#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 0.59 -0.45 1.24 5.08 -2.05 0.15 115.95 120.52 1abz h TRP 2 Ca 0.00 0.02 0.04 0.00 1.08 0.00 0.00 58.89 60.03 1abz h TRP 2 Cb 0.00 -0.16 -0.04 0.00 -3.00 0.00 0.00 29.16 25.95 1abz h TRP 2 CO 0.00 -0.02 0.20 -0.07 -1.28 0.00 0.00 178.44 177.28 1abz h LEU 3 N 0.29 0.27 -1.98 0.11 3.38 -2.05 0.42 115.31 115.76 1abz h LEU 3 Ca 0.65 0.03 0.29 0.00 0.09 0.00 0.00 57.88 58.94 1abz h LEU 3 Cb 1.83 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 42.52 1abz h LEU 3 CO -0.32 0.20 0.73 0.11 0.09 0.00 0.00 178.44 179.25 1abz h LYS 4 N 0.41 0.00 0.20 1.13 1.57 -1.13 0.95 116.57 119.70 1abz h LYS 4 Ca 0.20 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.65 1abz h LYS 4 Cb 0.13 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.46 1abz h LYS 4 CO -0.16 0.00 -1.54 0.00 -0.57 0.00 0.00 179.45 177.18 1abz h ALA 5 N 1.47 0.03 -0.15 3.86 0.00 -0.99 -3.27 119.26 120.21 1abz h ALA 5 Ca 0.47 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1abz h ALA 5 Cb 1.93 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.97 1abz h ALA 5 CO -0.00 0.89 0.00 2.89 0.00 0.00 0.00 179.25 183.03 1abz n ARG 6 N -3.62 1.65 -0.02 0.00 -4.01 0.88 -3.94 116.66 107.60 1abz n ARG 6 Ca -0.18 -0.98 -0.22 0.00 -1.04 0.00 0.00 57.85 55.43 1abz n ARG 6 Cb 1.08 -1.38 -0.13 0.00 -3.04 0.00 0.00 32.46 28.98 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 0.20 1.72 0.30 8.89 0.31 0.29 -3.14 118.33 126.90 1abz n VAL 7 Ca 0.16 -0.49 -0.17 0.00 -0.01 0.00 0.00 64.34 63.83 1abz n VAL 7 Cb 0.30 -1.82 -0.09 0.00 -0.91 0.00 0.00 33.84 31.33 1abz n VAL 7 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1abz h GLU 8 N -0.21 -0.68 -0.62 5.55 4.81 -1.68 -1.94 114.58 119.80 1abz h GLU 8 Ca -0.41 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 58.94 1abz h GLU 8 Cb 1.85 0.15 -0.04 0.00 0.63 0.00 0.00 28.75 31.34 1abz h GLU 8 CO 0.01 -0.45 0.41 1.96 -0.73 0.00 0.00 179.01 180.21 1abz h GLN 9 N -0.71 0.58 0.52 1.92 1.08 -1.76 -1.52 115.11 115.23 1abz h GLN 9 Ca -0.07 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.08 1abz h GLN 9 Cb 0.54 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.83 1abz h GLN 9 CO 0.12 0.38 -0.39 1.49 -0.95 0.00 0.00 178.83 179.48 1abz h GLU 10 N 0.59 -0.86 0.00 1.46 4.57 -1.34 -0.16 114.58 118.84 1abz h GLU 10 Ca 0.27 0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 1abz h GLU 10 Cb 0.31 0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1abz h GLU 10 CO -0.08 -0.57 0.00 1.28 -1.18 0.00 0.00 179.01 178.46 1abz n LEU 11 N -5.51 0.12 0.08 1.64 4.77 -0.79 -2.20 117.00 115.11 1abz n LEU 11 Ca -0.12 0.54 0.02 0.00 -0.03 0.00 0.00 56.01 56.42 1abz n LEU 11 Cb 0.40 -0.53 0.37 0.00 -2.33 0.00 0.00 43.42 41.33 1abz n LEU 11 CO 0.32 -0.42 0.92 -0.61 -1.33 0.00 0.00 177.39 176.26 1abz h GLN 12 N 0.00 0.32 -0.47 3.23 4.15 0.00 -2.58 115.11 119.78 1abz h GLN 12 Ca 0.00 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.31 1abz h GLN 12 Cb 0.16 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 1abz h GLN 12 CO 0.00 0.42 0.15 0.00 -1.93 0.00 0.00 178.83 177.46 1abz h ALA 13 N 1.62 0.61 0.00 3.38 0.00 -1.45 0.61 119.26 124.03 1abz h ALA 13 Ca 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1abz h ALA 13 Cb 0.34 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1abz h ALA 13 CO 0.02 0.26 -0.16 -0.07 0.00 0.00 0.00 179.25 179.30 1abz h LEU 14 N 0.62 0.00 -2.15 0.00 4.07 -1.65 -2.29 115.31 113.91 1abz h LEU 14 Ca 0.15 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1abz h LEU 14 Cb 0.27 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.01 1abz h LEU 14 CO -0.00 0.16 0.00 -0.62 -1.08 0.00 0.00 178.44 176.89 1abz n GLU 15 N -3.52 2.05 0.15 1.13 4.71 -0.85 -3.82 120.64 120.48 1abz n GLU 15 Ca -0.01 -1.92 0.08 0.00 -0.01 0.00 0.00 57.16 55.30 1abz n GLU 15 Cb 0.31 -1.39 0.06 0.00 -1.01 0.00 0.00 31.44 29.41 1abz n GLU 15 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1abz h ALA 16 N 3.51 0.74 0.00 0.62 0.00 0.82 -3.35 119.26 121.60 1abz h ALA 16 Ca 0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1abz h ALA 16 Cb 0.81 0.02 -0.21 0.00 0.00 0.00 0.00 17.79 18.42 1abz h ALA 16 CO 0.00 0.25 -0.75 -2.13 0.00 0.00 0.00 179.25 176.62 1abz n ARG 17 N -2.98 0.30 0.00 0.00 0.63 -1.25 -5.08 116.66 108.29 1abz n ARG 17 Ca 0.01 -1.95 0.00 0.00 -0.92 0.00 0.00 57.85 54.99 1abz n ARG 17 Cb 0.62 -0.46 0.00 0.00 0.45 0.00 0.00 32.46 33.07 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 0.01 2.74 1.45 5.14 0.00 -1.25 -4.85 105.19 108.43 1abz n GLY 18 Ca 0.07 0.31 -0.03 0.00 0.00 0.00 0.00 46.02 46.37 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 0.00 -1.17 -3.93 2.61 -1.04 -1.26 -3.74 114.28 105.75 1abz n THR 19 Ca 0.00 -0.10 -0.25 0.00 -2.04 0.00 0.00 64.05 61.66 1abz n THR 19 Cb 0.00 -3.00 -0.02 0.00 -1.82 0.00 0.00 70.33 65.50 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 -1.41 -0.43 -0.21 8.00 9.92 -1.26 -4.84 116.55 126.32 1abz n ASP 20 Ca -0.04 -0.99 0.03 0.00 -0.53 0.00 0.00 54.79 53.26 1abz n ASP 20 Cb 0.53 -3.14 0.02 0.00 -0.64 0.00 0.00 41.12 37.88 1abz n ASP 20 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1abz n SER 21 N -2.99 1.31 -0.99 -2.24 3.41 -1.25 -4.50 113.62 106.38 1abz n SER 21 Ca -0.30 -1.15 0.04 0.00 -0.26 0.00 0.00 58.87 57.20 1abz n SER 21 Cb 0.68 0.18 0.18 0.00 -0.26 0.00 0.00 64.21 65.00 1abz n SER 21 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1abz n ASN 22 N 0.09 2.80 -0.03 4.04 0.23 -1.26 -3.52 115.26 117.61 1abz n ASN 22 Ca 0.03 -2.28 -0.05 0.00 -0.53 0.00 0.00 54.58 51.76 1abz n ASN 22 Cb 0.15 -0.46 -0.02 0.00 -2.08 0.00 0.00 39.78 37.37 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 0.41 2.28 1.31 -2.53 0.00 -1.26 -4.60 120.51 116.12 1abz n ALA 23 Ca 0.13 -0.22 0.14 0.00 0.00 0.00 0.00 53.44 53.49 1abz n ALA 23 Cb 0.56 0.41 0.71 0.00 0.00 0.00 0.00 19.45 21.12 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 -2.96 0.36 -0.10 0.00 1.02 -1.26 -3.56 120.64 114.15 1abz n GLU 24 Ca -0.10 0.02 0.21 0.00 -0.02 0.00 0.00 57.16 57.27 1abz n GLU 24 Cb 0.59 -1.50 0.64 0.00 -0.02 0.00 0.00 31.44 31.15 1abz n GLU 24 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1abz h LEU 25 N 0.00 0.13 -0.07 -4.62 3.38 -1.81 0.87 115.31 113.19 1abz h LEU 25 Ca 0.00 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1abz h LEU 25 Cb 0.29 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1abz h LEU 25 CO 0.00 0.06 -0.22 0.03 0.09 0.00 0.00 178.44 178.40 1abz h ARG 26 N 0.13 0.28 0.00 1.13 -0.00 -1.90 -2.98 114.38 111.04 1abz h ARG 26 Ca 0.34 -0.20 0.00 0.00 -0.50 0.00 0.00 59.98 59.62 1abz h ARG 26 Cb 1.16 0.03 0.00 0.00 0.00 0.00 0.00 29.97 31.16 1abz h ARG 26 CO -0.05 0.82 0.00 0.00 0.00 0.00 0.00 179.97 180.75 1abz h ALA 27 N 0.45 1.00 -0.28 0.04 0.00 -1.36 -2.74 119.26 116.37 1abz h ALA 27 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1abz h ALA 27 Cb 0.84 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1abz h ALA 27 CO 0.05 0.00 -0.36 1.98 0.00 0.00 0.00 179.25 180.91 1abz h MET 28 N 0.00 0.63 -0.85 0.00 -1.53 -0.74 -2.94 114.93 109.51 1abz h MET 28 Ca 0.00 -0.31 0.19 0.00 -3.44 0.00 0.00 59.70 56.14 1abz h MET 28 Cb 0.35 -0.00 -0.11 0.00 -0.55 0.00 0.00 31.60 31.28 1abz h MET 28 CO 0.00 0.90 0.37 1.05 0.14 0.00 0.00 176.91 179.37 1abz h GLU 29 N 0.53 0.43 -0.08 0.39 4.11 -1.53 0.40 114.58 118.83 1abz h GLU 29 Ca 0.05 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.45 1abz h GLU 29 Cb 0.87 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 1abz h GLU 29 CO 0.08 0.28 0.02 0.00 0.07 0.00 0.00 179.01 179.46 1abz h ALA 30 N 1.65 0.10 -0.22 1.06 0.00 -1.69 -2.19 119.26 117.97 1abz h ALA 30 Ca 0.50 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.36 1abz h ALA 30 Cb 0.88 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1abz h ALA 30 CO -0.47 -0.28 0.24 0.87 0.00 0.00 0.00 179.25 179.60 1abz h LYS 31 N -0.07 0.00 0.45 0.00 1.57 -0.94 -1.99 116.57 115.60 1abz h LYS 31 Ca 0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1abz h LYS 31 Cb 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 1abz h LYS 31 CO -0.00 0.00 -0.28 1.25 -0.57 0.00 0.00 179.45 179.85 1abz h LEU 32 N 0.00 -0.70 -0.76 2.94 5.85 -0.44 -1.03 115.31 121.18 1abz h LEU 32 Ca 0.10 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1abz h LEU 32 Cb 0.57 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 1abz h LEU 32 CO -0.00 -0.43 0.49 0.11 -0.34 0.00 0.00 178.44 178.27 1abz h LYS 33 N -0.68 1.01 -0.26 1.25 1.57 -1.53 -0.58 116.57 117.35 1abz h LYS 33 Ca -0.06 -0.07 0.08 0.00 -1.87 0.00 0.00 60.65 58.73 1abz h LYS 33 Cb 0.55 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1abz h LYS 33 CO 0.06 0.68 0.34 0.00 -0.57 0.00 0.00 179.45 179.96 1abz h ALA 34 N 1.27 1.87 0.12 3.86 0.00 -1.22 -2.20 119.26 122.96 1abz h ALA 34 Ca 0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1abz h ALA 34 Cb -0.10 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1abz h ALA 34 CO -0.06 -0.48 -0.06 1.49 0.00 0.00 0.00 179.25 180.15 1abz h GLU 35 N 0.00 -0.15 -1.42 0.00 4.81 0.28 -3.26 114.58 114.84 1abz h GLU 35 Ca 0.12 0.01 0.42 0.00 -0.13 0.00 0.00 59.36 59.79 1abz h GLU 35 Cb 0.80 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 30.13 1abz h GLU 35 CO -0.00 -0.10 0.98 0.82 -0.73 0.00 0.00 179.01 179.98 1abz h ILE 36 N -0.92 0.23 0.00 2.32 1.08 -1.27 -1.67 117.51 117.28 1abz h ILE 36 Ca -0.02 -0.03 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 1abz h ILE 36 Cb 0.12 0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 1abz h ILE 36 CO 0.03 0.01 0.00 1.67 -0.69 0.00 0.00 178.15 179.17 1abz n GLN 37 N -4.33 0.00 0.00 2.37 7.27 -0.87 -5.14 117.38 116.68 1abz n GLN 37 Ca 0.34 0.54 0.10 0.00 0.07 0.00 0.00 57.00 58.05 1abz n GLN 37 Cb 1.46 -1.40 0.57 0.00 2.41 0.00 0.00 30.24 33.28 1abz n GLN 37 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76