#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 0.45 -0.98 2.11 5.08 -2.02 -0.10 115.95 120.48 1abz h TRP 2 Ca 0.00 0.01 0.10 0.00 1.08 0.00 0.00 58.89 60.08 1abz h TRP 2 Cb 0.00 -0.14 -0.08 0.00 -3.00 0.00 0.00 29.16 25.95 1abz h TRP 2 CO 0.00 0.14 0.63 -0.07 -1.28 0.00 0.00 178.44 177.85 1abz h LEU 3 N 0.35 0.94 -1.57 0.11 4.07 -1.97 0.27 115.31 117.51 1abz h LEU 3 Ca 0.42 0.03 0.20 0.00 0.08 0.00 0.00 57.88 58.62 1abz h LEU 3 Cb 1.11 -0.16 -0.06 0.00 1.08 0.00 0.00 40.66 42.62 1abz h LEU 3 CO -0.13 0.54 0.59 0.07 -1.08 0.00 0.00 178.44 178.42 1abz h LYS 4 N 1.03 0.35 0.08 1.13 2.10 -1.42 0.73 116.57 120.58 1abz h LYS 4 Ca 0.46 -0.02 -0.26 0.00 -2.00 0.00 0.00 60.65 58.83 1abz h LYS 4 Cb 0.38 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.62 1abz h LYS 4 CO -0.22 0.23 -1.22 0.00 -2.00 0.00 0.00 179.45 176.24 1abz h ALA 5 N 1.61 0.22 -0.03 0.07 0.00 -1.07 -3.24 119.26 116.82 1abz h ALA 5 Ca 0.45 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1abz h ALA 5 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1abz h ALA 5 CO -0.16 1.11 0.00 2.89 0.00 0.00 0.00 179.25 183.09 1abz n ARG 6 N -3.45 1.67 -0.03 0.00 -4.01 0.20 -3.88 116.66 107.16 1abz n ARG 6 Ca -0.07 -0.98 -0.02 0.00 -1.04 0.00 0.00 57.85 55.75 1abz n ARG 6 Cb 1.00 -1.47 -0.01 0.00 -3.04 0.00 0.00 32.46 28.94 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 0.19 0.51 -0.32 8.89 0.31 0.23 -3.75 118.33 124.38 1abz n VAL 7 Ca 0.19 0.40 0.22 0.00 -0.01 0.00 0.00 64.34 65.13 1abz n VAL 7 Cb 0.35 -1.82 0.49 0.00 -0.91 0.00 0.00 33.84 31.95 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 -0.36 0.42 -0.17 5.55 4.11 -1.76 0.62 114.58 122.99 1abz h GLU 8 Ca 0.00 -0.03 0.03 0.00 0.07 0.00 0.00 59.36 59.43 1abz h GLU 8 Cb 0.18 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1abz h GLU 8 CO 0.00 0.28 -0.00 0.37 0.07 0.00 0.00 179.01 179.72 1abz h GLN 9 N 0.43 0.05 -0.06 1.06 4.15 -1.75 1.21 115.11 120.20 1abz h GLN 9 Ca 0.59 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.01 1abz h GLN 9 Cb 1.43 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 29.10 1abz h GLN 9 CO -0.30 0.03 0.03 0.93 -1.93 0.00 0.00 178.83 177.59 1abz h GLU 10 N 0.05 0.07 -0.11 1.69 4.39 -0.98 -1.54 114.58 118.15 1abz h GLU 10 Ca 0.08 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1abz h GLU 10 Cb 0.10 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1abz h GLU 10 CO -0.13 0.04 0.00 1.28 -1.16 0.00 0.00 179.01 179.04 1abz n LEU 11 N -5.06 0.77 -0.04 1.33 4.77 -0.91 -3.93 117.00 113.92 1abz n LEU 11 Ca -0.06 -0.36 -0.12 0.00 -0.03 0.00 0.00 56.01 55.45 1abz n LEU 11 Cb 0.04 -0.07 -0.11 0.00 -2.33 0.00 0.00 43.42 40.95 1abz n LEU 11 CO 0.33 0.18 0.40 1.56 -1.33 0.00 0.00 177.39 178.52 1abz h GLN 12 N 0.93 -0.02 -0.11 3.23 4.20 0.26 -3.20 115.11 120.40 1abz h GLN 12 Ca 0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.74 1abz h GLN 12 Cb 0.21 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 1abz h GLN 12 CO 0.00 0.73 0.17 0.00 -0.67 0.00 0.00 178.83 179.06 1abz h ALA 13 N -0.03 1.56 -0.26 3.87 0.00 -1.68 -1.74 119.26 120.98 1abz h ALA 13 Ca -0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1abz h ALA 13 Cb 0.76 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1abz h ALA 13 CO 0.00 -0.23 0.06 -0.07 0.00 0.00 0.00 179.25 179.02 1abz h LEU 14 N 0.00 0.03 -0.11 0.00 4.07 -1.75 -1.30 115.31 116.25 1abz h LEU 14 Ca 0.05 0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1abz h LEU 14 Cb 0.39 0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1abz h LEU 14 CO -0.00 0.05 -0.24 -0.62 -1.08 0.00 0.00 178.44 176.54 1abz n GLU 15 N -5.08 0.26 -0.02 1.13 4.71 -0.71 -3.94 120.64 117.00 1abz n GLU 15 Ca -0.01 -0.11 -0.13 0.00 -0.01 0.00 0.00 57.16 56.90 1abz n GLU 15 Cb 0.11 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 28.95 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 3.22 0.04 -1.14 0.62 0.00 -0.65 -3.26 119.26 118.10 1abz h ALA 16 Ca 0.00 -0.25 -0.75 0.00 0.00 0.00 0.00 54.91 53.91 1abz h ALA 16 Cb 0.46 -0.01 -0.29 0.00 0.00 0.00 0.00 17.79 17.95 1abz h ALA 16 CO 0.00 -0.20 0.78 0.54 0.00 0.00 0.00 179.25 180.38 1abz n ARG 17 N -4.81 3.25 -3.15 0.00 1.74 -1.04 -4.82 116.66 107.83 1abz n ARG 17 Ca -0.08 -3.85 0.06 0.00 -0.77 0.00 0.00 57.85 53.20 1abz n ARG 17 Cb 0.27 -2.30 -0.01 0.00 -1.02 0.00 0.00 32.46 29.40 1abz n ARG 17 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1abz s GLY 18 N -1.50 -0.43 -0.17 -0.13 0.00 -1.23 -5.01 107.32 98.84 1abz s GLY 18 Ca 0.49 2.72 0.04 0.00 0.00 0.00 0.00 44.72 47.97 1abz s GLY 18 CO -0.34 3.98 1.29 -1.30 0.00 0.00 0.00 173.10 176.73 1abz n THR 19 N 5.35 1.74 -2.30 0.90 -2.24 -1.26 -4.37 114.28 112.11 1abz n THR 19 Ca -0.02 -0.81 -0.35 0.00 -2.27 0.00 0.00 64.05 60.59 1abz n THR 19 Cb 0.55 -0.60 0.02 0.00 -2.10 0.00 0.00 70.33 68.21 1abz n THR 19 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1abz n ASP 20 N -0.03 6.47 -1.11 3.42 8.00 -1.26 -4.44 116.55 127.60 1abz n ASP 20 Ca 0.22 -3.77 -0.00 0.00 0.71 0.00 0.00 54.79 51.95 1abz n ASP 20 Cb 0.91 -0.88 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 1abz n ASP 20 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1abz n SER 21 N -0.41 -0.14 -0.85 -2.24 2.88 -1.26 -4.97 113.62 106.63 1abz n SER 21 Ca 0.47 -0.69 0.04 0.00 -1.33 0.00 0.00 58.87 57.35 1abz n SER 21 Cb 0.36 0.06 0.15 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.09 2.36 0.00 -3.46 6.94 -1.26 -3.70 115.26 116.05 1abz n ASN 22 Ca -0.03 -2.22 0.00 0.00 -0.02 0.00 0.00 54.58 52.32 1abz n ASN 22 Cb 0.42 -0.42 0.00 0.00 -2.36 0.00 0.00 39.78 37.43 1abz n ASN 22 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1abz n ALA 23 N 0.31 2.29 1.78 -2.53 0.00 -1.26 -4.66 120.51 116.44 1abz n ALA 23 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.66 1abz n ALA 23 Cb 0.47 0.42 0.66 0.00 0.00 0.00 0.00 19.45 20.99 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 -2.50 0.89 -0.24 0.00 -0.58 -1.25 -3.73 120.64 113.23 1abz n GLU 24 Ca 0.00 0.00 0.19 0.00 -0.42 0.00 0.00 57.16 56.93 1abz n GLU 24 Cb 0.42 -1.39 0.51 0.00 -0.57 0.00 0.00 31.44 30.41 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 0.40 -0.23 -4.62 3.38 -1.83 0.74 115.31 113.16 1abz h LEU 25 Ca 0.00 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1abz h LEU 25 Cb 0.00 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1abz h LEU 25 CO 0.00 0.16 -0.38 0.03 0.09 0.00 0.00 178.44 178.34 1abz h ARG 26 N 0.40 0.66 -0.04 1.13 -0.00 -1.94 -2.89 114.38 111.71 1abz h ARG 26 Ca 0.47 -0.41 0.01 0.00 -0.50 0.00 0.00 59.98 59.55 1abz h ARG 26 Cb 1.17 0.04 -0.00 0.00 0.00 0.00 0.00 29.97 31.18 1abz h ARG 26 CO -0.18 1.02 0.03 0.00 0.00 0.00 0.00 179.97 180.85 1abz h ALA 27 N 0.63 2.00 -0.10 0.04 0.00 -1.14 -0.30 119.26 120.39 1abz h ALA 27 Ca 0.02 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1abz h ALA 27 Cb 0.98 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1abz h ALA 27 CO 0.09 -0.04 -0.10 1.98 0.00 0.00 0.00 179.25 181.17 1abz h MET 28 N 0.00 0.15 -0.39 0.00 -1.53 -1.10 -2.45 114.93 109.62 1abz h MET 28 Ca 0.02 -0.03 -0.04 0.00 -3.44 0.00 0.00 59.70 56.21 1abz h MET 28 Cb 0.07 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.08 1abz h MET 28 CO -0.00 0.27 0.10 1.49 0.14 0.00 0.00 176.91 178.90 1abz h GLU 29 N 0.15 0.62 0.38 0.39 4.57 -1.08 0.15 114.58 119.76 1abz h GLU 29 Ca 0.03 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1abz h GLU 29 Cb 0.28 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 1abz h GLU 29 CO 0.02 0.65 -0.37 0.00 -1.18 0.00 0.00 179.01 178.13 1abz h ALA 30 N 0.94 -0.80 0.00 2.92 0.00 -1.46 -0.63 119.26 120.24 1abz h ALA 30 Ca 0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1abz h ALA 30 Cb 0.31 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1abz h ALA 30 CO 0.00 -0.99 -0.03 0.87 0.00 0.00 0.00 179.25 179.10 1abz h LYS 31 N -0.76 0.00 -0.23 0.00 6.56 -1.46 -2.56 116.57 118.11 1abz h LYS 31 Ca -0.03 0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.60 1abz h LYS 31 Cb 0.68 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.31 1abz h LYS 31 CO -0.06 0.03 -0.02 1.25 -2.06 0.00 0.00 179.45 178.60 1abz h LEU 32 N 0.00 -0.12 -1.94 2.94 5.85 0.67 -0.02 115.31 122.69 1abz h LEU 32 Ca -0.00 0.06 0.21 0.00 0.84 0.00 0.00 57.88 58.98 1abz h LEU 32 Cb 0.12 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1abz h LEU 32 CO 0.00 -0.03 0.53 0.50 -0.34 0.00 0.00 178.44 179.10 1abz h LYS 33 N 0.05 0.05 -0.37 1.25 3.64 -1.29 0.21 116.57 120.12 1abz h LYS 33 Ca 0.11 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.36 1abz h LYS 33 Cb 0.15 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1abz h LYS 33 CO -0.20 0.04 -0.28 0.00 -2.27 0.00 0.00 179.45 176.73 1abz h ALA 34 N 1.63 0.81 -0.21 5.00 0.00 -1.11 -2.27 119.26 123.12 1abz h ALA 34 Ca 0.36 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1abz h ALA 34 Cb 1.35 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1abz h ALA 34 CO -0.02 0.64 -0.35 0.93 0.00 0.00 0.00 179.25 180.45 1abz h GLU 35 N 0.66 0.61 -0.70 0.00 5.08 -0.35 -3.12 114.58 116.77 1abz h GLU 35 Ca 0.08 -0.38 0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1abz h GLU 35 Cb 0.81 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.05 1abz h GLU 35 CO 0.07 0.99 0.45 0.82 -1.00 0.00 0.00 179.01 180.33 1abz h ILE 36 N 0.30 1.12 0.02 3.13 2.04 -1.27 -3.14 117.51 119.72 1abz h ILE 36 Ca 0.02 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 1abz h ILE 36 Cb 0.94 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 1abz h ILE 36 CO 0.08 0.16 -0.03 -0.61 0.00 0.00 0.00 178.15 177.76 1abz h GLN 37 N 0.89 -0.04 0.00 2.37 4.15 -1.37 -3.50 115.11 117.60 1abz h GLN 37 Ca 0.27 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.69 1abz h GLN 37 Cb -0.03 0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.67 1abz h GLN 37 CO -0.09 -0.03 0.00 1.63 -1.93 0.00 0.00 178.83 178.41