#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zue n PHE 3 N 0.00 2.19 -3.04 4.28 7.35 -1.26 -4.63 117.46 122.35 1zue n PHE 3 Ca 0.00 -1.59 0.04 0.00 -0.76 0.00 0.00 57.45 55.14 1zue n PHE 3 Cb 0.00 -0.80 0.00 0.00 0.35 0.00 0.00 39.48 39.03 1zue n PHE 3 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 1zue s PHE 4 N -2.38 -0.67 -0.34 -5.13 2.19 -1.26 -5.09 117.98 105.30 1zue s PHE 4 Ca 0.41 0.28 -0.04 0.00 0.33 0.00 0.00 56.93 57.91 1zue s PHE 4 Cb 0.34 0.12 0.25 0.00 -1.31 0.00 0.00 43.02 42.42 1zue s PHE 4 CO 0.07 -0.42 1.18 -1.91 1.83 0.00 0.00 175.22 175.97 1zue n GLU 5 N 4.64 0.12 -0.23 10.12 2.13 -1.26 -5.17 120.64 130.98 1zue n GLU 5 Ca 0.08 -0.74 -0.05 0.00 0.66 0.00 0.00 57.16 57.11 1zue n GLU 5 Cb 0.59 -0.07 0.04 0.00 0.27 0.00 0.00 31.44 32.28 1zue n GLU 5 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1zue n MET 6 N 1.99 -1.10 -3.60 5.31 2.81 -1.26 -4.98 117.12 116.30 1zue n MET 6 Ca 0.06 -0.34 -0.14 0.00 -1.81 0.00 0.00 57.70 55.47 1zue n MET 6 Cb 0.68 -0.29 -0.05 0.00 -0.71 0.00 0.00 33.22 32.85 1zue n MET 6 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1zue n GLN 7 N -1.97 0.36 -3.50 0.03 1.13 -1.20 -4.89 117.38 107.34 1zue n GLN 7 Ca 0.03 -2.39 -0.38 0.00 -1.94 0.00 0.00 57.00 52.32 1zue n GLN 7 Cb 0.11 2.03 -0.06 0.00 0.11 0.00 0.00 30.24 32.43 1zue n GLN 7 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1zue s ALA 8 N -2.89 3.70 0.54 -1.58 0.00 -1.26 -1.57 121.76 118.70 1zue s ALA 8 Ca 0.28 -0.22 0.26 0.00 0.00 0.00 0.00 51.96 52.28 1zue s ALA 8 Cb 0.01 -2.39 1.61 0.00 0.00 0.00 0.00 23.12 22.35 1zue s ALA 8 CO 0.20 0.48 2.19 0.00 0.00 0.00 0.00 175.76 178.63 1zue h TRP 10 N 0.00 0.00 -0.02 0.00 5.08 -1.89 -0.21 115.95 118.92 1zue h TRP 10 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1zue h TRP 10 Cb 0.08 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.24 1zue h TRP 10 CO 0.00 1.07 0.03 1.03 -1.28 0.00 0.00 178.44 179.29 1zue h SER 11 N -1.00 0.00 -0.55 0.11 0.87 -1.90 0.13 113.55 111.21 1zue h SER 11 Ca -0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1zue h SER 11 Cb 1.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 1zue h SER 11 CO -0.05 0.00 0.00 1.57 -0.53 0.00 0.00 176.83 177.82 1zue n HIS 12 N -3.45 0.72 -3.17 2.24 -0.00 -0.39 -4.98 115.22 106.19 1zue n HIS 12 Ca -0.03 -0.36 -0.16 0.00 -0.00 0.00 0.00 57.72 57.17 1zue n HIS 12 Cb 0.11 0.00 0.01 0.00 -0.00 0.00 0.00 29.99 30.12 1zue n HIS 12 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1zue n SER 13 N 1.59 -6.96 0.00 0.26 3.41 0.44 -5.03 113.62 107.33 1zue n SER 13 Ca 0.22 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 1zue n SER 13 Cb 0.62 -4.02 0.00 0.00 -0.26 0.00 0.00 64.21 60.55 1zue n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zue n GLY 14 N -0.72 5.24 3.13 5.00 0.00 -0.10 -4.99 105.19 112.75 1zue n GLY 14 Ca -0.01 -1.38 -0.09 0.00 0.00 0.00 0.00 46.02 44.55 1zue n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zue s VAL 15 N -0.65 0.15 -0.25 1.61 1.01 -0.57 -4.87 120.40 116.83 1zue s VAL 15 Ca 0.00 -1.85 0.01 0.00 0.00 0.00 0.00 61.98 60.14 1zue s VAL 15 Cb 0.00 -1.83 0.07 0.00 0.00 0.00 0.00 36.38 34.62 1zue s VAL 15 CO 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 175.10 174.39 1zue s ARG 17 N 1.35 2.27 0.72 0.00 0.52 -0.76 -4.87 118.95 118.18 1zue s ARG 17 Ca -0.04 -1.80 -0.16 0.00 -0.52 0.00 0.00 55.73 53.21 1zue s ARG 17 Cb -0.19 -2.04 0.03 0.00 0.52 0.00 0.00 34.95 33.27 1zue s ARG 17 CO -0.08 -0.13 1.24 -3.47 0.02 0.00 0.00 175.30 172.88 1zue n ASP 18 N -1.29 1.56 0.21 0.23 2.03 -1.26 -1.02 116.55 117.01 1zue n ASP 18 Ca -0.00 0.72 0.09 0.00 0.52 0.00 0.00 54.79 56.11 1zue n ASP 18 Cb 0.64 -1.53 0.35 0.00 -0.72 0.00 0.00 41.12 39.86 1zue n ASP 18 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1zue h LYS 19 N -0.10 0.00 -0.74 -0.67 1.57 -1.91 -3.06 116.57 111.66 1zue h LYS 19 Ca -0.49 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.09 1zue h LYS 19 Cb 1.32 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.51 1zue h LYS 19 CO 0.50 0.26 0.26 0.45 -0.57 0.00 0.00 179.45 180.34 1zue n SER 20 N -3.32 5.00 -4.82 0.86 2.88 -1.26 -4.98 113.62 107.97 1zue n SER 20 Ca 0.01 -3.20 -0.33 0.00 -1.33 0.00 0.00 58.87 54.02 1zue n SER 20 Cb 0.50 -0.75 -0.03 0.00 -0.75 0.00 0.00 64.21 63.18 1zue n SER 20 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1zue s GLU 21 N -2.98 3.82 -0.01 -1.46 2.12 -1.16 -4.98 118.70 114.06 1zue s GLU 21 Ca 0.56 1.09 0.15 0.00 0.36 0.00 0.00 54.97 57.13 1zue s GLU 21 Cb 0.44 -2.11 -0.18 0.00 0.26 0.00 0.00 34.13 32.54 1zue s GLU 21 CO 0.14 -0.38 0.55 0.54 -0.54 0.00 0.00 175.26 175.57 1zue n ARG 22 N -1.46 1.63 -3.23 4.30 5.12 -1.26 -4.67 116.66 117.08 1zue n ARG 22 Ca 0.07 -0.04 -0.26 0.00 -1.93 0.00 0.00 57.85 55.70 1zue n ARG 22 Cb 0.54 -1.25 -0.06 0.00 -1.16 0.00 0.00 32.46 30.52 1zue n ARG 22 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1zue n ASN 23 N -1.55 3.32 -4.07 0.55 5.15 -1.26 -5.06 115.26 112.35 1zue n ASN 23 Ca 0.01 -3.39 -0.16 0.00 -0.60 0.00 0.00 54.58 50.44 1zue n ASN 23 Cb 0.28 -0.63 -0.13 0.00 -0.53 0.00 0.00 39.78 38.77 1zue n ASN 23 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1zue s LYS 25 N -1.18 2.79 -0.43 0.00 -0.14 -1.26 -5.04 119.74 114.49 1zue s LYS 25 Ca -0.04 -2.27 -0.42 0.00 -1.36 0.00 0.00 55.97 51.88 1zue s LYS 25 Cb -0.08 -3.97 -0.17 0.00 -1.68 0.00 0.00 37.83 31.94 1zue s LYS 25 CO 0.01 -1.21 1.98 -2.30 -0.76 0.00 0.00 175.35 173.07 1zue n PRO 26 N 4.06 0.45 -3.67 -1.68 -0.02 -1.26 -1.82 135.00 131.06 1zue n PRO 26 Ca 0.05 0.14 -0.39 0.00 -2.02 0.00 0.00 63.50 61.28 1zue n PRO 26 Cb 0.41 -1.83 -0.10 0.00 -0.02 0.00 0.00 33.50 31.96 1zue n PRO 26 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1zue s MET 27 N 5.04 2.28 0.28 -0.52 1.75 -0.40 -4.83 119.30 122.90 1zue s MET 27 Ca 1.11 -1.73 -0.05 0.00 -1.25 0.00 0.00 55.69 53.77 1zue s MET 27 Cb -1.28 -3.73 0.07 0.00 2.84 0.00 0.00 34.83 32.73 1zue s MET 27 CO 0.65 -1.09 0.24 0.00 -0.65 0.00 0.00 175.02 174.17 1zue n ALA 28 N 4.76 -0.79 -4.04 4.11 0.00 -1.26 -4.24 120.51 119.05 1zue n ALA 28 Ca -0.06 -0.36 -0.32 0.00 0.00 0.00 0.00 53.44 52.70 1zue n ALA 28 Cb 0.41 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1zue n ALA 28 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1zue n TRP 29 N -3.07 -2.01 -3.64 0.00 5.03 -1.26 -4.91 117.44 107.58 1zue n TRP 29 Ca 0.03 0.85 -0.03 0.00 3.03 0.00 0.00 57.50 61.39 1zue n TRP 29 Cb 0.13 -3.55 -0.03 0.00 -1.03 0.00 0.00 31.31 26.83 1zue n TRP 29 CO 0.00 0.00 0.00 -0.08 -0.03 0.00 0.00 177.69 177.58 1zue s THR 30 N -3.36 0.00 0.18 -0.99 -1.32 -1.26 -3.26 115.64 105.62 1zue s THR 30 Ca 0.62 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 61.09 1zue s THR 30 Cb -0.32 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.63 1zue s THR 30 CO 0.87 0.00 0.11 -0.72 -2.21 0.00 0.00 174.62 172.68 1zue s TYR 31 N -1.54 1.07 0.48 9.09 -0.85 -0.61 -4.79 117.35 120.20 1zue s TYR 31 Ca 0.10 -1.33 0.07 0.00 -0.52 0.00 0.00 57.07 55.38 1zue s TYR 31 Cb -0.01 -0.53 0.01 0.00 0.38 0.00 0.00 41.96 41.81 1zue s TYR 31 CO -0.05 -0.61 0.42 0.00 -1.52 0.00 0.00 175.55 173.79 1zue h GLU 33 N 0.85 0.07 -6.23 0.00 4.81 -2.01 -3.45 114.58 108.61 1zue h GLU 33 Ca -0.38 -0.09 -0.57 0.00 -0.13 0.00 0.00 59.36 58.18 1zue h GLU 33 Cb 1.28 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.66 1zue h GLU 33 CO 0.56 0.96 -0.22 1.21 -0.73 0.00 0.00 179.01 180.79 1zue s ASN 34 N -6.82 6.60 -0.14 1.04 3.84 -1.26 -4.98 114.94 113.21 1zue s ASN 34 Ca -0.01 0.78 0.06 0.00 0.21 0.00 0.00 52.86 53.90 1zue s ASN 34 Cb 0.10 -2.17 0.41 0.00 -0.55 0.00 0.00 41.25 39.04 1zue s ASN 34 CO 0.82 0.06 1.21 0.54 -2.79 0.00 0.00 177.10 176.94 1zue n ARG 35 N 0.35 2.75 -0.33 0.43 5.12 -1.26 -3.64 116.66 120.07 1zue n ARG 35 Ca -0.04 -1.61 0.00 0.00 -1.93 0.00 0.00 57.85 54.27 1zue n ARG 35 Cb 0.52 -1.84 0.00 0.00 -1.16 0.00 0.00 32.46 29.98 1zue n ARG 35 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1zue n ASN 36 N 0.19 0.04 -4.00 0.55 4.05 -1.26 -5.07 115.26 109.76 1zue n ASN 36 Ca 0.18 -1.70 -0.18 0.00 0.45 0.00 0.00 54.58 53.32 1zue n ASN 36 Cb 0.81 -0.14 -0.15 0.00 1.23 0.00 0.00 39.78 41.54 1zue n ASN 36 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 1zue s GLN 37 N -0.04 0.70 0.03 1.20 0.74 -1.24 -3.23 119.66 117.82 1zue s GLN 37 Ca 0.00 -0.29 -0.00 0.00 0.05 0.00 0.00 55.36 55.12 1zue s GLN 37 Cb 0.00 -0.68 -0.04 0.00 1.10 0.00 0.00 33.01 33.40 1zue s GLN 37 CO 0.00 0.16 0.15 0.15 -0.55 0.00 0.00 175.29 175.20 1zue s LYS 38 N -0.11 3.27 -0.60 1.67 1.02 -0.18 -4.55 119.74 120.25 1zue s LYS 38 Ca 0.02 -0.45 -0.21 0.00 0.02 0.00 0.00 55.97 55.35 1zue s LYS 38 Cb -0.04 -2.97 0.07 0.00 -0.52 0.00 0.00 37.83 34.37 1zue s LYS 38 CO -0.00 0.63 0.83 0.00 -0.92 0.00 0.00 175.35 175.89 1zue h GLU 41 N 0.80 -0.58 -0.00 0.00 4.22 -1.66 -1.50 114.58 115.85 1zue h GLU 41 Ca -0.44 0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.04 1zue h GLU 41 Cb 1.26 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.65 1zue h GLU 41 CO 0.50 -0.30 0.00 0.98 -2.18 0.00 0.00 179.01 178.01