#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 1.06 0.00 0.44 3.04 -2.11 -3.41 116.25 115.26 1bwx h VAL 2 Ca 0.00 -2.63 0.00 0.00 -1.01 0.00 0.00 66.70 63.06 1bwx h VAL 2 Cb 0.00 2.80 0.00 0.00 -2.01 0.00 0.00 31.29 32.08 1bwx h VAL 2 CO 0.00 0.84 -0.43 -0.24 -1.01 0.00 0.00 177.57 176.73 1bwx n SER 3 N -3.56 1.42 0.00 3.17 2.88 -1.26 -5.05 113.62 111.23 1bwx n SER 3 Ca -0.21 0.53 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 1bwx n SER 3 Cb 1.07 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 1bwx n SER 3 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1bwx n GLU 4 N -4.10 0.00 -2.80 -1.46 2.13 -1.26 -5.04 120.64 108.12 1bwx n GLU 4 Ca -0.06 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.65 1bwx n GLU 4 Cb 0.22 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.92 1bwx n GLU 4 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1bwx n ILE 5 N 0.00 -0.34 -0.11 6.31 3.06 -1.26 -4.80 119.36 122.21 1bwx n ILE 5 Ca 0.00 0.00 -0.20 0.00 -2.50 0.00 0.00 62.75 60.05 1bwx n ILE 5 Cb 0.00 -0.87 -0.09 0.00 0.54 0.00 0.00 39.64 39.22 1bwx n ILE 5 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1bwx n GLN 6 N -2.92 0.52 0.23 9.51 3.00 -1.26 -4.44 117.38 122.01 1bwx n GLN 6 Ca -0.04 0.17 0.06 0.00 -0.01 0.00 0.00 57.00 57.19 1bwx n GLN 6 Cb 0.54 -1.38 0.53 0.00 0.00 0.00 0.00 30.24 29.92 1bwx n GLN 6 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1bwx h LEU 7 N -0.43 0.00 -0.74 1.08 3.38 -1.87 -1.78 115.31 114.94 1bwx h LEU 7 Ca -0.54 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.47 1bwx h LEU 7 Cb 1.64 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.34 1bwx h LEU 7 CO -0.22 0.16 0.46 0.24 0.09 0.00 0.00 178.44 179.16 1bwx h MET 8 N 0.00 0.85 0.00 1.13 2.86 -1.96 -1.21 114.93 116.59 1bwx h MET 8 Ca -0.00 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1bwx h MET 8 Cb 0.28 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1bwx h MET 8 CO 0.02 0.56 -0.10 1.25 1.06 0.00 0.00 176.91 179.70 1bwx h HIS 9 N 0.87 0.10 -3.08 -0.22 -0.00 -1.67 -3.43 115.15 107.73 1bwx h HIS 9 Ca 0.31 -0.06 -0.56 0.00 -0.00 0.00 0.00 60.37 60.06 1bwx h HIS 9 Cb 0.07 -0.01 -0.40 0.00 -0.00 0.00 0.00 27.41 27.07 1bwx h HIS 9 CO -0.04 0.88 -0.76 -0.80 -0.00 0.00 0.00 177.93 177.20 1bwx s ASN 10 N -6.16 3.75 -1.33 3.26 0.01 -0.71 -5.04 114.94 108.72 1bwx s ASN 10 Ca -0.17 -1.43 -0.17 0.00 -0.71 0.00 0.00 52.86 50.38 1bwx s ASN 10 Cb -0.01 -0.69 0.07 0.00 0.41 0.00 0.00 41.25 41.03 1bwx s ASN 10 CO 0.71 -0.41 1.82 -0.11 -1.51 0.00 0.00 177.10 177.60 1bwx n LEU 11 N 4.98 5.36 -2.10 0.60 7.94 -0.47 -4.01 117.00 129.29 1bwx n LEU 11 Ca -0.04 -4.01 -0.10 0.00 -1.11 0.00 0.00 56.01 50.75 1bwx n LEU 11 Cb 0.43 -1.72 0.04 0.00 0.53 0.00 0.00 43.42 42.70 1bwx n LEU 11 CO 0.10 0.39 0.09 0.61 -1.11 0.00 0.00 177.39 177.47 1bwx n GLY 12 N 5.03 0.14 5.39 -3.96 0.00 -1.26 -4.27 105.19 106.25 1bwx n GLY 12 Ca 0.49 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -2.65 0.00 -3.15 1.61 3.00 -1.26 -4.25 118.16 111.47 1bwx n LYS 13 Ca -0.06 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.30 1bwx n LYS 13 Cb 0.55 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.58 1bwx n LYS 13 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1bwx s HIS 14 N 0.00 -1.50 0.00 5.64 5.04 -1.26 -4.91 115.29 118.30 1bwx s HIS 14 Ca 0.00 0.92 0.00 0.00 -1.54 0.00 0.00 55.06 54.44 1bwx s HIS 14 Cb 0.00 0.27 0.00 0.00 0.04 0.00 0.00 32.58 32.89 1bwx s HIS 14 CO 0.00 -0.87 0.00 1.28 -2.34 0.00 0.00 174.74 172.81 1bwx n LEU 15 N 5.35 0.00 -3.21 8.88 4.77 -1.26 -5.05 117.00 126.48 1bwx n LEU 15 Ca 0.05 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.08 1bwx n LEU 15 Cb 0.55 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.61 1bwx n LEU 15 CO -0.08 0.00 0.72 0.21 -1.33 0.00 0.00 177.39 176.91 1bwx s ASN 16 N 1.00 -0.31 0.40 -1.43 2.47 -1.26 -4.86 114.94 110.95 1bwx s ASN 16 Ca 0.00 0.30 0.00 0.00 0.42 0.00 0.00 52.86 53.58 1bwx s ASN 16 Cb 0.00 1.30 0.00 0.00 -1.45 0.00 0.00 41.25 41.10 1bwx s ASN 16 CO 0.00 -0.06 0.00 -1.20 -3.72 0.00 0.00 177.10 172.12 1bwx n SER 17 N 5.10 0.00 -0.06 -4.21 7.64 -1.26 -0.68 113.62 120.14 1bwx n SER 17 Ca -0.08 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.79 1bwx n SER 17 Cb 0.54 0.00 0.26 0.00 -1.01 0.00 0.00 64.21 64.00 1bwx n SER 17 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1bwx h MET 18 N 0.00 0.67 0.00 1.43 2.86 -1.99 -1.38 114.93 116.52 1bwx h MET 18 Ca 0.00 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1bwx h MET 18 Cb 0.00 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 1bwx h MET 18 CO 0.00 0.63 -0.03 0.93 1.06 0.00 0.00 176.91 179.49 1bwx h GLU 19 N 0.65 0.00 -0.78 1.72 3.07 -1.30 -2.51 114.58 115.43 1bwx h GLU 19 Ca 0.15 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.45 1bwx h GLU 19 Cb 0.27 0.00 -0.37 0.00 -0.84 0.00 0.00 28.75 27.82 1bwx h GLU 19 CO 0.00 0.03 -0.31 -2.13 -1.40 0.00 0.00 179.01 175.20 1bwx n ARG 20 N -3.17 3.24 0.02 2.33 0.00 -0.53 -4.01 116.66 114.54 1bwx n ARG 20 Ca -0.00 -3.86 0.00 0.00 -0.00 0.00 0.00 57.85 53.98 1bwx n ARG 20 Cb 0.26 -2.25 0.00 0.00 0.00 0.00 0.00 32.46 30.47 1bwx n ARG 20 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 1bwx n VAL 21 N -0.80 0.00 0.22 5.15 3.14 -1.12 -4.82 118.33 120.11 1bwx n VAL 21 Ca 0.48 0.00 0.08 0.00 -2.96 0.00 0.00 64.34 61.94 1bwx n VAL 21 Cb 0.89 -0.34 0.49 0.00 -1.06 0.00 0.00 33.84 33.82 1bwx n VAL 21 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1bwx h GLU 22 N 0.00 0.00 -0.87 1.45 3.07 -1.71 -2.73 114.58 113.79 1bwx h GLU 22 Ca 0.00 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.96 1bwx h GLU 22 Cb 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.85 1bwx h GLU 22 CO 0.00 0.27 0.56 0.11 -1.40 0.00 0.00 179.01 178.55 1bwx h TRP 23 N 0.00 0.91 0.00 4.33 5.08 -1.75 -1.35 115.95 123.18 1bwx h TRP 23 Ca -0.00 0.02 -0.18 0.00 1.08 0.00 0.00 58.89 59.81 1bwx h TRP 23 Cb 0.61 -0.30 -0.03 0.00 -3.00 0.00 0.00 29.16 26.45 1bwx h TRP 23 CO 0.00 0.42 -0.86 -0.07 -1.28 0.00 0.00 178.44 176.65 1bwx h LEU 24 N 0.85 0.00 -0.68 0.11 3.38 -1.82 -1.58 115.31 115.58 1bwx h LEU 24 Ca 0.40 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.40 1bwx h LEU 24 Cb 0.41 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1bwx h LEU 24 CO -0.17 0.86 0.43 -0.09 0.09 0.00 0.00 178.44 179.56 1bwx h ARG 25 N 0.00 0.82 0.12 1.13 2.43 -1.23 0.52 114.38 118.17 1bwx h ARG 25 Ca -0.01 -0.05 -0.28 0.00 -0.81 0.00 0.00 59.98 58.83 1bwx h ARG 25 Cb 1.54 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1bwx h ARG 25 CO 0.11 0.54 -1.45 -0.22 -1.51 0.00 0.00 179.97 177.44 1bwx h LYS 26 N 0.84 0.26 -0.79 0.20 3.11 -1.59 -3.24 116.57 115.37 1bwx h LYS 26 Ca 0.27 -0.44 0.14 0.00 -2.81 0.00 0.00 60.65 57.81 1bwx h LYS 26 Cb -0.00 0.16 -0.09 0.00 -1.00 0.00 0.00 32.23 31.30 1bwx h LYS 26 CO -0.10 1.21 0.36 -0.22 -2.81 0.00 0.00 179.45 177.89 1bwx h LYS 27 N -0.26 0.52 -0.30 1.90 3.64 -1.21 0.46 116.57 121.31 1bwx h LYS 27 Ca -0.31 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 58.94 1bwx h LYS 27 Cb 1.79 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.49 1bwx h LYS 27 CO 0.07 0.34 -0.21 1.25 -2.27 0.00 0.00 179.45 178.63 1bwx h LEU 28 N 0.53 0.71 -3.53 5.20 5.85 -1.04 -3.02 115.31 120.01 1bwx h LEU 28 Ca 0.43 -0.44 -0.37 0.00 0.84 0.00 0.00 57.88 58.34 1bwx h LEU 28 Cb 0.61 -0.20 -0.22 0.00 0.37 0.00 0.00 40.66 41.22 1bwx h LEU 28 CO -0.37 1.00 0.47 0.00 -0.34 0.00 0.00 178.44 179.19 1bwx n GLN 29 N -4.32 2.21 -0.06 1.25 1.13 -0.69 -4.41 117.38 112.49 1bwx n GLN 29 Ca -0.03 -2.40 -0.05 0.00 -1.94 0.00 0.00 57.00 52.57 1bwx n GLN 29 Cb 0.42 -1.96 -0.04 0.00 0.11 0.00 0.00 30.24 28.78 1bwx n GLN 29 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1bwx h ASP 30 N 1.04 0.00 -0.40 1.08 3.32 0.01 -2.19 116.42 119.28 1bwx h ASP 30 Ca 0.46 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.22 1bwx h ASP 30 Cb 2.41 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.94 1bwx h ASP 30 CO 0.83 0.73 0.12 0.58 -1.72 0.00 0.00 179.24 179.78 1bwx h VAL 31 N -1.00 1.20 -0.54 -1.35 2.07 -1.77 -2.38 116.25 112.49 1bwx h VAL 31 Ca -0.03 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 1bwx h VAL 31 Cb 0.40 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1bwx h VAL 31 CO -0.02 0.26 0.24 0.45 0.02 0.00 0.00 177.57 178.52 1bwx h HIS 32 N 0.68 0.79 -2.41 1.57 3.86 -1.77 -3.23 115.15 114.63 1bwx h HIS 32 Ca 0.15 -0.05 -0.69 0.00 -1.16 0.00 0.00 60.37 58.62 1bwx h HIS 32 Cb 0.24 -0.24 -0.35 0.00 1.06 0.00 0.00 27.41 28.11 1bwx h HIS 32 CO 0.01 0.63 0.08 0.09 0.86 0.00 0.00 177.93 179.61 1bwx n ASN 33 N -4.55 5.36 -3.92 2.45 4.13 -0.82 -5.01 115.26 112.90 1bwx n ASN 33 Ca 0.03 -3.55 -0.20 0.00 1.68 0.00 0.00 54.58 52.53 1bwx n ASN 33 Cb 0.14 -0.90 -0.16 0.00 -1.54 0.00 0.00 39.78 37.31 1bwx n ASN 33 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1bwx s PHE 34 N -3.18 0.85 0.14 3.10 2.19 -1.02 -4.81 117.98 115.25 1bwx s PHE 34 Ca 0.40 -0.25 0.00 0.00 0.33 0.00 0.00 56.93 57.40 1bwx s PHE 34 Cb 0.16 -0.71 0.00 0.00 -1.31 0.00 0.00 43.02 41.16 1bwx s PHE 34 CO -0.03 -0.19 0.00 0.28 1.83 0.00 0.00 175.22 177.10 1bwx n VAL 35 N 3.94 0.30 0.25 3.12 0.31 -1.26 -5.04 118.33 119.94 1bwx n VAL 35 Ca -0.25 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1bwx n VAL 35 Cb 0.51 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 1bwx n VAL 35 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bwx n ALA 36 N -3.11 0.07 -2.55 3.52 0.00 -1.26 -5.09 120.51 112.09 1bwx n ALA 36 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1bwx n ALA 36 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 -6.99 4.33 -0.68 0.00 0.20 -1.26 -4.96 118.68 109.32 1bwx s LEU 37 Ca 0.00 -0.04 0.04 0.00 0.69 0.00 0.00 54.13 54.82 1bwx s LEU 37 Cb 0.00 -2.80 0.34 0.00 -0.43 0.00 0.00 46.19 43.30 1bwx s LEU 37 CO 0.00 -0.70 1.16 0.61 -0.29 0.00 0.00 176.35 177.13 1bwx n GLY 38 N 4.82 5.75 0.00 7.98 0.00 -1.26 -5.11 105.19 117.37 1bwx n GLY 38 Ca -0.01 -2.74 0.00 0.00 0.00 0.00 0.00 46.02 43.27 1bwx n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32