#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zba s GLY 16 N 0.00 -0.96 -0.32 0.46 0.00 -1.26 -4.98 107.32 100.26 1zba s GLY 16 Ca 0.00 1.80 -0.02 0.00 0.00 0.00 0.00 44.72 46.51 1zba s GLY 16 CO 0.00 3.67 0.28 -2.01 0.00 0.00 0.00 173.10 175.04 1zba n ASN 17 N 5.39 -2.80 -3.84 1.64 4.05 -1.26 -5.06 115.26 113.38 1zba n ASN 17 Ca 0.01 -0.14 -0.20 0.00 0.45 0.00 0.00 54.58 54.70 1zba n ASN 17 Cb 0.53 -1.62 -0.17 0.00 1.23 0.00 0.00 39.78 39.76 1zba n ASN 17 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1zba s THR 18 N -3.08 0.42 -0.07 -0.44 2.01 -1.26 -5.06 115.64 108.16 1zba s THR 18 Ca 0.11 -0.00 0.19 0.00 0.31 0.00 0.00 61.69 62.30 1zba s THR 18 Cb -0.05 -0.50 0.39 0.00 0.01 0.00 0.00 72.50 72.35 1zba s THR 18 CO 0.18 0.22 1.17 0.61 -0.69 0.00 0.00 174.62 176.12 1zba n GLY 19 N 4.45 2.45 3.78 4.40 0.00 -1.26 -5.04 105.19 113.97 1zba n GLY 19 Ca -0.19 -0.96 -0.38 0.00 0.00 0.00 0.00 46.02 44.49 1zba n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zba s SER 20 N -2.37 6.93 -0.10 1.61 1.04 -1.26 -5.00 113.70 114.55 1zba s SER 20 Ca 0.33 1.11 -0.28 0.00 0.48 0.00 0.00 55.95 57.59 1zba s SER 20 Cb 0.36 -2.33 -0.24 0.00 0.10 0.00 0.00 66.02 63.90 1zba s SER 20 CO -0.12 0.17 0.92 0.40 0.98 0.00 0.00 173.24 175.60 1zba h ILE 21 N 3.98 1.67 -3.13 -1.02 1.08 -2.08 -3.46 117.51 114.55 1zba h ILE 21 Ca -0.47 -2.01 -0.53 0.00 -0.39 0.00 0.00 64.86 61.46 1zba h ILE 21 Cb 1.20 3.02 0.06 0.00 -3.07 0.00 0.00 36.82 38.04 1zba h ILE 21 CO 0.67 0.53 0.85 -0.63 -0.69 0.00 0.00 178.15 178.88 1zba s ILE 22 N -2.83 2.43 0.50 -0.67 1.09 -1.26 -4.96 121.20 115.51 1zba s ILE 22 Ca -0.18 0.34 -0.22 0.00 -1.10 0.00 0.00 60.65 59.49 1zba s ILE 22 Cb -0.01 -3.22 -0.07 0.00 -1.06 0.00 0.00 42.46 38.10 1zba s ILE 22 CO 0.69 0.04 1.17 -3.20 -0.10 0.00 0.00 174.94 173.54 1zba n ASN 23 N 2.96 1.88 -4.77 3.58 5.15 -1.26 -4.93 115.26 117.86 1zba n ASN 23 Ca 0.10 0.98 -0.41 0.00 -0.60 0.00 0.00 54.58 54.65 1zba n ASN 23 Cb 0.38 -1.47 -0.01 0.00 -0.53 0.00 0.00 39.78 38.16 1zba n ASN 23 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1zba s ASN 24 N -0.86 6.58 0.36 1.20 3.84 -1.26 -4.94 114.94 119.86 1zba s ASN 24 Ca 0.68 2.85 0.17 0.00 0.21 0.00 0.00 52.86 56.77 1zba s ASN 24 Cb -0.47 -2.66 0.65 0.00 -0.55 0.00 0.00 41.25 38.22 1zba s ASN 24 CO 0.52 -0.68 1.73 0.22 -2.79 0.00 0.00 177.10 176.10 1zba h TYR 25 N 3.25 0.00 -2.95 0.43 3.20 -2.06 -3.44 116.97 115.41 1zba h TYR 25 Ca -0.50 0.00 -0.64 0.00 3.14 0.00 0.00 58.73 60.73 1zba h TYR 25 Cb 1.23 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 39.44 1zba h TYR 25 CO 0.55 0.41 -0.53 0.71 -1.64 0.00 0.00 178.16 177.66 1zba s TYR 26 N -3.68 3.43 0.68 -3.82 2.02 -1.26 -5.09 117.35 109.63 1zba s TYR 26 Ca -0.01 0.26 -0.16 0.00 -0.37 0.00 0.00 57.07 56.80 1zba s TYR 26 Cb 0.12 -1.77 0.01 0.00 -0.40 0.00 0.00 41.96 39.92 1zba s TYR 26 CO 0.70 0.60 1.15 -1.64 -1.57 0.00 0.00 175.55 174.79 1zba s MET 27 N -2.06 2.59 0.43 -0.62 -1.94 -1.26 -4.76 119.30 111.67 1zba s MET 27 Ca 0.28 1.58 0.09 0.00 -1.71 0.00 0.00 55.69 55.92 1zba s MET 27 Cb -0.12 -1.91 0.92 0.00 2.01 0.00 0.00 34.83 35.73 1zba s MET 27 CO 0.20 -1.45 2.07 0.37 -0.01 0.00 0.00 175.02 176.19 1zba h GLN 28 N 0.03 0.46 0.00 2.03 4.15 -1.96 -0.75 115.11 119.09 1zba h GLN 28 Ca -0.48 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.92 1zba h GLN 28 Cb 1.27 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.85 1zba h GLN 28 CO 0.53 0.31 0.00 0.00 -1.93 0.00 0.00 178.83 177.73 1zba n GLN 29 N -4.48 0.35 -0.06 1.69 10.64 -1.26 -1.42 117.38 122.83 1zba n GLN 29 Ca 0.03 0.08 -0.10 0.00 -1.83 0.00 0.00 57.00 55.18 1zba n GLN 29 Cb 0.08 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 27.91 1zba n GLN 29 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1zba n TYR 30 N -1.21 0.00 0.08 2.61 4.02 -0.49 -4.65 117.16 117.51 1zba n TYR 30 Ca 0.10 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.99 1zba n TYR 30 Cb 0.13 -0.49 0.28 0.00 -0.02 0.00 0.00 39.34 39.23 1zba n TYR 30 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1zba h GLN 31 N -0.08 0.31 -4.52 -0.72 5.75 -1.04 -3.46 115.11 111.35 1zba h GLN 31 Ca -0.30 -0.11 -0.22 0.00 -0.15 0.00 0.00 58.65 57.88 1zba h GLN 31 Cb 1.42 -0.02 -0.15 0.00 1.07 0.00 0.00 27.48 29.80 1zba h GLN 31 CO -0.07 0.55 -0.63 -0.80 -2.65 0.00 0.00 178.83 175.23 1zba s ASN 32 N -6.85 0.24 0.62 -0.69 -0.87 -0.51 -5.08 114.94 101.79 1zba s ASN 32 Ca -0.05 -1.31 -0.14 0.00 -1.57 0.00 0.00 52.86 49.79 1zba s ASN 32 Cb 0.14 0.34 -0.03 0.00 -0.02 0.00 0.00 41.25 41.68 1zba s ASN 32 CO 0.76 -0.79 1.04 -0.94 -2.57 0.00 0.00 177.10 174.61 1zba s SER 33 N -3.11 5.86 -0.20 -1.22 1.04 -1.26 -4.51 113.70 110.30 1zba s SER 33 Ca 0.32 1.66 -0.07 0.00 0.48 0.00 0.00 55.95 58.34 1zba s SER 33 Cb 0.07 -2.51 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 1zba s SER 33 CO 0.07 -1.11 0.06 -0.04 0.98 0.00 0.00 173.24 173.20 1zba s MET 34 N -4.52 3.89 0.45 4.02 1.00 -1.26 -5.01 119.30 117.87 1zba s MET 34 Ca 0.60 -0.38 -0.21 0.00 0.00 0.00 0.00 55.69 55.70 1zba s MET 34 Cb -0.14 -3.23 -0.10 0.00 0.00 0.00 0.00 34.83 31.37 1zba s MET 34 CO 0.44 0.17 0.99 -1.12 0.00 0.00 0.00 175.02 175.49 1zba s SER 35 N 0.65 6.71 0.20 3.03 0.01 -1.26 -5.08 113.70 117.96 1zba s SER 35 Ca 0.03 1.80 0.07 0.00 1.31 0.00 0.00 55.95 59.16 1zba s SER 35 Cb -0.13 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.50 1zba s SER 35 CO 0.02 -0.53 -0.12 0.42 0.41 0.00 0.00 173.24 173.44 1zba s THR 36 N -2.08 1.62 0.23 1.44 -4.23 -1.26 -5.17 115.64 106.20 1zba s THR 36 Ca 0.64 -2.18 0.06 0.00 -1.18 0.00 0.00 61.69 59.03 1zba s THR 36 Cb -0.12 -2.06 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 1zba s THR 36 CO 0.16 -0.58 -0.08 -1.10 -0.54 0.00 0.00 174.62 172.48 1zba s GLN 37 N -3.68 1.39 -0.16 3.99 -1.52 -1.26 -5.13 119.66 113.30 1zba s GLN 37 Ca 0.22 -1.67 -0.04 0.00 -1.95 0.00 0.00 55.36 51.92 1zba s GLN 37 Cb 0.00 -0.98 0.07 0.00 -0.22 0.00 0.00 33.01 31.89 1zba s GLN 37 CO 0.06 0.06 0.20 -0.48 -0.25 0.00 0.00 175.29 174.88 1zba s LEU 38 N -3.35 -0.08 0.00 2.90 0.05 -1.26 -5.31 118.68 111.63 1zba s LEU 38 Ca 0.26 -0.01 0.00 0.00 0.05 0.00 0.00 54.13 54.43 1zba s LEU 38 Cb 0.03 0.33 0.00 0.00 -2.05 0.00 0.00 46.19 44.50 1zba s LEU 38 CO 0.09 -0.30 0.00 0.61 -0.55 0.00 0.00 176.35 176.20 1zba n GLY 39 N 5.32 -0.99 3.55 -3.48 0.00 -1.26 -5.31 105.19 103.02 1zba n GLY 39 Ca -0.05 0.58 -0.35 0.00 0.00 0.00 0.00 46.02 46.19 1zba n GLY 39 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1zba s THR 62 N 0.51 3.28 0.59 2.61 -1.32 -1.26 -5.39 115.64 114.66 1zba s THR 62 Ca 0.00 0.08 0.09 0.00 -1.21 0.00 0.00 61.69 60.65 1zba s THR 62 Cb 0.00 -3.73 0.09 0.00 -1.51 0.00 0.00 72.50 67.35 1zba s THR 62 CO 0.00 -0.71 0.81 -1.10 -2.21 0.00 0.00 174.62 171.41 1zba s GLN 63 N 7.35 2.25 -1.30 7.08 -0.21 -1.26 -5.01 119.66 128.57 1zba s GLN 63 Ca 0.74 -1.62 -0.15 0.00 0.02 0.00 0.00 55.36 54.35 1zba s GLN 63 Cb -0.13 -2.63 0.10 0.00 1.00 0.00 0.00 33.01 31.36 1zba s GLN 63 CO 0.18 -0.91 1.76 -1.71 -2.12 0.00 0.00 175.29 172.49 1zba n ASN 64 N -2.29 4.85 -2.39 5.90 4.05 -1.26 -4.60 115.26 119.53 1zba n ASN 64 Ca 0.16 -2.94 -0.29 0.00 0.45 0.00 0.00 54.58 51.95 1zba n ASN 64 Cb 0.62 -1.65 0.02 0.00 1.23 0.00 0.00 39.78 39.99 1zba n ASN 64 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1zba n ASN 65 N 6.71 5.58 -4.30 1.20 5.15 -1.26 -4.92 115.26 123.42 1zba n ASN 65 Ca 0.45 -3.76 -0.45 0.00 -0.60 0.00 0.00 54.58 50.23 1zba n ASN 65 Cb 0.43 -0.58 -0.02 0.00 -0.53 0.00 0.00 39.78 39.08 1zba n ASN 65 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1zba s ASP 66 N -2.97 6.80 0.16 1.20 -1.08 -1.26 -4.92 116.67 114.59 1zba s ASP 66 Ca 0.52 -3.12 -0.20 0.00 -0.52 0.00 0.00 52.55 49.23 1zba s ASP 66 Cb 0.42 -2.16 0.06 0.00 -1.46 0.00 0.00 42.92 39.78 1zba s ASP 66 CO -0.13 -0.42 1.65 -0.25 0.52 0.00 0.00 175.17 176.54 1zba h TRP 67 N 7.18 -0.40 0.00 -5.34 2.91 -2.00 -2.15 115.95 116.15 1zba h TRP 67 Ca 0.13 0.04 -0.05 0.00 1.13 0.00 0.00 58.89 60.13 1zba h TRP 67 Cb 0.96 0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 29.82 1zba h TRP 67 CO 0.89 -0.24 -0.24 0.74 -1.03 0.00 0.00 178.44 178.56 1zba h PHE 68 N -0.12 0.00 -0.24 2.65 0.04 -1.99 -0.05 116.94 117.24 1zba h PHE 68 Ca 0.16 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.81 1zba h PHE 68 Cb 0.36 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 1zba h PHE 68 CO -0.36 0.24 -0.31 1.03 -0.60 0.00 0.00 178.31 178.31 1zba h SER 69 N 0.00 0.68 -0.17 2.17 0.87 -1.85 -1.24 113.55 114.01 1zba h SER 69 Ca -0.00 -0.50 -0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1zba h SER 69 Cb 0.55 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1zba h SER 69 CO 0.03 1.05 0.09 0.11 -0.53 0.00 0.00 176.83 177.58 1zba h LYS 70 N 0.33 0.24 -0.26 2.24 1.57 -0.83 -1.75 116.57 118.10 1zba h LYS 70 Ca 0.03 -0.03 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1zba h LYS 70 Cb 0.89 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.10 1zba h LYS 70 CO 0.07 0.24 -0.04 1.25 -0.57 0.00 0.00 179.45 180.41 1zba h LEU 71 N 0.17 -0.18 -0.57 2.94 5.85 -0.96 -1.36 115.31 121.20 1zba h LEU 71 Ca 0.06 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1zba h LEU 71 Cb 0.07 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1zba h LEU 71 CO -0.01 -0.06 0.20 0.00 -0.34 0.00 0.00 178.44 178.24 1zba h ALA 72 N 1.24 0.75 0.00 1.25 0.00 -1.11 -2.71 119.26 118.68 1zba h ALA 72 Ca 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1zba h ALA 72 Cb 0.18 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1zba h ALA 72 CO -0.24 0.39 -0.13 0.77 0.00 0.00 0.00 179.25 180.04 1zba h SER 73 N 0.80 0.00 0.58 0.00 0.02 -0.98 -2.55 113.55 111.42 1zba h SER 73 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1zba h SER 73 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1zba h SER 73 CO -0.01 0.13 -0.06 -1.54 -1.14 0.00 0.00 176.83 174.21 1zba n SER 74 N -3.37 0.16 -4.71 3.07 3.41 -0.54 -4.91 113.62 106.72 1zba n SER 74 Ca -0.01 -0.17 -0.43 0.00 -0.26 0.00 0.00 58.87 58.01 1zba n SER 74 Cb 0.32 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 1zba n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1zba n ALA 75 N -1.24 1.61 -2.20 7.33 0.00 -0.96 -4.93 120.51 120.12 1zba n ALA 75 Ca 0.13 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.52 1zba n ALA 75 Cb 0.27 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.37 1zba n ALA 75 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1zba s PHE 76 N -0.57 3.29 -0.00 0.00 5.36 -1.26 -4.92 117.98 119.88 1zba s PHE 76 Ca 0.61 1.06 0.00 0.00 -0.96 0.00 0.00 56.93 57.64 1zba s PHE 76 Cb -0.57 -3.62 -0.01 0.00 -0.34 0.00 0.00 43.02 38.49 1zba s PHE 76 CO 0.56 -2.08 0.01 2.41 -1.46 0.00 0.00 175.22 174.65 1zba n THR 77 N 3.76 0.00 0.00 0.12 -1.04 -1.26 -5.05 114.28 110.81 1zba n THR 77 Ca 0.10 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1zba n THR 77 Cb 0.43 0.57 0.00 0.00 -1.82 0.00 0.00 70.33 69.51 1zba n THR 77 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1zba n GLY 78 N 2.26 -3.21 3.15 3.41 0.00 -1.26 -5.06 105.19 104.48 1zba n GLY 78 Ca -0.00 -0.86 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 1zba n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1zba s LEU 79 N 0.00 -0.70 0.10 0.99 2.96 -1.26 -5.13 118.68 115.64 1zba s LEU 79 Ca 0.00 0.74 -0.30 0.00 -0.22 0.00 0.00 54.13 54.35 1zba s LEU 79 Cb 0.00 1.35 -0.06 0.00 0.50 0.00 0.00 46.19 47.98 1zba s LEU 79 CO 0.00 -0.26 1.18 0.12 -1.32 0.00 0.00 176.35 176.07 1zba s PHE 80 N 2.62 3.47 0.00 5.38 2.19 -1.26 -4.87 117.98 125.51 1zba s PHE 80 Ca 0.04 1.38 0.00 0.00 0.33 0.00 0.00 56.93 58.69 1zba s PHE 80 Cb -0.13 -3.39 0.00 0.00 -1.31 0.00 0.00 43.02 38.18 1zba s PHE 80 CO -0.14 -1.13 0.00 0.41 1.83 0.00 0.00 175.22 176.18 1zba n GLY 81 N 2.81 -3.36 3.84 13.12 0.00 -1.26 -4.99 105.19 115.35 1zba n GLY 81 Ca 0.07 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.75 1zba n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zba s ALA 82 N -1.27 3.30 0.05 4.61 0.00 -1.26 -5.09 121.76 122.09 1zba s ALA 82 Ca 0.00 0.11 0.08 0.00 0.00 0.00 0.00 51.96 52.15 1zba s ALA 82 Cb 0.00 -2.83 -0.03 0.00 0.00 0.00 0.00 23.12 20.26 1zba s ALA 82 CO 0.00 0.30 -0.21 -1.17 0.00 0.00 0.00 175.76 174.68 1zba s LEU 83 N -2.86 2.45 -0.46 0.00 1.98 -1.26 -5.09 118.68 113.43 1zba s LEU 83 Ca 0.54 -0.49 0.03 0.00 -2.89 0.00 0.00 54.13 51.31 1zba s LEU 83 Cb -0.11 -1.43 0.13 0.00 0.66 0.00 0.00 46.19 45.44 1zba s LEU 83 CO 0.17 0.25 0.25 -0.76 -1.89 0.00 0.00 176.35 174.37 1zba s LEU 84 N -1.40 3.14 0.00 -0.68 1.43 -1.26 -5.31 118.68 114.60 1zba s LEU 84 Ca 0.14 -2.74 0.18 0.00 -1.03 0.00 0.00 54.13 50.68 1zba s LEU 84 Cb -0.10 -1.20 0.14 0.00 0.03 0.00 0.00 46.19 45.06 1zba s LEU 84 CO 0.04 -0.26 1.07 0.00 0.23 0.00 0.00 176.35 177.44