#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 2.88 0.12 -2.24 1.04 -1.26 -4.95 113.70 109.28 1e0g s SER 2 Ca 0.00 -0.61 -0.13 0.00 0.48 0.00 0.00 55.95 55.70 1e0g s SER 2 Cb 0.00 -0.23 -0.06 0.00 0.10 0.00 0.00 66.02 65.83 1e0g s SER 2 CO 0.00 0.19 0.49 -0.63 0.98 0.00 0.00 173.24 174.26 1e0g s ILE 3 N -0.89 4.95 -0.16 -1.02 1.01 -1.25 -4.92 121.20 118.92 1e0g s ILE 3 Ca 0.10 0.69 -0.01 0.00 0.00 0.00 0.00 60.65 61.43 1e0g s ILE 3 Cb -0.10 -3.70 0.05 0.00 0.01 0.00 0.00 42.46 38.72 1e0g s ILE 3 CO 0.03 0.27 -0.01 -0.89 0.00 0.00 0.00 174.94 174.34 1e0g s THR 4 N -1.42 0.78 -0.06 2.92 2.01 -1.26 0.10 115.64 118.71 1e0g s THR 4 Ca 0.35 -0.47 0.05 0.00 0.31 0.00 0.00 61.69 61.94 1e0g s THR 4 Cb -0.15 -1.06 -0.01 0.00 0.01 0.00 0.00 72.50 71.29 1e0g s THR 4 CO 0.19 0.04 -0.22 -0.72 -0.69 0.00 0.00 174.62 173.22 1e0g s TYR 5 N 1.77 2.51 -0.17 4.92 -0.85 -0.51 -4.77 117.35 120.25 1e0g s TYR 5 Ca 0.01 -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 -0.02 0.00 0.38 0.00 0.00 41.96 40.55 1e0g s TYR 5 CO -0.07 -0.14 0.79 -0.98 -1.52 0.00 0.00 175.55 173.63 1e0g s ARG 6 N -0.23 4.28 -0.46 -3.49 1.70 -1.26 0.59 118.95 120.09 1e0g s ARG 6 Ca -0.01 0.94 -0.28 0.00 -0.47 0.00 0.00 55.73 55.91 1e0g s ARG 6 Cb -0.13 -3.57 0.03 0.00 -0.57 0.00 0.00 34.95 30.70 1e0g s ARG 6 CO 0.03 -0.31 1.07 0.08 -1.08 0.00 0.00 175.30 175.09 1e0g s VAL 7 N 2.10 4.32 0.26 4.99 1.01 0.11 -4.86 120.40 128.32 1e0g s VAL 7 Ca 0.36 1.14 0.05 0.00 0.00 0.00 0.00 61.98 63.53 1e0g s VAL 7 Cb -0.16 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 31.65 1e0g s VAL 7 CO 0.12 -0.90 0.39 -0.13 0.00 0.00 0.00 175.10 174.58 1e0g s ARG 8 N 4.17 3.42 0.29 2.72 1.81 -1.26 0.64 118.95 130.74 1e0g s ARG 8 Ca 0.44 -0.72 -0.29 0.00 -1.72 0.00 0.00 55.73 53.44 1e0g s ARG 8 Cb -0.08 -2.86 -0.13 0.00 -0.45 0.00 0.00 34.95 31.43 1e0g s ARG 8 CO 0.28 0.37 1.31 0.36 -0.68 0.00 0.00 175.30 176.95 1e0g n LYS 9 N -1.47 2.00 0.00 3.54 2.85 -1.26 -0.25 118.16 123.57 1e0g n LYS 9 Ca -0.08 0.71 0.00 0.00 -1.05 0.00 0.00 58.31 57.89 1e0g n LYS 9 Cb 0.57 -2.30 0.00 0.00 -0.65 0.00 0.00 35.03 32.65 1e0g n LYS 9 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1e0g n GLY 10 N 1.43 2.18 3.79 2.58 0.00 -1.26 -5.02 105.19 108.89 1e0g n GLY 10 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.33 7.26 -0.06 1.61 1.11 0.66 -5.05 116.67 119.86 1e0g s ASP 11 Ca 0.00 1.80 0.05 0.00 0.18 0.00 0.00 52.55 54.58 1e0g s ASP 11 Cb 0.00 -2.57 -0.02 0.00 1.07 0.00 0.00 42.92 41.41 1e0g s ASP 11 CO 0.00 -0.12 -0.21 -0.55 1.18 0.00 0.00 175.17 175.47 1e0g s SER 12 N -1.73 3.41 0.14 0.27 0.15 -1.26 -4.86 113.70 109.81 1e0g s SER 12 Ca 0.52 -0.41 -0.27 0.00 0.70 0.00 0.00 55.95 56.49 1e0g s SER 12 Cb -0.17 -0.90 -0.03 0.00 -1.71 0.00 0.00 66.02 63.22 1e0g s SER 12 CO 0.22 0.26 1.59 -0.07 1.20 0.00 0.00 173.24 176.44 1e0g h LEU 13 N 5.93 -1.20 -0.56 3.45 -0.00 -1.99 0.52 115.31 121.47 1e0g h LEU 13 Ca -0.35 0.17 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 1e0g h LEU 13 Cb 1.17 0.50 -0.03 0.00 -0.00 0.00 0.00 40.66 42.30 1e0g h LEU 13 CO 0.49 -0.39 0.35 0.77 -0.00 0.00 0.00 178.44 179.65 1e0g h SER 14 N -0.44 0.66 -0.68 -0.43 4.64 -1.96 -1.56 113.55 113.78 1e0g h SER 14 Ca 0.09 -0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.41 1e0g h SER 14 Cb 0.59 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 62.47 1e0g h SER 14 CO -0.40 0.51 0.41 0.28 -0.87 0.00 0.00 176.83 176.76 1e0g h SER 15 N 0.76 0.64 -0.51 4.97 0.02 -1.63 -1.06 113.55 116.74 1e0g h SER 15 Ca 0.20 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1e0g h SER 15 Cb -0.04 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1e0g h SER 15 CO -0.04 0.43 0.34 0.40 -1.14 0.00 0.00 176.83 176.82 1e0g h ILE 16 N 0.78 1.13 -0.60 3.27 2.04 0.45 -1.63 117.51 122.95 1e0g h ILE 16 Ca 0.29 -0.24 0.11 0.00 1.00 0.00 0.00 64.86 66.02 1e0g h ILE 16 Cb 0.10 0.38 -0.08 0.00 -0.74 0.00 0.00 36.82 36.47 1e0g h ILE 16 CO -0.14 0.13 0.15 0.00 0.00 0.00 0.00 178.15 178.29 1e0g h ALA 17 N 1.19 0.72 -0.99 1.87 0.00 -0.23 0.85 119.26 122.67 1e0g h ALA 17 Ca 0.19 0.12 0.22 0.00 0.00 0.00 0.00 54.91 55.43 1e0g h ALA 17 Cb -0.08 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 17.76 1e0g h ALA 17 CO -0.04 -0.28 0.62 -0.22 0.00 0.00 0.00 179.25 179.33 1e0g h LYS 18 N 0.29 0.57 -0.41 0.00 3.64 -0.35 0.55 116.57 120.85 1e0g h LYS 18 Ca 0.31 -0.03 0.11 0.00 -1.27 0.00 0.00 60.65 59.77 1e0g h LYS 18 Cb 0.45 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1e0g h LYS 18 CO -0.38 0.37 0.29 0.00 -2.27 0.00 0.00 179.45 177.47 1e0g h ARG 19 N 0.58 0.07 -0.08 1.90 3.08 -0.63 -1.46 114.38 117.83 1e0g h ARG 19 Ca 0.57 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.62 1e0g h ARG 19 Cb 1.14 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1e0g h ARG 19 CO -0.33 0.04 0.00 0.72 -1.07 0.00 0.00 179.97 179.33 1e0g n HIS 20 N -4.43 0.16 -3.80 3.04 -0.00 0.14 -4.98 115.22 105.34 1e0g n HIS 20 Ca 0.07 -0.64 -0.26 0.00 -0.00 0.00 0.00 57.72 56.88 1e0g n HIS 20 Cb 0.44 -0.09 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 -0.53 -0.50 3.68 -1.41 0.00 0.14 -4.95 105.19 101.63 1e0g n GLY 21 Ca 0.07 0.25 -0.30 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.73 1.70 -0.59 1.61 -7.23 -0.69 -4.79 120.40 106.68 1e0g s VAL 22 Ca 0.16 -1.98 -0.10 0.00 -1.81 0.00 0.00 61.98 58.26 1e0g s VAL 22 Cb -0.06 -2.68 0.15 0.00 0.56 0.00 0.00 36.38 34.36 1e0g s VAL 22 CO 0.86 0.00 0.48 0.20 -0.31 0.00 0.00 175.10 176.33 1e0g s ASN 23 N -3.79 5.89 0.61 4.85 0.01 -1.26 -4.58 114.94 116.67 1e0g s ASN 23 Ca 0.25 -2.28 0.28 0.00 -0.71 0.00 0.00 52.86 50.40 1e0g s ASN 23 Cb 0.06 -2.04 1.49 0.00 0.41 0.00 0.00 41.25 41.17 1e0g s ASN 23 CO 0.13 -0.61 1.88 0.40 -1.51 0.00 0.00 177.10 177.39 1e0g h ILE 24 N 5.62 0.26 -0.81 0.60 1.08 -1.91 0.96 117.51 123.31 1e0g h ILE 24 Ca -0.11 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.33 1e0g h ILE 24 Cb 1.04 0.62 -0.04 0.00 -3.07 0.00 0.00 36.82 35.37 1e0g h ILE 24 CO 0.82 0.00 0.37 0.07 -0.69 0.00 0.00 178.15 178.72 1e0g h LYS 25 N 0.00 1.18 -0.86 2.37 2.10 -1.98 0.23 116.57 119.61 1e0g h LYS 25 Ca 0.15 -0.19 -0.03 0.00 -2.00 0.00 0.00 60.65 58.59 1e0g h LYS 25 Cb 1.06 -0.21 -0.04 0.00 -0.90 0.00 0.00 32.23 32.14 1e0g h LYS 25 CO -0.00 0.92 0.43 -0.44 -2.00 0.00 0.00 179.45 178.36 1e0g h ASP 26 N 1.16 1.11 -0.67 7.07 3.32 0.54 0.53 116.42 129.48 1e0g h ASP 26 Ca 0.28 -0.13 0.05 0.00 0.02 0.00 0.00 57.03 57.26 1e0g h ASP 26 Cb 0.15 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.36 1e0g h ASP 26 CO -0.03 0.92 0.38 0.58 -1.72 0.00 0.00 179.24 179.37 1e0g h VAL 27 N 1.22 0.99 0.00 -1.35 2.07 -0.48 0.62 116.25 119.32 1e0g h VAL 27 Ca 0.30 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.58 1e0g h VAL 27 Cb 0.10 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1e0g h VAL 27 CO -0.04 0.13 0.00 0.23 0.02 0.00 0.00 177.57 177.91 1e0g n MET 28 N -4.77 0.18 0.00 1.57 2.81 0.61 -1.57 117.12 115.95 1e0g n MET 28 Ca 0.08 0.33 -0.18 0.00 -1.81 0.00 0.00 57.70 56.12 1e0g n MET 28 Cb 0.16 -1.80 -0.10 0.00 -0.71 0.00 0.00 33.22 30.77 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 0.50 0.18 0.03 2.43 0.52 -3.33 114.38 114.72 1e0g h ARG 29 Ca 0.00 -0.49 -0.32 0.00 -0.81 0.00 0.00 59.98 58.35 1e0g h ARG 29 Cb 0.46 0.13 0.02 0.00 -0.42 0.00 0.00 29.97 30.15 1e0g h ARG 29 CO 0.00 1.13 -1.52 -1.49 -1.51 0.00 0.00 179.97 176.58 1e0g h TRP 30 N 0.06 0.71 -2.94 2.20 6.55 -1.10 -3.44 115.95 117.98 1e0g h TRP 30 Ca -0.07 -0.52 -0.64 0.00 0.95 0.00 0.00 58.89 58.61 1e0g h TRP 30 Cb 1.34 -0.03 -0.09 0.00 -0.86 0.00 0.00 29.16 29.51 1e0g h TRP 30 CO 0.13 1.50 -0.48 -0.80 -1.05 0.00 0.00 178.44 177.74 1e0g s ASN 31 N -7.30 6.31 0.00 -3.49 0.01 -0.61 -5.03 114.94 104.84 1e0g s ASN 31 Ca -0.10 0.36 0.00 0.00 -0.71 0.00 0.00 52.86 52.42 1e0g s ASN 31 Cb 0.06 -2.08 0.00 0.00 0.41 0.00 0.00 41.25 39.63 1e0g s ASN 31 CO 0.89 0.30 0.00 -1.20 -1.51 0.00 0.00 177.10 175.58 1e0g n SER 32 N 2.71 0.00 -4.57 -1.22 7.64 -1.26 -4.42 113.62 112.51 1e0g n SER 32 Ca -0.18 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.29 1e0g n SER 32 Cb 0.54 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.71 1e0g n SER 32 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1e0g s ASP 33 N -1.00 5.97 -0.18 6.43 -1.08 -1.26 -4.86 116.67 120.69 1e0g s ASP 33 Ca 0.00 0.30 -0.04 0.00 -0.52 0.00 0.00 52.55 52.29 1e0g s ASP 33 Cb 0.00 -2.54 -0.10 0.00 -1.46 0.00 0.00 42.92 38.82 1e0g s ASP 33 CO 0.00 -1.83 3.08 0.35 0.52 0.00 0.00 175.17 177.28 1e0g n THR 34 N 6.91 3.01 0.38 1.71 -2.24 -1.26 -4.45 114.28 118.33 1e0g n THR 34 Ca 0.14 -1.94 0.07 0.00 -2.27 0.00 0.00 64.05 60.05 1e0g n THR 34 Cb 0.49 -1.77 0.30 0.00 -2.10 0.00 0.00 70.33 67.26 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 1.70 1.52 1.76 6.98 0.00 -1.26 -1.56 120.51 129.64 1e0g n ALA 35 Ca 0.40 -0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.95 1e0g n ALA 35 Cb 0.73 -1.22 0.59 0.00 0.00 0.00 0.00 19.45 19.55 1e0g n ALA 35 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1e0g n ASN 36 N -1.67 0.55 -3.79 0.00 3.02 -1.26 -4.35 115.26 107.76 1e0g n ASN 36 Ca 0.02 -1.41 -0.42 0.00 -0.03 0.00 0.00 54.58 52.74 1e0g n ASN 36 Cb 0.14 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1e0g n ASN 36 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1e0g n LEU 37 N -0.47 6.94 -4.80 3.41 4.32 -0.60 -4.43 117.00 121.38 1e0g n LEU 37 Ca 0.17 -4.72 -0.22 0.00 -0.02 0.00 0.00 56.01 51.22 1e0g n LEU 37 Cb 0.17 -1.45 -0.05 0.00 -1.62 0.00 0.00 43.42 40.47 1e0g n LEU 37 CO 0.13 1.53 -0.14 -1.10 -1.22 0.00 0.00 177.39 176.60 1e0g s GLN 38 N -0.04 2.58 -0.98 3.23 -0.21 -1.26 -4.99 119.66 117.98 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 -0.07 0.00 1.00 0.00 0.00 33.01 31.70 1e0g s GLN 38 CO -0.01 0.12 1.98 -1.25 -2.12 0.00 0.00 175.29 174.00 1e0g s PRO 39 N -3.92 2.44 0.00 2.91 0.04 -1.22 -1.42 135.00 133.82 1e0g s PRO 39 Ca 0.39 -0.51 0.00 0.00 0.04 0.00 0.00 61.00 60.92 1e0g s PRO 39 Cb -0.04 -5.10 0.00 0.00 0.04 0.00 0.00 34.50 29.40 1e0g s PRO 39 CO 0.25 -3.69 0.00 0.41 0.04 0.00 0.00 177.00 174.01 1e0g n GLY 40 N 6.52 1.04 3.53 0.56 0.00 0.21 -4.76 105.19 112.29 1e0g n GLY 40 Ca 0.42 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.34 4.11 0.55 1.61 1.11 -0.51 -4.86 116.67 117.34 1e0g s ASP 41 Ca 0.00 -0.48 -0.08 0.00 0.18 0.00 0.00 52.55 52.17 1e0g s ASP 41 Cb 0.00 -0.68 -0.04 0.00 1.07 0.00 0.00 42.92 43.28 1e0g s ASP 41 CO 0.00 0.18 0.91 -1.59 1.18 0.00 0.00 175.17 175.85 1e0g s LYS 42 N -2.17 3.58 -0.01 8.23 -2.85 -1.26 0.05 119.74 125.31 1e0g s LYS 42 Ca 0.19 0.48 0.01 0.00 -1.00 0.00 0.00 55.97 55.66 1e0g s LYS 42 Cb -0.11 -2.23 0.01 0.00 -2.06 0.00 0.00 37.83 33.44 1e0g s LYS 42 CO 0.12 -0.39 -0.03 -1.17 0.10 0.00 0.00 175.35 173.98 1e0g s LEU 43 N -4.94 1.76 -0.14 2.77 0.20 0.20 -4.77 118.68 113.74 1e0g s LEU 43 Ca 0.51 -0.06 -0.29 0.00 0.69 0.00 0.00 54.13 54.98 1e0g s LEU 43 Cb -0.11 -0.21 -0.03 0.00 -0.43 0.00 0.00 46.19 45.41 1e0g s LEU 43 CO 0.49 0.00 1.44 -0.89 -0.29 0.00 0.00 176.35 177.10 1e0g s THR 44 N 0.25 3.97 -0.71 3.68 2.01 -1.26 -1.43 115.64 122.15 1e0g s THR 44 Ca -0.02 1.16 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 1.44 0.18 -0.69 0.00 0.00 174.62 175.40 1e0g n LEU 45 N 7.06 5.92 0.19 4.42 4.77 0.11 -4.74 117.00 134.72 1e0g n LEU 45 Ca 0.16 -5.31 0.18 0.00 -0.03 0.00 0.00 56.01 51.01 1e0g n LEU 45 Cb 0.44 -0.79 0.76 0.00 -2.33 0.00 0.00 43.42 41.50 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 -1.22 -1.77 0.04 -1.91 -3.33 116.94 111.93 1e0g h PHE 46 Ca 0.37 0.00 -0.62 0.00 2.80 0.00 0.00 57.97 60.52 1e0g h PHE 46 Cb 0.46 0.00 0.12 0.00 2.20 0.00 0.00 35.95 38.73 1e0g h PHE 46 CO 1.03 0.00 -0.67 1.33 -0.60 0.00 0.00 178.31 179.40 1e0g n VAL 47 N -3.37 1.35 0.33 -0.55 0.24 -1.26 -4.89 118.33 110.17 1e0g n VAL 47 Ca 0.04 -0.47 0.04 0.00 -2.04 0.00 0.00 64.34 61.90 1e0g n VAL 47 Cb 0.53 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.94 1e0g n VAL 47 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98