93 1bwx h VAL 31 CO 0.14 0.57 0.05 -0.74 -1.01 0.00 0.00 177.57 176.58 1bwx h HIS 32 N 0.11 0.11 0.05 3.17 -0.00 -1.62 -2.84 115.15 114.13 1bwx h HIS 32 Ca -0.00 -0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.20 1bwx h HIS 32 Cb 1.05 -0.04 0.02 0.00 -0.00 0.00 0.00 27.41 28.44 1bwx h HIS 32 CO 0.01 0.12 -0.67 -0.91 -0.00 0.00 0.00 177.93 176.48 1bwx h ASN 33 N 0.07 0.50 -3.67 3.26 2.35 -0.94 -3.38 115.58 113.77 1bwx h ASN 33 Ca 0.03 -0.83 -0.78 0.00 -0.55 0.00 0.00 56.30 54.17 1bwx h ASN 33 Cb 0.04 -0.16 -0.29 0.00 0.05 0.00 0.00 38.32 37.97 1bwx h ASN 33 CO -0.01 1.28 0.21 -0.36 -1.65 0.00 0.00 177.43 176.90 1bwx s PHE 34 N -2.93 4.00 -0.15 1.19 0.08 0.20 -4.86 117.98 115.50 1bwx s PHE 34 Ca -0.13 -2.51 -0.17 0.00 0.12 0.00 0.00 56.93 54.24 1bwx s PHE 34 Cb 0.03 -3.71 -0.14 0.00 -0.57 0.00 0.00 43.02 38.63 1bwx s PHE 34 CO 0.82 -0.93 0.24 0.28 -0.10 0.00 0.00 175.22 175.54 1bwx h VAL 35 N 4.19 0.79 -2.01 -0.44 2.07 -1.70 -3.38 116.25 115.77 1bwx h VAL 35 Ca 0.14 -1.74 0.21 0.00 0.82 0.00 0.00 66.70 66.12 1bwx h VAL 35 Cb 0.93 1.64 -0.10 0.00 -1.52 0.00 0.00 31.29 32.23 1bwx h VAL 35 CO 0.88 0.27 -0.66 0.00 0.02 0.00 0.00 177.57 178.08 1bwx n ALA 36 N -3.11 -2.20 -3.73 1.67 0.00 -1.26 -4.93 120.51 106.95 1bwx n ALA 36 Ca -0.14 0.49 -0.29 0.00 0.00 0.00 0.00 53.44 53.50 1bwx n ALA 36 Cb 0.40 -0.89 -0.15 0.00 0.00 0.00 0.00 19.45 18.81 1bwx n ALA 36 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1bwx s LEU 37 N -6.07 1.79 0.00 0.00 2.96 -1.26 -4.92 118.68 111.18 1bwx s LEU 37 Ca 0.00 -1.35 0.00 0.00 -0.22 0.00 0.00 54.13 52.56 1bwx s LEU 37 Cb 0.00 -0.75 0.00 0.00 0.50 0.00 0.00 46.19 45.94 1bwx s LEU 37 CO 0.00 -0.38 0.00 0.61 -1.32 0.00 0.00 176.35 175.26 1bwx n GLY 38 N 4.94 2.12 0.52 7.98 0.00 -1.26 -5.37 105.19 114.12 1bwx n GLY 38 Ca -0.05 -0.20 0.07 0.00 0.00 0.00 0.00 46.02 45.83 1bwx n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32