#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1azk s GLN 2 N 0.00 4.32 1.11 -0.78 0.74 0.41 -4.93 119.66 120.53 1azk s GLN 2 Ca 0.00 0.86 -0.18 0.00 0.05 0.00 0.00 55.36 56.09 1azk s GLN 2 Cb 0.00 -3.53 0.26 0.00 1.10 0.00 0.00 33.01 30.84 1azk s GLN 2 CO 0.00 -0.17 1.21 0.45 -0.55 0.00 0.00 175.29 176.22 1azk s SER 3 N 1.05 1.73 0.35 6.67 0.15 -1.26 -1.53 113.70 120.85 1azk s SER 3 Ca 0.35 0.44 -0.28 0.00 0.70 0.00 0.00 55.95 57.16 1azk s SER 3 Cb -0.17 -0.56 -0.12 0.00 -1.71 0.00 0.00 66.02 63.47 1azk s SER 3 CO 0.14 -3.61 1.40 1.57 1.20 0.00 0.00 173.24 173.94 1azk n HIS 4 N -4.38 2.63 -1.81 3.44 -0.00 -1.26 -3.47 115.22 110.36 1azk n HIS 4 Ca 0.15 0.49 -0.07 0.00 0.46 0.00 0.00 57.72 58.74 1azk n HIS 4 Cb 0.59 -2.48 -0.01 0.00 -0.12 0.00 0.00 29.99 27.97 1azk n HIS 4 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1azk n TYR 5 N 0.53 -0.21 -3.63 1.57 4.01 0.71 -5.04 117.16 115.11 1azk n TYR 5 Ca 0.04 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.41 1azk n TYR 5 Cb 0.37 -1.79 -0.06 0.00 -0.31 0.00 0.00 39.34 37.55 1azk n TYR 5 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1azk s GLY 6 N -2.78 2.28 0.13 2.72 0.00 -1.23 -4.83 107.32 103.61 1azk s GLY 6 Ca 0.00 -0.44 -0.32 0.00 0.00 0.00 0.00 44.72 43.96 1azk s GLY 6 CO 0.00 0.11 1.77 -0.18 0.00 0.00 0.00 173.10 174.80 1azk n GLN 7 N 2.57 2.63 -2.22 2.90 7.27 -1.26 -0.16 117.38 129.10 1azk n GLN 7 Ca -0.15 0.95 -0.26 0.00 0.07 0.00 0.00 57.00 57.61 1azk n GLN 7 Cb 0.53 -2.81 0.01 0.00 2.41 0.00 0.00 30.24 30.38 1azk n GLN 7 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1azk s GLY 9 N -3.41 0.57 -0.04 0.00 0.00 -1.23 -4.44 107.32 98.76 1azk s GLY 9 Ca 0.50 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 43.97 1azk s GLY 9 CO -0.09 -1.00 0.95 -1.33 0.00 0.00 0.00 173.10 171.63 1azk h GLY 10 N 2.69 0.32 -6.07 0.20 0.00 -1.78 -3.43 103.07 95.00 1azk h GLY 10 Ca -0.33 -0.70 -0.65 0.00 0.00 0.00 0.00 47.33 45.65 1azk h GLY 10 CO 0.53 0.62 1.12 1.39 0.00 0.00 0.00 176.54 180.19 1azk n ILE 11 N -4.25 0.48 -2.89 2.60 5.41 -1.26 -1.25 119.36 118.20 1azk n ILE 11 Ca -0.12 -0.13 -0.22 0.00 1.00 0.00 0.00 62.75 63.28 1azk n ILE 11 Cb 0.71 -1.75 0.02 0.00 -0.71 0.00 0.00 39.64 37.91 1azk n ILE 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1azk n GLY 12 N 4.67 -0.52 3.25 7.39 0.00 -1.26 -4.97 105.19 113.76 1azk n GLY 12 Ca 0.26 0.10 -0.21 0.00 0.00 0.00 0.00 46.02 46.17 1azk n GLY 12 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1azk n TYR 13 N -4.35 -0.61 0.13 1.61 9.36 -0.38 -5.07 117.16 117.85 1azk n TYR 13 Ca -0.14 -2.78 0.00 0.00 3.32 0.00 0.00 57.90 58.30 1azk n TYR 13 Cb 0.63 0.23 0.00 0.00 -0.63 0.00 0.00 39.34 39.57 1azk n TYR 13 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1azk n SER 14 N -1.65 -2.34 -2.87 2.98 7.64 -1.26 -5.00 113.62 111.12 1azk n SER 14 Ca 0.05 0.60 -0.03 0.00 1.01 0.00 0.00 58.87 60.50 1azk n SER 14 Cb 0.61 2.36 0.00 0.00 -1.01 0.00 0.00 64.21 66.17 1azk n SER 14 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1azk n GLY 15 N -1.36 -2.79 3.27 0.23 0.00 -1.26 -4.83 105.19 98.45 1azk n GLY 15 Ca 0.00 0.55 -0.42 0.00 0.00 0.00 0.00 46.02 46.15 1azk n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1azk n PRO 16 N 0.61 1.01 -2.04 1.61 -0.04 -1.26 -4.83 135.00 130.06 1azk n PRO 16 Ca 0.01 -1.63 -0.40 0.00 -0.04 0.00 0.00 63.50 61.44 1azk n PRO 16 Cb 0.21 -2.89 -0.00 0.00 -0.04 0.00 0.00 33.50 30.77 1azk n PRO 16 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1azk n THR 17 N 6.56 5.11 -1.95 0.52 -2.24 -1.26 -4.88 114.28 116.14 1azk n THR 17 Ca 0.48 -4.33 -0.27 0.00 -2.27 0.00 0.00 64.05 57.67 1azk n THR 17 Cb 0.42 -2.12 -0.07 0.00 -2.10 0.00 0.00 70.33 66.46 1azk n THR 17 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1azk n VAL 18 N 1.96 1.62 -1.26 2.28 0.31 -1.26 -4.82 118.33 117.16 1azk n VAL 18 Ca 0.59 -1.68 -0.36 0.00 -0.01 0.00 0.00 64.34 62.88 1azk n VAL 18 Cb 0.26 -2.15 0.06 0.00 -0.91 0.00 0.00 33.84 31.11 1azk n VAL 18 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1azk n ALA 20 N -2.30 1.41 -1.01 0.00 0.00 -0.58 -4.68 120.51 113.35 1azk n ALA 20 Ca 0.10 -2.78 -0.26 0.00 0.00 0.00 0.00 53.44 50.50 1azk n ALA 20 Cb 0.50 -3.58 -0.11 0.00 0.00 0.00 0.00 19.45 16.26 1azk n ALA 20 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1azk n SER 21 N 12.32 0.05 0.00 0.00 2.88 -1.26 -1.12 113.62 126.49 1azk n SER 21 Ca 0.46 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 1azk n SER 21 Cb 0.44 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1azk n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1azk n GLY 22 N 4.29 2.97 3.91 0.46 0.00 -1.26 -5.06 105.19 110.49 1azk n GLY 22 Ca 0.45 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1azk n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1azk s THR 23 N 0.00 2.96 0.00 2.61 -4.23 -0.28 -5.09 115.64 111.61 1azk s THR 23 Ca 0.00 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.59 1azk s THR 23 Cb 0.00 -3.27 0.00 0.00 1.34 0.00 0.00 72.50 70.57 1azk s THR 23 CO 0.00 -0.32 0.00 0.35 -0.54 0.00 0.00 174.62 174.11 1azk n THR 24 N -2.94 0.00 0.00 3.99 -2.24 -1.26 -4.55 114.28 107.28 1azk n THR 24 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1azk n THR 24 Cb 0.59 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1azk n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1azk s GLN 26 N 0.00 0.85 -0.25 0.00 -2.07 0.42 -4.49 119.66 114.12 1azk s GLN 26 Ca 0.00 -1.25 -0.33 0.00 -1.82 0.00 0.00 55.36 51.96 1azk s GLN 26 Cb 0.00 -0.39 -0.10 0.00 -1.09 0.00 0.00 33.01 31.44 1azk s GLN 26 CO 0.00 0.03 2.12 0.28 -1.32 0.00 0.00 175.29 176.41 1azk n VAL 27 N 0.24 0.33 -0.07 3.63 0.31 -1.26 -0.03 118.33 121.48 1azk n VAL 27 Ca -0.14 -0.28 -0.10 0.00 -0.01 0.00 0.00 64.34 63.82 1azk n VAL 27 Cb 0.59 -1.96 -0.06 0.00 -0.91 0.00 0.00 33.84 31.51 1azk n VAL 27 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1azk h LEU 28 N 12.36 0.00 -7.87 7.52 3.38 -1.17 -3.47 115.31 126.05 1azk h LEU 28 Ca -0.36 -0.31 0.16 0.00 0.09 0.00 0.00 57.88 57.46 1azk h LEU 28 Cb 1.29 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.99 1azk h LEU 28 CO 0.98 0.93 0.55 0.54 0.09 0.00 0.00 178.44 181.53 1azk s ASN 29 N -6.06 -0.04 0.29 -0.43 2.20 -1.16 -5.02 114.94 104.72 1azk s ASN 29 Ca -0.16 -0.63 0.05 0.00 -0.94 0.00 0.00 52.86 51.19 1azk s ASN 29 Cb 0.02 0.51 0.74 0.00 -2.00 0.00 0.00 41.25 40.52 1azk s ASN 29 CO 0.34 -1.00 1.72 -0.65 -2.94 0.00 0.00 177.10 174.57 1azk h PRO 30 N 2.00 0.48 -0.27 3.55 0.11 -2.04 -1.54 132.00 134.29 1azk h PRO 30 Ca -0.27 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.75 1azk h PRO 30 Cb 1.22 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1azk h PRO 30 CO 0.33 0.32 -0.05 1.88 -0.21 0.00 0.00 178.00 180.27 1azk h TYR 31 N 0.50 0.58 -3.19 0.65 -1.99 -1.95 -3.41 116.97 108.16 1azk h TYR 31 Ca 0.57 -0.12 -0.61 0.00 2.00 0.00 0.00 58.73 60.57 1azk h TYR 31 Cb 1.04 -0.14 -0.40 0.00 2.00 0.00 0.00 36.73 39.22 1azk h TYR 31 CO -0.09 0.72 -0.74 0.00 -0.00 0.00 0.00 178.16 178.05 1azk s ALA 32 N -4.80 2.07 -0.65 3.88 0.00 -0.58 -2.91 121.76 118.77 1azk s ALA 32 Ca -0.13 -2.24 -0.27 0.00 0.00 0.00 0.00 51.96 49.32 1azk s ALA 32 Cb 0.08 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.41 1azk s ALA 32 CO 0.77 -1.84 1.40 0.45 0.00 0.00 0.00 175.76 176.54 1azk s SER 33 N 0.93 6.03 -0.06 0.00 0.15 -1.26 -0.52 113.70 118.98 1azk s SER 33 Ca 0.13 -0.06 -0.02 0.00 0.70 0.00 0.00 55.95 56.71 1azk s SER 33 Cb -0.21 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.52 1azk s SER 33 CO -0.12 -1.86 0.05 -1.58 1.20 0.00 0.00 173.24 170.94 1azk s GLN 34 N 5.81 3.06 -0.18 5.44 0.74 0.96 0.01 119.66 135.50 1azk s GLN 34 Ca 0.46 -0.41 -0.25 0.00 0.05 0.00 0.00 55.36 55.22 1azk s GLN 34 Cb -0.09 -2.86 -0.29 0.00 1.10 0.00 0.00 33.01 30.87 1azk s GLN 34 CO 0.20 0.69 1.49 0.00 -0.55 0.00 0.00 175.29 177.12