#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bds n ALA 2 N 0.00 -4.38 -1.66 0.00 0.00 -1.26 -4.70 120.51 108.51 2bds n ALA 2 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 53.44 52.74 2bds n ALA 2 Cb 0.00 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 2bds n ALA 2 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2bds n PRO 3 N 2.03 2.81 -3.22 0.00 -0.04 -1.25 -3.88 135.00 131.45 2bds n PRO 3 Ca 0.03 -2.74 -0.39 0.00 -0.04 0.00 0.00 63.50 60.36 2bds n PRO 3 Cb 0.52 -2.23 -0.06 0.00 -0.04 0.00 0.00 33.50 31.69 2bds n PRO 3 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bds s PHE 5 N -0.43 2.18 0.47 0.00 0.40 -1.26 0.31 117.98 119.65 2bds s PHE 5 Ca 0.30 0.53 0.03 0.00 -0.60 0.00 0.00 56.93 57.19 2bds s PHE 5 Cb -0.19 -3.80 -0.01 0.00 0.51 0.00 0.00 43.02 39.53 2bds s PHE 5 CO 0.18 -2.31 0.09 0.00 0.70 0.00 0.00 175.22 173.88 2bds s SER 7 N -3.74 7.18 0.00 0.00 0.01 -1.26 -2.62 113.70 113.27 2bds s SER 7 Ca 0.14 1.81 0.00 0.00 1.31 0.00 0.00 55.95 59.20 2bds s SER 7 Cb 0.01 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2bds s SER 7 CO 0.09 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 173.92 2bds n GLY 8 N 3.14 2.89 2.89 3.44 0.00 -1.26 -4.94 105.19 111.35 2bds n GLY 8 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2bds n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bds s LYS 9 N -0.14 1.17 0.62 1.61 3.01 -1.08 -5.10 119.74 119.83 2bds s LYS 9 Ca 0.00 -1.58 -0.15 0.00 -1.01 0.00 0.00 55.97 53.24 2bds s LYS 9 Cb 0.00 -2.68 -0.02 0.00 -1.01 0.00 0.00 37.83 34.12 2bds s LYS 9 CO 0.00 -0.97 1.06 -1.25 0.51 0.00 0.00 175.35 174.70 2bds s PRO 10 N 1.14 3.18 0.00 -1.68 0.05 -1.26 -2.35 135.00 134.07 2bds s PRO 10 Ca 0.11 1.17 0.00 0.00 0.05 0.00 0.00 61.00 62.33 2bds s PRO 10 Cb -0.19 -2.01 0.00 0.00 0.05 0.00 0.00 34.50 32.35 2bds s PRO 10 CO -0.15 -0.92 0.00 0.41 0.05 0.00 0.00 177.00 176.39 2bds n GLY 11 N -1.16 1.46 3.45 0.56 0.00 -1.26 -4.94 105.19 103.30 2bds n GLY 11 Ca 0.09 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 2bds n GLY 11 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2bds s ARG 12 N 0.00 1.20 0.14 1.61 1.04 -1.26 -4.51 118.95 117.17 2bds s ARG 12 Ca 0.00 -0.28 -0.13 0.00 -1.04 0.00 0.00 55.73 54.28 2bds s ARG 12 Cb 0.00 0.56 0.01 0.00 -2.04 0.00 0.00 34.95 33.48 2bds s ARG 12 CO 0.00 -0.49 0.34 0.20 -0.04 0.00 0.00 175.30 175.31 2bds s GLY 13 N -2.34 0.05 -0.09 3.88 0.00 0.93 -4.53 107.32 105.22 2bds s GLY 13 Ca -0.02 -0.44 -0.30 0.00 0.00 0.00 0.00 44.72 43.96 2bds s GLY 13 CO -0.07 -0.56 1.09 0.99 0.00 0.00 0.00 173.10 174.55 2bds s ASP 14 N -2.87 7.16 -0.44 1.64 1.01 -0.82 -1.87 116.67 120.48 2bds s ASP 14 Ca 0.08 1.65 -0.21 0.00 0.71 0.00 0.00 52.55 54.78 2bds s ASP 14 Cb 0.02 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.42 2bds s ASP 14 CO -0.07 -0.51 0.68 -0.22 0.21 0.00 0.00 175.17 175.26 2bds s LEU 15 N 2.13 4.45 0.43 1.23 0.20 -1.26 0.93 118.68 126.79 2bds s LEU 15 Ca 0.51 -0.30 -0.02 0.00 0.69 0.00 0.00 54.13 55.02 2bds s LEU 15 Cb -0.21 -2.78 -0.02 0.00 -0.43 0.00 0.00 46.19 42.75 2bds s LEU 15 CO 0.19 -0.82 0.67 0.26 -0.29 0.00 0.00 176.35 176.37 2bds s TRP 16 N 2.93 3.42 0.00 5.38 0.52 0.88 -4.59 118.94 127.47 2bds s TRP 16 Ca 0.24 0.46 0.00 0.00 0.02 0.00 0.00 56.10 56.82 2bds s TRP 16 Cb -0.14 -2.19 0.00 0.00 -1.15 0.00 0.00 33.47 29.99 2bds s TRP 16 CO 0.20 -0.20 0.00 -0.89 0.02 0.00 0.00 176.95 176.08 2bds n ILE 17 N -2.06 0.00 -0.86 2.03 5.41 -1.26 -0.30 119.36 122.33 2bds n ILE 17 Ca -0.01 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.39 2bds n ILE 17 Cb 0.56 -1.51 -0.05 0.00 -0.71 0.00 0.00 39.64 37.93 2bds n ILE 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bds n LEU 18 N 0.00 3.42 -4.20 1.39 -0.00 -0.39 -1.78 117.00 115.43 2bds n LEU 18 Ca 0.00 -2.50 -0.35 0.00 -0.00 0.00 0.00 56.01 53.15 2bds n LEU 18 Cb 0.00 -0.96 -0.14 0.00 -0.00 0.00 0.00 43.42 42.33 2bds n LEU 18 CO 0.00 -0.49 -0.35 -0.13 -0.00 0.00 0.00 177.39 176.41 2bds s ARG 19 N 4.99 2.58 0.61 1.47 0.52 -1.26 -4.93 118.95 122.92 2bds s ARG 19 Ca 0.51 -1.17 0.38 0.00 -0.52 0.00 0.00 55.73 54.93 2bds s ARG 19 Cb 0.12 -3.18 1.93 0.00 0.52 0.00 0.00 34.95 34.34 2bds s ARG 19 CO 0.11 -0.56 2.20 0.78 0.02 0.00 0.00 175.30 177.85 2bds h GLY 20 N 8.04 0.00 -4.48 -3.53 0.00 -1.96 -3.44 103.07 97.71 2bds h GLY 20 Ca -0.25 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.94 2bds h GLY 20 CO 0.55 0.00 -0.63 -0.51 0.00 0.00 0.00 176.54 175.95 2bds s THR 21 N -4.01 0.13 0.25 4.70 -4.23 -1.26 -5.10 115.64 106.12 2bds s THR 21 Ca -0.03 -1.06 -0.02 0.00 -1.18 0.00 0.00 61.69 59.40 2bds s THR 21 Cb 0.12 -0.61 -0.05 0.00 1.34 0.00 0.00 72.50 73.30 2bds s THR 21 CO 0.48 -0.58 0.47 0.00 -0.54 0.00 0.00 174.62 174.45 2bds s PRO 23 N -3.51 3.98 0.00 0.00 0.04 -1.26 -4.91 135.00 129.35 2bds s PRO 23 Ca 0.41 2.07 0.23 0.00 0.04 0.00 0.00 61.00 63.75 2bds s PRO 23 Cb -0.11 -2.73 1.15 0.00 0.04 0.00 0.00 34.50 32.85 2bds s PRO 23 CO 0.30 -0.46 1.77 0.41 0.04 0.00 0.00 177.00 179.06 2bds n GLY 24 N 0.67 -0.49 0.15 0.56 0.00 -1.26 -3.40 105.19 101.41 2bds n GLY 24 Ca 0.04 -0.27 0.08 0.00 0.00 0.00 0.00 46.02 45.87 2bds n GLY 24 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bds h GLY 25 N 5.14 0.00 2.00 -0.02 0.00 -1.96 -3.21 103.07 105.02 2bds h GLY 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bds h GLY 25 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 176.54 175.57 2bds h TYR 26 N 0.00 0.00 0.00 5.60 -1.99 -1.97 -3.46 116.97 115.15 2bds h TYR 26 Ca -0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.70 2bds h TYR 26 Cb 1.19 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.92 2bds h TYR 26 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2bds n GLY 27 N 1.14 0.72 3.45 3.88 0.00 -1.22 -5.03 105.19 108.14 2bds n GLY 27 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2bds n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bds n TYR 28 N -2.02 -0.97 0.00 1.61 4.01 -1.26 -4.89 117.16 113.64 2bds n TYR 28 Ca 0.00 0.23 0.00 0.00 -0.16 0.00 0.00 57.90 57.97 2bds n TYR 28 Cb 0.00 -1.80 0.00 0.00 -0.31 0.00 0.00 39.34 37.23 2bds n TYR 28 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2bds n THR 29 N -3.92 0.00 -3.55 -0.72 -2.24 -1.23 -4.97 114.28 97.65 2bds n THR 29 Ca 0.07 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.45 2bds n THR 29 Cb 0.54 -0.29 -0.11 0.00 -2.10 0.00 0.00 70.33 68.38 2bds n THR 29 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2bds s SER 30 N -3.81 6.04 0.02 3.42 1.04 -1.23 -5.00 113.70 114.19 2bds s SER 30 Ca 0.00 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2bds s SER 30 Cb 0.00 -2.13 -0.02 0.00 0.10 0.00 0.00 66.02 63.97 2bds s SER 30 CO 0.00 -0.19 -0.04 0.54 0.98 0.00 0.00 173.24 174.53 2bds s ASN 31 N 1.73 0.35 -0.06 7.02 2.20 -1.26 -0.93 114.94 123.99 2bds s ASN 31 Ca 0.06 -0.47 -0.02 0.00 -0.94 0.00 0.00 52.86 51.50 2bds s ASN 31 Cb -0.17 0.08 -0.03 0.00 -2.00 0.00 0.00 41.25 39.12 2bds s ASN 31 CO 0.11 -0.26 0.03 0.00 -2.94 0.00 0.00 177.10 174.04 2bds s TYR 33 N -0.98 2.36 -0.50 0.00 1.51 -1.26 -2.20 117.35 116.28 2bds s TYR 33 Ca 0.16 -0.50 0.06 0.00 -1.01 0.00 0.00 57.07 55.78 2bds s TYR 33 Cb -0.12 -1.52 0.19 0.00 -0.11 0.00 0.00 41.96 40.40 2bds s TYR 33 CO 0.05 -0.08 0.66 -1.59 -1.11 0.00 0.00 175.55 173.48 2bds s LYS 34 N -0.51 1.04 0.91 -0.62 0.00 -0.84 -4.97 119.74 114.75 2bds s LYS 34 Ca 0.07 -1.21 -0.16 0.00 0.00 0.00 0.00 55.97 54.67 2bds s LYS 34 Cb -0.11 -0.28 -0.09 0.00 0.00 0.00 0.00 37.83 37.36 2bds s LYS 34 CO 0.00 -1.33 -0.29 1.87 0.00 0.00 0.00 175.35 175.60 2bds n TRP 35 N 2.99 -3.58 0.90 1.78 -0.00 -1.26 -1.87 117.44 116.41 2bds n TRP 35 Ca 0.20 0.12 0.00 0.00 -0.00 0.00 0.00 57.50 57.82 2bds n TRP 35 Cb 0.55 -1.60 0.00 0.00 -0.00 0.00 0.00 31.31 30.26 2bds n TRP 35 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2bds n PRO 36 N 0.97 0.90 -4.18 5.87 -0.05 -1.26 -4.98 135.00 132.27 2bds n PRO 36 Ca 0.02 0.00 -0.17 0.00 -0.05 0.00 0.00 63.50 63.30 2bds n PRO 36 Cb 0.54 -1.10 -0.06 0.00 -0.05 0.00 0.00 33.50 32.83 2bds n PRO 36 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 175.50 174.65 2bds s ASN 37 N 0.86 1.33 -0.01 3.54 0.01 -0.78 -1.27 114.94 118.62 2bds s ASN 37 Ca 0.00 -1.64 -0.09 0.00 -0.71 0.00 0.00 52.86 50.42 2bds s ASN 37 Cb 0.00 0.63 0.01 0.00 0.41 0.00 0.00 41.25 42.30 2bds s ASN 37 CO 0.00 -1.21 0.19 -0.51 -1.51 0.00 0.00 177.10 174.06 2bds s ILE 38 N -3.16 0.07 -0.14 0.60 2.07 0.59 -1.99 121.20 119.24 2bds s ILE 38 Ca 0.35 -0.54 0.02 0.00 -1.41 0.00 0.00 60.65 59.07 2bds s ILE 38 Cb 0.01 -0.45 0.02 0.00 0.13 0.00 0.00 42.46 42.16 2bds s ILE 38 CO 0.24 -0.30 -0.18 0.00 -1.91 0.00 0.00 174.94 172.79 2bds s TYR 41 N -1.56 2.38 0.54 0.00 1.51 -0.11 -1.93 117.35 118.18 2bds s TYR 41 Ca 0.39 -0.71 -0.12 0.00 -1.01 0.00 0.00 57.07 55.62 2bds s TYR 41 Cb -0.13 -1.62 -0.05 0.00 -0.11 0.00 0.00 41.96 40.05 2bds s TYR 41 CO 0.20 0.37 0.95 -1.25 -1.11 0.00 0.00 175.55 174.71 2bds s PRO 42 N -3.74 3.72 0.00 -1.71 0.04 -1.17 -3.54 135.00 128.60 2bds s PRO 42 Ca 0.35 0.70 0.14 0.00 0.04 0.00 0.00 61.00 62.23 2bds s PRO 42 Cb 0.09 -2.18 0.11 0.00 0.04 0.00 0.00 34.50 32.56 2bds s PRO 42 CO 0.17 -0.36 0.95 -2.39 0.04 0.00 0.00 177.00 175.41