#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zei n VAL 2 N 0.00 0.00 -0.32 -4.37 0.24 -1.26 -4.78 118.33 107.84 1zei n VAL 2 Ca 0.00 -0.45 0.17 0.00 -2.04 0.00 0.00 64.34 62.01 1zei n VAL 2 Cb 0.00 1.17 0.41 0.00 -1.47 0.00 0.00 33.84 33.95 1zei n VAL 2 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1zei h ASN 3 N 1.61 0.62 0.97 -1.34 -0.00 -2.05 -1.68 115.58 113.71 1zei h ASN 3 Ca 0.00 0.09 -0.20 0.00 -0.00 0.00 0.00 56.30 56.18 1zei h ASN 3 Cb 0.39 -0.02 -0.03 0.00 -0.00 0.00 0.00 38.32 38.66 1zei h ASN 3 CO 0.00 0.20 -0.97 1.56 -0.00 0.00 0.00 177.43 178.21 1zei h GLN 4 N 0.59 0.00 -0.32 4.14 1.08 -1.99 0.12 115.11 118.74 1zei h GLN 4 Ca 0.57 -0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 57.65 1zei h GLN 4 Cb 1.12 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.54 1zei h GLN 4 CO -0.33 0.97 -0.27 1.25 -0.95 0.00 0.00 178.83 179.51 1zei h HIS 5 N 0.00 0.73 0.01 2.96 2.76 -1.73 -1.19 115.15 118.69 1zei h HIS 5 Ca -0.01 -0.17 -0.00 0.00 -2.20 0.00 0.00 60.37 57.99 1zei h HIS 5 Cb 1.72 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 30.51 1zei h HIS 5 CO 0.00 0.84 -0.01 -0.07 -1.30 0.00 0.00 177.93 177.40 1zei h LEU 6 N 0.56 -0.01 -0.63 0.26 -0.00 -1.06 -2.20 115.31 112.22 1zei h LEU 6 Ca 0.07 -0.69 0.13 0.00 -0.00 0.00 0.00 57.88 57.39 1zei h LEU 6 Cb 0.74 0.00 -0.10 0.00 -0.00 0.00 0.00 40.66 41.30 1zei h LEU 6 CO 0.06 0.70 0.03 0.00 -0.00 0.00 0.00 178.44 179.23 1zei h GLY 8 N 0.15 0.59 2.00 0.00 0.00 -1.07 -0.48 103.07 104.26 1zei h GLY 8 Ca 0.34 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 47.25 1zei h GLY 8 CO -0.52 0.27 -0.61 1.48 0.00 0.00 0.00 176.54 177.16 1zei h SER 9 N 0.55 0.00 0.97 0.19 4.64 -0.82 -1.37 113.55 117.72 1zei h SER 9 Ca 0.13 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.31 1zei h SER 9 Cb 0.14 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 1zei h SER 9 CO -0.01 0.61 -0.71 0.45 -0.87 0.00 0.00 176.83 176.30 1zei h HIS 10 N 0.00 0.00 -0.38 4.77 3.86 -1.15 -2.76 115.15 119.50 1zei h HIS 10 Ca -0.01 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.06 1zei h HIS 10 Cb 1.12 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.58 1zei h HIS 10 CO 0.00 0.71 -0.34 -0.07 0.86 0.00 0.00 177.93 179.09 1zei h LEU 11 N 0.00 0.90 -0.86 2.43 3.38 -0.69 -1.09 115.31 119.37 1zei h LEU 11 Ca -0.01 -0.39 0.04 0.00 0.09 0.00 0.00 57.88 57.61 1zei h LEU 11 Cb 1.39 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 1zei h LEU 11 CO 0.09 1.15 0.55 0.58 0.09 0.00 0.00 178.44 180.91 1zei h VAL 12 N 0.71 1.12 0.04 1.22 2.07 -1.11 0.11 116.25 120.43 1zei h VAL 12 Ca 0.07 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1zei h VAL 12 Cb 0.90 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1zei h VAL 12 CO 0.08 0.19 -0.02 -0.08 0.02 0.00 0.00 177.57 177.77 1zei h GLU 13 N 1.06 -0.05 0.00 1.57 4.81 -1.33 -0.10 114.58 120.54 1zei h GLU 13 Ca 0.35 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 1zei h GLU 13 Cb 0.03 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1zei h GLU 13 CO -0.12 0.11 -0.07 0.00 -0.73 0.00 0.00 179.01 178.20 1zei h ALA 14 N 0.74 1.30 -0.00 2.92 0.00 -0.86 -2.25 119.26 121.10 1zei h ALA 14 Ca -0.01 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1zei h ALA 14 Cb 0.19 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1zei h ALA 14 CO 0.01 0.08 -0.57 -0.07 0.00 0.00 0.00 179.25 178.70 1zei h LEU 15 N 0.00 0.50 -0.69 0.00 3.38 -0.62 -1.02 115.31 116.87 1zei h LEU 15 Ca -0.00 -0.76 0.15 0.00 0.09 0.00 0.00 57.88 57.36 1zei h LEU 15 Cb 0.21 -0.15 -0.11 0.00 0.09 0.00 0.00 40.66 40.70 1zei h LEU 15 CO 0.01 1.20 0.13 0.22 0.09 0.00 0.00 178.44 180.08 1zei h TYR 16 N -0.14 0.19 -0.21 1.13 3.20 -0.92 -0.01 116.97 120.21 1zei h TYR 16 Ca -0.07 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 1zei h TYR 16 Cb 1.28 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.57 1zei h TYR 16 CO 0.15 -0.10 0.04 1.25 -1.64 0.00 0.00 178.16 177.86 1zei h LEU 17 N 0.23 0.32 -0.22 2.82 5.85 -1.14 -1.82 115.31 121.35 1zei h LEU 17 Ca 0.38 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1zei h LEU 17 Cb 0.63 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1zei h LEU 17 CO -0.50 0.49 0.01 0.58 -0.34 0.00 0.00 178.44 178.68 1zei h VAL 18 N 0.14 1.24 0.01 1.05 2.07 -0.98 -3.31 116.25 116.48 1zei h VAL 18 Ca 0.06 -0.83 -0.25 0.00 0.82 0.00 0.00 66.70 66.50 1zei h VAL 18 Cb 0.30 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1zei h VAL 18 CO 0.00 0.26 -1.30 0.00 0.02 0.00 0.00 177.57 176.56 1zei n GLY 20 N 1.45 3.12 0.02 0.00 0.00 -0.68 -2.07 105.19 107.02 1zei n GLY 20 Ca -0.07 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.81 1zei n GLY 20 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1zei n GLU 21 N 13.84 1.03 0.07 1.61 1.02 -1.26 -2.44 120.64 134.51 1zei n GLU 21 Ca 0.00 -0.04 -0.06 0.00 -0.02 0.00 0.00 57.16 57.04 1zei n GLU 21 Cb 0.00 -1.38 -0.08 0.00 -0.02 0.00 0.00 31.44 29.97 1zei n GLU 21 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1zei h ARG 22 N 0.10 0.00 -1.86 3.49 3.08 -1.79 -3.49 114.38 113.91 1zei h ARG 22 Ca 0.00 0.00 0.22 0.00 0.07 0.00 0.00 59.98 60.27 1zei h ARG 22 Cb 0.02 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.01 1zei h ARG 22 CO 0.00 0.94 -0.32 0.41 -1.07 0.00 0.00 179.97 179.93 1zei n GLY 23 N 1.18 -1.70 3.30 0.04 0.00 -1.02 -4.27 105.19 102.72 1zei n GLY 23 Ca -0.00 -1.31 -0.16 0.00 0.00 0.00 0.00 46.02 44.54 1zei n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1zei s PHE 24 N -1.80 1.45 0.16 1.61 -0.12 -1.26 -1.05 117.98 116.96 1zei s PHE 24 Ca 0.00 -0.87 0.08 0.00 -0.05 0.00 0.00 56.93 56.08 1zei s PHE 24 Cb 0.00 -0.80 -0.04 0.00 -0.63 0.00 0.00 43.02 41.54 1zei s PHE 24 CO 0.00 -0.00 -0.03 0.12 -0.05 0.00 0.00 175.22 175.25 1zei s PHE 25 N -3.40 2.79 -0.09 3.49 5.36 -1.16 -4.83 117.98 120.13 1zei s PHE 25 Ca 0.24 -0.15 0.03 0.00 -0.96 0.00 0.00 56.93 56.09 1zei s PHE 25 Cb 0.05 -1.37 -0.01 0.00 -0.34 0.00 0.00 43.02 41.34 1zei s PHE 25 CO 0.06 0.51 -0.18 -0.47 -1.46 0.00 0.00 175.22 173.68 1zei s TYR 26 N -1.66 2.67 0.13 10.12 5.04 -1.26 -4.99 117.35 127.40 1zei s TYR 26 Ca 0.26 -0.63 0.01 0.00 -2.44 0.00 0.00 57.07 54.27 1zei s TYR 26 Cb -0.09 -1.73 -0.04 0.00 0.35 0.00 0.00 41.96 40.44 1zei s TYR 26 CO 0.17 -0.17 -0.02 0.95 -1.34 0.00 0.00 175.55 175.15 1zei s THR 27 N 0.02 0.54 0.23 4.34 -4.23 -1.26 -5.05 115.64 110.23 1zei s THR 27 Ca -0.06 -1.93 -0.08 0.00 -1.18 0.00 0.00 61.69 58.43 1zei s THR 27 Cb -0.15 -1.88 0.21 0.00 1.34 0.00 0.00 72.50 72.02 1zei s THR 27 CO 0.05 -0.67 1.90 0.44 -0.54 0.00 0.00 174.62 175.80 1zei h ASP 28 N 2.87 1.01 -0.06 3.99 3.32 -1.99 0.16 116.42 125.72 1zei h ASP 28 Ca -0.36 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 56.65 1zei h ASP 28 Cb 1.18 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.48 1zei h ASP 28 CO 0.63 0.74 -0.03 0.50 -1.72 0.00 0.00 179.24 179.36 1zei h LYS 29 N 1.20 0.13 0.00 3.56 1.63 -1.99 -2.07 116.57 119.02 1zei h LYS 29 Ca 0.32 -0.05 -0.10 0.00 -0.85 0.00 0.00 60.65 59.96 1zei h LYS 29 Cb -0.13 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.48 1zei h LYS 29 CO -0.07 0.50 -0.49 0.00 -3.45 0.00 0.00 179.45 175.94 1zei h ALA 30 N 0.62 0.97 -0.42 5.00 0.00 -1.74 -1.15 119.26 122.54 1zei h ALA 30 Ca 0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1zei h ALA 30 Cb 0.46 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1zei h ALA 30 CO 0.01 0.62 -0.13 0.00 0.00 0.00 0.00 179.25 179.74 1zei h ALA 31 N 1.51 0.99 0.03 0.00 0.00 -0.53 0.18 119.26 121.43 1zei h ALA 31 Ca -0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 1zei h ALA 31 Cb 1.01 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1zei h ALA 31 CO 0.06 0.60 -0.01 0.87 0.00 0.00 0.00 179.25 180.77 1zei h LYS 32 N 0.68 -0.04 -0.70 0.00 1.57 -1.38 -2.86 116.57 113.85 1zei h LYS 32 Ca 0.11 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.94 1zei h LYS 32 Cb 0.61 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.88 1zei h LYS 32 CO 0.04 0.20 0.42 0.78 -0.57 0.00 0.00 179.45 180.31 1zei h GLY 33 N -0.27 1.02 2.00 3.86 0.00 -1.01 -1.87 103.07 106.80 1zei h GLY 33 Ca -0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 1zei h GLY 33 CO 0.01 0.22 -0.38 1.19 0.00 0.00 0.00 176.54 177.57 1zei h ILE 34 N 0.79 0.86 0.00 2.60 2.10 -0.87 -1.10 117.51 121.89 1zei h ILE 34 Ca 0.30 -1.60 -0.21 0.00 1.08 0.00 0.00 64.86 64.43 1zei h ILE 34 Cb 0.11 1.99 -0.01 0.00 -1.09 0.00 0.00 36.82 37.82 1zei h ILE 34 CO -0.15 0.38 -0.91 0.58 -1.08 0.00 0.00 178.15 176.97 1zei h VAL 35 N 0.00 1.46 -0.13 2.19 2.07 -1.35 1.10 116.25 121.60 1zei h VAL 35 Ca -0.00 -2.56 -0.18 0.00 0.82 0.00 0.00 66.70 64.77 1zei h VAL 35 Cb 0.96 2.46 -0.00 0.00 -1.52 0.00 0.00 31.29 33.18 1zei h VAL 35 CO 0.05 0.75 -0.68 -0.33 0.02 0.00 0.00 177.57 177.38 1zei h GLU 36 N 0.16 0.53 0.01 1.57 5.08 -1.19 0.24 114.58 120.98 1zei h GLU 36 Ca -0.06 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 57.88 1zei h GLU 36 Cb 1.55 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.87 1zei h GLU 36 CO 0.15 1.02 -0.09 0.37 -1.00 0.00 0.00 179.01 179.46 1zei h GLN 37 N 0.38 0.02 -0.01 2.33 4.15 -1.15 -3.34 115.11 117.50 1zei h GLN 37 Ca -0.02 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1zei h GLN 37 Cb 1.26 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.96 1zei h GLN 37 CO 0.13 1.02 -0.23 0.00 -1.93 0.00 0.00 178.83 177.81 1zei n THR 40 N 1.35 0.99 -3.87 0.00 -1.04 -1.12 -5.02 114.28 105.58 1zei n THR 40 Ca 0.20 -0.42 -0.10 0.00 -2.04 0.00 0.00 64.05 61.70 1zei n THR 40 Cb 0.56 -1.04 -0.08 0.00 -1.82 0.00 0.00 70.33 67.95 1zei n THR 40 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1zei s SER 41 N -5.52 0.09 -0.06 8.00 1.04 -1.08 -5.11 113.70 111.06 1zei s SER 41 Ca -0.21 -0.48 -0.30 0.00 0.48 0.00 0.00 55.95 55.45 1zei s SER 41 Cb 0.06 0.29 -0.06 0.00 0.10 0.00 0.00 66.02 66.40 1zei s SER 41 CO 0.43 -0.59 1.82 -0.63 0.98 0.00 0.00 173.24 175.25 1zei s ILE 42 N -2.92 3.33 0.08 -1.02 -1.09 -1.26 -4.33 121.20 113.99 1zei s ILE 42 Ca -0.02 0.40 -0.20 0.00 -2.23 0.00 0.00 60.65 58.59 1zei s ILE 42 Cb 0.01 -3.28 -0.07 0.00 -1.58 0.00 0.00 42.46 37.54 1zei s ILE 42 CO -0.06 -0.06 0.60 0.00 -1.23 0.00 0.00 174.94 174.19 1zei s SER 44 N -1.05 3.45 0.32 0.00 1.04 -1.26 -4.94 113.70 111.27 1zei s SER 44 Ca 0.30 0.99 0.10 0.00 0.48 0.00 0.00 55.95 57.81 1zei s SER 44 Cb -0.20 -1.57 0.53 0.00 0.10 0.00 0.00 66.02 64.88 1zei s SER 44 CO 0.20 -2.59 1.72 -0.07 0.98 0.00 0.00 173.24 173.48 1zei h LEU 45 N -1.52 0.10 -0.72 2.42 3.38 -1.99 -1.07 115.31 115.90 1zei h LEU 45 Ca -0.51 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1zei h LEU 45 Cb 1.33 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1zei h LEU 45 CO 0.62 0.54 0.00 1.88 0.09 0.00 0.00 178.44 181.56 1zei h TYR 46 N 0.08 0.00 0.10 1.13 0.05 -2.01 -1.85 116.97 114.46 1zei h TYR 46 Ca 0.00 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.50 1zei h TYR 46 Cb 0.83 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.56 1zei h TYR 46 CO 0.01 0.00 -1.42 1.96 -1.05 0.00 0.00 178.16 177.65 1zei h GLN 47 N 0.00 0.20 -0.09 4.88 4.20 -1.58 -3.22 115.11 119.51 1zei h GLN 47 Ca 0.00 -0.35 -0.09 0.00 0.06 0.00 0.00 58.65 58.27 1zei h GLN 47 Cb 0.47 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1zei h GLN 47 CO 0.00 1.07 -0.36 -0.07 -0.67 0.00 0.00 178.83 178.80 1zei h LEU 48 N 0.06 0.18 -1.96 1.46 4.07 -0.93 -3.17 115.31 115.02 1zei h LEU 48 Ca -0.20 -0.07 0.13 0.00 0.08 0.00 0.00 57.88 57.83 1zei h LEU 48 Cb 1.98 -0.05 -0.02 0.00 1.08 0.00 0.00 40.66 43.65 1zei h LEU 48 CO 0.16 0.54 0.47 -0.08 -1.08 0.00 0.00 178.44 178.44 1zei h GLU 49 N 0.15 0.00 0.00 1.13 4.81 -1.36 -1.26 114.58 118.05 1zei h GLU 49 Ca 0.02 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1zei h GLU 49 Cb 0.72 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 1zei h GLU 49 CO 0.05 0.00 -0.12 -0.91 -0.73 0.00 0.00 179.01 177.31 1zei h ASN 50 N 0.00 0.00 0.19 1.04 2.35 -1.70 -1.78 115.58 115.68 1zei h ASN 50 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1zei h ASN 50 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1zei h ASN 50 CO -0.00 0.12 -0.08 -1.22 -1.65 0.00 0.00 177.43 174.60 1zei n TYR 51 N -3.87 0.00 -2.10 1.19 4.02 -0.48 -4.91 117.16 111.00 1zei n TYR 51 Ca -0.02 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.53 1zei n TYR 51 Cb 0.21 -0.10 0.01 0.00 -0.02 0.00 0.00 39.34 39.45 1zei n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85