#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 0.17 -0.64 -0.67 5.08 -2.03 0.82 115.95 118.68 1abz h TRP 2 Ca 0.00 0.01 0.06 0.00 1.08 0.00 0.00 58.89 60.03 1abz h TRP 2 Cb 0.00 -0.05 -0.05 0.00 -3.00 0.00 0.00 29.16 26.06 1abz h TRP 2 CO 0.00 0.02 0.35 -0.07 -1.28 0.00 0.00 178.44 177.46 1abz h LEU 3 N 0.10 0.52 -1.89 0.11 4.07 -2.00 0.63 115.31 116.85 1abz h LEU 3 Ca 0.54 0.03 0.24 0.00 0.08 0.00 0.00 57.88 58.77 1abz h LEU 3 Cb 1.94 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 43.57 1abz h LEU 3 CO -0.08 0.34 0.61 0.50 -1.08 0.00 0.00 178.44 178.73 1abz h LYS 4 N 0.65 0.08 0.15 1.13 3.64 -1.26 1.19 116.57 122.16 1abz h LYS 4 Ca 0.29 -0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.35 1abz h LYS 4 Cb 0.18 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1abz h LYS 4 CO -0.18 0.05 -1.49 0.00 -2.27 0.00 0.00 179.45 175.57 1abz h ALA 5 N 1.58 0.14 -0.28 5.00 0.00 -1.01 -3.27 119.26 121.42 1abz h ALA 5 Ca 0.42 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1abz h ALA 5 Cb 1.54 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1abz h ALA 5 CO -0.04 1.01 0.00 2.89 0.00 0.00 0.00 179.25 183.11 1abz n ARG 6 N -3.53 1.84 -0.09 0.00 -4.01 0.65 -4.01 116.66 107.52 1abz n ARG 6 Ca -0.16 -1.29 -0.22 0.00 -1.04 0.00 0.00 57.85 55.14 1abz n ARG 6 Cb 1.05 -1.36 -0.12 0.00 -3.04 0.00 0.00 32.46 29.00 1abz n ARG 6 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1abz h VAL 7 N 2.35 0.88 0.00 8.89 2.07 0.12 -3.23 116.25 127.33 1abz h VAL 7 Ca 0.00 -2.21 -0.01 0.00 0.82 0.00 0.00 66.70 65.30 1abz h VAL 7 Cb 0.52 2.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1abz h VAL 7 CO 0.00 0.40 -0.07 -0.08 0.02 0.00 0.00 177.57 177.85 1abz h GLU 8 N -0.83 0.00 -0.02 1.57 4.81 -1.71 -2.26 114.58 116.13 1abz h GLU 8 Ca -0.36 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.82 1abz h GLU 8 Cb 1.42 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.80 1abz h GLU 8 CO -0.16 0.07 -0.17 0.37 -0.73 0.00 0.00 179.01 178.38 1abz h GLN 9 N 0.00 0.15 -0.26 1.92 4.15 -1.70 -1.55 115.11 117.82 1abz h GLN 9 Ca -0.00 -0.14 -0.10 0.00 0.77 0.00 0.00 58.65 59.19 1abz h GLN 9 Cb 0.43 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1abz h GLN 9 CO 0.01 0.84 -0.25 1.05 -1.93 0.00 0.00 178.83 178.54 1abz h GLU 10 N -0.50 0.50 0.00 1.69 4.11 -1.54 -2.43 114.58 116.42 1abz h GLU 10 Ca -0.02 -0.19 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1abz h GLU 10 Cb 0.89 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1abz h GLU 10 CO 0.03 0.71 0.00 -0.07 0.07 0.00 0.00 179.01 179.76 1abz h LEU 11 N 0.44 0.00 -2.08 3.06 3.38 -1.46 -3.20 115.31 115.45 1abz h LEU 11 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1abz h LEU 11 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1abz h LEU 11 CO 0.05 0.00 0.07 0.06 0.09 0.00 0.00 178.44 178.71 1abz h GLN 12 N 0.00 0.00 0.13 1.13 -0.00 -0.75 -2.00 115.11 113.62 1abz h GLN 12 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.64 1abz h GLN 12 Cb 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.22 1abz h GLN 12 CO 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 178.83 178.77 1abz h ALA 13 N 1.85 -0.40 -0.70 0.06 0.00 -1.71 0.16 119.26 118.51 1abz h ALA 13 Ca 0.00 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1abz h ALA 13 Cb 0.13 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 1abz h ALA 13 CO 0.00 -0.38 0.37 -0.07 0.00 0.00 0.00 179.25 179.16 1abz h LEU 14 N -0.41 0.50 -1.09 0.00 -0.00 -1.75 -0.03 115.31 112.53 1abz h LEU 14 Ca -0.02 0.05 -0.09 0.00 -0.00 0.00 0.00 57.88 57.82 1abz h LEU 14 Cb 0.13 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 40.74 1abz h LEU 14 CO 0.03 0.30 -0.43 -0.08 -0.00 0.00 0.00 178.44 178.27 1abz h GLU 15 N 0.64 0.00 -0.65 1.13 4.81 -1.48 0.10 114.58 119.14 1abz h GLU 15 Ca 0.34 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.58 1abz h GLU 15 Cb 0.31 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1abz h GLU 15 CO -0.24 0.43 0.43 0.00 -0.73 0.00 0.00 179.01 178.90 1abz h ALA 16 N 1.57 1.56 -0.67 2.92 0.00 0.13 -3.35 119.26 121.42 1abz h ALA 16 Ca -0.00 -0.04 -0.33 0.00 0.00 0.00 0.00 54.91 54.53 1abz h ALA 16 Cb 0.82 -0.25 -0.23 0.00 0.00 0.00 0.00 17.79 18.13 1abz h ALA 16 CO 0.06 0.39 -0.70 2.89 0.00 0.00 0.00 179.25 181.89 1abz n ARG 17 N -4.44 0.82 -0.49 0.00 1.85 -1.06 -4.95 116.66 108.38 1abz n ARG 17 Ca 0.07 -2.28 0.05 0.00 -1.00 0.00 0.00 57.85 54.68 1abz n ARG 17 Cb 0.06 -1.35 0.20 0.00 -1.05 0.00 0.00 32.46 30.32 1abz n ARG 17 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1abz n GLY 18 N 1.24 4.83 1.98 2.89 0.00 0.34 -4.91 105.19 111.56 1abz n GLY 18 Ca 0.13 -1.20 -0.02 0.00 0.00 0.00 0.00 46.02 44.93 1abz n GLY 18 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1abz n THR 19 N -1.11 -5.34 -4.03 2.61 -1.04 -1.26 -4.17 114.28 99.94 1abz n THR 19 Ca 0.23 0.37 -0.36 0.00 -2.04 0.00 0.00 64.05 62.25 1abz n THR 19 Cb 0.81 -5.18 -0.01 0.00 -1.82 0.00 0.00 70.33 64.13 1abz n THR 19 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1abz n ASP 20 N -0.34 -2.47 -0.16 8.00 9.92 -1.26 -4.77 116.55 125.47 1abz n ASP 20 Ca 0.04 -1.18 0.01 0.00 -0.53 0.00 0.00 54.79 53.13 1abz n ASP 20 Cb 0.14 -2.27 0.03 0.00 -0.64 0.00 0.00 41.12 38.38 1abz n ASP 20 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1abz n SER 21 N -2.59 0.46 -1.10 -2.24 7.64 -1.26 -3.69 113.62 110.84 1abz n SER 21 Ca -0.20 -2.00 0.02 0.00 1.01 0.00 0.00 58.87 57.70 1abz n SER 21 Cb 0.62 -0.07 0.16 0.00 -1.01 0.00 0.00 64.21 63.92 1abz n SER 21 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1abz n ASN 22 N -0.26 2.99 -0.01 6.43 4.13 -1.26 -3.59 115.26 123.69 1abz n ASN 22 Ca 0.03 -2.40 -0.01 0.00 1.68 0.00 0.00 54.58 53.88 1abz n ASN 22 Cb 0.08 -0.58 -0.00 0.00 -1.54 0.00 0.00 39.78 37.73 1abz n ASN 22 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1abz n ALA 23 N 0.24 2.65 0.54 5.41 0.00 -1.24 -4.62 120.51 123.49 1abz n ALA 23 Ca 0.12 -0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.62 1abz n ALA 23 Cb 0.66 0.48 0.43 0.00 0.00 0.00 0.00 19.45 21.02 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 -2.90 0.11 -0.15 0.00 -0.58 -1.25 -3.28 120.64 112.59 1abz n GLU 24 Ca -0.02 0.28 0.28 0.00 -0.42 0.00 0.00 57.16 57.27 1abz n GLU 24 Cb 0.52 -1.68 0.59 0.00 -0.57 0.00 0.00 31.44 30.29 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 0.00 0.00 0.48 -4.62 3.38 -1.82 -0.42 115.31 112.31 1abz h LEU 25 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1abz h LEU 25 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1abz h LEU 25 CO 0.00 0.00 -0.37 0.03 0.09 0.00 0.00 178.44 178.19 1abz h ARG 26 N 0.00 -0.79 0.00 1.13 -0.00 -1.91 -1.82 114.38 110.99 1abz h ARG 26 Ca 0.42 0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.95 1abz h ARG 26 Cb 2.31 0.18 -0.00 0.00 0.00 0.00 0.00 29.97 32.46 1abz h ARG 26 CO -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 179.97 179.42 1abz h ALA 27 N -1.25 1.84 -0.52 0.04 0.00 -1.38 -1.22 119.26 116.78 1abz h ALA 27 Ca -0.06 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1abz h ALA 27 Cb 0.68 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1abz h ALA 27 CO 0.01 0.02 0.34 1.98 0.00 0.00 0.00 179.25 181.61 1abz h MET 28 N 0.00 0.61 -0.75 0.00 -1.53 -0.96 -1.65 114.93 110.64 1abz h MET 28 Ca -0.00 -0.04 -0.00 0.00 -3.44 0.00 0.00 59.70 56.22 1abz h MET 28 Cb 0.03 -0.14 -0.04 0.00 -0.55 0.00 0.00 31.60 30.91 1abz h MET 28 CO 0.00 0.40 0.45 0.93 0.14 0.00 0.00 176.91 178.84 1abz h GLU 29 N 0.63 1.02 0.19 0.39 4.39 -0.53 -0.98 114.58 119.69 1abz h GLU 29 Ca 0.20 -0.09 0.01 0.00 0.34 0.00 0.00 59.36 59.82 1abz h GLU 29 Cb 0.04 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 1abz h GLU 29 CO -0.05 0.72 -0.27 0.00 -1.16 0.00 0.00 179.01 178.25 1abz h ALA 30 N 1.24 -0.51 0.00 3.43 0.00 -1.38 0.47 119.26 122.51 1abz h ALA 30 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1abz h ALA 30 Cb -0.03 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1abz h ALA 30 CO -0.05 -0.83 0.00 1.57 0.00 0.00 0.00 179.25 179.94 1abz h LYS 31 N -0.53 0.00 -0.56 0.00 2.10 -1.38 -2.31 116.57 113.89 1abz h LYS 31 Ca 0.01 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 1abz h LYS 31 Cb 0.52 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.82 1abz h LYS 31 CO -0.11 0.00 0.33 1.25 -2.00 0.00 0.00 179.45 178.92 1abz h LEU 32 N 0.00 0.69 -0.67 7.07 5.85 0.49 -2.32 115.31 126.42 1abz h LEU 32 Ca 0.00 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.74 1abz h LEU 32 Cb 0.13 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 40.92 1abz h LEU 32 CO 0.00 0.56 0.31 0.50 -0.34 0.00 0.00 178.44 179.47 1abz h LYS 33 N 0.76 0.53 -0.45 1.25 1.63 -1.28 0.62 116.57 119.63 1abz h LYS 33 Ca 0.20 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.96 1abz h LYS 33 Cb 0.01 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.49 1abz h LYS 33 CO -0.04 0.35 0.25 0.00 -3.45 0.00 0.00 179.45 176.56 1abz h ALA 34 N 1.41 1.60 -0.59 5.00 0.00 -1.54 -1.99 119.26 123.15 1abz h ALA 34 Ca 0.33 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1abz h ALA 34 Cb 0.35 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1abz h ALA 34 CO -0.27 0.34 0.19 0.93 0.00 0.00 0.00 179.25 180.44 1abz h GLU 35 N 0.61 0.91 0.21 0.00 4.39 -0.43 -2.37 114.58 117.91 1abz h GLU 35 Ca 0.16 -0.19 0.01 0.00 0.34 0.00 0.00 59.36 59.68 1abz h GLU 35 Cb 0.01 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 1abz h GLU 35 CO -0.03 0.81 -0.35 0.82 -1.16 0.00 0.00 179.01 179.11 1abz h ILE 36 N 0.83 0.28 0.10 3.13 2.04 -0.71 -2.94 117.51 120.24 1abz h ILE 36 Ca 0.19 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.06 1abz h ILE 36 Cb 0.27 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1abz h ILE 36 CO -0.01 0.00 -0.38 -0.61 0.00 0.00 0.00 178.15 177.15 1abz h GLN 37 N -0.63 -0.53 0.00 2.37 5.75 -1.40 -3.49 115.11 117.17 1abz h GLN 37 Ca 0.01 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1abz h GLN 37 Cb 0.62 0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.29 1abz h GLN 37 CO -0.15 -0.35 0.00 1.63 -2.65 0.00 0.00 178.83 177.31