#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 0.88 -0.24 -0.67 5.08 -2.05 -0.98 115.95 117.97 1abz h TRP 2 Ca 0.00 0.02 0.07 0.00 1.08 0.00 0.00 58.89 60.06 1abz h TRP 2 Cb 0.00 -0.29 -0.01 0.00 -3.00 0.00 0.00 29.16 25.86 1abz h TRP 2 CO 0.00 0.50 0.22 -0.07 -1.28 0.00 0.00 178.44 177.81 1abz h LEU 3 N 0.90 0.00 -1.14 0.11 3.38 -2.04 0.56 115.31 117.08 1abz h LEU 3 Ca 0.31 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 1abz h LEU 3 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1abz h LEU 3 CO -0.10 0.00 0.04 0.11 0.09 0.00 0.00 178.44 178.58 1abz h LYS 4 N 0.00 0.64 0.02 1.13 1.57 -1.60 0.57 116.57 118.90 1abz h LYS 4 Ca 0.11 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1abz h LYS 4 Cb 0.56 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1abz h LYS 4 CO -0.00 0.63 -0.13 0.00 -0.57 0.00 0.00 179.45 179.38 1abz h ALA 5 N 1.43 -0.00 0.00 3.86 0.00 -1.02 -2.53 119.26 121.00 1abz h ALA 5 Ca 0.13 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1abz h ALA 5 Cb 0.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1abz h ALA 5 CO 0.01 0.03 0.00 2.89 0.00 0.00 0.00 179.25 182.18 1abz n ARG 6 N -4.56 0.01 -0.08 0.00 -4.01 -0.81 -3.10 116.66 104.11 1abz n ARG 6 Ca -0.10 0.21 -0.09 0.00 -1.04 0.00 0.00 57.85 56.83 1abz n ARG 6 Cb 0.50 -1.50 -0.04 0.00 -3.04 0.00 0.00 32.46 28.38 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 -1.49 1.45 -0.31 8.89 0.31 0.20 -3.43 118.33 123.95 1abz n VAL 7 Ca 0.04 0.15 0.16 0.00 -0.01 0.00 0.00 64.34 64.68 1abz n VAL 7 Cb 0.19 -2.31 0.34 0.00 -0.91 0.00 0.00 33.84 31.15 1abz n VAL 7 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1abz h GLU 8 N -1.00 0.33 -0.06 5.55 4.11 -1.48 0.12 114.58 122.15 1abz h GLU 8 Ca -0.09 -0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.32 1abz h GLU 8 Cb 0.72 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.90 1abz h GLU 8 CO -0.05 0.22 0.02 0.37 0.07 0.00 0.00 179.01 179.64 1abz h GLN 9 N 0.34 0.08 -0.85 1.06 5.75 -1.72 -1.45 115.11 118.32 1abz h GLN 9 Ca 0.60 -0.01 0.13 0.00 -0.15 0.00 0.00 58.65 59.22 1abz h GLN 9 Cb 1.21 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.69 1abz h GLN 9 CO -0.58 0.20 0.55 0.93 -2.65 0.00 0.00 178.83 177.28 1abz h GLU 10 N -0.05 0.64 -0.07 1.69 4.39 -0.82 -0.21 114.58 120.16 1abz h GLU 10 Ca 0.02 -0.04 -0.17 0.00 0.34 0.00 0.00 59.36 59.51 1abz h GLU 10 Cb 0.14 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1abz h GLU 10 CO -0.00 0.43 -0.69 -0.07 -1.16 0.00 0.00 179.01 177.51 1abz h LEU 11 N 0.66 0.37 -1.57 1.33 3.38 -0.87 -3.06 115.31 115.56 1abz h LEU 11 Ca 0.42 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 1abz h LEU 11 Cb 0.68 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1abz h LEU 11 CO -0.18 0.95 -0.22 -0.61 0.09 0.00 0.00 178.44 178.47 1abz h GLN 12 N 0.22 0.00 0.63 1.13 -0.00 0.03 -1.11 115.11 116.01 1abz h GLN 12 Ca -0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.60 1abz h GLN 12 Cb 1.25 0.00 0.01 0.00 0.00 0.00 0.00 27.48 28.73 1abz h GLN 12 CO 0.11 0.22 -0.30 0.00 0.00 0.00 0.00 178.83 178.86 1abz h ALA 13 N 1.78 -0.85 0.00 3.38 0.00 -1.35 0.28 119.26 122.51 1abz h ALA 13 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1abz h ALA 13 Cb 0.38 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1abz h ALA 13 CO 0.03 -0.93 0.00 1.28 0.00 0.00 0.00 179.25 179.63 1abz n LEU 14 N -5.42 0.30 0.01 0.00 4.32 -1.16 -2.30 117.00 112.74 1abz n LEU 14 Ca -0.13 0.56 0.11 0.00 -0.02 0.00 0.00 56.01 56.53 1abz n LEU 14 Cb 0.36 -0.50 0.04 0.00 -1.62 0.00 0.00 43.42 41.70 1abz n LEU 14 CO 0.36 -0.28 0.09 -0.62 -1.22 0.00 0.00 177.39 175.72 1abz n GLU 15 N -1.81 0.14 -0.16 3.23 -0.58 -0.43 -3.45 120.64 117.58 1abz n GLU 15 Ca 0.04 -0.01 -0.02 0.00 -0.42 0.00 0.00 57.16 56.75 1abz n GLU 15 Cb 0.26 -1.54 0.07 0.00 -0.57 0.00 0.00 31.44 29.65 1abz n GLU 15 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1abz h ALA 16 N 2.77 0.61 -0.32 0.62 0.00 -0.03 -3.37 119.26 119.53 1abz h ALA 16 Ca 0.00 0.08 -0.28 0.00 0.00 0.00 0.00 54.91 54.72 1abz h ALA 16 Cb 0.61 0.08 -0.18 0.00 0.00 0.00 0.00 17.79 18.30 1abz h ALA 16 CO 0.00 -0.25 -0.58 -2.13 0.00 0.00 0.00 179.25 176.29 1abz n ARG 17 N -5.05 0.87 -0.98 0.00 0.63 -1.26 -4.99 116.66 105.88 1abz n ARG 17 Ca 0.06 -2.05 -0.19 0.00 -0.92 0.00 0.00 57.85 54.74 1abz n ARG 17 Cb 0.23 -1.31 0.03 0.00 0.45 0.00 0.00 32.46 31.86 1abz n ARG 17 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1abz n GLY 18 N 1.08 4.27 3.38 5.14 0.00 -1.22 -4.87 105.19 112.96 1abz n GLY 18 Ca 0.10 -1.27 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 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 0.30 -6.30 -2.17 2.61 -2.24 -1.26 -3.76 114.28 101.46 1abz n THR 19 Ca 0.34 0.18 -0.03 0.00 -2.27 0.00 0.00 64.05 62.27 1abz n THR 19 Cb 0.58 -4.73 0.02 0.00 -2.10 0.00 0.00 70.33 64.10 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 -1.13 -2.28 -1.53 3.42 2.03 -1.26 -4.94 116.55 110.87 1abz n ASP 20 Ca -0.09 -0.13 0.04 0.00 0.52 0.00 0.00 54.79 55.12 1abz n ASP 20 Cb 0.61 -1.45 0.29 0.00 -0.72 0.00 0.00 41.12 39.84 1abz n ASP 20 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1abz n SER 21 N -1.55 4.38 -1.53 1.67 7.64 -1.25 -4.24 113.62 118.74 1abz n SER 21 Ca -0.05 -2.70 -0.05 0.00 1.01 0.00 0.00 58.87 57.09 1abz n SER 21 Cb 0.53 -0.64 0.18 0.00 -1.01 0.00 0.00 64.21 63.27 1abz n SER 21 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1abz n ASN 22 N 0.40 3.65 0.00 6.43 2.85 -1.26 -4.11 115.26 123.22 1abz n ASN 22 Ca 0.21 -2.75 0.00 0.00 -0.11 0.00 0.00 54.58 51.93 1abz n ASN 22 Cb 0.96 -0.66 0.00 0.00 1.24 0.00 0.00 39.78 41.32 1abz n ASN 22 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1abz n ALA 23 N -0.04 2.57 0.18 5.20 0.00 -1.26 -4.67 120.51 122.49 1abz n ALA 23 Ca 0.26 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.82 1abz n ALA 23 Cb 1.00 0.36 0.66 0.00 0.00 0.00 0.00 19.45 21.47 1abz n ALA 23 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1abz h GLU 24 N 0.00 0.00 -1.51 0.00 5.08 -1.86 -2.60 114.58 113.70 1abz h GLU 24 Ca 0.00 0.00 0.44 0.00 -1.00 0.00 0.00 59.36 58.80 1abz h GLU 24 Cb 0.71 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.90 1abz h GLU 24 CO 0.00 0.00 1.08 -0.07 -1.00 0.00 0.00 179.01 179.02 1abz h LEU 25 N 0.00 0.02 -0.05 1.33 3.38 -1.83 0.44 115.31 118.59 1abz h LEU 25 Ca 0.00 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1abz h LEU 25 Cb 0.01 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1abz h LEU 25 CO 0.00 -0.01 -0.07 0.03 0.09 0.00 0.00 178.44 178.49 1abz h ARG 26 N 0.01 0.14 0.00 1.13 2.47 -1.83 -2.73 114.38 113.57 1abz h ARG 26 Ca 0.73 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 59.37 1abz h ARG 26 Cb 2.87 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 31.20 1abz h ARG 26 CO -0.03 0.62 0.00 0.00 0.56 0.00 0.00 179.97 181.12 1abz n ALA 27 N -2.39 1.07 -0.27 0.04 0.00 0.15 -1.90 120.51 117.21 1abz n ALA 27 Ca -0.08 0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.45 1abz n ALA 27 Cb 0.31 -1.24 0.06 0.00 0.00 0.00 0.00 19.45 18.57 1abz n ALA 27 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1abz h MET 28 N 0.00 1.12 -0.35 0.00 -1.53 -1.10 -1.55 114.93 111.51 1abz h MET 28 Ca 0.00 -0.20 0.04 0.00 -3.44 0.00 0.00 59.70 56.11 1abz h MET 28 Cb 0.02 -0.18 -0.04 0.00 -0.55 0.00 0.00 31.60 30.84 1abz h MET 28 CO 0.00 0.91 0.12 1.49 0.14 0.00 0.00 176.91 179.56 1abz h GLU 29 N 1.08 0.25 -0.43 0.39 4.81 -1.52 -1.15 114.58 118.02 1abz h GLU 29 Ca 0.25 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.37 1abz h GLU 29 Cb 0.20 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1abz h GLU 29 CO -0.02 0.17 -0.13 0.00 -0.73 0.00 0.00 179.01 178.29 1abz h ALA 30 N 1.23 0.97 -0.25 2.92 0.00 -1.66 -2.75 119.26 119.71 1abz h ALA 30 Ca 0.16 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1abz h ALA 30 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1abz h ALA 30 CO -0.17 0.61 -0.03 0.87 0.00 0.00 0.00 179.25 180.53 1abz h LYS 31 N 0.70 0.38 0.41 0.00 1.57 -0.58 -2.88 116.57 116.18 1abz h LYS 31 Ca 0.12 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1abz h LYS 31 Cb 0.62 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1abz h LYS 31 CO 0.04 0.44 -0.50 -0.07 -0.57 0.00 0.00 179.45 178.78 1abz h LEU 32 N 0.37 -1.41 -2.92 2.94 3.38 -0.92 0.47 115.31 117.21 1abz h LEU 32 Ca 0.08 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1abz h LEU 32 Cb 0.30 0.48 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1abz h LEU 32 CO 0.01 -0.64 0.02 0.50 0.09 0.00 0.00 178.44 178.43 1abz h LYS 33 N -0.94 0.00 -0.16 1.13 3.64 -1.61 -0.73 116.57 117.89 1abz h LYS 33 Ca -0.05 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 1abz h LYS 33 Cb 0.84 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 1abz h LYS 33 CO -0.12 0.00 -0.30 0.00 -2.27 0.00 0.00 179.45 176.77 1abz h ALA 34 N 1.95 1.20 0.00 5.00 0.00 -0.69 -1.26 119.26 125.47 1abz h ALA 34 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1abz h ALA 34 Cb 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1abz h ALA 34 CO -0.00 0.52 -0.28 0.93 0.00 0.00 0.00 179.25 180.42 1abz h GLU 35 N 0.27 0.00 -1.05 0.00 5.08 -0.82 -3.37 114.58 114.69 1abz h GLU 35 Ca 0.04 0.00 0.28 0.00 -1.00 0.00 0.00 59.36 58.67 1abz h GLU 35 Cb 0.67 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.84 1abz h GLU 35 CO 0.05 0.00 0.70 -0.84 -1.00 0.00 0.00 179.01 177.92 1abz h ILE 36 N -0.67 0.51 -0.29 3.13 3.07 -1.60 -1.88 117.51 119.78 1abz h ILE 36 Ca 0.00 -0.10 0.03 0.00 1.55 0.00 0.00 64.86 66.34 1abz h ILE 36 Cb 0.28 0.19 -0.05 0.00 -0.27 0.00 0.00 36.82 36.97 1abz h ILE 36 CO 0.00 0.05 -0.36 1.56 -1.05 0.00 0.00 178.15 178.35 1abz h GLN 37 N 0.30 -0.23 0.00 0.16 1.08 -1.39 -3.51 115.11 111.52 1abz h GLN 37 Ca 0.57 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.79 1abz h GLN 37 Cb 1.64 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 29.12 1abz h GLN 37 CO -0.22 -0.15 0.00 1.63 -0.95 0.00 0.00 178.83 179.14