#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 4.28 -0.13 -1.12 1.04 -1.26 -4.96 113.70 111.55 1e0g s SER 2 Ca 0.00 -0.13 -0.18 0.00 0.48 0.00 0.00 55.95 56.12 1e0g s SER 2 Cb 0.00 -1.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.06 1e0g s SER 2 CO 0.00 0.34 0.47 -0.63 0.98 0.00 0.00 173.24 174.40 1e0g s ILE 3 N -0.70 5.19 -0.23 -1.02 1.01 -1.26 -4.95 121.20 119.24 1e0g s ILE 3 Ca 0.11 0.94 0.02 0.00 0.00 0.00 0.00 60.65 61.71 1e0g s ILE 3 Cb -0.11 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.59 1e0g s ILE 3 CO 0.01 0.32 -0.14 -0.89 0.00 0.00 0.00 174.94 174.23 1e0g s THR 4 N 0.70 2.15 -0.04 2.92 2.01 -1.26 0.29 115.64 122.41 1e0g s THR 4 Ca 0.25 -1.33 0.06 0.00 0.31 0.00 0.00 61.69 60.98 1e0g s THR 4 Cb -0.15 -2.12 -0.02 0.00 0.01 0.00 0.00 72.50 70.22 1e0g s THR 4 CO 0.10 0.21 -0.21 -0.72 -0.69 0.00 0.00 174.62 173.31 1e0g s TYR 5 N 1.19 2.49 -0.23 4.92 -0.85 -0.48 -4.79 117.35 119.60 1e0g s TYR 5 Ca -0.03 -0.40 -0.20 0.00 -0.52 0.00 0.00 57.07 55.93 1e0g s TYR 5 Cb -0.17 -1.58 -0.03 0.00 0.38 0.00 0.00 41.96 40.57 1e0g s TYR 5 CO -0.08 0.00 0.58 1.03 -1.52 0.00 0.00 175.55 175.56 1e0g s ARG 6 N -0.54 4.15 -0.42 -3.49 0.52 -1.26 0.48 118.95 118.40 1e0g s ARG 6 Ca 0.07 0.49 -0.29 0.00 -0.52 0.00 0.00 55.73 55.49 1e0g s ARG 6 Cb -0.11 -3.61 0.02 0.00 0.52 0.00 0.00 34.95 31.77 1e0g s ARG 6 CO 0.01 -0.30 1.27 0.08 0.02 0.00 0.00 175.30 176.38 1e0g s VAL 7 N 2.12 4.08 0.26 3.52 1.01 0.22 -4.83 120.40 126.78 1e0g s VAL 7 Ca 0.25 1.12 0.05 0.00 0.00 0.00 0.00 61.98 63.40 1e0g s VAL 7 Cb -0.16 -4.38 -0.03 0.00 0.00 0.00 0.00 36.38 31.82 1e0g s VAL 7 CO 0.09 -0.82 0.39 -0.13 0.00 0.00 0.00 175.10 174.63 1e0g s ARG 8 N 4.60 3.41 0.29 2.72 0.52 -1.26 0.66 118.95 129.89 1e0g s ARG 8 Ca 0.54 -0.73 -0.29 0.00 -0.52 0.00 0.00 55.73 54.73 1e0g s ARG 8 Cb -0.11 -2.86 -0.13 0.00 0.52 0.00 0.00 34.95 32.37 1e0g s ARG 8 CO 0.30 0.36 1.30 0.36 0.02 0.00 0.00 175.30 177.65 1e0g n LYS 9 N -1.47 1.98 0.00 3.54 2.85 -1.26 -0.13 118.16 123.67 1e0g n LYS 9 Ca -0.08 0.70 0.00 0.00 -1.05 0.00 0.00 58.31 57.88 1e0g n LYS 9 Cb 0.57 -2.28 0.00 0.00 -0.65 0.00 0.00 35.03 32.67 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 1.41 2.22 3.76 2.58 0.00 -1.26 -5.02 105.19 108.89 1e0g n GLY 10 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.34 7.14 0.01 1.61 1.11 0.82 -5.06 116.67 119.96 1e0g s ASP 11 Ca 0.00 1.35 0.03 0.00 0.18 0.00 0.00 52.55 54.12 1e0g s ASP 11 Cb 0.00 -2.43 -0.03 0.00 1.07 0.00 0.00 42.92 41.53 1e0g s ASP 11 CO 0.00 0.09 -0.06 -0.55 1.18 0.00 0.00 175.17 175.83 1e0g s SER 12 N -0.32 4.67 0.12 0.27 0.15 -1.26 -4.78 113.70 112.55 1e0g s SER 12 Ca 0.35 -0.14 -0.30 0.00 0.70 0.00 0.00 55.95 56.55 1e0g s SER 12 Cb -0.20 -1.09 -0.08 0.00 -1.71 0.00 0.00 66.02 62.93 1e0g s SER 12 CO 0.21 0.28 1.58 -0.07 1.20 0.00 0.00 173.24 176.44 1e0g h LEU 13 N 4.45 -1.29 -0.67 3.45 -0.00 -1.99 0.51 115.31 119.76 1e0g h LEU 13 Ca -0.48 0.16 -0.02 0.00 -0.00 0.00 0.00 57.88 57.53 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 0.54 -0.46 0.34 0.77 -0.00 0.00 0.00 178.44 179.63 1e0g h SER 14 N -0.58 0.85 -0.64 -0.43 4.64 -1.96 -1.66 113.55 113.78 1e0g h SER 14 Ca 0.05 -0.12 0.03 0.00 -0.47 0.00 0.00 61.79 61.28 1e0g h SER 14 Cb 0.66 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.49 1e0g h SER 14 CO -0.32 0.73 0.39 0.28 -0.87 0.00 0.00 176.83 177.03 1e0g h SER 15 N 0.92 0.62 -0.38 4.97 0.02 -1.72 -1.48 113.55 116.50 1e0g h SER 15 Ca 0.23 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1e0g h SER 15 Cb 0.08 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1e0g h SER 15 CO -0.03 0.43 0.24 0.40 -1.14 0.00 0.00 176.83 176.72 1e0g h ILE 16 N 0.75 1.12 -0.62 3.27 5.03 0.35 -1.83 117.51 125.59 1e0g h ILE 16 Ca 0.26 -0.26 0.13 0.00 -0.12 0.00 0.00 64.86 64.87 1e0g h ILE 16 Cb 0.04 0.60 -0.10 0.00 -3.03 0.00 0.00 36.82 34.34 1e0g h ILE 16 CO -0.11 0.12 0.06 0.00 -0.68 0.00 0.00 178.15 177.53 1e0g h ALA 17 N 1.11 0.67 -0.98 1.87 0.00 -0.35 0.21 119.26 121.79 1e0g h ALA 17 Ca 0.14 0.17 0.21 0.00 0.00 0.00 0.00 54.91 55.43 1e0g h ALA 17 Cb -0.02 0.27 -0.09 0.00 0.00 0.00 0.00 17.79 17.95 1e0g h ALA 17 CO -0.03 -0.36 0.62 0.87 0.00 0.00 0.00 179.25 180.35 1e0g h LYS 18 N 0.17 0.56 -0.41 0.00 1.57 -0.44 0.49 116.57 118.51 1e0g h LYS 18 Ca 0.33 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 59.16 1e0g h LYS 18 Cb 0.52 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1e0g h LYS 18 CO -0.49 0.37 0.28 -0.09 -0.57 0.00 0.00 179.45 178.96 1e0g h ARG 19 N 0.58 0.16 -0.19 3.15 2.43 -0.37 -1.29 114.38 118.84 1e0g h ARG 19 Ca 0.55 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1e0g h ARG 19 Cb 1.11 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1e0g h ARG 19 CO -0.30 0.11 0.00 0.72 -1.51 0.00 0.00 179.97 178.99 1e0g n HIS 20 N -4.46 0.37 -3.77 2.20 -0.00 0.13 -4.98 115.22 104.71 1e0g n HIS 20 Ca 0.06 -0.62 -0.25 0.00 -0.00 0.00 0.00 57.72 56.91 1e0g n HIS 20 Cb 0.36 -0.10 0.02 0.00 -0.00 0.00 0.00 29.99 30.27 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 -0.18 -0.44 3.66 -1.41 0.00 0.11 -4.97 105.19 101.97 1e0g n GLY 21 Ca 0.11 0.22 -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 1.63 -0.52 1.61 -7.23 -0.62 -4.81 120.40 106.74 1e0g s VAL 22 Ca 0.12 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.21 1e0g s VAL 22 Cb -0.04 -2.67 0.13 0.00 0.56 0.00 0.00 36.38 34.37 1e0g s VAL 22 CO 0.85 0.00 0.38 0.20 -0.31 0.00 0.00 175.10 176.22 1e0g s ASN 23 N -3.76 5.68 0.64 4.85 -0.87 -1.26 -4.52 114.94 115.70 1e0g s ASN 23 Ca 0.24 -2.14 0.29 0.00 -1.57 0.00 0.00 52.86 49.68 1e0g s ASN 23 Cb 0.07 -1.99 1.58 0.00 -0.02 0.00 0.00 41.25 40.88 1e0g s ASN 23 CO 0.12 -0.62 1.91 0.40 -2.57 0.00 0.00 177.10 176.34 1e0g h ILE 24 N 5.91 0.12 -0.67 0.60 1.08 -1.91 0.86 117.51 123.50 1e0g h ILE 24 Ca -0.14 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.27 1e0g h ILE 24 Cb 1.05 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 35.43 1e0g h ILE 24 CO 0.81 0.00 0.19 0.07 -0.69 0.00 0.00 178.15 178.54 1e0g h LYS 25 N 0.00 1.05 -0.86 2.37 2.10 -1.97 0.37 116.57 119.62 1e0g h LYS 25 Ca 0.06 -0.23 -0.02 0.00 -2.00 0.00 0.00 60.65 58.45 1e0g h LYS 25 Cb 0.80 -0.15 -0.04 0.00 -0.90 0.00 0.00 32.23 31.94 1e0g h LYS 25 CO -0.00 0.92 0.46 -0.44 -2.00 0.00 0.00 179.45 178.39 1e0g h ASP 26 N 0.98 1.09 -0.29 7.07 3.32 0.32 0.53 116.42 129.45 1e0g h ASP 26 Ca 0.21 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.19 1e0g h ASP 26 Cb 0.32 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1e0g h ASP 26 CO -0.00 0.89 0.09 0.58 -1.72 0.00 0.00 179.24 179.08 1e0g h VAL 27 N 1.22 0.91 0.00 -1.35 2.07 -0.56 0.58 116.25 119.12 1e0g h VAL 27 Ca 0.30 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.75 1e0g h VAL 27 Cb 0.05 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1e0g h VAL 27 CO -0.05 0.04 0.00 0.23 0.02 0.00 0.00 177.57 177.81 1e0g n MET 28 N -5.04 0.15 0.01 1.57 2.81 0.12 -1.59 117.12 115.15 1e0g n MET 28 Ca -0.00 0.42 -0.18 0.00 -1.81 0.00 0.00 57.70 56.12 1e0g n MET 28 Cb 0.11 -1.80 -0.11 0.00 -0.71 0.00 0.00 33.22 30.71 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 0.00 0.03 2.43 0.52 -3.36 114.38 114.52 1e0g h ARG 29 Ca 0.00 -0.55 -0.04 0.00 -0.81 0.00 0.00 59.98 58.58 1e0g h ARG 29 Cb 0.29 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1e0g h ARG 29 CO 0.00 1.18 -0.20 -1.49 -1.51 0.00 0.00 179.97 177.96 1e0g h TRP 30 N 0.09 0.00 -3.20 2.20 6.55 -0.84 -3.44 115.95 117.31 1e0g h TRP 30 Ca -0.09 0.00 -0.60 0.00 0.95 0.00 0.00 58.89 59.15 1e0g h TRP 30 Cb 1.44 0.00 -0.08 0.00 -0.86 0.00 0.00 29.16 29.66 1e0g h TRP 30 CO 0.13 1.04 -0.27 0.54 -1.05 0.00 0.00 178.44 178.84 1e0g s ASN 31 N -6.30 6.57 -0.24 -3.49 2.20 -0.62 -4.95 114.94 108.11 1e0g s ASN 31 Ca -0.20 0.67 0.08 0.00 -0.94 0.00 0.00 52.86 52.47 1e0g s ASN 31 Cb -0.02 -2.21 -0.20 0.00 -2.00 0.00 0.00 41.25 36.82 1e0g s ASN 31 CO 0.65 0.14 -0.12 -0.24 -2.94 0.00 0.00 177.10 174.60 1e0g n SER 32 N 3.13 1.25 -4.38 3.54 2.88 -1.26 -4.32 113.62 114.46 1e0g n SER 32 Ca -0.12 -0.09 -0.45 0.00 -1.33 0.00 0.00 58.87 56.88 1e0g n SER 32 Cb 0.52 0.13 -0.01 0.00 -0.75 0.00 0.00 64.21 64.09 1e0g n SER 32 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1e0g s ASP 33 N -6.11 6.97 -0.10 -3.46 2.15 -1.26 -4.83 116.67 110.03 1e0g s ASP 33 Ca -0.25 -2.91 0.04 0.00 0.43 0.00 0.00 52.55 49.86 1e0g s ASP 33 Cb 0.08 -2.28 0.27 0.00 -0.30 0.00 0.00 42.92 40.69 1e0g s ASP 33 CO 0.68 -0.61 1.03 0.35 -0.17 0.00 0.00 175.17 176.46 1e0g n THR 34 N 3.98 1.17 0.51 1.71 -2.24 -1.26 -4.15 114.28 114.00 1e0g n THR 34 Ca 0.23 -0.53 0.05 0.00 -2.27 0.00 0.00 64.05 61.53 1e0g n THR 34 Cb 0.44 -0.52 0.27 0.00 -2.10 0.00 0.00 70.33 68.42 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 0.14 1.67 1.77 6.98 0.00 -1.26 -1.57 120.51 128.24 1e0g n ALA 35 Ca 0.12 -0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.63 1e0g n ALA 35 Cb 0.66 -1.17 0.59 0.00 0.00 0.00 0.00 19.45 19.53 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 -1.28 0.55 -4.31 0.00 3.02 -1.26 -4.56 115.26 107.42 1e0g n ASN 36 Ca 0.05 -1.41 -0.40 0.00 -0.03 0.00 0.00 54.58 52.79 1e0g n ASN 36 Cb 0.08 -0.02 -0.02 0.00 -0.61 0.00 0.00 39.78 39.21 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 4.82 -4.79 3.41 4.32 -0.61 -4.61 117.00 119.08 1e0g n LEU 37 Ca 0.17 -3.69 -0.22 0.00 -0.02 0.00 0.00 56.01 52.25 1e0g n LEU 37 Cb 0.17 -1.66 -0.05 0.00 -1.62 0.00 0.00 43.42 40.25 1e0g n LEU 37 CO 0.13 -0.16 -0.15 -1.10 -1.22 0.00 0.00 177.39 174.89 1e0g s GLN 38 N 4.61 2.55 -1.02 3.23 -0.21 -1.26 -4.99 119.66 122.57 1e0g s GLN 38 Ca 0.56 -1.41 -0.24 0.00 0.02 0.00 0.00 55.36 54.30 1e0g s GLN 38 Cb 0.06 -2.33 -0.07 0.00 1.00 0.00 0.00 33.01 31.67 1e0g s GLN 38 CO 0.06 0.13 1.97 -1.25 -2.12 0.00 0.00 175.29 174.08 1e0g s PRO 39 N -3.90 2.44 0.00 2.91 0.04 -1.22 -1.45 135.00 133.81 1e0g s PRO 39 Ca 0.39 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 60.79 1e0g s PRO 39 Cb -0.04 -5.13 0.00 0.00 0.04 0.00 0.00 34.50 29.37 1e0g s PRO 39 CO 0.24 -3.75 0.00 0.41 0.04 0.00 0.00 177.00 173.94 1e0g n GLY 40 N 6.39 1.22 3.71 0.56 0.00 0.21 -4.78 105.19 112.50 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 -1.44 5.12 0.47 1.61 1.11 -0.53 -4.85 116.67 118.15 1e0g s ASP 41 Ca 0.00 -0.17 -0.14 0.00 0.18 0.00 0.00 52.55 52.42 1e0g s ASP 41 Cb 0.00 -1.24 -0.07 0.00 1.07 0.00 0.00 42.92 42.68 1e0g s ASP 41 CO 0.00 0.16 0.90 -0.54 1.18 0.00 0.00 175.17 176.86 1e0g s LYS 42 N -2.45 3.87 -0.01 8.23 1.02 -1.26 -0.61 119.74 128.54 1e0g s LYS 42 Ca 0.27 0.75 0.00 0.00 0.02 0.00 0.00 55.97 57.01 1e0g s LYS 42 Cb -0.11 -2.24 0.01 0.00 -0.52 0.00 0.00 37.83 34.96 1e0g s LYS 42 CO 0.19 -0.18 0.00 -0.51 -0.92 0.00 0.00 175.35 173.94 1e0g s LEU 43 N -4.00 1.71 0.06 3.17 1.43 0.18 -4.87 118.68 116.36 1e0g s LEU 43 Ca 0.56 -0.00 -0.31 0.00 -1.03 0.00 0.00 54.13 53.35 1e0g s LEU 43 Cb -0.10 -0.06 -0.06 0.00 0.03 0.00 0.00 46.19 46.00 1e0g s LEU 43 CO 0.32 -0.03 1.28 -0.89 0.23 0.00 0.00 176.35 177.26 1e0g s THR 44 N 0.34 3.78 -0.47 5.49 2.01 -1.26 -1.39 115.64 124.13 1e0g s THR 44 Ca -0.03 1.25 0.06 0.00 0.31 0.00 0.00 61.69 63.29 1e0g s THR 44 Cb -0.04 -3.80 0.40 0.00 0.01 0.00 0.00 72.50 69.06 1e0g s THR 44 CO -0.01 0.08 1.03 0.18 -0.69 0.00 0.00 174.62 175.21 1e0g n LEU 45 N 4.20 4.21 0.27 4.42 4.77 0.15 -4.80 117.00 130.21 1e0g n LEU 45 Ca 0.10 -5.22 0.17 0.00 -0.03 0.00 0.00 56.01 51.03 1e0g n LEU 45 Cb 0.45 -0.36 0.85 0.00 -2.33 0.00 0.00 43.42 42.03 1e0g n LEU 45 CO 0.57 2.22 1.15 -0.26 -1.33 0.00 0.00 177.39 179.74 1e0g h PHE 46 N 2.75 0.00 -0.95 -1.77 0.04 -1.92 -3.35 116.94 111.74 1e0g h PHE 46 Ca 0.21 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.33 1e0g h PHE 46 Cb 0.82 0.00 0.10 0.00 2.20 0.00 0.00 35.95 39.07 1e0g h PHE 46 CO 0.78 0.00 -0.44 1.33 -0.60 0.00 0.00 178.31 179.38 1e0g n VAL 47 N -3.20 1.70 1.05 -0.55 0.24 -1.26 -4.93 118.33 111.38 1e0g n VAL 47 Ca 0.00 -0.42 0.12 0.00 -2.04 0.00 0.00 64.34 62.00 1e0g n VAL 47 Cb 0.38 0.00 0.15 0.00 -1.47 0.00 0.00 33.84 32.90 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86