#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e0g s SER 2 N 0.00 2.72 0.10 -2.24 1.04 -1.26 -4.93 113.70 109.13 1e0g s SER 2 Ca 0.00 -0.44 -0.14 0.00 0.48 0.00 0.00 55.95 55.86 1e0g s SER 2 Cb 0.00 -0.57 -0.06 0.00 0.10 0.00 0.00 66.02 65.48 1e0g s SER 2 CO 0.00 0.24 0.49 -0.63 0.98 0.00 0.00 173.24 174.32 1e0g s ILE 3 N -0.27 4.93 -0.14 -1.02 1.01 -1.25 -4.93 121.20 119.52 1e0g s ILE 3 Ca 0.01 0.76 -0.01 0.00 0.00 0.00 0.00 60.65 61.41 1e0g s ILE 3 Cb -0.11 -3.72 0.04 0.00 0.01 0.00 0.00 42.46 38.68 1e0g s ILE 3 CO 0.02 0.32 -0.02 -0.89 0.00 0.00 0.00 174.94 174.37 1e0g s THR 4 N -1.37 0.76 -0.06 2.92 2.01 -1.26 0.09 115.64 118.73 1e0g s THR 4 Ca 0.34 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 62.01 1e0g s THR 4 Cb -0.15 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.34 1e0g s THR 4 CO 0.18 0.10 -0.23 -0.72 -0.69 0.00 0.00 174.62 173.26 1e0g s TYR 5 N 1.79 2.50 -0.23 4.92 -0.85 -0.52 -4.77 117.35 120.18 1e0g s TYR 5 Ca 0.02 -0.61 -0.24 0.00 -0.52 0.00 0.00 57.07 55.71 1e0g s TYR 5 Cb -0.15 -1.62 -0.01 0.00 0.38 0.00 0.00 41.96 40.57 1e0g s TYR 5 CO -0.07 -0.15 0.81 0.50 -1.52 0.00 0.00 175.55 175.12 1e0g s ARG 6 N -0.23 4.20 -0.43 -3.49 6.06 -1.26 0.55 118.95 124.35 1e0g s ARG 6 Ca -0.01 0.92 -0.29 0.00 -2.50 0.00 0.00 55.73 53.84 1e0g s ARG 6 Cb -0.13 -3.63 0.02 0.00 0.06 0.00 0.00 34.95 31.27 1e0g s ARG 6 CO 0.03 -0.47 1.16 0.08 -2.50 0.00 0.00 175.30 173.60 1e0g s VAL 7 N 2.68 4.24 0.27 7.11 1.01 1.00 -4.86 120.40 131.85 1e0g s VAL 7 Ca 0.35 1.31 0.04 0.00 0.00 0.00 0.00 61.98 63.67 1e0g s VAL 7 Cb -0.15 -4.50 -0.03 0.00 0.00 0.00 0.00 36.38 31.69 1e0g s VAL 7 CO 0.08 -0.85 0.41 -0.60 0.00 0.00 0.00 175.10 174.15 1e0g s ARG 8 N 4.32 3.43 0.32 2.72 3.52 -1.26 0.66 118.95 132.65 1e0g s ARG 8 Ca 0.49 -0.67 -0.29 0.00 -0.13 0.00 0.00 55.73 55.14 1e0g s ARG 8 Cb -0.09 -2.83 -0.13 0.00 -1.56 0.00 0.00 34.95 30.34 1e0g s ARG 8 CO 0.28 0.33 1.27 0.36 -0.81 0.00 0.00 175.30 176.73 1e0g n LYS 9 N -1.52 2.00 -0.27 5.12 0.00 -1.26 -0.45 118.16 121.78 1e0g n LYS 9 Ca -0.07 0.70 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1e0g n LYS 9 Cb 0.57 -2.27 0.00 0.00 -0.00 0.00 0.00 35.03 33.33 1e0g n LYS 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1e0g n GLY 10 N 1.07 1.72 3.85 2.58 0.00 -1.26 -5.02 105.19 108.13 1e0g n GLY 10 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1e0g n GLY 10 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1e0g s ASP 11 N -3.30 6.63 -0.07 1.61 1.11 0.40 -5.07 116.67 117.99 1e0g s ASP 11 Ca 0.00 1.42 0.04 0.00 0.18 0.00 0.00 52.55 54.19 1e0g s ASP 11 Cb 0.00 -2.44 -0.00 0.00 1.07 0.00 0.00 42.92 41.55 1e0g s ASP 11 CO 0.00 -0.48 -0.20 -0.55 1.18 0.00 0.00 175.17 175.12 1e0g s SER 12 N -2.96 2.55 0.14 0.27 0.15 -1.26 -4.91 113.70 107.68 1e0g s SER 12 Ca 0.56 -0.44 -0.25 0.00 0.70 0.00 0.00 55.95 56.52 1e0g s SER 12 Cb -0.10 -0.93 -0.00 0.00 -1.71 0.00 0.00 66.02 63.28 1e0g s SER 12 CO 0.29 0.15 1.60 -0.07 1.20 0.00 0.00 173.24 176.41 1e0g h LEU 13 N 6.48 -1.06 -0.55 3.45 -0.00 -1.99 0.49 115.31 122.13 1e0g h LEU 13 Ca -0.28 0.16 -0.01 0.00 -0.00 0.00 0.00 57.88 57.75 1e0g h LEU 13 Cb 1.20 0.46 -0.03 0.00 -0.00 0.00 0.00 40.66 42.29 1e0g h LEU 13 CO 0.47 -0.35 0.31 0.28 -0.00 0.00 0.00 178.44 179.15 1e0g h SER 14 N -0.36 0.68 -0.56 -0.43 0.02 -1.96 -1.56 113.55 109.37 1e0g h SER 14 Ca 0.12 -0.08 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1e0g h SER 14 Cb 0.55 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.87 1e0g h SER 14 CO -0.42 0.56 0.31 0.28 -1.14 0.00 0.00 176.83 176.43 1e0g h SER 15 N 0.74 0.48 -0.49 3.07 0.02 -1.61 -1.12 113.55 114.64 1e0g h SER 15 Ca 0.20 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.19 1e0g h SER 15 Cb 0.02 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 1e0g h SER 15 CO -0.03 0.33 0.29 0.40 -1.14 0.00 0.00 176.83 176.67 1e0g h ILE 16 N 0.61 1.04 -0.63 3.27 2.04 0.29 -1.34 117.51 122.78 1e0g h ILE 16 Ca 0.24 -0.20 0.12 0.00 1.00 0.00 0.00 64.86 66.02 1e0g h ILE 16 Cb 0.10 0.42 -0.09 0.00 -0.74 0.00 0.00 36.82 36.52 1e0g h ILE 16 CO -0.14 0.10 0.17 0.00 0.00 0.00 0.00 178.15 178.28 1e0g h ALA 17 N 1.22 0.78 -1.00 1.87 0.00 -0.23 0.60 119.26 122.51 1e0g h ALA 17 Ca 0.20 0.12 0.22 0.00 0.00 0.00 0.00 54.91 55.45 1e0g h ALA 17 Cb 0.03 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 1e0g h ALA 17 CO -0.09 -0.28 0.62 -0.22 0.00 0.00 0.00 179.25 179.28 1e0g h LYS 18 N 0.31 0.60 -0.37 0.00 1.63 -0.25 0.62 116.57 119.10 1e0g h LYS 18 Ca 0.33 -0.04 0.10 0.00 -0.85 0.00 0.00 60.65 60.20 1e0g h LYS 18 Cb 0.49 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.97 1e0g h LYS 18 CO -0.40 0.39 0.26 0.00 -3.45 0.00 0.00 179.45 176.26 1e0g h ARG 19 N 0.61 0.03 -0.11 1.90 3.08 -0.70 -1.42 114.38 117.77 1e0g h ARG 19 Ca 0.58 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.62 1e0g h ARG 19 Cb 1.11 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.15 1e0g h ARG 19 CO -0.35 0.02 0.00 0.72 -1.07 0.00 0.00 179.97 179.29 1e0g n HIS 20 N -4.43 0.19 -3.80 3.04 -0.00 0.16 -4.98 115.22 105.39 1e0g n HIS 20 Ca 0.06 -0.58 -0.27 0.00 -0.00 0.00 0.00 57.72 56.93 1e0g n HIS 20 Cb 0.43 -0.07 0.01 0.00 -0.00 0.00 0.00 29.99 30.36 1e0g n HIS 20 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1e0g n GLY 21 N -0.31 -0.53 3.69 -1.41 0.00 0.17 -4.94 105.19 101.84 1e0g n GLY 21 Ca 0.06 0.26 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 1e0g n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1e0g s VAL 22 N -3.72 1.68 -0.63 1.61 -7.23 -0.74 -4.78 120.40 106.59 1e0g s VAL 22 Ca 0.18 -1.98 -0.10 0.00 -1.81 0.00 0.00 61.98 58.27 1e0g s VAL 22 Cb -0.07 -2.66 0.16 0.00 0.56 0.00 0.00 36.38 34.38 1e0g s VAL 22 CO 0.86 0.00 0.53 0.20 -0.31 0.00 0.00 175.10 176.38 1e0g s ASN 23 N -3.79 6.03 0.60 4.85 0.01 -1.26 -4.61 114.94 116.76 1e0g s ASN 23 Ca 0.24 -2.36 0.29 0.00 -0.71 0.00 0.00 52.86 50.31 1e0g s ASN 23 Cb 0.06 -2.07 1.50 0.00 0.41 0.00 0.00 41.25 41.15 1e0g s ASN 23 CO 0.12 -0.61 1.91 0.40 -1.51 0.00 0.00 177.10 177.41 1e0g h ILE 24 N 5.46 0.32 -0.75 0.60 1.08 -1.91 0.97 117.51 123.28 1e0g h ILE 24 Ca -0.08 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.35 1e0g h ILE 24 Cb 1.04 0.64 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 1e0g h ILE 24 CO 0.82 0.00 0.31 0.07 -0.69 0.00 0.00 178.15 178.66 1e0g h LYS 25 N 0.00 1.12 -0.85 2.37 2.10 -1.97 0.22 116.57 119.55 1e0g h LYS 25 Ca 0.18 -0.19 -0.03 0.00 -2.00 0.00 0.00 60.65 58.60 1e0g h LYS 25 Cb 1.07 -0.19 -0.04 0.00 -0.90 0.00 0.00 32.23 32.17 1e0g h LYS 25 CO -0.00 0.90 0.41 -0.44 -2.00 0.00 0.00 179.45 178.32 1e0g h ASP 26 N 1.09 1.11 -0.63 7.07 3.32 0.56 0.57 116.42 129.52 1e0g h ASP 26 Ca 0.25 -0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.22 1e0g h ASP 26 Cb 0.20 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 39.41 1e0g h ASP 26 CO -0.02 0.93 0.34 0.58 -1.72 0.00 0.00 179.24 179.36 1e0g h VAL 27 N 1.21 0.97 0.00 -1.35 2.07 -0.42 0.62 116.25 119.36 1e0g h VAL 27 Ca 0.29 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1e0g h VAL 27 Cb 0.12 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1e0g h VAL 27 CO -0.04 0.12 0.00 0.23 0.02 0.00 0.00 177.57 177.90 1e0g n MET 28 N -4.81 0.15 0.01 1.57 2.81 0.56 -1.55 117.12 115.85 1e0g n MET 28 Ca 0.07 0.28 -0.18 0.00 -1.81 0.00 0.00 57.70 56.07 1e0g n MET 28 Cb 0.16 -1.73 -0.10 0.00 -0.71 0.00 0.00 33.22 30.83 1e0g n MET 28 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 1e0g h ARG 29 N 0.00 0.51 0.23 0.03 2.43 0.55 -3.33 114.38 114.80 1e0g h ARG 29 Ca 0.00 -0.52 -0.34 0.00 -0.81 0.00 0.00 59.98 58.31 1e0g h ARG 29 Cb 0.45 0.14 0.03 0.00 -0.42 0.00 0.00 29.97 30.17 1e0g h ARG 29 CO 0.00 1.16 -1.59 -1.49 -1.51 0.00 0.00 179.97 176.54 1e0g h TRP 30 N 0.07 0.87 -3.14 2.20 6.55 -1.08 -3.44 115.95 117.97 1e0g h TRP 30 Ca -0.08 -0.63 -0.60 0.00 0.95 0.00 0.00 58.89 58.53 1e0g h TRP 30 Cb 1.39 -0.03 -0.07 0.00 -0.86 0.00 0.00 29.16 29.58 1e0g h TRP 30 CO 0.13 1.60 -0.24 -0.80 -1.05 0.00 0.00 178.44 178.08 1e0g s ASN 31 N -7.46 6.65 0.00 -3.49 0.01 -0.60 -5.02 114.94 105.04 1e0g s ASN 31 Ca -0.12 0.77 0.00 0.00 -0.71 0.00 0.00 52.86 52.81 1e0g s ASN 31 Cb 0.05 -2.23 0.00 0.00 0.41 0.00 0.00 41.25 39.48 1e0g s ASN 31 CO 0.91 0.20 0.00 -1.20 -1.51 0.00 0.00 177.10 175.49 1e0g n SER 32 N 2.73 0.00 -4.59 -1.22 7.64 -1.26 -4.47 113.62 112.44 1e0g n SER 32 Ca -0.12 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.33 1e0g n SER 32 Cb 0.52 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 1e0g n SER 32 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1e0g s ASP 33 N -1.00 6.48 -0.29 6.43 -4.77 -1.26 -4.88 116.67 117.38 1e0g s ASP 33 Ca 0.00 0.46 -0.02 0.00 -3.30 0.00 0.00 52.55 49.70 1e0g s ASP 33 Cb 0.00 -2.55 0.14 0.00 -1.09 0.00 0.00 42.92 39.42 1e0g s ASP 33 CO 0.00 -1.39 2.24 0.35 0.70 0.00 0.00 175.17 177.08 1e0g n THR 34 N 6.88 2.81 0.45 2.11 -2.24 -1.26 -4.41 114.28 118.62 1e0g n THR 34 Ca 0.12 -1.77 0.06 0.00 -2.27 0.00 0.00 64.05 60.19 1e0g n THR 34 Cb 0.49 -1.44 0.27 0.00 -2.10 0.00 0.00 70.33 67.55 1e0g n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e0g n ALA 35 N 0.68 1.59 1.87 6.98 0.00 -1.26 -1.57 120.51 128.80 1e0g n ALA 35 Ca 0.31 -0.05 0.14 0.00 0.00 0.00 0.00 53.44 53.84 1e0g n ALA 35 Cb 0.58 -1.19 0.76 0.00 0.00 0.00 0.00 19.45 19.60 1e0g n ALA 35 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1e0g n ASN 36 N -1.45 0.35 -3.80 0.00 5.15 -1.26 -4.37 115.26 109.88 1e0g n ASN 36 Ca 0.04 -1.21 -0.42 0.00 -0.60 0.00 0.00 54.58 52.38 1e0g n ASN 36 Cb 0.13 -0.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.38 1e0g n ASN 36 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1e0g n LEU 37 N -0.68 6.77 -4.80 1.20 4.32 -0.61 -4.54 117.00 118.67 1e0g n LEU 37 Ca 0.21 -4.48 -0.22 0.00 -0.02 0.00 0.00 56.01 51.50 1e0g n LEU 37 Cb 0.15 -1.54 -0.05 0.00 -1.62 0.00 0.00 43.42 40.37 1e0g n LEU 37 CO 0.16 1.31 -0.14 -1.10 -1.22 0.00 0.00 177.39 176.40 1e0g s GLN 38 N 1.33 2.58 -1.00 3.23 -0.21 -1.26 -4.99 119.66 119.34 1e0g s GLN 38 Ca 0.42 -1.39 -0.24 0.00 0.02 0.00 0.00 55.36 54.17 1e0g s GLN 38 Cb 0.11 -2.35 -0.08 0.00 1.00 0.00 0.00 33.01 31.70 1e0g s GLN 38 CO -0.03 0.12 1.99 -1.25 -2.12 0.00 0.00 175.29 174.01 1e0g s PRO 39 N -3.92 2.38 0.00 2.91 0.04 -1.21 -1.49 135.00 133.71 1e0g s PRO 39 Ca 0.39 -0.52 0.00 0.00 0.04 0.00 0.00 61.00 60.91 1e0g s PRO 39 Cb -0.05 -5.09 0.00 0.00 0.04 0.00 0.00 34.50 29.40 1e0g s PRO 39 CO 0.25 -3.79 0.00 0.41 0.04 0.00 0.00 177.00 173.91 1e0g n GLY 40 N 6.47 0.65 3.54 0.56 0.00 0.21 -4.71 105.19 111.92 1e0g n GLY 40 Ca 0.42 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 1e0g n GLY 40 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1e0g s ASP 41 N -1.11 4.21 0.56 1.61 1.11 -0.56 -4.87 116.67 117.62 1e0g s ASP 41 Ca 0.00 -0.44 -0.08 0.00 0.18 0.00 0.00 52.55 52.21 1e0g s ASP 41 Cb 0.00 -0.74 -0.04 0.00 1.07 0.00 0.00 42.92 43.21 1e0g s ASP 41 CO 0.00 0.18 0.92 -1.59 1.18 0.00 0.00 175.17 175.86 1e0g s LYS 42 N -2.14 3.57 -0.01 8.23 -2.85 -1.26 -0.00 119.74 125.29 1e0g s LYS 42 Ca 0.20 0.50 0.01 0.00 -1.00 0.00 0.00 55.97 55.67 1e0g s LYS 42 Cb -0.11 -2.22 0.01 0.00 -2.06 0.00 0.00 37.83 33.45 1e0g s LYS 42 CO 0.12 -0.40 -0.03 -1.17 0.10 0.00 0.00 175.35 173.97 1e0g s LEU 43 N -4.98 1.74 -0.14 2.77 0.20 0.19 -4.81 118.68 113.65 1e0g s LEU 43 Ca 0.51 -0.06 -0.29 0.00 0.69 0.00 0.00 54.13 54.99 1e0g s LEU 43 Cb -0.11 -0.20 -0.03 0.00 -0.43 0.00 0.00 46.19 45.42 1e0g s LEU 43 CO 0.50 -0.00 1.44 -0.89 -0.29 0.00 0.00 176.35 177.11 1e0g s THR 44 N 0.27 3.97 -0.71 3.68 2.01 -1.26 -1.44 115.64 122.16 1e0g s THR 44 Ca -0.03 1.15 0.02 0.00 0.31 0.00 0.00 61.69 63.15 1e0g s THR 44 Cb -0.05 -3.79 0.36 0.00 0.01 0.00 0.00 72.50 69.02 1e0g s THR 44 CO -0.01 -0.15 1.45 0.18 -0.69 0.00 0.00 174.62 175.40 1e0g n LEU 45 N 7.07 5.94 0.18 4.42 4.77 0.11 -4.74 117.00 134.76 1e0g n LEU 45 Ca 0.16 -5.30 0.18 0.00 -0.03 0.00 0.00 56.01 51.02 1e0g n LEU 45 Cb 0.44 -0.80 0.75 0.00 -2.33 0.00 0.00 43.42 41.49 1e0g n LEU 45 CO 0.60 2.12 1.16 -0.26 -1.33 0.00 0.00 177.39 179.67 1e0g h PHE 46 N 3.18 0.00 -1.44 -1.77 0.04 -1.91 -3.33 116.94 111.71 1e0g h PHE 46 Ca 0.37 0.00 -0.63 0.00 2.80 0.00 0.00 57.97 60.52 1e0g h PHE 46 Cb 0.46 0.00 0.14 0.00 2.20 0.00 0.00 35.95 38.75 1e0g h PHE 46 CO 1.03 0.00 -0.80 1.33 -0.60 0.00 0.00 178.31 179.27 1e0g n VAL 47 N -3.39 1.05 1.07 -0.55 0.24 -1.26 -4.89 118.33 110.60 1e0g n VAL 47 Ca 0.04 -0.49 0.12 0.00 -2.04 0.00 0.00 64.34 61.97 1e0g n VAL 47 Cb 0.56 0.00 0.16 0.00 -1.47 0.00 0.00 33.84 33.08 1e0g n VAL 47 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98