#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 0.01 0.00 -2.24 1.04 -1.26 -4.99 113.70 106.26 1e0g s SER 2 Ca 0.00 -0.01 -0.17 0.00 0.48 0.00 0.00 55.95 56.24 1e0g s SER 2 Cb 0.00 0.00 -0.06 0.00 0.10 0.00 0.00 66.02 66.07 1e0g s SER 2 CO 0.00 -0.01 0.48 -0.63 0.98 0.00 0.00 173.24 174.07 1e0g s ILE 3 N -0.04 4.96 -0.17 -1.02 1.01 -1.26 -4.95 121.20 119.73 1e0g s ILE 3 Ca -0.00 1.01 -0.01 0.00 0.00 0.00 0.00 60.65 61.64 1e0g s ILE 3 Cb -0.00 -3.80 0.04 0.00 0.01 0.00 0.00 42.46 38.71 1e0g s ILE 3 CO -0.00 0.52 -0.04 -0.89 0.00 0.00 0.00 174.94 174.53 1e0g s THR 4 N -0.74 1.07 -0.04 2.92 2.01 -1.26 0.13 115.64 119.74 1e0g s THR 4 Ca 0.26 -0.66 0.06 0.00 0.31 0.00 0.00 61.69 61.66 1e0g s THR 4 Cb -0.17 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.03 1e0g s THR 4 CO 0.15 0.07 -0.22 -0.72 -0.69 0.00 0.00 174.62 173.21 1e0g s TYR 5 N 1.64 2.47 -0.16 4.92 -0.85 -0.44 -4.79 117.35 120.15 1e0g s TYR 5 Ca -0.00 -0.44 -0.21 0.00 -0.52 0.00 0.00 57.07 55.89 1e0g s TYR 5 Cb -0.16 -1.57 -0.03 0.00 0.38 0.00 0.00 41.96 40.58 1e0g s TYR 5 CO -0.07 -0.03 0.63 -0.98 -1.52 0.00 0.00 175.55 173.57 1e0g s ARG 6 N -0.49 4.28 -0.44 -3.49 1.70 -1.26 0.66 118.95 119.91 1e0g s ARG 6 Ca 0.06 0.67 -0.28 0.00 -0.47 0.00 0.00 55.73 55.70 1e0g s ARG 6 Cb -0.11 -3.53 0.03 0.00 -0.57 0.00 0.00 34.95 30.76 1e0g s ARG 6 CO 0.01 -0.12 1.09 0.08 -1.08 0.00 0.00 175.30 175.28 1e0g s VAL 7 N 1.50 4.31 0.27 4.99 1.01 0.68 -4.87 120.40 128.29 1e0g s VAL 7 Ca 0.31 1.27 0.04 0.00 0.00 0.00 0.00 61.98 63.60 1e0g s VAL 7 Cb -0.16 -4.54 -0.03 0.00 0.00 0.00 0.00 36.38 31.65 1e0g s VAL 7 CO 0.12 -0.87 0.41 -0.13 0.00 0.00 0.00 175.10 174.62 1e0g s ARG 8 N 4.19 3.42 0.31 2.72 0.52 -1.26 0.68 118.95 129.52 1e0g s ARG 8 Ca 0.46 -0.70 -0.29 0.00 -0.52 0.00 0.00 55.73 54.68 1e0g s ARG 8 Cb -0.09 -2.84 -0.13 0.00 0.52 0.00 0.00 34.95 32.42 1e0g s ARG 8 CO 0.27 0.35 1.29 0.36 0.02 0.00 0.00 175.30 177.59 1e0g n LYS 9 N -1.50 2.01 0.00 3.54 -0.00 -1.26 -0.30 118.16 120.65 1e0g n LYS 9 Ca -0.08 0.71 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1e0g n LYS 9 Cb 0.57 -2.28 0.00 0.00 -0.00 0.00 0.00 35.03 33.32 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 1.18 2.18 3.80 2.58 0.00 -1.26 -5.02 105.19 108.65 1e0g n GLY 10 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.80 7.19 -0.05 1.61 1.11 0.58 -5.06 116.67 119.26 1e0g s ASP 11 Ca 0.00 1.72 0.06 0.00 0.18 0.00 0.00 52.55 54.51 1e0g s ASP 11 Cb 0.00 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.43 1e0g s ASP 11 CO 0.00 -0.13 -0.23 -0.44 1.18 0.00 0.00 175.17 175.56 1e0g s SER 12 N -1.78 3.30 0.13 0.27 0.01 -1.26 -4.86 113.70 109.51 1e0g s SER 12 Ca 0.52 -0.43 -0.29 0.00 1.31 0.00 0.00 55.95 57.06 1e0g s SER 12 Cb -0.16 -0.75 -0.05 0.00 0.21 0.00 0.00 66.02 65.27 1e0g s SER 12 CO 0.21 0.28 1.59 -0.07 0.41 0.00 0.00 173.24 175.65 1e0g h LEU 13 N 5.81 -1.28 -0.61 2.44 -0.00 -1.99 0.48 115.31 120.16 1e0g h LEU 13 Ca -0.37 0.17 0.00 0.00 -0.00 0.00 0.00 57.88 57.68 1e0g h LEU 13 Cb 1.16 0.52 -0.03 0.00 -0.00 0.00 0.00 40.66 42.31 1e0g h LEU 13 CO 0.48 -0.42 0.38 0.28 -0.00 0.00 0.00 178.44 179.16 1e0g h SER 14 N -0.49 0.72 -0.57 -0.43 0.02 -1.96 -1.66 113.55 109.17 1e0g h SER 14 Ca 0.07 -0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1e0g h SER 14 Cb 0.62 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 1e0g h SER 14 CO -0.39 0.55 0.31 0.28 -1.14 0.00 0.00 176.83 176.44 1e0g h SER 15 N 0.82 0.48 -0.37 3.07 0.02 -1.65 -1.32 113.55 114.60 1e0g h SER 15 Ca 0.22 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 1e0g h SER 15 Cb -0.05 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 1e0g h SER 15 CO -0.04 0.32 0.20 0.40 -1.14 0.00 0.00 176.83 176.57 1e0g h ILE 16 N 0.61 1.02 -0.68 3.27 5.03 0.33 -1.40 117.51 125.68 1e0g h ILE 16 Ca 0.25 -0.14 0.13 0.00 -0.12 0.00 0.00 64.86 64.97 1e0g h ILE 16 Cb 0.11 0.57 -0.09 0.00 -3.03 0.00 0.00 36.82 34.37 1e0g h ILE 16 CO -0.15 0.08 0.19 0.00 -0.68 0.00 0.00 178.15 177.59 1e0g h ALA 17 N 1.17 0.87 -1.01 1.87 0.00 -0.34 0.66 119.26 122.49 1e0g h ALA 17 Ca 0.15 0.13 0.22 0.00 0.00 0.00 0.00 54.91 55.42 1e0g h ALA 17 Cb 0.03 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 17.87 1e0g h ALA 17 CO -0.08 -0.28 0.62 -0.22 0.00 0.00 0.00 179.25 179.28 1e0g h LYS 18 N 0.32 0.60 -0.33 0.00 3.11 -0.28 0.57 116.57 120.56 1e0g h LYS 18 Ca 0.37 -0.04 0.10 0.00 -2.81 0.00 0.00 60.65 58.27 1e0g h LYS 18 Cb 0.56 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 1e0g h LYS 18 CO -0.43 0.40 0.24 0.00 -2.81 0.00 0.00 179.45 176.85 1e0g h ARG 19 N 0.62 0.00 -0.13 1.90 3.08 -0.72 -1.38 114.38 117.75 1e0g h ARG 19 Ca 0.60 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.65 1e0g h ARG 19 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1e0g h ARG 19 CO -0.39 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.23 1e0g n HIS 20 N -4.44 0.22 -3.80 3.04 -0.00 0.15 -4.98 115.22 105.41 1e0g n HIS 20 Ca 0.05 -0.60 -0.27 0.00 -0.00 0.00 0.00 57.72 56.90 1e0g n HIS 20 Cb 0.41 -0.08 0.01 0.00 -0.00 0.00 0.00 29.99 30.34 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 -0.32 -0.52 3.69 -1.41 0.00 0.14 -4.88 105.19 101.88 1e0g n GLY 21 Ca 0.07 0.26 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 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 1.73 -0.62 1.61 -7.23 -0.73 -4.91 120.40 106.53 1e0g s VAL 22 Ca 0.18 -1.95 -0.10 0.00 -1.81 0.00 0.00 61.98 58.29 1e0g s VAL 22 Cb -0.06 -2.69 0.16 0.00 0.56 0.00 0.00 36.38 34.35 1e0g s VAL 22 CO 0.86 0.00 0.51 0.20 -0.31 0.00 0.00 175.10 176.36 1e0g s ASN 23 N -3.80 5.97 0.62 4.85 0.01 -1.26 -4.60 114.94 116.71 1e0g s ASN 23 Ca 0.26 -2.34 0.29 0.00 -0.71 0.00 0.00 52.86 50.35 1e0g s ASN 23 Cb 0.06 -2.06 1.50 0.00 0.41 0.00 0.00 41.25 41.16 1e0g s ASN 23 CO 0.13 -0.61 1.89 0.40 -1.51 0.00 0.00 177.10 177.41 1e0g h ILE 24 N 5.52 0.24 -0.84 0.60 1.08 -1.91 1.03 117.51 123.23 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 0.63 -0.04 0.00 -3.07 0.00 0.00 36.82 35.38 1e0g h ILE 24 CO 0.82 0.00 0.38 0.07 -0.69 0.00 0.00 178.15 178.73 1e0g h LYS 25 N 0.00 1.22 -0.83 2.37 2.10 -1.98 0.26 116.57 119.73 1e0g h LYS 25 Ca 0.14 -0.19 -0.04 0.00 -2.00 0.00 0.00 60.65 58.56 1e0g h LYS 25 Cb 1.01 -0.21 -0.04 0.00 -0.90 0.00 0.00 32.23 32.09 1e0g h LYS 25 CO -0.00 0.95 0.37 -0.44 -2.00 0.00 0.00 179.45 178.33 1e0g h ASP 26 N 1.21 1.11 -0.70 7.07 3.32 0.69 0.55 116.42 129.66 1e0g h ASP 26 Ca 0.29 -0.15 0.05 0.00 0.02 0.00 0.00 57.03 57.24 1e0g h ASP 26 Cb 0.15 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 39.36 1e0g h ASP 26 CO -0.03 0.95 0.40 0.58 -1.72 0.00 0.00 179.24 179.42 1e0g h VAL 27 N 1.19 1.00 0.00 -1.35 2.07 -0.47 0.65 116.25 119.34 1e0g h VAL 27 Ca 0.28 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1e0g h VAL 27 Cb 0.16 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1e0g h VAL 27 CO -0.03 0.14 0.00 0.23 0.02 0.00 0.00 177.57 177.93 1e0g n MET 28 N -4.75 0.18 -0.01 1.57 2.81 0.75 -1.53 117.12 116.14 1e0g n MET 28 Ca 0.09 0.32 -0.17 0.00 -1.81 0.00 0.00 57.70 56.13 1e0g n MET 28 Cb 0.16 -1.79 -0.09 0.00 -0.71 0.00 0.00 33.22 30.79 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 0.52 0.18 0.03 2.43 0.54 -3.32 114.38 114.77 1e0g h ARG 29 Ca 0.00 -0.48 -0.32 0.00 -0.81 0.00 0.00 59.98 58.37 1e0g h ARG 29 Cb 0.47 0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1e0g h ARG 29 CO 0.00 1.11 -1.52 -1.49 -1.51 0.00 0.00 179.97 176.56 1e0g h TRP 30 N 0.11 0.70 -3.08 2.20 6.55 -1.09 -3.44 115.95 117.90 1e0g h TRP 30 Ca -0.06 -0.51 -0.64 0.00 0.95 0.00 0.00 58.89 58.64 1e0g h TRP 30 Cb 1.27 -0.03 -0.12 0.00 -0.86 0.00 0.00 29.16 29.42 1e0g h TRP 30 CO 0.12 1.50 -0.53 -0.80 -1.05 0.00 0.00 178.44 177.68 1e0g s ASN 31 N -7.28 5.97 0.00 -3.49 0.01 -0.58 -5.03 114.94 104.53 1e0g s ASN 31 Ca -0.10 0.25 0.00 0.00 -0.71 0.00 0.00 52.86 52.30 1e0g s ASN 31 Cb 0.06 -1.97 0.00 0.00 0.41 0.00 0.00 41.25 39.75 1e0g s ASN 31 CO 0.89 0.28 0.00 -1.20 -1.51 0.00 0.00 177.10 175.56 1e0g n SER 32 N 2.85 0.00 -4.56 -1.22 7.64 -1.26 -4.37 113.62 112.70 1e0g n SER 32 Ca -0.18 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.31 1e0g n SER 32 Cb 0.53 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.70 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 5.54 -0.17 6.43 -1.08 -1.26 -4.84 116.67 120.29 1e0g s ASP 33 Ca 0.00 0.27 -0.04 0.00 -0.52 0.00 0.00 52.55 52.26 1e0g s ASP 33 Cb 0.00 -2.54 -0.08 0.00 -1.46 0.00 0.00 42.92 38.84 1e0g s ASP 33 CO 0.00 -2.18 2.98 0.35 0.52 0.00 0.00 175.17 176.84 1e0g n THR 34 N 7.06 2.94 0.40 1.71 -2.24 -1.26 -4.44 114.28 118.45 1e0g n THR 34 Ca 0.17 -1.84 0.06 0.00 -2.27 0.00 0.00 64.05 60.17 1e0g n THR 34 Cb 0.51 -1.74 0.26 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 1.64 1.54 1.73 6.98 0.00 -1.26 -1.57 120.51 129.56 1e0g n ALA 35 Ca 0.38 -0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.89 1e0g n ALA 35 Cb 0.71 -1.20 0.55 0.00 0.00 0.00 0.00 19.45 19.52 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 -1.53 0.63 -3.72 0.00 5.15 -1.26 -4.35 115.26 110.17 1e0g n ASN 36 Ca 0.03 -1.46 -0.42 0.00 -0.60 0.00 0.00 54.58 52.14 1e0g n ASN 36 Cb 0.14 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.36 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 -0.40 7.16 -4.79 1.20 4.32 -0.61 -4.42 117.00 119.45 1e0g n LEU 37 Ca 0.16 -4.70 -0.22 0.00 -0.02 0.00 0.00 56.01 51.24 1e0g n LEU 37 Cb 0.17 -1.45 -0.05 0.00 -1.62 0.00 0.00 43.42 40.48 1e0g n LEU 37 CO 0.13 1.60 -0.15 -1.10 -1.22 0.00 0.00 177.39 176.65 1e0g s GLN 38 N 0.05 2.60 -1.03 3.23 -1.52 -1.26 -4.99 119.66 116.73 1e0g s GLN 38 Ca 0.45 -1.36 -0.24 0.00 -1.95 0.00 0.00 55.36 52.27 1e0g s GLN 38 Cb 0.13 -2.37 -0.08 0.00 -0.22 0.00 0.00 33.01 30.48 1e0g s GLN 38 CO -0.03 0.16 1.96 -1.25 -0.25 0.00 0.00 175.29 175.88 1e0g s PRO 39 N -3.90 2.44 0.00 2.91 0.04 -1.22 -1.50 135.00 133.77 1e0g s PRO 39 Ca 0.38 -0.66 0.00 0.00 0.04 0.00 0.00 61.00 60.76 1e0g s PRO 39 Cb -0.05 -5.13 0.00 0.00 0.04 0.00 0.00 34.50 29.36 1e0g s PRO 39 CO 0.25 -3.77 0.00 0.41 0.04 0.00 0.00 177.00 173.92 1e0g n GLY 40 N 6.35 0.62 3.60 0.56 0.00 0.21 -4.73 105.19 111.81 1e0g n GLY 40 Ca 0.43 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.07 4.47 0.55 1.61 1.01 -0.56 -4.87 116.67 117.81 1e0g s ASP 41 Ca 0.00 -0.46 -0.09 0.00 0.71 0.00 0.00 52.55 52.71 1e0g s ASP 41 Cb 0.00 -0.85 -0.04 0.00 1.01 0.00 0.00 42.92 43.03 1e0g s ASP 41 CO 0.00 0.12 0.91 -0.54 0.21 0.00 0.00 175.17 175.87 1e0g s LYS 42 N -2.71 3.60 -0.01 8.23 1.02 -1.26 -0.23 119.74 128.38 1e0g s LYS 42 Ca 0.25 0.50 -0.00 0.00 0.02 0.00 0.00 55.97 56.74 1e0g s LYS 42 Cb -0.10 -2.23 0.01 0.00 -0.52 0.00 0.00 37.83 35.00 1e0g s LYS 42 CO 0.16 -0.38 0.03 -0.51 -0.92 0.00 0.00 175.35 173.73 1e0g s LEU 43 N -4.89 1.56 -0.01 3.17 1.43 0.21 -4.78 118.68 115.37 1e0g s LEU 43 Ca 0.52 0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 53.36 1e0g s LEU 43 Cb -0.11 0.03 -0.05 0.00 0.03 0.00 0.00 46.19 46.09 1e0g s LEU 43 CO 0.48 -0.06 1.30 -0.89 0.23 0.00 0.00 176.35 177.42 1e0g s THR 44 N 0.46 3.93 -0.57 5.49 2.01 -1.26 -1.33 115.64 124.37 1e0g s THR 44 Ca -0.04 1.31 0.04 0.00 0.31 0.00 0.00 61.69 63.31 1e0g s THR 44 Cb -0.05 -3.84 0.38 0.00 0.01 0.00 0.00 72.50 68.99 1e0g s THR 44 CO -0.01 0.01 1.19 0.18 -0.69 0.00 0.00 174.62 175.29 1e0g n LEU 45 N 5.12 5.08 0.30 4.42 4.77 0.12 -4.77 117.00 132.04 1e0g n LEU 45 Ca 0.12 -5.38 0.18 0.00 -0.03 0.00 0.00 56.01 50.90 1e0g n LEU 45 Cb 0.45 -0.61 0.91 0.00 -2.33 0.00 0.00 43.42 41.84 1e0g n LEU 45 CO 0.57 2.23 1.15 -0.26 -1.33 0.00 0.00 177.39 179.75 1e0g h PHE 46 N 2.89 0.00 -0.84 -1.77 0.04 -1.92 -2.44 116.94 112.90 1e0g h PHE 46 Ca 0.28 0.00 0.33 0.00 2.80 0.00 0.00 57.97 61.38 1e0g h PHE 46 Cb 0.63 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.63 1e0g h PHE 46 CO 0.90 0.00 0.36 1.33 -0.60 0.00 0.00 178.31 180.30 1e0g n VAL 47 N -3.12 -0.35 0.06 -0.55 0.24 -1.26 -4.94 118.33 108.41 1e0g n VAL 47 Ca -0.01 1.74 0.01 0.00 -2.04 0.00 0.00 64.34 64.04 1e0g n VAL 47 Cb 0.32 -2.77 0.01 0.00 -1.47 0.00 0.00 33.84 29.93 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86