#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 -1.14 -3.23 4.28 -0.00 -1.26 -5.24 117.46 110.87 1zue n PHE 3 Ca 0.00 0.20 0.03 0.00 -0.00 0.00 0.00 57.45 57.69 1zue n PHE 3 Cb 0.00 0.44 -0.02 0.00 -0.00 0.00 0.00 39.48 39.90 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 -2.00 -1.36 -0.72 -5.13 0.08 -1.26 -5.05 117.98 102.54 1zue s PHE 4 Ca 0.00 1.60 -0.00 0.00 0.12 0.00 0.00 56.93 58.65 1zue s PHE 4 Cb 0.00 0.54 0.38 0.00 -0.57 0.00 0.00 43.02 43.37 1zue s PHE 4 CO 0.00 -0.73 1.78 -1.91 -0.10 0.00 0.00 175.22 174.26 1zue n GLU 5 N 5.42 2.94 -3.58 0.44 2.13 -1.26 -4.99 120.64 121.73 1zue n GLU 5 Ca -0.04 -3.77 -0.24 0.00 0.66 0.00 0.00 57.16 53.77 1zue n GLU 5 Cb 0.51 -2.27 0.02 0.00 0.27 0.00 0.00 31.44 29.97 1zue n GLU 5 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 1zue s MET 6 N -3.91 2.28 0.41 5.31 -1.94 -1.26 -4.78 119.30 115.42 1zue s MET 6 Ca 0.52 -1.87 0.04 0.00 -1.71 0.00 0.00 55.69 52.67 1zue s MET 6 Cb 0.43 -2.30 -0.02 0.00 2.01 0.00 0.00 34.83 34.96 1zue s MET 6 CO -0.32 -0.68 0.15 1.04 -0.01 0.00 0.00 175.02 175.20 1zue n GLN 7 N -1.92 0.57 -2.70 2.03 6.02 -0.92 -4.83 117.38 115.62 1zue n GLN 7 Ca 0.05 -3.52 -0.37 0.00 -0.01 0.00 0.00 57.00 53.15 1zue n GLN 7 Cb 0.63 1.94 -0.06 0.00 1.02 0.00 0.00 30.24 33.77 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 -3.14 3.18 0.44 -1.58 0.00 -1.26 -1.39 121.76 118.01 1zue s ALA 8 Ca 0.22 0.58 0.18 0.00 0.00 0.00 0.00 51.96 52.94 1zue s ALA 8 Cb 0.01 -3.21 1.13 0.00 0.00 0.00 0.00 23.12 21.05 1zue s ALA 8 CO 0.15 0.05 2.01 0.00 0.00 0.00 0.00 175.76 177.98 1zue h TRP 10 N 0.00 0.46 -0.33 0.00 5.08 -1.90 -0.09 115.95 119.17 1zue h TRP 10 Ca -0.00 -0.34 0.10 0.00 1.08 0.00 0.00 58.89 59.73 1zue h TRP 10 Cb 0.33 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 26.46 1zue h TRP 10 CO 0.00 1.34 0.24 1.03 -1.28 0.00 0.00 178.44 179.77 1zue h SER 11 N 0.07 0.00 -0.00 0.11 0.87 -1.84 -1.03 113.55 111.73 1zue h SER 11 Ca -0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 1zue h SER 11 Cb 2.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.96 1zue h SER 11 CO 0.18 0.00 -0.65 1.41 -0.53 0.00 0.00 176.83 177.24 1zue n HIS 12 N -4.42 0.00 -2.13 2.24 8.25 -1.14 -5.02 115.22 113.01 1zue n HIS 12 Ca 0.05 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.48 1zue n HIS 12 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 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 -1.20 -4.85 -0.02 0.41 2.88 -0.39 -5.09 113.62 105.36 1zue n SER 13 Ca 0.03 0.36 0.00 0.00 -1.33 0.00 0.00 58.87 57.94 1zue n SER 13 Cb 0.24 -3.09 0.00 0.00 -0.75 0.00 0.00 64.21 60.61 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 -0.22 5.85 2.97 0.46 0.00 -0.12 -4.84 105.19 109.28 1zue n GLY 14 Ca 0.04 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.39 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 -0.50 0.10 -0.54 1.61 1.01 -0.14 -4.90 120.40 117.04 1zue s VAL 15 Ca 0.00 -0.84 -0.13 0.00 0.00 0.00 0.00 61.98 61.01 1zue s VAL 15 Cb 0.00 -0.24 0.13 0.00 0.00 0.00 0.00 36.38 36.27 1zue s VAL 15 CO 0.00 -0.46 0.47 0.00 0.00 0.00 0.00 175.10 175.11 1zue s ARG 17 N 1.35 2.37 0.35 0.00 1.81 -0.81 -4.86 118.95 119.16 1zue s ARG 17 Ca 0.06 -1.33 -0.27 0.00 -1.72 0.00 0.00 55.73 52.47 1zue s ARG 17 Cb -0.27 -2.23 -0.12 0.00 -0.45 0.00 0.00 34.95 31.88 1zue s ARG 17 CO 0.00 0.38 1.21 -3.47 -0.68 0.00 0.00 175.30 172.75 1zue n ASP 18 N -0.79 2.32 0.20 0.23 2.03 -1.26 -1.30 116.55 117.99 1zue n ASP 18 Ca -0.07 1.17 0.14 0.00 0.52 0.00 0.00 54.79 56.55 1zue n ASP 18 Cb 0.58 -1.44 0.69 0.00 -0.72 0.00 0.00 41.12 40.24 1zue n ASP 18 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1zue h LYS 19 N 2.27 0.00 -0.54 -0.67 2.10 -1.90 -1.65 116.57 116.18 1zue h LYS 19 Ca -0.45 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.04 1zue h LYS 19 Cb 1.30 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 32.54 1zue h LYS 19 CO 0.61 0.00 0.14 0.45 -2.00 0.00 0.00 179.45 178.65 1zue n SER 20 N -2.49 4.11 -4.86 7.07 2.88 -1.26 -5.00 113.62 114.08 1zue n SER 20 Ca -0.01 -3.28 -0.31 0.00 -1.33 0.00 0.00 58.87 53.94 1zue n SER 20 Cb 0.12 -0.67 -0.03 0.00 -0.75 0.00 0.00 64.21 62.87 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 -3.01 3.85 0.00 -1.46 -6.30 -0.62 -4.99 118.70 106.17 1zue s GLU 21 Ca 0.50 0.76 0.22 0.00 -2.50 0.00 0.00 54.97 53.95 1zue s GLU 21 Cb 0.41 -2.22 -0.21 0.00 0.00 0.00 0.00 34.13 32.11 1zue s GLU 21 CO 0.10 -0.23 0.75 0.54 0.02 0.00 0.00 175.26 176.44 1zue n ARG 22 N -1.63 0.38 -3.31 4.30 5.12 -1.26 -4.57 116.66 115.68 1zue n ARG 22 Ca 0.05 -0.08 -0.28 0.00 -1.93 0.00 0.00 57.85 55.60 1zue n ARG 22 Cb 0.54 -1.54 -0.07 0.00 -1.16 0.00 0.00 32.46 30.23 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 -1.98 4.10 -3.67 0.55 5.15 -1.26 -5.01 115.26 113.13 1zue n ASN 23 Ca -0.00 -3.49 -0.12 0.00 -0.60 0.00 0.00 54.58 50.37 1zue n ASN 23 Cb 0.47 -0.70 -0.13 0.00 -0.53 0.00 0.00 39.78 38.89 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 2.21 2.85 0.39 0.00 -0.14 -1.26 -5.04 119.74 118.75 1zue s LYS 25 Ca -0.01 -2.93 -0.23 0.00 -1.36 0.00 0.00 55.97 51.44 1zue s LYS 25 Cb -0.12 -3.80 -0.14 0.00 -1.68 0.00 0.00 37.83 32.10 1zue s LYS 25 CO -0.09 -1.22 0.42 -2.30 -0.76 0.00 0.00 175.35 171.40 1zue n PRO 26 N 2.85 0.38 -3.03 -1.68 -0.02 -1.26 -2.04 135.00 130.19 1zue n PRO 26 Ca 0.15 0.14 -0.19 0.00 -2.02 0.00 0.00 63.50 61.58 1zue n PRO 26 Cb 0.37 -1.33 0.04 0.00 -0.02 0.00 0.00 33.50 32.57 1zue n PRO 26 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1zue s MET 27 N -1.36 2.52 -0.02 -0.52 -1.94 -0.85 -4.72 119.30 112.41 1zue s MET 27 Ca 0.62 -1.48 -0.19 0.00 -1.71 0.00 0.00 55.69 52.93 1zue s MET 27 Cb -0.64 -2.69 -0.05 0.00 2.01 0.00 0.00 34.83 33.45 1zue s MET 27 CO 0.59 -0.62 0.54 0.00 -0.01 0.00 0.00 175.02 175.52 1zue s ALA 28 N -2.54 3.52 -0.49 3.03 0.00 -1.26 -4.54 121.76 119.47 1zue s ALA 28 Ca 0.59 -0.05 -0.26 0.00 0.00 0.00 0.00 51.96 52.24 1zue s ALA 28 Cb -0.07 -2.66 0.04 0.00 0.00 0.00 0.00 23.12 20.42 1zue s ALA 28 CO 0.37 0.20 0.64 0.91 0.00 0.00 0.00 175.76 177.88 1zue n TRP 29 N 2.70 -2.92 -3.59 0.00 7.02 -1.26 -4.88 117.44 114.51 1zue n TRP 29 Ca -0.08 1.20 -0.11 0.00 -1.02 0.00 0.00 57.50 57.49 1zue n TRP 29 Cb 0.51 -2.75 -0.06 0.00 -2.42 0.00 0.00 31.31 26.60 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 -2.06 0.00 0.07 -0.99 -1.32 -1.26 -2.16 115.64 107.93 1zue s THR 30 Ca 0.29 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.78 1zue s THR 30 Cb -0.04 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.91 1zue s THR 30 CO 0.84 0.00 -0.06 -0.72 -2.21 0.00 0.00 174.62 172.46 1zue s TYR 31 N -0.78 0.77 0.53 9.09 -0.85 -0.48 -4.78 117.35 120.84 1zue s TYR 31 Ca -0.01 -0.79 0.09 0.00 -0.52 0.00 0.00 57.07 55.84 1zue s TYR 31 Cb -0.02 -0.46 0.06 0.00 0.38 0.00 0.00 41.96 41.93 1zue s TYR 31 CO 0.00 -0.15 0.73 0.00 -1.52 0.00 0.00 175.55 174.61 1zue h GLU 33 N 0.31 0.89 -6.48 0.00 4.81 -1.98 -3.44 114.58 108.68 1zue h GLU 33 Ca -0.33 -0.49 -0.53 0.00 -0.13 0.00 0.00 59.36 57.88 1zue h GLU 33 Cb 1.29 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.66 1zue h GLU 33 CO 0.42 1.14 -0.08 1.21 -0.73 0.00 0.00 179.01 180.97 1zue s ASN 34 N -6.81 6.66 -0.11 1.04 2.47 -1.26 -4.98 114.94 111.95 1zue s ASN 34 Ca -0.11 0.99 0.08 0.00 0.42 0.00 0.00 52.86 54.24 1zue s ASN 34 Cb 0.10 -2.25 0.41 0.00 -1.45 0.00 0.00 41.25 38.06 1zue s ASN 34 CO 0.88 -0.09 1.16 -1.14 -3.72 0.00 0.00 177.10 174.18 1zue n ARG 35 N -0.13 2.89 -0.08 0.43 0.00 -1.26 -3.64 116.66 114.87 1zue n ARG 35 Ca 0.01 -1.59 0.00 0.00 -0.00 0.00 0.00 57.85 56.27 1zue n ARG 35 Cb 0.52 -1.83 0.01 0.00 0.00 0.00 0.00 32.46 31.16 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 0.35 0.51 -4.45 6.15 2.85 -1.26 -5.08 115.26 114.34 1zue n ASN 36 Ca 0.14 -1.45 -0.22 0.00 -0.11 0.00 0.00 54.58 52.94 1zue n ASN 36 Cb 0.69 -0.05 -0.10 0.00 1.24 0.00 0.00 39.78 41.56 1zue n ASN 36 CO 0.00 0.00 0.00 -1.58 -2.11 0.00 0.00 177.26 173.57 1zue s GLN 37 N -0.34 1.59 0.09 1.20 0.74 -1.24 -3.75 119.66 117.96 1zue s GLN 37 Ca 0.02 -1.81 0.09 0.00 0.05 0.00 0.00 55.36 53.70 1zue s GLN 37 Cb 0.01 -1.21 -0.04 0.00 1.10 0.00 0.00 33.01 32.87 1zue s GLN 37 CO 0.00 0.04 -0.22 -1.59 -0.55 0.00 0.00 175.29 172.97 1zue s LYS 38 N -3.72 1.73 -0.57 1.67 -2.85 -0.42 -4.68 119.74 110.91 1zue s LYS 38 Ca 0.30 -1.18 -0.16 0.00 -1.00 0.00 0.00 55.97 53.93 1zue s LYS 38 Cb 0.04 -2.04 0.13 0.00 -2.06 0.00 0.00 37.83 33.90 1zue s LYS 38 CO 0.13 0.49 0.55 0.00 0.10 0.00 0.00 175.35 176.61 1zue h GLU 41 N 0.99 -0.29 0.00 0.00 4.81 -1.70 -0.34 114.58 118.05 1zue h GLU 41 Ca -0.49 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1zue h GLU 41 Cb 1.24 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.69 1zue h GLU 41 CO 0.57 -0.19 0.00 2.48 -0.73 0.00 0.00 179.01 181.14