#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 4.03 0.05 -1.12 1.04 -1.26 -4.91 113.70 111.53 1e0g s SER 2 Ca 0.00 -0.29 -0.14 0.00 0.48 0.00 0.00 55.95 56.00 1e0g s SER 2 Cb 0.00 -1.43 -0.06 0.00 0.10 0.00 0.00 66.02 64.64 1e0g s SER 2 CO 0.00 0.21 0.44 -0.63 0.98 0.00 0.00 173.24 174.24 1e0g s ILE 3 N 0.08 4.99 -0.15 -1.02 1.01 -1.25 -4.94 121.20 119.92 1e0g s ILE 3 Ca -0.05 0.79 -0.01 0.00 0.00 0.00 0.00 60.65 61.37 1e0g s ILE 3 Cb -0.15 -3.72 0.04 0.00 0.01 0.00 0.00 42.46 38.65 1e0g s ILE 3 CO 0.04 0.46 -0.02 -0.89 0.00 0.00 0.00 174.94 174.54 1e0g s THR 4 N -1.21 0.80 -0.04 2.92 2.01 -1.26 0.27 115.64 119.15 1e0g s THR 4 Ca 0.28 -0.41 0.06 0.00 0.31 0.00 0.00 61.69 61.93 1e0g s THR 4 Cb -0.16 -1.03 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 1e0g s THR 4 CO 0.16 0.11 -0.21 -0.72 -0.69 0.00 0.00 174.62 173.26 1e0g s TYR 5 N 1.77 2.49 -0.23 4.92 -0.85 -0.33 -4.77 117.35 120.35 1e0g s TYR 5 Ca 0.02 -0.37 -0.21 0.00 -0.52 0.00 0.00 57.07 55.99 1e0g s TYR 5 Cb -0.15 -1.56 -0.02 0.00 0.38 0.00 0.00 41.96 40.61 1e0g s TYR 5 CO -0.07 0.02 0.66 1.03 -1.52 0.00 0.00 175.55 175.67 1e0g s ARG 6 N -0.59 4.16 -0.42 -3.49 0.52 -1.26 0.66 118.95 118.53 1e0g s ARG 6 Ca 0.09 0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 55.65 1e0g s ARG 6 Cb -0.11 -3.62 0.02 0.00 0.52 0.00 0.00 34.95 31.76 1e0g s ARG 6 CO 0.00 -0.37 1.23 0.08 0.02 0.00 0.00 175.30 176.27 1e0g s VAL 7 N 2.35 4.14 0.27 3.52 1.01 0.85 -4.85 120.40 127.68 1e0g s VAL 7 Ca 0.28 1.20 0.04 0.00 0.00 0.00 0.00 61.98 63.51 1e0g s VAL 7 Cb -0.16 -4.40 -0.03 0.00 0.00 0.00 0.00 36.38 31.79 1e0g s VAL 7 CO 0.09 -0.80 0.41 -0.13 0.00 0.00 0.00 175.10 174.67 1e0g s ARG 8 N 4.47 3.41 0.32 2.72 0.52 -1.26 0.69 118.95 129.82 1e0g s ARG 8 Ca 0.53 -0.70 -0.28 0.00 -0.52 0.00 0.00 55.73 54.75 1e0g s ARG 8 Cb -0.11 -2.84 -0.13 0.00 0.52 0.00 0.00 34.95 32.40 1e0g s ARG 8 CO 0.29 0.34 1.25 0.36 0.02 0.00 0.00 175.30 177.55 1e0g n LYS 9 N -1.51 1.95 -0.13 3.54 -0.00 -1.26 -0.37 118.16 120.39 1e0g n LYS 9 Ca -0.07 0.69 0.00 0.00 -0.00 0.00 0.00 58.31 58.92 1e0g n LYS 9 Cb 0.57 -2.23 0.00 0.00 -0.00 0.00 0.00 35.03 33.37 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 1.04 1.96 3.85 2.58 0.00 -1.26 -5.02 105.19 108.33 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 -3.38 6.72 -0.05 1.61 1.11 0.50 -5.07 116.67 118.12 1e0g s ASP 11 Ca 0.00 1.44 0.05 0.00 0.18 0.00 0.00 52.55 54.22 1e0g s ASP 11 Cb 0.00 -2.44 -0.01 0.00 1.07 0.00 0.00 42.92 41.54 1e0g s ASP 11 CO 0.00 -0.40 -0.21 -0.44 1.18 0.00 0.00 175.17 175.30 1e0g s SER 12 N -2.67 2.58 0.13 0.27 0.01 -1.26 -4.89 113.70 107.87 1e0g s SER 12 Ca 0.57 -0.43 -0.29 0.00 1.31 0.00 0.00 55.95 57.11 1e0g s SER 12 Cb -0.10 -0.69 -0.06 0.00 0.21 0.00 0.00 66.02 65.38 1e0g s SER 12 CO 0.23 0.20 1.58 -0.07 0.41 0.00 0.00 173.24 175.59 1e0g h LEU 13 N 6.13 -1.32 -0.80 2.44 -0.00 -1.99 0.48 115.31 120.26 1e0g h LEU 13 Ca -0.33 0.17 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1e0g h LEU 13 Cb 1.17 0.53 -0.04 0.00 -0.00 0.00 0.00 40.66 42.32 1e0g h LEU 13 CO 0.47 -0.44 0.51 0.77 -0.00 0.00 0.00 178.44 179.75 1e0g h SER 14 N -0.52 0.93 -0.35 -0.43 4.64 -1.96 -1.70 113.55 114.17 1e0g h SER 14 Ca 0.07 -0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.37 1e0g h SER 14 Cb 0.63 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.46 1e0g h SER 14 CO -0.38 0.70 0.16 -1.28 -0.87 0.00 0.00 176.83 175.16 1e0g h SER 15 N 1.09 0.23 -0.52 4.97 0.87 -1.56 -1.41 113.55 117.21 1e0g h SER 15 Ca 0.29 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.90 1e0g h SER 15 Cb -0.09 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 61.82 1e0g h SER 15 CO -0.06 0.17 0.29 0.40 -0.53 0.00 0.00 176.83 177.10 1e0g h ILE 16 N 0.34 1.01 -0.60 2.23 5.03 0.30 -1.15 117.51 124.68 1e0g h ILE 16 Ca 0.15 -0.20 0.11 0.00 -0.12 0.00 0.00 64.86 64.81 1e0g h ILE 16 Cb 0.08 0.39 -0.09 0.00 -3.03 0.00 0.00 36.82 34.17 1e0g h ILE 16 CO -0.12 0.10 0.11 0.00 -0.68 0.00 0.00 178.15 177.57 1e0g h ALA 17 N 1.25 0.70 -0.99 1.87 0.00 -0.39 0.13 119.26 121.83 1e0g h ALA 17 Ca 0.22 0.14 0.22 0.00 0.00 0.00 0.00 54.91 55.48 1e0g h ALA 17 Cb 0.07 0.19 -0.09 0.00 0.00 0.00 0.00 17.79 17.96 1e0g h ALA 17 CO -0.12 -0.32 0.63 -0.22 0.00 0.00 0.00 179.25 179.22 1e0g h LYS 18 N 0.24 0.53 -0.42 0.00 3.64 -0.20 0.57 116.57 120.93 1e0g h LYS 18 Ca 0.31 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.76 1e0g h LYS 18 Cb 0.47 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1e0g h LYS 18 CO -0.41 0.35 0.29 -0.09 -2.27 0.00 0.00 179.45 177.32 1e0g h ARG 19 N 0.54 0.15 -0.14 1.90 9.65 -0.53 -1.43 114.38 124.52 1e0g h ARG 19 Ca 0.56 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.43 1e0g h ARG 19 Cb 1.17 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.72 1e0g h ARG 19 CO -0.30 0.10 0.00 0.72 2.80 0.00 0.00 179.97 183.29 1e0g n HIS 20 N -4.45 0.27 -3.80 2.20 -0.00 0.15 -4.98 115.22 104.61 1e0g n HIS 20 Ca 0.06 -0.65 -0.26 0.00 -0.00 0.00 0.00 57.72 56.88 1e0g n HIS 20 Cb 0.39 -0.10 0.01 0.00 -0.00 0.00 0.00 29.99 30.29 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 -0.39 -0.47 3.68 -1.41 0.00 0.13 -4.96 105.19 101.78 1e0g n GLY 21 Ca 0.09 0.24 -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 -3.74 1.72 -0.58 1.61 -7.23 -0.67 -4.81 120.40 106.71 1e0g s VAL 22 Ca 0.14 -1.97 -0.09 0.00 -1.81 0.00 0.00 61.98 58.25 1e0g s VAL 22 Cb -0.05 -2.69 0.15 0.00 0.56 0.00 0.00 36.38 34.35 1e0g s VAL 22 CO 0.86 0.00 0.46 0.20 -0.31 0.00 0.00 175.10 176.31 1e0g s ASN 23 N -3.79 5.85 0.60 4.85 -0.87 -1.26 -4.56 114.94 115.75 1e0g s ASN 23 Ca 0.25 -2.24 0.29 0.00 -1.57 0.00 0.00 52.86 49.59 1e0g s ASN 23 Cb 0.06 -2.03 1.53 0.00 -0.02 0.00 0.00 41.25 40.79 1e0g s ASN 23 CO 0.13 -0.62 1.94 0.40 -2.57 0.00 0.00 177.10 176.38 1e0g h ILE 24 N 5.69 0.34 -0.75 0.60 1.08 -1.91 0.95 117.51 123.51 1e0g h ILE 24 Ca -0.12 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.32 1e0g h ILE 24 Cb 1.04 0.67 -0.03 0.00 -3.07 0.00 0.00 36.82 35.43 1e0g h ILE 24 CO 0.82 0.00 0.33 0.07 -0.69 0.00 0.00 178.15 178.68 1e0g h LYS 25 N 0.00 1.08 -0.81 2.37 2.10 -1.97 0.23 116.57 119.57 1e0g h LYS 25 Ca 0.16 -0.17 -0.04 0.00 -2.00 0.00 0.00 60.65 58.60 1e0g h LYS 25 Cb 0.97 -0.19 -0.04 0.00 -0.90 0.00 0.00 32.23 32.07 1e0g h LYS 25 CO -0.00 0.85 0.36 -0.44 -2.00 0.00 0.00 179.45 178.22 1e0g h ASP 26 N 1.07 1.09 -0.60 7.07 3.32 0.50 0.54 116.42 129.41 1e0g h ASP 26 Ca 0.25 -0.16 0.06 0.00 0.02 0.00 0.00 57.03 57.21 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 0.95 0.31 0.58 -1.72 0.00 0.00 179.24 179.33 1e0g h VAL 27 N 1.17 0.94 0.00 -1.35 2.07 -0.34 0.66 116.25 119.40 1e0g h VAL 27 Ca 0.28 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1e0g h VAL 27 Cb 0.17 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1e0g h VAL 27 CO -0.03 0.11 0.00 0.23 0.02 0.00 0.00 177.57 177.90 1e0g n MET 28 N -4.85 0.18 -0.00 1.57 2.81 0.60 -1.54 117.12 115.88 1e0g n MET 28 Ca 0.07 0.33 -0.18 0.00 -1.81 0.00 0.00 57.70 56.11 1e0g n MET 28 Cb 0.17 -1.79 -0.10 0.00 -0.71 0.00 0.00 33.22 30.80 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 0.56 0.13 0.03 2.43 0.55 -3.31 114.38 114.76 1e0g h ARG 29 Ca 0.00 -0.53 -0.30 0.00 -0.81 0.00 0.00 59.98 58.34 1e0g h ARG 29 Cb 0.45 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1e0g h ARG 29 CO 0.00 1.15 -1.49 -1.49 -1.51 0.00 0.00 179.97 176.64 1e0g h TRP 30 N 0.16 0.50 -3.17 2.20 6.55 -1.05 -3.45 115.95 117.69 1e0g h TRP 30 Ca -0.07 -0.36 -0.59 0.00 0.95 0.00 0.00 58.89 58.82 1e0g h TRP 30 Cb 1.35 -0.02 -0.06 0.00 -0.86 0.00 0.00 29.16 29.57 1e0g h TRP 30 CO 0.12 1.38 -0.14 -0.80 -1.05 0.00 0.00 178.44 177.95 1e0g s ASN 31 N -7.05 6.82 -0.07 -3.49 0.01 -0.59 -4.95 114.94 105.62 1e0g s ASN 31 Ca -0.08 0.98 0.20 0.00 -0.71 0.00 0.00 52.86 53.24 1e0g s ASN 31 Cb 0.07 -2.29 -0.30 0.00 0.41 0.00 0.00 41.25 39.14 1e0g s ASN 31 CO 0.86 0.21 0.34 -0.24 -1.51 0.00 0.00 177.10 176.76 1e0g n SER 32 N 2.41 0.27 -3.74 -1.22 2.88 -1.26 -4.58 113.62 108.39 1e0g n SER 32 Ca -0.11 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.13 1e0g n SER 32 Cb 0.52 1.67 -0.14 0.00 -0.75 0.00 0.00 64.21 65.50 1e0g n SER 32 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1e0g s ASP 33 N -4.66 3.92 -0.21 -3.46 1.01 -1.26 -4.96 116.67 107.05 1e0g s ASP 33 Ca -0.08 -2.00 0.02 0.00 0.71 0.00 0.00 52.55 51.20 1e0g s ASP 33 Cb 0.11 -0.95 0.33 0.00 1.01 0.00 0.00 42.92 43.42 1e0g s ASP 33 CO 0.84 -0.36 1.41 0.35 0.21 0.00 0.00 175.17 177.61 1e0g n THR 34 N 4.37 1.99 0.49 -1.27 -2.24 -1.26 -4.28 114.28 112.08 1e0g n THR 34 Ca 0.02 -0.90 0.05 0.00 -2.27 0.00 0.00 64.05 60.96 1e0g n THR 34 Cb 0.39 -0.71 0.27 0.00 -2.10 0.00 0.00 70.33 68.19 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 -0.23 1.63 1.79 6.98 0.00 -1.26 -1.59 120.51 127.83 1e0g n ALA 35 Ca 0.27 -0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.79 1e0g n ALA 35 Cb 1.03 -1.18 0.65 0.00 0.00 0.00 0.00 19.45 19.95 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 -1.35 0.52 -4.14 0.00 2.85 -1.26 -4.54 115.26 107.33 1e0g n ASN 36 Ca 0.05 -1.34 -0.40 0.00 -0.11 0.00 0.00 54.58 52.77 1e0g n ASN 36 Cb 0.10 -0.02 -0.02 0.00 1.24 0.00 0.00 39.78 41.08 1e0g n ASN 36 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1e0g n LEU 37 N -0.52 5.02 -4.79 1.20 4.32 -0.62 -4.58 117.00 117.02 1e0g n LEU 37 Ca 0.18 -3.66 -0.22 0.00 -0.02 0.00 0.00 56.01 52.30 1e0g n LEU 37 Cb 0.17 -1.60 -0.05 0.00 -1.62 0.00 0.00 43.42 40.32 1e0g n LEU 37 CO 0.14 -0.02 -0.15 -1.10 -1.22 0.00 0.00 177.39 175.04 1e0g s GLN 38 N 4.48 2.58 -1.04 3.23 -1.52 -1.26 -4.99 119.66 121.14 1e0g s GLN 38 Ca 0.55 -1.37 -0.24 0.00 -1.95 0.00 0.00 55.36 52.35 1e0g s GLN 38 Cb 0.08 -2.35 -0.08 0.00 -0.22 0.00 0.00 33.01 30.44 1e0g s GLN 38 CO 0.05 0.16 1.96 -1.25 -0.25 0.00 0.00 175.29 175.96 1e0g s PRO 39 N -3.90 2.44 0.00 2.91 0.04 -1.22 -1.46 135.00 133.81 1e0g s PRO 39 Ca 0.38 -0.68 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1e0g s PRO 39 Cb -0.05 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.36 1e0g s PRO 39 CO 0.24 -3.79 0.00 0.41 0.04 0.00 0.00 177.00 173.91 1e0g n GLY 40 N 6.33 0.67 3.66 0.56 0.00 0.22 -4.72 105.19 111.92 1e0g n GLY 40 Ca 0.43 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 -1.07 4.87 0.55 1.61 1.01 -0.54 -4.86 116.67 118.24 1e0g s ASP 41 Ca 0.00 -0.24 -0.09 0.00 0.71 0.00 0.00 52.55 52.93 1e0g s ASP 41 Cb 0.00 -1.10 -0.04 0.00 1.01 0.00 0.00 42.92 42.79 1e0g s ASP 41 CO 0.00 0.17 0.92 -1.59 0.21 0.00 0.00 175.17 174.88 1e0g s LYS 42 N -2.33 3.60 -0.02 8.23 0.00 -1.26 -0.11 119.74 127.85 1e0g s LYS 42 Ca 0.25 0.54 -0.01 0.00 0.00 0.00 0.00 55.97 56.74 1e0g s LYS 42 Cb -0.11 -2.21 0.01 0.00 0.00 0.00 0.00 37.83 35.52 1e0g s LYS 42 CO 0.17 -0.40 0.05 -0.51 0.00 0.00 0.00 175.35 174.67 1e0g s LEU 43 N -4.91 1.53 0.04 2.77 1.43 0.21 -4.83 118.68 114.92 1e0g s LEU 43 Ca 0.52 0.11 -0.31 0.00 -1.03 0.00 0.00 54.13 53.42 1e0g s LEU 43 Cb -0.11 0.13 -0.06 0.00 0.03 0.00 0.00 46.19 46.19 1e0g s LEU 43 CO 0.49 -0.06 1.31 -0.89 0.23 0.00 0.00 176.35 177.43 1e0g s THR 44 N 0.39 3.77 -0.50 5.49 2.01 -1.26 -1.18 115.64 124.36 1e0g s THR 44 Ca -0.03 1.22 0.05 0.00 0.31 0.00 0.00 61.69 63.24 1e0g s THR 44 Cb -0.04 -3.78 0.39 0.00 0.01 0.00 0.00 72.50 69.07 1e0g s THR 44 CO -0.01 0.05 1.04 0.18 -0.69 0.00 0.00 174.62 175.19 1e0g n LEU 45 N 4.56 4.61 0.19 4.42 4.77 0.14 -4.79 117.00 130.91 1e0g n LEU 45 Ca 0.11 -5.42 0.18 0.00 -0.03 0.00 0.00 56.01 50.85 1e0g n LEU 45 Cb 0.44 -0.50 0.77 0.00 -2.33 0.00 0.00 43.42 41.80 1e0g n LEU 45 CO 0.57 2.29 1.16 -0.26 -1.33 0.00 0.00 177.39 179.82 1e0g h PHE 46 N 2.75 0.00 -0.98 -1.77 0.04 -1.91 -3.33 116.94 111.74 1e0g h PHE 46 Ca 0.23 0.00 -0.67 0.00 2.80 0.00 0.00 57.97 60.33 1e0g h PHE 46 Cb 0.74 0.00 0.10 0.00 2.20 0.00 0.00 35.95 38.99 1e0g h PHE 46 CO 0.83 0.00 -0.46 1.33 -0.60 0.00 0.00 178.31 179.40 1e0g n VAL 47 N -3.39 1.77 1.11 -0.55 0.24 -1.26 -4.90 118.33 111.34 1e0g n VAL 47 Ca 0.04 -0.44 0.12 0.00 -2.04 0.00 0.00 64.34 62.02 1e0g n VAL 47 Cb 0.53 0.00 0.19 0.00 -1.47 0.00 0.00 33.84 33.09 1e0g n VAL 47 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86