#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 0.00 -3.35 1.39 -0.00 -1.26 -5.18 117.46 109.05 1zue n PHE 3 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.34 1zue n PHE 3 Cb 0.00 -0.46 -0.08 0.00 -0.00 0.00 0.00 39.48 38.94 1zue n PHE 3 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 1zue s PHE 4 N 0.00 -0.77 -0.29 -5.13 0.08 -1.26 -5.10 117.98 105.50 1zue s PHE 4 Ca 0.65 0.39 0.01 0.00 0.12 0.00 0.00 56.93 58.09 1zue s PHE 4 Cb -0.42 -0.18 0.19 0.00 -0.57 0.00 0.00 43.02 42.05 1zue s PHE 4 CO 0.28 -0.85 0.68 -2.00 -0.10 0.00 0.00 175.22 173.22 1zue s GLU 5 N 2.49 0.49 0.55 0.44 2.12 -1.26 -5.17 118.70 118.36 1zue s GLU 5 Ca 0.10 0.60 0.07 0.00 0.36 0.00 0.00 54.97 56.11 1zue s GLU 5 Cb -0.14 0.30 0.06 0.00 0.26 0.00 0.00 34.13 34.61 1zue s GLU 5 CO -0.24 -0.79 0.56 -1.64 -0.54 0.00 0.00 175.26 172.61 1zue s MET 6 N 2.86 2.29 0.00 4.30 -1.94 -1.26 -4.79 119.30 120.76 1zue s MET 6 Ca 0.14 -1.84 0.00 0.00 -1.71 0.00 0.00 55.69 52.29 1zue s MET 6 Cb -0.10 -2.34 0.00 0.00 2.01 0.00 0.00 34.83 34.39 1zue s MET 6 CO -0.23 -0.70 0.00 1.04 -0.01 0.00 0.00 175.02 175.12 1zue n GLN 7 N -1.95 1.85 -3.48 2.03 6.02 -0.83 -4.80 117.38 116.21 1zue n GLN 7 Ca 0.06 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.70 1zue n GLN 7 Cb 0.63 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.83 1zue n GLN 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1zue s ALA 8 N -2.00 3.66 0.15 -1.58 0.00 -1.26 -1.84 121.76 118.89 1zue s ALA 8 Ca 0.00 -0.28 0.16 0.00 0.00 0.00 0.00 51.96 51.84 1zue s ALA 8 Cb 0.00 -2.38 0.47 0.00 0.00 0.00 0.00 23.12 21.21 1zue s ALA 8 CO 0.00 0.52 1.64 0.00 0.00 0.00 0.00 175.76 177.92 1zue h TRP 10 N 0.00 0.03 -0.56 0.00 5.08 -1.91 -0.21 115.95 118.37 1zue h TRP 10 Ca -0.00 -0.02 0.13 0.00 1.08 0.00 0.00 58.89 60.08 1zue h TRP 10 Cb 1.06 -0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 27.19 1zue h TRP 10 CO 0.00 1.04 0.39 1.03 -1.28 0.00 0.00 178.44 179.62 1zue h SER 11 N 0.00 0.16 -0.31 0.11 0.87 -1.96 -0.17 113.55 112.26 1zue h SER 11 Ca -0.28 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1zue h SER 11 Cb 2.00 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.94 1zue h SER 11 CO 0.08 0.09 0.00 0.00 -0.53 0.00 0.00 176.83 176.47 1zue n HIS 12 N -4.43 0.59 -2.99 2.24 1.44 -1.24 -5.03 115.22 105.80 1zue n HIS 12 Ca 0.10 -0.61 -0.13 0.00 -2.01 0.00 0.00 57.72 55.07 1zue n HIS 12 Cb 0.51 -0.11 0.01 0.00 0.12 0.00 0.00 29.99 30.52 1zue n HIS 12 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1zue n SER 13 N 0.17 -7.35 0.00 4.39 2.88 -0.08 -5.05 113.62 108.59 1zue n SER 13 Ca 0.14 0.56 0.00 0.00 -1.33 0.00 0.00 58.87 58.24 1zue n SER 13 Cb 0.56 -4.30 0.00 0.00 -0.75 0.00 0.00 64.21 59.72 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 0.05 5.55 3.12 0.46 0.00 -0.09 -5.01 105.19 109.27 1zue n GLY 14 Ca 0.04 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.40 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 1.24 0.17 -0.17 1.61 1.01 -0.79 -4.93 120.40 118.53 1zue s VAL 15 Ca 0.00 -1.86 -0.02 0.00 0.00 0.00 0.00 61.98 60.10 1zue s VAL 15 Cb 0.00 -1.78 0.05 0.00 0.00 0.00 0.00 36.38 34.65 1zue s VAL 15 CO 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 175.10 174.36 1zue s ARG 17 N 1.77 2.08 0.25 0.00 1.81 -0.76 -4.90 118.95 119.20 1zue s ARG 17 Ca -0.00 -2.14 -0.30 0.00 -1.72 0.00 0.00 55.73 51.57 1zue s ARG 17 Cb -0.16 -1.69 -0.09 0.00 -0.45 0.00 0.00 34.95 32.56 1zue s ARG 17 CO -0.07 -0.17 1.32 -0.51 -0.68 0.00 0.00 175.30 175.19 1zue s ASP 18 N -3.82 6.83 0.27 0.23 1.11 -1.26 -1.31 116.67 118.73 1zue s ASP 18 Ca 0.28 2.53 0.22 0.00 0.18 0.00 0.00 52.55 55.75 1zue s ASP 18 Cb 0.06 -2.62 1.03 0.00 1.07 0.00 0.00 42.92 42.46 1zue s ASP 18 CO 0.15 -0.54 1.66 2.29 1.18 0.00 0.00 175.17 179.90 1zue n LYS 19 N 1.98 0.16 -0.46 8.23 2.85 -1.24 -1.73 118.16 127.96 1zue n LYS 19 Ca 0.04 0.52 0.06 0.00 -1.05 0.00 0.00 58.31 57.89 1zue n LYS 19 Cb 0.42 -1.89 0.25 0.00 -0.65 0.00 0.00 35.03 33.16 1zue n LYS 19 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1zue n SER 20 N -2.21 3.55 -4.90 -5.58 2.88 -1.26 -4.92 113.62 101.18 1zue n SER 20 Ca 0.00 -2.35 -0.29 0.00 -1.33 0.00 0.00 58.87 54.90 1zue n SER 20 Cb 0.13 -0.50 -0.03 0.00 -0.75 0.00 0.00 64.21 63.06 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 -1.81 3.66 -0.01 -1.46 2.12 -0.70 -5.00 118.70 115.50 1zue s GLU 21 Ca 0.36 0.15 0.12 0.00 0.36 0.00 0.00 54.97 55.95 1zue s GLU 21 Cb 0.24 -2.55 -0.15 0.00 0.26 0.00 0.00 34.13 31.93 1zue s GLU 21 CO 0.16 0.10 0.42 0.54 -0.54 0.00 0.00 175.26 175.95 1zue n ARG 22 N -1.18 2.24 -3.37 4.30 1.74 -1.26 -4.73 116.66 114.40 1zue n ARG 22 Ca -0.00 -0.04 -0.32 0.00 -0.77 0.00 0.00 57.85 56.72 1zue n ARG 22 Cb 0.54 -1.13 -0.06 0.00 -1.02 0.00 0.00 32.46 30.79 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 -1.48 4.42 -3.80 0.55 5.15 -1.26 -5.02 115.26 113.81 1zue n ASN 23 Ca 0.01 -3.40 -0.13 0.00 -0.60 0.00 0.00 54.58 50.46 1zue n ASN 23 Cb 0.22 -0.85 -0.10 0.00 -0.53 0.00 0.00 39.78 38.52 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 -0.68 3.56 -0.18 0.00 2.36 -1.26 -5.02 119.74 118.51 1zue s LYS 25 Ca -0.08 -2.21 -0.34 0.00 -2.55 0.00 0.00 55.97 50.79 1zue s LYS 25 Cb -0.04 -4.54 -0.11 0.00 -1.05 0.00 0.00 37.83 32.08 1zue s LYS 25 CO 0.02 -1.43 1.98 -0.35 1.55 0.00 0.00 175.35 177.12 1zue n PRO 26 N 4.77 1.80 -3.77 4.03 -0.04 -1.26 -1.86 135.00 138.67 1zue n PRO 26 Ca 0.14 0.61 -0.37 0.00 -0.04 0.00 0.00 63.50 63.85 1zue n PRO 26 Cb 0.47 -2.62 -0.13 0.00 -0.04 0.00 0.00 33.50 31.19 1zue n PRO 26 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1zue s MET 27 N 4.80 3.29 0.65 0.54 1.75 -0.67 -4.88 119.30 124.76 1zue s MET 27 Ca 0.98 -0.72 -0.11 0.00 -1.25 0.00 0.00 55.69 54.59 1zue s MET 27 Cb -0.73 -3.33 0.16 0.00 2.84 0.00 0.00 34.83 33.77 1zue s MET 27 CO 0.51 -0.35 0.66 0.00 -0.65 0.00 0.00 175.02 175.20 1zue n ALA 28 N 4.88 -1.57 -4.21 4.11 0.00 -1.26 -4.25 120.51 118.22 1zue n ALA 28 Ca -0.15 -0.94 -0.32 0.00 0.00 0.00 0.00 53.44 52.03 1zue n ALA 28 Cb 0.49 -0.06 -0.05 0.00 0.00 0.00 0.00 19.45 19.83 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 -3.56 -1.49 -3.65 0.00 7.02 -1.26 -4.90 117.44 109.60 1zue n TRP 29 Ca 0.09 0.71 -0.02 0.00 -1.02 0.00 0.00 57.50 57.26 1zue n TRP 29 Cb 0.33 -3.03 -0.06 0.00 -2.42 0.00 0.00 31.31 26.13 1zue n TRP 29 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 1zue s THR 30 N -3.84 0.00 0.19 -0.99 -1.32 -1.26 -1.97 115.64 106.46 1zue s THR 30 Ca 0.29 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.75 1zue s THR 30 Cb -0.16 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.79 1zue s THR 30 CO 0.95 0.00 0.13 -0.72 -2.21 0.00 0.00 174.62 172.77 1zue s TYR 31 N -0.28 1.11 0.50 9.09 1.13 -0.77 -4.61 117.35 123.51 1zue s TYR 31 Ca 0.08 -1.35 0.07 0.00 -1.41 0.00 0.00 57.07 54.46 1zue s TYR 31 Cb -0.04 -0.54 0.07 0.00 -1.10 0.00 0.00 41.96 40.35 1zue s TYR 31 CO -0.14 -0.63 0.54 0.00 -2.51 0.00 0.00 175.55 172.81 1zue h GLU 33 N 0.00 0.00 -6.40 0.00 -0.00 -2.01 -3.45 114.58 102.72 1zue h GLU 33 Ca -0.27 0.00 -0.54 0.00 -0.00 0.00 0.00 59.36 58.54 1zue h GLU 33 Cb 1.11 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.82 1zue h GLU 33 CO 0.41 0.61 -0.07 1.21 -0.00 0.00 0.00 179.01 181.17 1zue s ASN 34 N -6.58 6.78 -0.11 3.06 2.47 -1.26 -4.98 114.94 114.32 1zue s ASN 34 Ca 0.01 1.07 0.08 0.00 0.42 0.00 0.00 52.86 54.43 1zue s ASN 34 Cb 0.10 -2.28 0.42 0.00 -1.45 0.00 0.00 41.25 38.03 1zue s ASN 34 CO 0.75 0.03 1.16 0.54 -3.72 0.00 0.00 177.10 175.85 1zue n ARG 35 N 0.44 2.91 -0.34 0.43 5.12 -1.26 -3.66 116.66 120.30 1zue n ARG 35 Ca -0.03 -1.60 0.00 0.00 -1.93 0.00 0.00 57.85 54.29 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 0.35 0.00 -4.16 0.55 4.05 -1.26 -5.08 115.26 109.71 1zue n ASN 36 Ca 0.14 -1.68 -0.23 0.00 0.45 0.00 0.00 54.58 53.26 1zue n ASN 36 Cb 0.70 -0.14 -0.14 0.00 1.23 0.00 0.00 39.78 41.43 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 0.00 1.20 0.04 1.20 0.74 -1.24 -3.60 119.66 118.00 1zue s GLN 37 Ca 0.00 -0.70 0.01 0.00 0.05 0.00 0.00 55.36 54.72 1zue s GLN 37 Cb 0.00 -1.21 -0.04 0.00 1.10 0.00 0.00 33.01 32.86 1zue s GLN 37 CO 0.00 0.32 0.11 0.15 -0.55 0.00 0.00 175.29 175.32 1zue s LYS 38 N -0.75 3.10 -0.49 1.67 1.02 -0.43 -4.44 119.74 119.41 1zue s LYS 38 Ca 0.05 -0.54 -0.19 0.00 0.02 0.00 0.00 55.97 55.31 1zue s LYS 38 Cb -0.07 -2.86 0.05 0.00 -0.52 0.00 0.00 37.83 34.43 1zue s LYS 38 CO 0.00 0.61 0.61 0.00 -0.92 0.00 0.00 175.35 175.65 1zue h GLU 41 N 0.92 -0.16 -0.02 0.00 4.81 -1.67 -2.10 114.58 116.36 1zue h GLU 41 Ca -0.47 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1zue h GLU 41 Cb 1.25 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.67 1zue h GLU 41 CO 0.55 -0.11 0.00 2.48 -0.73 0.00 0.00 179.01 181.20