#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 0.25 -3.54 9.51 7.35 -1.26 -5.12 117.46 124.65 1zue n PHE 3 Ca 0.00 -0.14 -0.01 0.00 -0.76 0.00 0.00 57.45 56.54 1zue n PHE 3 Cb 0.00 -1.13 -0.05 0.00 0.35 0.00 0.00 39.48 38.65 1zue n PHE 3 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1zue s PHE 4 N 6.98 -0.80 -0.44 -5.13 0.08 -1.26 -5.11 117.98 112.31 1zue s PHE 4 Ca 0.37 1.46 0.05 0.00 0.12 0.00 0.00 56.93 58.92 1zue s PHE 4 Cb 0.02 0.48 0.17 0.00 -0.57 0.00 0.00 43.02 43.12 1zue s PHE 4 CO 0.12 -0.40 0.46 -2.00 -0.10 0.00 0.00 175.22 173.31 1zue s GLU 5 N 2.09 0.91 1.29 0.44 2.56 -1.26 -5.13 118.70 119.61 1zue s GLU 5 Ca -0.06 -1.59 0.00 0.00 0.00 0.00 0.00 54.97 53.32 1zue s GLU 5 Cb -0.06 -0.89 0.00 0.00 2.00 0.00 0.00 34.13 35.18 1zue s GLU 5 CO -0.17 -1.34 0.00 -1.33 -0.56 0.00 0.00 175.26 171.86 1zue n MET 6 N 3.11 -0.09 -3.10 4.30 2.81 -1.26 -4.99 117.12 117.90 1zue n MET 6 Ca 0.23 0.06 -0.09 0.00 -1.81 0.00 0.00 57.70 56.09 1zue n MET 6 Cb 0.50 -0.10 -0.02 0.00 -0.71 0.00 0.00 33.22 32.89 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 -1.41 0.47 -3.90 0.03 6.02 -1.20 -4.88 117.38 112.50 1zue n GLN 7 Ca 0.00 -1.78 -0.37 0.00 -0.01 0.00 0.00 57.00 54.85 1zue n GLN 7 Cb 0.02 1.73 -0.06 0.00 1.02 0.00 0.00 30.24 32.95 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 -2.31 3.82 0.52 -1.58 0.00 -1.26 -0.95 121.76 120.01 1zue s ALA 8 Ca 0.18 -0.66 0.19 0.00 0.00 0.00 0.00 51.96 51.68 1zue s ALA 8 Cb -0.01 -1.95 1.32 0.00 0.00 0.00 0.00 23.12 22.48 1zue s ALA 8 CO 0.13 0.58 2.10 0.00 0.00 0.00 0.00 175.76 178.56 1zue h TRP 10 N 0.00 0.53 -0.16 0.00 5.08 -1.87 -0.20 115.95 119.32 1zue h TRP 10 Ca 0.09 -0.39 0.05 0.00 1.08 0.00 0.00 58.89 59.72 1zue h TRP 10 Cb 0.36 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 26.49 1zue h TRP 10 CO 0.00 1.76 0.13 1.03 -1.28 0.00 0.00 178.44 180.09 1zue h SER 11 N 0.06 0.00 -0.68 0.11 0.87 -1.82 0.11 113.55 112.20 1zue h SER 11 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 1zue h SER 11 Cb 2.04 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 64.00 1zue h SER 11 CO 0.10 0.00 0.00 1.57 -0.53 0.00 0.00 176.83 177.97 1zue n HIS 12 N -4.23 1.46 -3.28 2.24 -0.00 -0.53 -4.96 115.22 105.92 1zue n HIS 12 Ca 0.01 -0.59 -0.10 0.00 0.46 0.00 0.00 57.72 57.49 1zue n HIS 12 Cb 0.26 -0.22 0.00 0.00 -0.12 0.00 0.00 29.99 29.92 1zue n HIS 12 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 1zue n SER 13 N 1.24 -6.82 -0.70 0.26 3.41 0.37 -5.03 113.62 106.36 1zue n SER 13 Ca 0.26 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 1zue n SER 13 Cb 0.87 -4.05 0.00 0.00 -0.26 0.00 0.00 64.21 60.77 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 -1.51 5.39 3.19 5.00 0.00 -0.09 -4.84 105.19 112.34 1zue n GLY 14 Ca -0.09 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.71 0.04 -0.15 1.61 1.01 -0.92 -4.81 120.40 116.46 1zue s VAL 15 Ca 0.00 -1.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.02 1zue s VAL 15 Cb 0.00 -2.32 0.04 0.00 0.00 0.00 0.00 36.38 34.10 1zue s VAL 15 CO 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 175.10 174.90 1zue s ARG 17 N 1.74 2.20 0.70 0.00 0.52 -0.66 -4.87 118.95 118.57 1zue s ARG 17 Ca 0.01 -2.12 -0.16 0.00 -0.52 0.00 0.00 55.73 52.94 1zue s ARG 17 Cb -0.15 -1.82 0.02 0.00 0.52 0.00 0.00 34.95 33.52 1zue s ARG 17 CO -0.07 -0.34 1.25 0.16 0.02 0.00 0.00 175.30 176.31 1zue s ASP 18 N -3.98 4.34 0.00 0.23 -4.77 -1.26 -1.24 116.67 109.98 1zue s ASP 18 Ca 0.26 2.48 0.14 0.00 -3.30 0.00 0.00 52.55 52.13 1zue s ASP 18 Cb 0.02 -2.60 0.62 0.00 -1.09 0.00 0.00 42.92 39.87 1zue s ASP 18 CO 0.15 -2.17 1.43 2.29 0.70 0.00 0.00 175.17 177.56 1zue n LYS 19 N -2.37 1.36 -0.05 2.11 -0.00 -1.26 -3.38 118.16 114.56 1zue n LYS 19 Ca 0.15 -0.55 0.06 0.00 -0.00 0.00 0.00 58.31 57.97 1zue n LYS 19 Cb 0.49 -1.26 0.09 0.00 -0.00 0.00 0.00 35.03 34.36 1zue n LYS 19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1zue n SER 20 N -0.16 2.18 -4.87 -5.58 2.88 -1.26 -5.04 113.62 101.76 1zue n SER 20 Ca 0.11 -2.68 -0.30 0.00 -1.33 0.00 0.00 58.87 54.67 1zue n SER 20 Cb 0.17 -0.27 -0.03 0.00 -0.75 0.00 0.00 64.21 63.32 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 -2.16 3.79 -0.01 -1.46 2.12 -1.22 -4.99 118.70 114.76 1zue s GLU 21 Ca 0.20 0.48 0.15 0.00 0.36 0.00 0.00 54.97 56.16 1zue s GLU 21 Cb 0.18 -2.39 -0.20 0.00 0.26 0.00 0.00 34.13 31.98 1zue s GLU 21 CO 0.02 -0.03 0.52 0.54 -0.54 0.00 0.00 175.26 175.77 1zue n ARG 22 N -1.26 1.38 -3.32 4.30 1.74 -1.26 -4.70 116.66 113.53 1zue n ARG 22 Ca 0.02 -0.06 -0.34 0.00 -0.77 0.00 0.00 57.85 56.71 1zue n ARG 22 Cb 0.54 -1.28 -0.05 0.00 -1.02 0.00 0.00 32.46 30.65 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 -1.64 4.73 -3.75 0.55 5.15 -1.26 -5.01 115.26 114.03 1zue n ASN 23 Ca 0.00 -3.38 -0.13 0.00 -0.60 0.00 0.00 54.58 50.47 1zue n ASN 23 Cb 0.30 -0.93 -0.09 0.00 -0.53 0.00 0.00 39.78 38.53 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 -0.60 2.72 0.08 0.00 3.01 -1.26 -5.07 119.74 118.62 1zue s LYS 25 Ca -0.07 -2.52 -0.37 0.00 -1.01 0.00 0.00 55.97 52.00 1zue s LYS 25 Cb -0.04 -3.83 -0.17 0.00 -1.01 0.00 0.00 37.83 32.78 1zue s LYS 25 CO 0.03 -1.19 1.26 -2.30 0.51 0.00 0.00 175.35 173.66 1zue n PRO 26 N 3.55 0.93 -3.99 -1.68 -0.02 -1.26 -1.97 135.00 130.57 1zue n PRO 26 Ca 0.09 0.34 -0.33 0.00 -2.02 0.00 0.00 63.50 61.58 1zue n PRO 26 Cb 0.39 -1.93 -0.14 0.00 -0.02 0.00 0.00 33.50 31.80 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 0.29 1.89 0.00 -0.52 -1.94 -0.65 -4.79 119.30 113.58 1zue s MET 27 Ca 0.84 -1.64 0.00 0.00 -1.71 0.00 0.00 55.69 53.18 1zue s MET 27 Cb -1.00 -3.17 0.00 0.00 2.01 0.00 0.00 34.83 32.67 1zue s MET 27 CO 0.49 -0.81 0.00 0.00 -0.01 0.00 0.00 175.02 174.69 1zue n ALA 28 N 4.40 0.00 -4.10 3.03 0.00 -1.26 -4.32 120.51 118.26 1zue n ALA 28 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.11 1zue n ALA 28 Cb 0.42 0.00 -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 -2.17 -1.54 -3.64 0.00 7.02 -1.26 -4.92 117.44 110.94 1zue n TRP 29 Ca 0.00 0.71 -0.02 0.00 -1.02 0.00 0.00 57.50 57.17 1zue n TRP 29 Cb 0.00 -3.35 -0.04 0.00 -2.42 0.00 0.00 31.31 25.50 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 -3.99 0.00 0.11 -0.99 -1.32 -1.26 -3.26 115.64 104.93 1zue s THR 30 Ca 0.10 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.65 1zue s THR 30 Cb -0.06 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.90 1zue s THR 30 CO 0.93 0.00 -0.16 -0.72 -2.21 0.00 0.00 174.62 172.45 1zue s TYR 31 N -1.01 1.52 0.03 9.09 -0.85 -0.12 -4.83 117.35 121.17 1zue s TYR 31 Ca 0.09 -0.49 0.00 0.00 -0.52 0.00 0.00 57.07 56.16 1zue s TYR 31 Cb -0.01 -0.81 0.00 0.00 0.38 0.00 0.00 41.96 41.53 1zue s TYR 31 CO -0.08 0.17 0.04 0.00 -1.52 0.00 0.00 175.55 174.16 1zue n GLU 33 N -1.06 0.69 -3.31 0.00 0.28 -1.26 -4.92 120.64 111.06 1zue n GLU 33 Ca 0.01 -0.01 -0.39 0.00 -0.16 0.00 0.00 57.16 56.61 1zue n GLU 33 Cb 0.03 -1.52 -0.06 0.00 1.43 0.00 0.00 31.44 31.32 1zue n GLU 33 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1zue s ASN 34 N -5.49 7.02 -0.08 -1.84 3.84 -1.26 -4.97 114.94 112.16 1zue s ASN 34 Ca -0.10 1.21 0.09 0.00 0.21 0.00 0.00 52.86 54.27 1zue s ASN 34 Cb 0.06 -2.34 0.40 0.00 -0.55 0.00 0.00 41.25 38.81 1zue s ASN 34 CO 0.83 0.28 1.19 0.54 -2.79 0.00 0.00 177.10 177.16 1zue n ARG 35 N 1.73 2.64 -0.32 0.43 1.74 -1.26 -3.70 116.66 117.93 1zue n ARG 35 Ca -0.11 -1.54 0.00 0.00 -0.77 0.00 0.00 57.85 55.43 1zue n ARG 35 Cb 0.51 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1zue n ARG 35 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1zue n ASN 36 N 0.42 0.00 -4.14 0.55 4.05 -1.26 -5.09 115.26 109.80 1zue n ASN 36 Ca 0.14 -1.64 -0.16 0.00 0.45 0.00 0.00 54.58 53.37 1zue n ASN 36 Cb 0.60 -0.13 -0.12 0.00 1.23 0.00 0.00 39.78 41.37 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 0.73 0.06 1.20 0.74 -1.24 -4.13 119.66 117.02 1zue s GLN 37 Ca 0.00 -0.94 0.01 0.00 0.05 0.00 0.00 55.36 54.48 1zue s GLN 37 Cb 0.00 -0.60 -0.04 0.00 1.10 0.00 0.00 33.01 33.47 1zue s GLN 37 CO 0.00 0.12 0.16 0.15 -0.55 0.00 0.00 175.29 175.17 1zue s LYS 38 N -1.90 3.24 -0.47 1.67 1.02 -0.37 -4.85 119.74 118.08 1zue s LYS 38 Ca -0.03 -0.52 -0.17 0.00 0.02 0.00 0.00 55.97 55.27 1zue s LYS 38 Cb -0.09 -2.93 0.05 0.00 -0.52 0.00 0.00 37.83 34.34 1zue s LYS 38 CO 0.01 0.60 0.47 0.00 -0.92 0.00 0.00 175.35 175.51 1zue n GLU 41 N -1.76 0.00 0.00 0.00 2.13 -0.83 -2.16 120.64 118.02 1zue n GLU 41 Ca 0.04 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.40 1zue n GLU 41 Cb 0.59 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.80 1zue n GLU 41 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20