#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1azj s GLN 2 N 0.00 -0.50 0.21 -0.78 1.11 0.26 -4.94 119.66 115.02 1azj s GLN 2 Ca 0.00 0.82 0.00 0.00 0.01 0.00 0.00 55.36 56.20 1azj s GLN 2 Cb 0.00 -1.60 0.00 0.00 -1.01 0.00 0.00 33.01 30.40 1azj s GLN 2 CO 0.00 -3.44 0.03 0.43 0.01 0.00 0.00 175.29 172.33 1azj n SER 3 N -4.71 2.41 -4.57 5.90 7.64 -1.26 -2.47 113.62 116.56 1azj n SER 3 Ca 0.04 -1.89 -0.49 0.00 1.01 0.00 0.00 58.87 57.54 1azj n SER 3 Cb 0.55 0.11 -0.04 0.00 -1.01 0.00 0.00 64.21 63.82 1azj n SER 3 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1azj n HIS 4 N -0.63 1.18 -0.90 1.43 -0.00 -1.26 -1.38 115.22 113.66 1azj n HIS 4 Ca -0.07 0.71 0.00 0.00 0.46 0.00 0.00 57.72 58.82 1azj n HIS 4 Cb 0.26 -2.25 0.00 0.00 -0.12 0.00 0.00 29.99 27.88 1azj n HIS 4 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1azj n TYR 5 N 1.27 0.00 -2.28 1.57 4.01 0.61 -5.03 117.16 117.31 1azj n TYR 5 Ca 0.15 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.46 1azj n TYR 5 Cb 0.25 -0.36 -0.02 0.00 -0.31 0.00 0.00 39.34 38.90 1azj n TYR 5 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1azj s GLY 6 N -2.00 1.28 0.32 2.72 0.00 -0.48 -4.79 107.32 104.38 1azj s GLY 6 Ca 0.00 0.24 -0.28 0.00 0.00 0.00 0.00 44.72 44.68 1azj s GLY 6 CO 0.00 2.79 1.21 -0.18 0.00 0.00 0.00 173.10 176.92 1azj n GLN 7 N 7.53 1.89 0.00 2.90 7.27 -1.26 -0.83 117.38 134.88 1azj n GLN 7 Ca 0.17 0.66 0.00 0.00 0.07 0.00 0.00 57.00 57.90 1azj n GLN 7 Cb 0.46 -2.18 0.00 0.00 2.41 0.00 0.00 30.24 30.93 1azj n GLN 7 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1azj n GLY 9 N 0.00 -1.23 3.32 0.00 0.00 -1.19 -4.49 105.19 101.60 1azj n GLY 9 Ca 0.00 0.81 -0.00 0.00 0.00 0.00 0.00 46.02 46.83 1azj n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1azj s GLY 10 N -0.28 -0.77 -0.19 -0.02 0.00 -1.26 -4.60 107.32 100.20 1azj s GLY 10 Ca 0.27 1.90 -0.34 0.00 0.00 0.00 0.00 44.72 46.55 1azj s GLY 10 CO -0.12 3.09 2.01 1.39 0.00 0.00 0.00 173.10 179.47 1azj n ILE 11 N 5.43 0.43 0.00 0.90 2.08 -1.20 -1.09 119.36 125.91 1azj n ILE 11 Ca -0.06 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 63.05 1azj n ILE 11 Cb 0.50 -1.89 0.00 0.00 -0.75 0.00 0.00 39.64 37.50 1azj n ILE 11 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1azj n GLY 12 N 5.15 3.88 3.59 7.39 0.00 -1.26 -4.68 105.19 119.27 1azj n GLY 12 Ca 0.29 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 1azj n GLY 12 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1azj s TYR 13 N 0.00 1.73 -0.05 1.61 1.13 -0.25 -5.12 117.35 116.41 1azj s TYR 13 Ca 0.00 1.15 -0.20 0.00 -1.41 0.00 0.00 57.07 56.61 1azj s TYR 13 Cb 0.00 -3.18 0.04 0.00 -1.10 0.00 0.00 41.96 37.72 1azj s TYR 13 CO 0.00 -3.32 0.45 -1.54 -2.51 0.00 0.00 175.55 168.62 1azj s SER 14 N -2.96 -0.38 0.00 -0.18 1.04 -1.26 -4.93 113.70 105.03 1azj s SER 14 Ca 0.67 0.40 0.00 0.00 0.48 0.00 0.00 55.95 57.49 1azj s SER 14 Cb -0.22 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.37 1azj s SER 14 CO 0.61 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.97 1azj n GLY 15 N 1.35 0.79 3.58 7.32 0.00 -1.26 -5.09 105.19 111.89 1azj n GLY 15 Ca -0.20 -2.02 -0.34 0.00 0.00 0.00 0.00 46.02 43.46 1azj n GLY 15 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1azj n PRO 16 N 0.00 0.09 -2.80 1.61 -0.02 -1.26 -5.01 135.00 127.61 1azj n PRO 16 Ca 0.00 0.09 -0.21 0.00 -2.02 0.00 0.00 63.50 61.37 1azj n PRO 16 Cb 0.00 -2.18 -0.01 0.00 -0.02 0.00 0.00 33.50 31.29 1azj n PRO 16 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1azj n THR 17 N -3.19 1.66 -3.67 3.45 -2.24 -1.26 -4.82 114.28 104.21 1azj n THR 17 Ca 0.11 -4.57 -0.09 0.00 -2.27 0.00 0.00 64.05 57.24 1azj n THR 17 Cb 0.51 -0.61 -0.10 0.00 -2.10 0.00 0.00 70.33 68.03 1azj n THR 17 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1azj s VAL 18 N -4.00 -0.50 0.81 2.28 1.01 -1.26 -5.04 120.40 113.70 1azj s VAL 18 Ca 0.41 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.44 1azj s VAL 18 Cb 0.37 -0.66 0.10 0.00 0.00 0.00 0.00 36.38 36.20 1azj s VAL 18 CO -0.10 0.06 1.15 0.00 0.00 0.00 0.00 175.10 176.22 1azj s ALA 20 N -3.53 3.53 0.20 0.00 0.00 -1.03 -4.71 121.76 116.22 1azj s ALA 20 Ca 0.64 -0.25 -0.31 0.00 0.00 0.00 0.00 51.96 52.03 1azj s ALA 20 Cb -0.09 -3.45 -0.16 0.00 0.00 0.00 0.00 23.12 19.42 1azj s ALA 20 CO 0.48 -1.30 1.04 0.45 0.00 0.00 0.00 175.76 176.44 1azj n SER 21 N 6.45 0.95 0.00 0.00 2.88 -1.26 -1.35 113.62 121.29 1azj n SER 21 Ca 0.07 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 1azj n SER 21 Cb 0.48 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 1azj n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1azj n GLY 22 N 1.79 2.37 3.92 0.46 0.00 -1.26 -5.06 105.19 107.41 1azj n GLY 22 Ca 0.14 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 45.20 1azj n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1azj s THR 23 N 0.00 4.70 0.19 2.61 -4.23 -0.46 -5.06 115.64 113.39 1azj s THR 23 Ca 0.00 0.02 -0.11 0.00 -1.18 0.00 0.00 61.69 60.42 1azj s THR 23 Cb 0.00 -3.78 -0.00 0.00 1.34 0.00 0.00 72.50 70.06 1azj s THR 23 CO 0.00 -0.72 0.36 0.28 -0.54 0.00 0.00 174.62 174.00 1azj s THR 24 N -2.70 0.04 -1.12 3.99 -1.32 -1.26 -4.48 115.64 108.79 1azj s THR 24 Ca 0.47 -1.33 -0.20 0.00 -1.21 0.00 0.00 61.69 59.43 1azj s THR 24 Cb -0.10 -1.92 0.08 0.00 -1.51 0.00 0.00 72.50 69.05 1azj s THR 24 CO 0.43 -0.18 1.50 0.00 -2.21 0.00 0.00 174.62 174.16 1azj s GLN 26 N 4.13 3.56 -1.16 0.00 -0.21 -0.58 -4.61 119.66 120.78 1azj s GLN 26 Ca 0.47 -1.62 -0.22 0.00 0.02 0.00 0.00 55.36 54.00 1azj s GLN 26 Cb 0.00 -4.92 -0.07 0.00 1.00 0.00 0.00 33.01 29.03 1azj s GLN 26 CO -0.03 -1.82 1.91 0.54 -2.12 0.00 0.00 175.29 173.77 1azj s VAL 27 N 3.03 3.59 0.15 1.09 0.11 -1.26 -4.06 120.40 123.06 1azj s VAL 27 Ca 0.33 -0.95 -0.16 0.00 -2.93 0.00 0.00 61.98 58.27 1azj s VAL 27 Cb -0.05 -4.58 0.02 0.00 -1.53 0.00 0.00 36.38 30.24 1azj s VAL 27 CO -0.08 -1.10 1.76 -0.07 -3.33 0.00 0.00 175.10 172.28 1azj h LEU 28 N 17.20 0.20 -7.00 2.54 3.38 -1.94 -3.48 115.31 126.21 1azj h LEU 28 Ca 0.23 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.34 1azj h LEU 28 Cb 0.94 -0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.42 1azj h LEU 28 CO 1.25 0.15 0.64 0.54 0.09 0.00 0.00 178.44 181.11 1azj s ASN 29 N -5.39 -0.29 0.36 -0.43 6.03 -1.26 -5.08 114.94 108.88 1azj s ASN 29 Ca -0.13 0.45 0.14 0.00 -1.03 0.00 0.00 52.86 52.29 1azj s ASN 29 Cb 0.12 0.42 1.00 0.00 -3.03 0.00 0.00 41.25 39.76 1azj s ASN 29 CO 0.71 -0.17 1.76 1.55 -2.03 0.00 0.00 177.10 178.92 1azj h PRO 30 N 3.14 0.47 -0.75 3.55 0.13 -1.96 0.12 132.00 136.70 1azj h PRO 30 Ca -0.22 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.83 1azj h PRO 30 Cb 1.18 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 1azj h PRO 30 CO 0.21 0.31 0.25 0.00 -0.23 0.00 0.00 178.00 178.53 1azj h ALA 31 N 1.66 0.99 -2.40 -0.56 0.00 -1.89 -3.19 119.26 113.87 1azj h ALA 31 Ca 0.61 -0.22 -0.51 0.00 0.00 0.00 0.00 54.91 54.79 1azj h ALA 31 Cb 1.37 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1azj h ALA 31 CO -0.37 0.66 -0.09 -0.47 0.00 0.00 0.00 179.25 178.98 1azj s TYR 32 N -5.44 3.48 0.00 0.00 5.04 0.42 -4.60 117.35 116.24 1azj s TYR 32 Ca -0.12 0.72 0.00 0.00 -2.44 0.00 0.00 57.07 55.23 1azj s TYR 32 Cb 0.15 -2.17 0.00 0.00 0.35 0.00 0.00 41.96 40.29 1azj s TYR 32 CO 0.84 0.11 0.00 0.45 -1.34 0.00 0.00 175.55 175.62 1azj n SER 33 N -1.02 0.00 -3.71 4.32 2.88 -1.26 -4.15 113.62 110.68 1azj n SER 33 Ca -0.01 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.39 1azj n SER 33 Cb 0.54 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.92 1azj n SER 33 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1azj s GLN 34 N -0.10 0.71 -0.94 -1.46 0.74 -1.26 -1.67 119.66 115.68 1azj s GLN 34 Ca 0.00 0.03 -0.24 0.00 0.05 0.00 0.00 55.36 55.20 1azj s GLN 34 Cb 0.00 0.33 0.04 0.00 1.10 0.00 0.00 33.01 34.47 1azj s GLN 34 CO 0.00 -0.19 1.46 0.00 -0.55 0.00 0.00 175.29 176.01