#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1abz h TRP 2 N 0.00 0.79 -0.84 -0.67 5.08 -2.02 0.94 115.95 119.23 1abz h TRP 2 Ca 0.00 0.03 0.07 0.00 1.08 0.00 0.00 58.89 60.07 1abz h TRP 2 Cb 0.00 -0.23 -0.07 0.00 -3.00 0.00 0.00 29.16 25.86 1abz h TRP 2 CO 0.00 0.13 0.51 -0.07 -1.28 0.00 0.00 178.44 177.73 1abz h LEU 3 N 0.53 0.78 -1.54 0.11 3.38 -2.00 0.41 115.31 116.98 1abz h LEU 3 Ca 0.57 0.03 0.28 0.00 0.09 0.00 0.00 57.88 58.85 1abz h LEU 3 Cb 1.23 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.77 1abz h LEU 3 CO -0.31 0.48 0.71 0.50 0.09 0.00 0.00 178.44 179.90 1abz h LYS 4 N 0.90 0.28 0.18 1.13 3.64 -1.23 0.86 116.57 122.33 1abz h LYS 4 Ca 0.38 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.74 1abz h LYS 4 Cb 0.24 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1abz h LYS 4 CO -0.20 0.18 -0.08 0.00 -2.27 0.00 0.00 179.45 177.08 1abz h ALA 5 N 1.57 -0.24 0.00 5.00 0.00 -0.99 -3.01 119.26 121.59 1abz h ALA 5 Ca 0.58 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1abz h ALA 5 Cb 1.68 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1abz h ALA 5 CO -0.22 -0.35 0.00 2.89 0.00 0.00 0.00 179.25 181.57 1abz n ARG 6 N -4.96 0.79 -0.01 0.00 -4.01 -0.22 -3.04 116.66 105.21 1abz n ARG 6 Ca -0.08 0.00 -0.16 0.00 -1.04 0.00 0.00 57.85 56.57 1abz n ARG 6 Cb 0.26 -1.37 -0.14 0.00 -3.04 0.00 0.00 32.46 28.17 1abz n ARG 6 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1abz n VAL 7 N -0.87 1.70 -0.04 8.89 0.31 0.28 -3.38 118.33 125.23 1abz n VAL 7 Ca 0.14 -0.72 -0.12 0.00 -0.01 0.00 0.00 64.34 63.63 1abz n VAL 7 Cb 0.06 -1.41 -0.06 0.00 -0.91 0.00 0.00 33.84 31.52 1abz n VAL 7 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1abz h GLU 8 N 0.04 0.21 -0.70 5.55 5.08 -1.45 -2.37 114.58 120.94 1abz h GLU 8 Ca -0.37 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 57.90 1abz h GLU 8 Cb 2.03 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 31.22 1abz h GLU 8 CO 0.08 0.42 0.33 0.37 -1.00 0.00 0.00 179.01 179.22 1abz h GLN 9 N -0.03 0.99 -0.42 2.33 4.15 -1.74 -2.53 115.11 117.86 1abz h GLN 9 Ca 0.04 -0.13 0.01 0.00 0.77 0.00 0.00 58.65 59.33 1abz h GLN 9 Cb 0.32 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.80 1abz h GLN 9 CO 0.00 0.76 0.27 1.49 -1.93 0.00 0.00 178.83 179.43 1abz h GLU 10 N 0.99 0.53 -1.00 1.69 4.22 -1.52 0.70 114.58 120.18 1abz h GLU 10 Ca 0.24 -0.03 0.06 0.00 0.08 0.00 0.00 59.36 59.71 1abz h GLU 10 Cb 0.10 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.16 1abz h GLU 10 CO -0.03 0.35 0.65 -0.07 -2.18 0.00 0.00 179.01 177.73 1abz h LEU 11 N 0.55 1.04 -0.49 1.64 3.38 -1.01 -0.07 115.31 120.35 1abz h LEU 11 Ca 0.16 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1abz h LEU 11 Cb -0.04 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 1abz h LEU 11 CO -0.05 0.66 -0.16 -0.61 0.09 0.00 0.00 178.44 178.37 1abz h GLN 12 N 1.18 0.00 0.00 1.13 4.15 -1.13 -3.05 115.11 117.39 1abz h GLN 12 Ca 0.43 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.80 1abz h GLN 12 Cb 0.16 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 1abz h GLN 12 CO -0.17 0.16 -0.23 0.00 -1.93 0.00 0.00 178.83 176.66 1abz h ALA 13 N 1.84 1.54 0.05 3.38 0.00 0.11 -2.30 119.26 123.88 1abz h ALA 13 Ca -0.00 -0.21 -0.23 0.00 0.00 0.00 0.00 54.91 54.46 1abz h ALA 13 Cb 0.95 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1abz h ALA 13 CO 0.02 0.29 -1.07 1.25 0.00 0.00 0.00 179.25 179.74 1abz h LEU 14 N 0.00 0.23 -0.07 0.00 5.85 -1.40 -3.18 115.31 116.75 1abz h LEU 14 Ca -0.00 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 1abz h LEU 14 Cb 0.43 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 1abz h LEU 14 CO 0.03 1.15 0.02 -0.08 -0.34 0.00 0.00 178.44 179.22 1abz h GLU 15 N 0.05 0.10 0.00 1.25 4.57 -1.46 -1.63 114.58 117.47 1abz h GLU 15 Ca -0.07 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1abz h GLU 15 Cb 1.80 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.37 1abz h GLU 15 CO 0.16 0.26 0.00 0.00 -1.18 0.00 0.00 179.01 178.25 1abz n ALA 16 N -2.21 1.49 -1.38 2.92 0.00 -1.02 -2.09 120.51 118.22 1abz n ALA 16 Ca -0.06 -0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.11 1abz n ALA 16 Cb 0.13 -1.16 0.14 0.00 0.00 0.00 0.00 19.45 18.56 1abz n ALA 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1abz n ARG 17 N -1.44 2.41 0.00 0.00 1.74 -0.62 -4.95 116.66 113.80 1abz n ARG 17 Ca 0.03 -3.24 0.00 0.00 -0.77 0.00 0.00 57.85 53.87 1abz n ARG 17 Cb 0.10 -2.14 0.00 0.00 -1.02 0.00 0.00 32.46 29.40 1abz n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1abz n GLY 18 N -1.04 4.10 0.38 -0.13 0.00 -0.89 -5.01 105.19 102.60 1abz n GLY 18 Ca 0.54 -0.45 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1abz n GLY 18 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1abz n THR 19 N -1.21 0.78 -2.80 2.61 -2.24 -1.26 -4.67 114.28 105.48 1abz n THR 19 Ca 0.00 -0.89 -0.27 0.00 -2.27 0.00 0.00 64.05 60.62 1abz n THR 19 Cb 0.00 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 68.84 1abz n THR 19 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1abz n ASP 20 N 0.20 4.50 -0.66 3.42 -0.08 -1.26 -4.66 116.55 118.01 1abz n ASP 20 Ca 0.07 -3.69 -0.01 0.00 -1.51 0.00 0.00 54.79 49.65 1abz n ASP 20 Cb 0.32 -0.53 -0.01 0.00 2.34 0.00 0.00 41.12 43.24 1abz n ASP 20 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1abz n SER 21 N -0.31 -0.14 -1.05 1.67 2.88 -1.26 -4.97 113.62 110.44 1abz n SER 21 Ca 0.33 -0.34 0.06 0.00 -1.33 0.00 0.00 58.87 57.59 1abz n SER 21 Cb 0.48 0.04 0.22 0.00 -0.75 0.00 0.00 64.21 64.20 1abz n SER 21 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1abz n ASN 22 N -0.02 3.03 -0.03 -3.46 0.23 -1.26 -3.80 115.26 109.95 1abz n ASN 22 Ca -0.04 -2.24 -0.01 0.00 -0.53 0.00 0.00 54.58 51.76 1abz n ASN 22 Cb 0.33 -0.43 -0.07 0.00 -2.08 0.00 0.00 39.78 37.52 1abz n ASN 22 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1abz n ALA 23 N 0.63 1.97 0.97 -2.53 0.00 -1.26 -4.44 120.51 115.84 1abz n ALA 23 Ca 0.16 -0.47 0.04 0.00 0.00 0.00 0.00 53.44 53.17 1abz n ALA 23 Cb 0.57 -0.07 0.12 0.00 0.00 0.00 0.00 19.45 20.08 1abz n ALA 23 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1abz n GLU 24 N -2.17 1.79 0.28 0.00 -0.58 -1.25 -4.00 120.64 114.72 1abz n GLU 24 Ca -0.10 -1.00 0.19 0.00 -0.42 0.00 0.00 57.16 55.82 1abz n GLU 24 Cb 0.61 -1.33 0.92 0.00 -0.57 0.00 0.00 31.44 31.08 1abz n GLU 24 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1abz h LEU 25 N 1.54 0.00 -0.30 -4.62 4.07 -1.78 -1.17 115.31 113.06 1abz h LEU 25 Ca 0.00 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.83 1abz h LEU 25 Cb 0.51 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 1abz h LEU 25 CO 0.04 0.00 -0.60 0.03 -1.08 0.00 0.00 178.44 176.83 1abz h ARG 26 N 0.00 0.00 0.30 1.13 -0.00 -1.93 -2.95 114.38 110.92 1abz h ARG 26 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 1abz h ARG 26 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.16 1abz h ARG 26 CO 0.00 0.60 -0.14 0.00 0.00 0.00 0.00 179.97 180.43 1abz h ALA 27 N 1.40 -0.40 0.00 0.04 0.00 -1.51 -2.18 119.26 116.62 1abz h ALA 27 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1abz h ALA 27 Cb 1.33 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1abz h ALA 27 CO 0.08 -0.64 0.00 0.00 0.00 0.00 0.00 179.25 178.69 1abz h MET 28 N -0.56 0.00 -0.57 0.00 -0.00 -1.63 -2.81 114.93 109.36 1abz h MET 28 Ca -0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 59.60 1abz h MET 28 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.99 1abz h MET 28 CO 0.07 0.00 0.11 1.49 -0.00 0.00 0.00 176.91 178.57 1abz h GLU 29 N 0.00 0.93 0.40 -0.10 4.22 -1.21 -0.91 114.58 117.92 1abz h GLU 29 Ca 0.00 -0.24 -0.02 0.00 0.08 0.00 0.00 59.36 59.18 1abz h GLU 29 Cb 0.33 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1abz h GLU 29 CO 0.00 0.88 -0.19 0.00 -2.18 0.00 0.00 179.01 177.52 1abz h ALA 30 N 1.01 -1.11 -0.37 2.92 0.00 -1.38 -2.49 119.26 117.85 1abz h ALA 30 Ca 0.17 -0.12 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1abz h ALA 30 Cb 0.39 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1abz h ALA 30 CO 0.01 -1.07 0.40 0.87 0.00 0.00 0.00 179.25 179.46 1abz h LYS 31 N -0.56 0.00 0.00 0.00 1.57 -1.67 -2.77 116.57 113.14 1abz h LYS 31 Ca -0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1abz h LYS 31 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1abz h LYS 31 CO 0.09 0.00 -0.00 1.25 -0.57 0.00 0.00 179.45 180.22 1abz h LEU 32 N 0.00 -0.01 -0.80 2.94 5.85 -0.68 -0.20 115.31 122.40 1abz h LEU 32 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1abz h LEU 32 Cb 0.97 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1abz h LEU 32 CO -0.00 -0.00 0.00 2.29 -0.34 0.00 0.00 178.44 180.38 1abz n LYS 33 N -2.36 0.08 0.07 1.25 2.85 -1.07 -1.25 118.16 117.73 1abz n LYS 33 Ca -0.00 0.56 -0.07 0.00 -1.05 0.00 0.00 58.31 57.76 1abz n LYS 33 Cb 0.00 -1.76 -0.10 0.00 -0.65 0.00 0.00 35.03 32.52 1abz n LYS 33 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1abz h ALA 34 N 2.03 0.39 0.00 0.58 0.00 -0.87 -3.31 119.26 118.08 1abz h ALA 34 Ca 0.00 -0.89 -0.26 0.00 0.00 0.00 0.00 54.91 53.76 1abz h ALA 34 Cb 0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1abz h ALA 34 CO 0.00 1.22 -1.58 1.49 0.00 0.00 0.00 179.25 180.37 1abz h GLU 35 N 0.00 0.00 -1.37 0.00 4.81 0.31 -3.34 114.58 114.99 1abz h GLU 35 Ca -0.01 0.00 0.40 0.00 -0.13 0.00 0.00 59.36 59.62 1abz h GLU 35 Cb 1.73 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 31.03 1abz h GLU 35 CO 0.13 0.51 0.95 -0.84 -0.73 0.00 0.00 179.01 179.03 1abz h ILE 36 N 0.00 0.28 0.91 2.32 -0.00 -1.55 -0.03 117.51 119.43 1abz h ILE 36 Ca -0.24 -0.03 -0.04 0.00 -0.00 0.00 0.00 64.86 64.55 1abz h ILE 36 Cb 1.92 0.19 0.01 0.00 -0.00 0.00 0.00 36.82 38.94 1abz h ILE 36 CO 0.08 0.01 -0.43 1.56 -0.00 0.00 0.00 178.15 179.37 1abz h GLN 37 N 0.08 -1.17 0.00 0.16 1.08 -1.74 -3.47 115.11 110.05 1abz h GLN 37 Ca 0.70 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.98 1abz h GLN 37 Cb 2.55 0.27 0.00 0.00 -0.05 0.00 0.00 27.48 30.24 1abz h GLN 37 CO -0.13 -0.78 0.00 1.63 -0.95 0.00 0.00 178.83 178.60