#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 3.27 -3.65 9.51 -1.74 -1.26 -5.20 117.46 118.39 1zue n PHE 3 Ca 0.00 -3.57 -0.15 0.00 -0.56 0.00 0.00 57.45 53.17 1zue n PHE 3 Cb 0.00 -0.95 -0.14 0.00 1.52 0.00 0.00 39.48 39.91 1zue n PHE 3 CO 0.00 0.00 0.00 -0.59 -0.56 0.00 0.00 176.76 175.61 1zue s PHE 4 N -2.36 -0.31 -0.84 2.97 -0.12 -1.26 -5.04 117.98 111.02 1zue s PHE 4 Ca 0.34 0.76 -0.02 0.00 -0.05 0.00 0.00 56.93 57.96 1zue s PHE 4 Cb 0.06 -0.16 0.35 0.00 -0.63 0.00 0.00 43.02 42.65 1zue s PHE 4 CO 0.01 -0.34 1.96 -0.85 -0.05 0.00 0.00 175.22 175.95 1zue n GLU 5 N 5.34 2.99 -2.13 1.99 0.28 -1.26 -5.00 120.64 122.85 1zue n GLU 5 Ca -0.05 -3.66 -0.28 0.00 -0.16 0.00 0.00 57.16 53.00 1zue n GLU 5 Cb 0.50 -2.28 0.17 0.00 1.43 0.00 0.00 31.44 31.26 1zue n GLU 5 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1zue s MET 6 N -4.07 0.81 0.15 3.44 -1.94 -1.26 -4.93 119.30 111.50 1zue s MET 6 Ca 0.51 -0.68 0.00 0.00 -1.71 0.00 0.00 55.69 53.80 1zue s MET 6 Cb 0.42 -1.98 -0.00 0.00 2.01 0.00 0.00 34.83 35.28 1zue s MET 6 CO -0.39 -2.22 0.01 1.04 -0.01 0.00 0.00 175.02 173.45 1zue n GLN 7 N -3.54 1.53 -3.49 2.03 1.13 -0.30 -4.82 117.38 109.91 1zue n GLN 7 Ca 0.16 -1.09 -0.37 0.00 -1.94 0.00 0.00 57.00 53.76 1zue n GLN 7 Cb 0.60 0.33 -0.06 0.00 0.11 0.00 0.00 30.24 31.21 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 -2.27 3.62 0.64 -1.58 0.00 -1.26 -1.77 121.76 119.14 1zue s ALA 8 Ca 0.01 -0.32 0.36 0.00 0.00 0.00 0.00 51.96 52.01 1zue s ALA 8 Cb 0.00 -2.42 2.00 0.00 0.00 0.00 0.00 23.12 22.69 1zue s ALA 8 CO 0.01 0.24 2.19 0.00 0.00 0.00 0.00 175.76 178.19 1zue n TRP 10 N -3.27 0.00 -0.30 0.00 4.27 -1.26 -0.90 117.44 115.98 1zue n TRP 10 Ca -0.02 0.00 -0.05 0.00 -3.89 0.00 0.00 57.50 53.54 1zue n TRP 10 Cb 0.21 -0.36 0.07 0.00 -1.36 0.00 0.00 31.31 29.87 1zue n TRP 10 CO 0.00 0.00 0.00 0.77 -2.29 0.00 0.00 177.69 176.17 1zue h SER 11 N 0.00 1.11 0.00 -0.67 0.02 -1.40 -3.39 113.55 109.22 1zue h SER 11 Ca 0.00 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1zue h SER 11 Cb 0.79 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.04 1zue h SER 11 CO 0.00 0.97 0.00 1.41 -1.14 0.00 0.00 176.83 178.07 1zue n HIS 12 N -4.28 0.00 0.00 3.45 8.25 -1.15 -5.01 115.22 116.47 1zue n HIS 12 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1zue n HIS 12 Cb 0.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.29 1zue n HIS 12 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1zue n SER 13 N -1.89 0.00 -0.61 0.41 2.88 -1.24 -5.13 113.62 108.03 1zue n SER 13 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1zue n SER 13 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1zue n SER 13 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1zue n GLY 14 N 0.00 4.48 3.08 0.46 0.00 -0.08 -4.90 105.19 108.23 1zue n GLY 14 Ca 0.00 -1.57 -0.07 0.00 0.00 0.00 0.00 46.02 44.38 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 -1.61 0.21 -0.36 1.61 1.01 -0.68 -4.87 120.40 115.72 1zue s VAL 15 Ca 0.00 -1.72 -0.01 0.00 0.00 0.00 0.00 61.98 60.24 1zue s VAL 15 Cb 0.00 -1.41 0.09 0.00 0.00 0.00 0.00 36.38 35.05 1zue s VAL 15 CO 0.00 -0.95 0.10 0.00 0.00 0.00 0.00 175.10 174.25 1zue s ARG 17 N 1.15 2.41 0.22 0.00 0.52 -0.72 -4.89 118.95 117.64 1zue s ARG 17 Ca 0.03 -1.43 -0.30 0.00 -0.52 0.00 0.00 55.73 53.52 1zue s ARG 17 Cb -0.21 -2.22 -0.09 0.00 0.52 0.00 0.00 34.95 32.95 1zue s ARG 17 CO -0.04 0.26 1.41 -0.51 0.02 0.00 0.00 175.30 176.44 1zue s ASP 18 N -3.77 6.74 0.46 0.23 1.11 -1.26 -1.14 116.67 119.04 1zue s ASP 18 Ca 0.34 2.55 0.31 0.00 0.18 0.00 0.00 52.55 55.94 1zue s ASP 18 Cb -0.05 -2.61 1.64 0.00 1.07 0.00 0.00 42.92 42.96 1zue s ASP 18 CO 0.22 -0.65 1.94 0.07 1.18 0.00 0.00 175.17 177.93 1zue h LYS 19 N 5.42 0.00 -0.68 8.23 2.10 -1.92 -1.04 116.57 128.67 1zue h LYS 19 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1zue h LYS 19 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1zue h LYS 19 CO 0.79 0.00 0.00 0.45 -2.00 0.00 0.00 179.45 178.69 1zue n SER 20 N -2.60 3.62 -4.89 7.07 2.88 -1.26 -4.92 113.62 113.51 1zue n SER 20 Ca -0.02 -2.45 -0.29 0.00 -1.33 0.00 0.00 58.87 54.78 1zue n SER 20 Cb 0.07 -0.55 -0.03 0.00 -0.75 0.00 0.00 64.21 62.95 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 -1.94 3.68 -0.01 -1.46 2.12 -0.40 -5.00 118.70 115.70 1zue s GLU 21 Ca 0.33 0.17 0.16 0.00 0.36 0.00 0.00 54.97 55.99 1zue s GLU 21 Cb 0.24 -2.55 -0.21 0.00 0.26 0.00 0.00 34.13 31.86 1zue s GLU 21 CO 0.12 0.12 0.47 0.54 -0.54 0.00 0.00 175.26 175.97 1zue n ARG 22 N -1.08 1.09 -3.34 4.30 1.74 -1.26 -4.69 116.66 113.41 1zue n ARG 22 Ca -0.00 -0.08 -0.33 0.00 -0.77 0.00 0.00 57.85 56.66 1zue n ARG 22 Cb 0.54 -1.31 -0.05 0.00 -1.02 0.00 0.00 32.46 30.61 1zue n ARG 22 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1zue n ASN 23 N -1.76 4.61 -3.81 0.55 2.85 -1.26 -5.02 115.26 111.43 1zue n ASN 23 Ca -0.00 -3.39 -0.12 0.00 -0.11 0.00 0.00 54.58 50.95 1zue n ASN 23 Cb 0.34 -0.90 -0.11 0.00 1.24 0.00 0.00 39.78 40.35 1zue n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1zue s LYS 25 N -0.47 2.72 0.08 0.00 1.02 -1.26 -5.07 119.74 116.78 1zue s LYS 25 Ca -0.06 -2.66 -0.37 0.00 0.02 0.00 0.00 55.97 52.91 1zue s LYS 25 Cb -0.04 -3.80 -0.17 0.00 -0.52 0.00 0.00 37.83 33.31 1zue s LYS 25 CO 0.01 -1.20 1.31 -2.30 -0.92 0.00 0.00 175.35 172.26 1zue n PRO 26 N 3.31 1.06 -4.02 -1.68 -0.02 -1.26 -2.04 135.00 130.34 1zue n PRO 26 Ca 0.10 0.38 -0.33 0.00 -2.02 0.00 0.00 63.50 61.64 1zue n PRO 26 Cb 0.38 -2.00 -0.15 0.00 -0.02 0.00 0.00 33.50 31.71 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 0.40 2.19 0.50 -0.52 1.75 -0.84 -4.82 119.30 117.96 1zue s MET 27 Ca 0.84 -1.40 -0.08 0.00 -1.25 0.00 0.00 55.69 53.80 1zue s MET 27 Cb -0.97 -3.00 0.13 0.00 2.84 0.00 0.00 34.83 33.82 1zue s MET 27 CO 0.48 -0.63 0.33 0.00 -0.65 0.00 0.00 175.02 174.55 1zue n ALA 28 N 4.45 -1.69 -3.21 4.11 0.00 -1.26 -3.98 120.51 118.93 1zue n ALA 28 Ca -0.12 -0.56 -0.21 0.00 0.00 0.00 0.00 53.44 52.55 1zue n ALA 28 Cb 0.42 -0.05 -0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 -3.82 -1.75 -3.62 0.00 5.03 -1.26 -4.90 117.44 107.12 1zue n TRP 29 Ca 0.05 0.41 -0.06 0.00 3.03 0.00 0.00 57.50 60.93 1zue n TRP 29 Cb 0.21 -2.99 -0.05 0.00 -1.03 0.00 0.00 31.31 27.46 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 -2.89 0.00 0.07 -0.99 -1.32 -1.26 -1.15 115.64 108.10 1zue s THR 30 Ca 0.34 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.81 1zue s THR 30 Cb -0.18 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.77 1zue s THR 30 CO 0.42 0.00 -0.01 -0.72 -2.21 0.00 0.00 174.62 172.10 1zue s TYR 31 N -0.90 0.59 0.23 9.09 -0.85 -0.73 -4.77 117.35 120.02 1zue s TYR 31 Ca 0.04 -1.10 0.05 0.00 -0.52 0.00 0.00 57.07 55.54 1zue s TYR 31 Cb -0.01 -0.41 -0.03 0.00 0.38 0.00 0.00 41.96 41.89 1zue s TYR 31 CO -0.04 -0.41 0.30 0.00 -1.52 0.00 0.00 175.55 173.87 1zue h GLU 33 N 1.38 0.00 -6.02 0.00 5.08 -1.99 -3.41 114.58 109.63 1zue h GLU 33 Ca -0.50 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.28 1zue h GLU 33 Cb 1.23 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.42 1zue h GLU 33 CO 0.62 0.00 -0.06 1.21 -1.00 0.00 0.00 179.01 179.78 1zue s ASN 34 N -6.42 6.91 0.00 1.42 3.84 -1.26 -4.95 114.94 114.48 1zue s ASN 34 Ca -0.05 1.08 0.29 0.00 0.21 0.00 0.00 52.86 54.39 1zue s ASN 34 Cb 0.16 -2.34 1.69 0.00 -0.55 0.00 0.00 41.25 40.21 1zue s ASN 34 CO 0.61 0.11 2.09 0.54 -2.79 0.00 0.00 177.10 177.66 1zue n ARG 35 N 2.76 1.04 -0.00 0.43 3.00 -1.26 -3.21 116.66 119.41 1zue n ARG 35 Ca -0.08 -0.05 0.01 0.00 -0.01 0.00 0.00 57.85 57.72 1zue n ARG 35 Cb 0.51 -1.45 -0.01 0.00 0.00 0.00 0.00 32.46 31.51 1zue n ARG 35 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1zue n ASN 36 N -0.89 2.53 -4.91 0.55 4.05 -1.26 -5.03 115.26 110.30 1zue n ASN 36 Ca 0.22 -0.25 -0.32 0.00 0.45 0.00 0.00 54.58 54.68 1zue n ASN 36 Cb 0.11 1.03 -0.04 0.00 1.23 0.00 0.00 39.78 42.11 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 -1.63 3.45 0.17 1.20 0.74 -1.20 -3.82 119.66 118.57 1zue s GLN 37 Ca -0.00 -0.38 0.04 0.00 0.05 0.00 0.00 55.36 55.07 1zue s GLN 37 Cb 0.01 -3.06 -0.04 0.00 1.10 0.00 0.00 33.01 31.03 1zue s GLN 37 CO 0.05 0.63 0.22 0.15 -0.55 0.00 0.00 175.29 175.79 1zue s LYS 38 N -2.29 3.16 -0.48 1.67 1.02 -0.29 -4.58 119.74 117.94 1zue s LYS 38 Ca 0.32 -0.77 -0.16 0.00 0.02 0.00 0.00 55.97 55.39 1zue s LYS 38 Cb -0.13 -2.78 0.08 0.00 -0.52 0.00 0.00 37.83 34.48 1zue s LYS 38 CO 0.24 0.49 0.41 0.00 -0.92 0.00 0.00 175.35 175.58 1zue h GLU 41 N 0.85 -0.46 0.00 0.00 4.81 -1.72 -1.79 114.58 116.27 1zue h GLU 41 Ca -0.45 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 1zue h GLU 41 Cb 1.26 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.74 1zue h GLU 41 CO 0.52 -0.31 0.00 0.66 -0.73 0.00 0.00 179.01 179.16