#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 -3.83 4.28 7.35 -1.26 -4.70 117.46 119.31 1zue n PHE 3 Ca 0.00 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.35 1zue n PHE 3 Cb 0.00 -0.35 -0.12 0.00 0.35 0.00 0.00 39.48 39.36 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 -0.83 3.47 -0.40 -5.13 2.19 -1.26 -4.96 117.98 111.06 1zue s PHE 4 Ca 0.00 -2.77 0.09 0.00 0.33 0.00 0.00 56.93 54.58 1zue s PHE 4 Cb 0.00 -3.09 0.28 0.00 -1.31 0.00 0.00 43.02 38.89 1zue s PHE 4 CO 0.00 -0.87 0.59 -1.91 1.83 0.00 0.00 175.22 174.85 1zue n GLU 5 N 3.83 0.90 -2.49 10.12 2.13 -1.26 -5.12 120.64 128.75 1zue n GLU 5 Ca 0.04 -3.35 -0.18 0.00 0.66 0.00 0.00 57.16 54.32 1zue n GLU 5 Cb 0.38 -1.40 0.08 0.00 0.27 0.00 0.00 31.44 30.78 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 1.08 0.30 -4.44 5.31 2.81 -1.26 -4.92 117.12 116.00 1zue n MET 6 Ca 0.23 -2.52 -0.24 0.00 -1.81 0.00 0.00 57.70 53.36 1zue n MET 6 Cb 0.55 -0.41 -0.08 0.00 -0.71 0.00 0.00 33.22 32.58 1zue n MET 6 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1zue s GLN 7 N -4.53 1.90 0.35 0.03 -0.21 -1.16 -4.88 119.66 111.15 1zue s GLN 7 Ca 0.55 -2.14 -0.25 0.00 0.02 0.00 0.00 55.36 53.54 1zue s GLN 7 Cb -0.04 -0.26 -0.10 0.00 1.00 0.00 0.00 33.01 33.62 1zue s GLN 7 CO 0.36 -0.56 0.99 0.00 -2.12 0.00 0.00 175.29 173.95 1zue s ALA 8 N -3.28 3.17 0.37 6.09 0.00 -1.26 -1.97 121.76 124.88 1zue s ALA 8 Ca 0.29 0.59 0.12 0.00 0.00 0.00 0.00 51.96 52.96 1zue s ALA 8 Cb 0.02 -3.22 0.70 0.00 0.00 0.00 0.00 23.12 20.62 1zue s ALA 8 CO 0.19 0.03 1.82 0.00 0.00 0.00 0.00 175.76 177.80 1zue n TRP 10 N -4.09 0.43 0.12 0.00 4.27 -1.26 -0.92 117.44 115.98 1zue n TRP 10 Ca -0.02 0.12 0.01 0.00 -3.89 0.00 0.00 57.50 53.73 1zue n TRP 10 Cb 0.41 -0.57 0.33 0.00 -1.36 0.00 0.00 31.31 30.13 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 0.21 0.00 -0.67 0.02 -1.86 -3.39 113.55 107.86 1zue h SER 11 Ca 0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1zue h SER 11 Cb 0.77 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.26 1zue h SER 11 CO 0.00 0.47 0.00 1.41 -1.14 0.00 0.00 176.83 177.57 1zue n HIS 12 N -4.18 0.00 0.00 3.45 8.25 -1.22 -5.02 115.22 116.50 1zue n HIS 12 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1zue n HIS 12 Cb 0.35 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.46 1zue n HIS 12 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1zue n SER 13 N -1.81 0.00 -1.56 0.41 7.64 -1.20 -5.14 113.62 111.96 1zue n SER 13 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1zue n SER 13 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1zue n SER 13 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zue n GLY 14 N 0.00 3.74 3.09 0.23 0.00 -0.10 -4.80 105.19 107.35 1zue n GLY 14 Ca 0.00 -1.71 -0.07 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.34 0.21 -0.57 1.61 1.01 -0.68 -4.68 120.40 114.96 1zue s VAL 15 Ca 0.10 -1.73 -0.16 0.00 0.00 0.00 0.00 61.98 60.19 1zue s VAL 15 Cb 0.00 -1.44 0.14 0.00 0.00 0.00 0.00 36.38 35.08 1zue s VAL 15 CO 0.07 -0.96 0.54 0.00 0.00 0.00 0.00 175.10 174.75 1zue s ARG 17 N 1.55 3.16 0.26 0.00 1.81 -0.34 -4.86 118.95 120.53 1zue s ARG 17 Ca 0.05 -0.96 -0.30 0.00 -1.72 0.00 0.00 55.73 52.80 1zue s ARG 17 Cb -0.28 -2.83 -0.10 0.00 -0.45 0.00 0.00 34.95 31.30 1zue s ARG 17 CO 0.02 0.11 1.35 0.34 -0.68 0.00 0.00 175.30 176.44 1zue s ASP 18 N -4.15 6.77 0.25 0.23 2.15 -1.26 -1.42 116.67 119.25 1zue s ASP 18 Ca 0.44 2.59 0.21 0.00 0.43 0.00 0.00 52.55 56.22 1zue s ASP 18 Cb -0.09 -2.63 0.98 0.00 -0.30 0.00 0.00 42.92 40.88 1zue s ASP 18 CO 0.31 -0.58 1.65 0.29 -0.17 0.00 0.00 175.17 176.67 1zue n LYS 19 N 1.87 0.16 -0.85 4.34 5.02 -1.22 -2.00 118.16 125.48 1zue n LYS 19 Ca 0.04 0.49 0.08 0.00 -2.02 0.00 0.00 58.31 56.89 1zue n LYS 19 Cb 0.42 -1.86 0.40 0.00 -0.02 0.00 0.00 35.03 33.96 1zue n LYS 19 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1zue n SER 20 N -2.17 5.58 -4.87 4.39 2.88 -1.26 -4.96 113.62 113.21 1zue n SER 20 Ca 0.01 -2.83 -0.31 0.00 -1.33 0.00 0.00 58.87 54.40 1zue n SER 20 Cb 0.15 -0.67 -0.04 0.00 -0.75 0.00 0.00 64.21 62.90 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 -2.58 3.86 -0.00 -1.46 2.12 -0.85 -4.99 118.70 114.80 1zue s GLU 21 Ca 0.54 0.51 0.11 0.00 0.36 0.00 0.00 54.97 56.50 1zue s GLU 21 Cb 0.40 -2.43 -0.13 0.00 0.26 0.00 0.00 34.13 32.23 1zue s GLU 21 CO 0.18 0.07 0.44 0.54 -0.54 0.00 0.00 175.26 175.95 1zue n ARG 22 N -0.85 2.85 -3.32 4.30 1.74 -1.26 -4.72 116.66 115.40 1zue n ARG 22 Ca 0.03 -0.02 -0.27 0.00 -0.77 0.00 0.00 57.85 56.82 1zue n ARG 22 Cb 0.54 -1.07 -0.07 0.00 -1.02 0.00 0.00 32.46 30.84 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 -1.36 3.60 -3.89 0.55 2.85 -1.26 -5.05 115.26 110.70 1zue n ASN 23 Ca 0.01 -3.43 -0.12 0.00 -0.11 0.00 0.00 54.58 50.94 1zue n ASN 23 Cb 0.19 -0.65 -0.14 0.00 1.24 0.00 0.00 39.78 40.43 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 -0.21 3.52 0.09 0.00 1.02 -1.26 -5.04 119.74 117.86 1zue s LYS 25 Ca -0.02 -2.36 -0.31 0.00 0.02 0.00 0.00 55.97 53.30 1zue s LYS 25 Cb -0.01 -4.41 -0.10 0.00 -0.52 0.00 0.00 37.83 32.79 1zue s LYS 25 CO -0.00 -1.30 1.85 -1.25 -0.92 0.00 0.00 175.35 173.74 1zue s PRO 26 N 0.35 4.14 -0.17 -1.68 0.04 -1.26 -1.87 135.00 134.55 1zue s PRO 26 Ca 0.16 2.57 -0.05 0.00 0.04 0.00 0.00 61.00 63.71 1zue s PRO 26 Cb -0.13 -3.78 -0.03 0.00 0.04 0.00 0.00 34.50 30.60 1zue s PRO 26 CO -0.07 -0.87 0.01 1.41 0.04 0.00 0.00 177.00 177.52 1zue s MET 27 N 3.31 3.81 0.24 4.56 1.75 -0.60 -4.91 119.30 127.45 1zue s MET 27 Ca 0.83 -0.44 -0.04 0.00 -1.25 0.00 0.00 55.69 54.79 1zue s MET 27 Cb -0.44 -3.06 0.06 0.00 2.84 0.00 0.00 34.83 34.23 1zue s MET 27 CO 0.37 0.25 0.28 0.00 -0.65 0.00 0.00 175.02 175.27 1zue n ALA 28 N 3.56 -0.51 -4.14 4.11 0.00 -1.26 -4.24 120.51 118.03 1zue n ALA 28 Ca -0.17 -0.38 -0.35 0.00 0.00 0.00 0.00 53.44 52.54 1zue n ALA 28 Cb 0.52 -0.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 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 -2.65 -1.58 -3.65 0.00 7.02 -1.26 -4.87 117.44 110.45 1zue n TRP 29 Ca 0.04 0.68 -0.02 0.00 -1.02 0.00 0.00 57.50 57.18 1zue n TRP 29 Cb 0.13 -2.50 -0.06 0.00 -2.42 0.00 0.00 31.31 26.47 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 -3.16 0.00 0.28 -0.99 -1.32 -1.26 -3.00 115.64 106.19 1zue s THR 30 Ca 0.70 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 61.21 1zue s THR 30 Cb -0.39 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.56 1zue s THR 30 CO 0.86 0.00 0.20 -0.72 -2.21 0.00 0.00 174.62 172.75 1zue s TYR 31 N -0.34 1.51 0.23 9.09 -0.85 -0.83 -4.71 117.35 121.45 1zue s TYR 31 Ca 0.08 -1.49 0.06 0.00 -0.52 0.00 0.00 57.07 55.20 1zue s TYR 31 Cb -0.04 -0.70 -0.03 0.00 0.38 0.00 0.00 41.96 41.57 1zue s TYR 31 CO -0.14 -0.70 0.26 0.00 -1.52 0.00 0.00 175.55 173.45 1zue h GLU 33 N 1.51 0.31 -6.49 0.00 5.08 -1.99 -3.42 114.58 109.57 1zue h GLU 33 Ca -0.50 -0.03 -0.53 0.00 -1.00 0.00 0.00 59.36 57.31 1zue h GLU 33 Cb 1.23 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.38 1zue h GLU 33 CO 0.62 0.24 -0.07 1.21 -1.00 0.00 0.00 179.01 180.01 1zue s ASN 34 N -6.85 6.66 -0.09 1.42 2.47 -1.26 -4.98 114.94 112.31 1zue s ASN 34 Ca -0.07 0.99 0.08 0.00 0.42 0.00 0.00 52.86 54.29 1zue s ASN 34 Cb 0.17 -2.25 0.40 0.00 -1.45 0.00 0.00 41.25 38.11 1zue s ASN 34 CO 0.71 -0.10 1.18 -1.14 -3.72 0.00 0.00 177.10 174.03 1zue n ARG 35 N -0.17 2.69 -0.22 0.43 0.63 -1.26 -3.60 116.66 115.16 1zue n ARG 35 Ca 0.01 -1.54 0.01 0.00 -0.92 0.00 0.00 57.85 55.41 1zue n ARG 35 Cb 0.53 -1.73 0.01 0.00 0.45 0.00 0.00 32.46 31.72 1zue n ARG 35 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1zue n ASN 36 N 0.40 0.36 -4.04 6.15 4.05 -1.26 -5.07 115.26 115.85 1zue n ASN 36 Ca 0.14 -1.69 -0.20 0.00 0.45 0.00 0.00 54.58 53.29 1zue n ASN 36 Cb 0.62 -0.12 -0.15 0.00 1.23 0.00 0.00 39.78 41.36 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 -0.32 0.84 0.15 1.20 0.74 -1.24 -3.43 119.66 117.61 1zue s GLN 37 Ca 0.03 -0.37 0.02 0.00 0.05 0.00 0.00 55.36 55.09 1zue s GLN 37 Cb 0.02 -0.82 -0.04 0.00 1.10 0.00 0.00 33.01 33.28 1zue s GLN 37 CO 0.00 0.22 0.29 0.15 -0.55 0.00 0.00 175.29 175.40 1zue s LYS 38 N -0.23 3.44 -0.50 1.67 1.02 -0.51 -4.28 119.74 120.36 1zue s LYS 38 Ca 0.04 -0.59 -0.16 0.00 0.02 0.00 0.00 55.97 55.27 1zue s LYS 38 Cb -0.04 -2.96 0.09 0.00 -0.52 0.00 0.00 37.83 34.39 1zue s LYS 38 CO -0.00 0.52 0.47 0.00 -0.92 0.00 0.00 175.35 175.41 1zue h GLU 41 N 0.87 -0.29 0.00 0.00 5.08 -1.68 -1.81 114.58 116.75 1zue h GLU 41 Ca -0.46 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1zue h GLU 41 Cb 1.26 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1zue h GLU 41 CO 0.53 -0.19 0.00 0.66 -1.00 0.00 0.00 179.01 179.01