#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 4.84 -0.03 -2.13 0.24 -1.26 -4.62 118.33 115.37 1zei n VAL 2 Ca 0.00 -5.22 -0.13 0.00 -2.04 0.00 0.00 64.34 56.95 1zei n VAL 2 Cb 0.00 -2.24 -0.09 0.00 -1.47 0.00 0.00 33.84 30.04 1zei n VAL 2 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 1zei h ASN 3 N 5.71 0.15 -0.28 -1.34 2.35 -2.05 -1.50 115.58 118.63 1zei h ASN 3 Ca 0.28 -0.48 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 1zei h ASN 3 Cb 0.65 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 1zei h ASN 3 CO 1.43 0.60 0.15 -0.61 -1.65 0.00 0.00 177.43 177.35 1zei h GLN 4 N -0.29 0.30 -0.54 0.81 -0.00 -2.00 -1.18 115.11 112.20 1zei h GLN 4 Ca 0.01 -0.02 -0.09 0.00 -0.00 0.00 0.00 58.65 58.55 1zei h GLN 4 Cb 0.55 -0.07 -0.02 0.00 0.00 0.00 0.00 27.48 27.95 1zei h GLN 4 CO 0.01 0.20 -0.03 1.25 0.00 0.00 0.00 178.83 180.26 1zei h HIS 5 N 0.31 1.04 -0.10 3.99 2.76 -1.81 0.48 115.15 121.81 1zei h HIS 5 Ca 0.11 -0.18 -0.15 0.00 -2.20 0.00 0.00 60.37 57.96 1zei h HIS 5 Cb 0.02 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.70 1zei h HIS 5 CO -0.09 0.94 -0.58 -0.07 -1.30 0.00 0.00 177.93 176.84 1zei h LEU 6 N 0.87 0.36 -0.56 0.26 4.07 -1.21 -1.29 115.31 117.81 1zei h LEU 6 Ca 0.15 -0.20 -0.15 0.00 0.08 0.00 0.00 57.88 57.76 1zei h LEU 6 Cb 0.55 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.17 1zei h LEU 6 CO 0.03 0.86 -0.71 0.00 -1.08 0.00 0.00 178.44 177.54 1zei h GLY 8 N 2.02 0.00 1.04 0.00 0.00 -0.57 -1.82 103.07 103.74 1zei h GLY 8 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.19 1zei h GLY 8 CO 0.10 0.00 -0.30 1.48 0.00 0.00 0.00 176.54 177.82 1zei h SER 9 N 0.00 0.87 -0.40 0.19 4.64 -0.74 -2.18 113.55 115.92 1zei h SER 9 Ca -0.00 -0.45 -0.12 0.00 -0.47 0.00 0.00 61.79 60.74 1zei h SER 9 Cb 0.91 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 1zei h SER 9 CO 0.06 1.14 -0.19 0.45 -0.87 0.00 0.00 176.83 177.41 1zei h HIS 10 N 0.61 1.02 -0.34 4.77 3.86 -1.33 -3.21 115.15 120.52 1zei h HIS 10 Ca 0.06 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 59.01 1zei h HIS 10 Cb 0.87 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 29.08 1zei h HIS 10 CO 0.07 1.01 0.08 -0.07 0.86 0.00 0.00 177.93 179.87 1zei h LEU 11 N 0.78 0.45 -0.47 2.43 3.38 -1.04 -0.15 115.31 120.70 1zei h LEU 11 Ca 0.11 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.85 1zei h LEU 11 Cb 0.74 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1zei h LEU 11 CO 0.06 0.46 -0.59 0.58 0.09 0.00 0.00 178.44 179.04 1zei h VAL 12 N 0.49 1.32 -0.27 1.22 2.07 -1.44 -0.46 116.25 119.18 1zei h VAL 12 Ca 0.12 -1.86 -0.15 0.00 0.82 0.00 0.00 66.70 65.63 1zei h VAL 12 Cb 0.19 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1zei h VAL 12 CO -0.00 0.58 -0.45 -0.08 0.02 0.00 0.00 177.57 177.63 1zei h GLU 13 N 0.42 0.71 -0.45 1.57 4.57 -1.42 -2.00 114.58 117.98 1zei h GLU 13 Ca -0.00 -0.39 -0.14 0.00 -1.18 0.00 0.00 59.36 57.65 1zei h GLU 13 Cb 1.15 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 1zei h GLU 13 CO 0.11 1.01 -0.26 0.00 -1.18 0.00 0.00 179.01 178.70 1zei h ALA 14 N 0.92 0.64 -0.38 2.92 0.00 -0.50 -2.40 119.26 120.46 1zei h ALA 14 Ca 0.03 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.46 1zei h ALA 14 Cb 1.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1zei h ALA 14 CO 0.10 0.66 -0.07 -0.07 0.00 0.00 0.00 179.25 179.86 1zei h LEU 15 N 0.82 0.62 -0.30 0.00 3.38 -0.96 -1.37 115.31 117.50 1zei h LEU 15 Ca 0.10 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1zei h LEU 15 Cb 0.84 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1zei h LEU 15 CO 0.07 0.74 0.17 0.22 0.09 0.00 0.00 178.44 179.73 1zei h TYR 16 N 0.60 0.40 -0.26 1.13 3.20 -1.21 -0.70 116.97 120.12 1zei h TYR 16 Ca 0.11 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 1zei h TYR 16 Cb 0.48 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1zei h TYR 16 CO 0.02 0.31 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.65 1zei h LEU 17 N 0.37 0.57 0.04 2.82 3.38 -1.16 -2.78 115.31 118.55 1zei h LEU 17 Ca 0.11 -0.41 -0.28 0.00 0.09 0.00 0.00 57.88 57.39 1zei h LEU 17 Cb 0.03 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 40.64 1zei h LEU 17 CO -0.02 0.85 -1.16 0.58 0.09 0.00 0.00 178.44 178.78 1zei h VAL 18 N 0.28 1.34 0.00 1.22 2.07 -1.18 -3.29 116.25 116.69 1zei h VAL 18 Ca 0.06 -2.52 -0.19 0.00 0.82 0.00 0.00 66.70 64.87 1zei h VAL 18 Cb 0.64 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 33.02 1zei h VAL 18 CO 0.04 0.76 -0.88 0.00 0.02 0.00 0.00 177.57 177.51 1zei n GLY 20 N 0.98 3.44 0.20 0.00 0.00 -1.05 -0.98 105.19 107.77 1zei n GLY 20 Ca -0.01 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.10 1zei n GLY 20 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1zei h GLU 21 N 0.00 0.00 -0.05 1.61 4.81 -1.91 -2.71 114.58 116.32 1zei h GLU 21 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1zei h GLU 21 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1zei h GLU 21 CO 0.00 0.33 -0.14 0.00 -0.73 0.00 0.00 179.01 178.47 1zei h ARG 22 N 0.00 0.08 0.00 1.92 3.08 -1.40 -3.49 114.38 114.57 1zei h ARG 22 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1zei h ARG 22 Cb 0.63 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1zei h ARG 22 CO 0.04 0.23 0.00 0.41 -1.07 0.00 0.00 179.97 179.58 1zei n GLY 23 N -1.03 -1.20 3.77 0.04 0.00 -1.03 -4.13 105.19 101.62 1zei n GLY 23 Ca -0.02 -1.12 -0.02 0.00 0.00 0.00 0.00 46.02 44.86 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 0.00 -0.04 -0.06 1.61 -0.71 -1.26 -0.51 117.98 117.00 1zei s PHE 24 Ca 0.00 -0.23 0.04 0.00 -1.04 0.00 0.00 56.93 55.70 1zei s PHE 24 Cb 0.00 0.63 -0.00 0.00 -1.21 0.00 0.00 43.02 42.44 1zei s PHE 24 CO 0.00 -0.69 -0.18 -0.06 -1.34 0.00 0.00 175.22 172.95 1zei s PHE 25 N -2.70 1.92 -0.62 3.49 0.40 -1.26 -4.92 117.98 114.28 1zei s PHE 25 Ca 0.16 -0.64 0.05 0.00 -0.60 0.00 0.00 56.93 55.91 1zei s PHE 25 Cb -0.00 -1.30 0.19 0.00 0.51 0.00 0.00 43.02 42.42 1zei s PHE 25 CO 0.01 -0.24 0.52 0.98 0.70 0.00 0.00 175.22 177.19 1zei n TYR 26 N 3.33 2.34 -3.24 0.36 9.36 -1.26 -4.96 117.16 123.09 1zei n TYR 26 Ca -0.19 -4.05 -0.38 0.00 3.32 0.00 0.00 57.90 56.59 1zei n TYR 26 Cb 0.53 -0.43 -0.06 0.00 -0.63 0.00 0.00 39.34 38.75 1zei n TYR 26 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1zei s THR 27 N -1.38 5.12 -0.80 2.97 -4.23 -1.26 -4.92 115.64 111.15 1zei s THR 27 Ca 0.30 1.10 0.01 0.00 -1.18 0.00 0.00 61.69 61.92 1zei s THR 27 Cb 0.02 -3.88 0.01 0.00 1.34 0.00 0.00 72.50 69.99 1zei s THR 27 CO -0.14 0.32 0.93 0.47 -0.54 0.00 0.00 174.62 175.66 1zei n ASP 28 N 3.57 0.01 -0.17 3.99 9.92 -1.26 0.48 116.55 133.09 1zei n ASP 28 Ca -0.06 0.42 0.08 0.00 -0.53 0.00 0.00 54.79 54.70 1zei n ASP 28 Cb 0.51 -0.42 -0.06 0.00 -0.64 0.00 0.00 41.12 40.52 1zei n ASP 28 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1zei n LYS 29 N -1.43 1.47 0.00 -1.24 3.00 -1.26 -4.02 118.16 114.67 1zei n LYS 29 Ca -0.00 -0.36 0.06 0.00 -0.00 0.00 0.00 58.31 58.01 1zei n LYS 29 Cb 0.09 -1.31 -0.03 0.00 0.00 0.00 0.00 35.03 33.78 1zei n LYS 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1zei n ALA 30 N -0.85 3.26 0.93 3.14 0.00 0.91 -4.47 120.51 123.44 1zei n ALA 30 Ca 0.05 -0.44 0.11 0.00 0.00 0.00 0.00 53.44 53.16 1zei n ALA 30 Cb 0.31 -0.47 0.31 0.00 0.00 0.00 0.00 19.45 19.60 1zei n ALA 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zei n ALA 31 N -0.60 2.49 0.06 0.00 0.00 1.74 -4.11 120.51 120.08 1zei n ALA 31 Ca 0.04 -0.69 -0.20 0.00 0.00 0.00 0.00 53.44 52.59 1zei n ALA 31 Cb 0.25 -0.99 -0.11 0.00 0.00 0.00 0.00 19.45 18.60 1zei n ALA 31 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1zei h LYS 32 N 3.26 0.66 0.69 0.00 3.64 -1.77 -2.04 116.57 121.01 1zei h LYS 32 Ca 0.00 -0.76 -0.03 0.00 -1.27 0.00 0.00 60.65 58.59 1zei h LYS 32 Cb 0.71 0.23 0.01 0.00 -0.41 0.00 0.00 32.23 32.76 1zei h LYS 32 CO 0.00 1.33 -0.33 0.78 -2.27 0.00 0.00 179.45 178.96 1zei h GLY 33 N 0.45 -0.97 2.00 5.01 0.00 -1.89 0.38 103.07 108.05 1zei h GLY 33 Ca -0.14 0.36 -0.05 0.00 0.00 0.00 0.00 47.33 47.49 1zei h GLY 33 CO 0.21 -0.35 -0.26 1.19 0.00 0.00 0.00 176.54 177.33 1zei h ILE 34 N -1.03 1.16 -0.13 2.60 2.10 -1.77 0.56 117.51 120.99 1zei h ILE 34 Ca -0.10 -0.90 -0.22 0.00 1.08 0.00 0.00 64.86 64.72 1zei h ILE 34 Cb 0.74 1.49 0.01 0.00 -1.09 0.00 0.00 36.82 37.97 1zei h ILE 34 CO 0.16 0.26 -0.78 0.58 -1.08 0.00 0.00 178.15 177.28 1zei h VAL 35 N 0.00 1.30 -0.77 2.19 2.07 -1.30 -0.09 116.25 119.65 1zei h VAL 35 Ca -0.00 -2.02 -0.04 0.00 0.82 0.00 0.00 66.70 65.46 1zei h VAL 35 Cb 0.47 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1zei h VAL 35 CO 0.03 0.63 0.30 -0.33 0.02 0.00 0.00 177.57 178.23 1zei h GLU 36 N 0.49 1.15 0.24 1.57 5.08 -0.60 -0.91 114.58 121.60 1zei h GLU 36 Ca -0.05 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 1zei h GLU 36 Cb 1.40 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1zei h GLU 36 CO 0.16 0.94 -0.12 0.37 -1.00 0.00 0.00 179.01 179.35 1zei h GLN 37 N 1.11 -0.32 -0.12 2.33 4.15 -0.83 -3.33 115.11 118.11 1zei h GLN 37 Ca 0.26 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.70 1zei h GLN 37 Cb 0.22 0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.98 1zei h GLN 37 CO -0.02 0.05 0.00 0.00 -1.93 0.00 0.00 178.83 176.93 1zei n THR 40 N 1.03 0.53 -3.54 0.00 -2.24 -1.23 -5.03 114.28 103.81 1zei n THR 40 Ca 0.12 -0.76 -0.12 0.00 -2.27 0.00 0.00 64.05 61.02 1zei n THR 40 Cb 0.46 0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 69.39 1zei n THR 40 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1zei s SER 41 N -0.55 -0.44 -0.39 3.42 1.04 -1.14 -5.10 113.70 110.54 1zei s SER 41 Ca 0.01 0.34 -0.29 0.00 0.48 0.00 0.00 55.95 56.49 1zei s SER 41 Cb 0.01 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.53 1zei s SER 41 CO 0.01 -0.51 1.25 -0.63 0.98 0.00 0.00 173.24 174.34 1zei s ILE 42 N -1.82 4.14 0.16 -1.02 1.01 -1.26 -4.46 121.20 117.95 1zei s ILE 42 Ca -0.02 1.21 -0.30 0.00 0.00 0.00 0.00 60.65 61.54 1zei s ILE 42 Cb -0.01 -4.35 -0.08 0.00 0.01 0.00 0.00 42.46 38.04 1zei s ILE 42 CO -0.00 -0.73 1.20 0.00 0.00 0.00 0.00 174.94 175.40 1zei s SER 44 N 0.34 2.52 0.36 0.00 1.04 -1.26 -4.86 113.70 111.84 1zei s SER 44 Ca 0.54 1.07 0.16 0.00 0.48 0.00 0.00 55.95 58.20 1zei s SER 44 Cb -0.32 -1.67 0.66 0.00 0.10 0.00 0.00 66.02 64.79 1zei s SER 44 CO 0.35 -3.18 1.74 -0.07 0.98 0.00 0.00 173.24 173.06 1zei h LEU 45 N -1.93 0.00 -1.34 2.42 -0.00 -2.00 0.11 115.31 112.58 1zei h LEU 45 Ca -0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.32 1zei h LEU 45 Cb 1.33 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.97 1zei h LEU 45 CO 0.56 0.41 0.15 1.88 -0.00 0.00 0.00 178.44 181.45 1zei h TYR 46 N 0.00 0.60 -0.52 1.13 0.05 -2.00 -1.61 116.97 114.61 1zei h TYR 46 Ca -0.00 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.68 1zei h TYR 46 Cb 0.87 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.40 1zei h TYR 46 CO 0.00 0.48 0.06 1.96 -1.05 0.00 0.00 178.16 179.62 1zei h GLN 47 N 0.60 0.89 -0.91 4.88 4.20 -1.41 -2.69 115.11 120.66 1zei h GLN 47 Ca 0.14 -0.25 0.02 0.00 0.06 0.00 0.00 58.65 58.62 1zei h GLN 47 Cb 0.15 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.78 1zei h GLN 47 CO -0.01 0.88 0.60 -0.07 -0.67 0.00 0.00 178.83 179.56 1zei h LEU 48 N 0.76 1.02 -2.61 1.46 3.38 -0.90 -2.65 115.31 115.78 1zei h LEU 48 Ca 0.16 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1zei h LEU 48 Cb 0.44 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1zei h LEU 48 CO 0.01 0.73 0.00 -0.08 0.09 0.00 0.00 178.44 179.19 1zei h GLU 49 N 1.20 0.00 0.00 1.13 4.81 -0.95 0.05 114.58 120.83 1zei h GLU 49 Ca 0.35 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.58 1zei h GLU 49 Cb -0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1zei h GLU 49 CO -0.09 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.28 1zei n ASN 50 N -2.91 0.40 -1.15 1.04 3.02 -1.00 -1.89 115.26 112.77 1zei n ASN 50 Ca -0.03 0.65 0.08 0.00 -0.03 0.00 0.00 54.58 55.26 1zei n ASN 50 Cb 0.07 -0.72 0.28 0.00 -0.61 0.00 0.00 39.78 38.80 1zei n ASN 50 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1zei n TYR 51 N -2.00 1.02 -2.42 3.10 4.01 0.01 -5.00 117.16 115.88 1zei n TYR 51 Ca 0.00 -0.61 -0.28 0.00 -0.16 0.00 0.00 57.90 56.85 1zei n TYR 51 Cb 0.09 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 1zei n TYR 51 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40