#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 -2.47 -0.94 0.00 0.00 -1.25 -3.53 120.51 112.32 2bds n ALA 2 Ca 0.00 0.26 -0.24 0.00 0.00 0.00 0.00 53.44 53.46 2bds n ALA 2 Cb 0.00 -1.62 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 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 1.03 2.47 -2.58 0.00 -0.04 -1.23 -1.21 135.00 133.43 2bds n PRO 3 Ca 0.14 -1.50 -0.36 0.00 -0.04 0.00 0.00 63.50 61.73 2bds n PRO 3 Cb 0.34 -2.40 -0.04 0.00 -0.04 0.00 0.00 33.50 31.36 2bds n PRO 3 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bds n PHE 5 N -0.02 -3.95 -4.49 0.00 3.01 -1.26 0.34 117.46 111.10 2bds n PHE 5 Ca 0.05 -0.71 -0.26 0.00 1.01 0.00 0.00 57.45 57.54 2bds n PHE 5 Cb 0.50 -0.60 -0.08 0.00 -0.01 0.00 0.00 39.48 39.30 2bds n PHE 5 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2bds s SER 7 N -3.60 6.68 0.00 0.00 1.04 -1.26 -2.75 113.70 113.82 2bds s SER 7 Ca 0.25 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.26 2bds s SER 7 Cb 0.01 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.67 2bds s SER 7 CO 0.17 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.15 2bds n GLY 8 N 4.37 1.08 3.10 7.32 0.00 -1.26 -5.01 105.19 114.79 2bds n GLY 8 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.68 2.14 0.47 1.61 1.02 -1.11 -5.09 119.74 118.09 2bds s LYS 9 Ca 0.00 -1.48 -0.23 0.00 0.02 0.00 0.00 55.97 54.28 2bds s LYS 9 Cb 0.00 -3.14 -0.07 0.00 -0.52 0.00 0.00 37.83 34.10 2bds s LYS 9 CO 0.00 -0.72 1.18 -2.14 -0.92 0.00 0.00 175.35 172.75 2bds s PRO 10 N 1.12 3.69 0.00 -1.68 0.02 -1.26 -2.85 135.00 134.03 2bds s PRO 10 Ca -0.02 1.82 0.00 0.00 0.02 0.00 0.00 61.00 62.82 2bds s PRO 10 Cb -0.20 -2.39 0.00 0.00 0.02 0.00 0.00 34.50 31.93 2bds s PRO 10 CO -0.04 -0.62 0.00 0.41 -0.33 0.00 0.00 177.00 176.42 2bds n GLY 11 N 0.47 1.36 3.51 0.52 0.00 -1.26 -4.94 105.19 104.85 2bds n GLY 11 Ca 0.08 -0.83 -0.16 0.00 0.00 0.00 0.00 46.02 45.11 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 1.03 0.15 1.61 1.70 -1.26 -4.41 118.95 117.77 2bds s ARG 12 Ca 0.00 0.15 -0.01 0.00 -0.47 0.00 0.00 55.73 55.40 2bds s ARG 12 Cb 0.00 0.48 -0.04 0.00 -0.57 0.00 0.00 34.95 34.82 2bds s ARG 12 CO 0.00 -0.34 0.08 0.20 -1.08 0.00 0.00 175.30 174.16 2bds s GLY 13 N -1.39 1.11 -0.36 3.88 0.00 1.06 -4.46 107.32 107.17 2bds s GLY 13 Ca -0.08 -1.53 -0.29 0.00 0.00 0.00 0.00 44.72 42.82 2bds s GLY 13 CO 0.06 -1.36 1.11 0.99 0.00 0.00 0.00 173.10 173.90 2bds s ASP 14 N -3.08 6.83 -0.80 1.64 1.01 0.06 -1.89 116.67 120.44 2bds s ASP 14 Ca 0.28 0.90 -0.23 0.00 0.71 0.00 0.00 52.55 54.21 2bds s ASP 14 Cb 0.07 -2.55 0.06 0.00 1.01 0.00 0.00 42.92 41.52 2bds s ASP 14 CO 0.05 -1.00 1.19 -0.22 0.21 0.00 0.00 175.17 175.40 2bds s LEU 15 N 3.93 3.93 0.44 1.23 2.96 -0.35 0.17 118.68 131.00 2bds s LEU 15 Ca 0.47 -1.10 -0.23 0.00 -0.22 0.00 0.00 54.13 53.05 2bds s LEU 15 Cb -0.11 -2.49 -0.08 0.00 0.50 0.00 0.00 46.19 44.01 2bds s LEU 15 CO 0.20 -1.52 1.17 0.26 -1.32 0.00 0.00 176.35 175.14 2bds s TRP 16 N 4.55 2.93 -0.64 5.38 0.52 0.71 -3.94 118.94 128.44 2bds s TRP 16 Ca 0.33 1.54 0.10 0.00 0.02 0.00 0.00 56.10 58.09 2bds s TRP 16 Cb -0.09 -3.38 -0.08 0.00 -1.15 0.00 0.00 33.47 28.77 2bds s TRP 16 CO 0.04 -1.45 0.51 -0.89 0.02 0.00 0.00 176.95 175.18 2bds n ILE 17 N -0.35 0.00 -2.88 2.03 -0.00 -1.26 0.04 119.36 116.94 2bds n ILE 17 Ca 0.06 -0.29 -0.12 0.00 -0.00 0.00 0.00 62.75 62.40 2bds n ILE 17 Cb 0.48 1.04 0.05 0.00 -0.00 0.00 0.00 39.64 41.21 2bds n ILE 17 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2bds n LEU 18 N -0.94 -1.23 -3.61 1.39 4.77 -1.17 -3.49 117.00 112.72 2bds n LEU 18 Ca 0.03 -4.14 -0.13 0.00 -0.03 0.00 0.00 56.01 51.75 2bds n LEU 18 Cb 0.18 0.84 -0.05 0.00 -2.33 0.00 0.00 43.42 42.06 2bds n LEU 18 CO 0.19 2.14 0.22 -0.13 -1.33 0.00 0.00 177.39 178.47 2bds s ARG 19 N -0.67 1.02 0.00 3.23 0.52 0.23 -4.95 118.95 118.33 2bds s ARG 19 Ca 0.28 -0.40 0.12 0.00 -0.52 0.00 0.00 55.73 55.21 2bds s ARG 19 Cb 0.31 0.46 -0.08 0.00 0.52 0.00 0.00 34.95 36.17 2bds s ARG 19 CO -0.06 -0.38 0.58 0.41 0.02 0.00 0.00 175.30 175.88 2bds n GLY 20 N 0.24 -0.10 3.17 -3.53 0.00 -1.26 -4.36 105.19 99.35 2bds n GLY 20 Ca -0.18 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.37 2bds n GLY 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bds s THR 21 N -1.89 0.85 0.08 2.61 -4.23 -1.26 -5.06 115.64 106.74 2bds s THR 21 Ca 0.07 -1.74 0.04 0.00 -1.18 0.00 0.00 61.69 58.87 2bds s THR 21 Cb 0.09 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.43 2bds s THR 21 CO 0.41 -0.67 0.03 0.00 -0.54 0.00 0.00 174.62 173.85 2bds s PRO 23 N -2.25 4.07 -0.00 0.00 0.04 -1.26 -4.88 135.00 130.72 2bds s PRO 23 Ca 0.26 2.15 0.06 0.00 0.04 0.00 0.00 61.00 63.51 2bds s PRO 23 Cb -0.12 -2.83 0.18 0.00 0.04 0.00 0.00 34.50 31.77 2bds s PRO 23 CO 0.19 -0.40 1.13 0.41 0.04 0.00 0.00 177.00 178.37 2bds n GLY 24 N 0.70 0.07 0.04 0.56 0.00 -1.26 -3.42 105.19 101.88 2bds n GLY 24 Ca 0.03 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.94 2bds n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bds n GLY 25 N 0.78 -1.15 0.11 -0.02 0.00 -1.26 -4.19 105.19 99.46 2bds n GLY 25 Ca 0.07 -0.43 -0.15 0.00 0.00 0.00 0.00 46.02 45.51 2bds n GLY 25 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2bds h TYR 26 N 0.00 0.46 0.00 1.61 -1.99 -1.96 -3.47 116.97 111.62 2bds h TYR 26 Ca 0.00 -0.33 0.00 0.00 2.00 0.00 0.00 58.73 60.40 2bds h TYR 26 Cb 0.96 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.67 2bds h TYR 26 CO 0.00 1.24 0.00 0.41 -0.00 0.00 0.00 178.16 179.81 2bds n GLY 27 N 1.44 1.03 3.48 3.88 0.00 -1.26 -5.10 105.19 108.66 2bds n GLY 27 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 2bds n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bds s TYR 28 N -2.00 1.29 0.00 1.61 2.02 -1.26 -4.87 117.35 114.14 2bds s TYR 28 Ca 0.00 1.20 0.00 0.00 -0.37 0.00 0.00 57.07 57.90 2bds s TYR 28 Cb 0.00 -3.09 0.00 0.00 -0.40 0.00 0.00 41.96 38.47 2bds s TYR 28 CO 0.00 -3.95 0.00 0.25 -1.57 0.00 0.00 175.55 170.28 2bds n THR 29 N -4.98 0.00 -3.42 -0.71 -2.24 -1.23 -4.95 114.28 96.76 2bds n THR 29 Ca 0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.40 2bds n THR 29 Cb 0.54 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.67 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 -1.38 6.15 0.03 3.42 1.04 -1.23 -5.02 113.70 116.72 2bds s SER 30 Ca 0.00 -0.38 -0.09 0.00 0.48 0.00 0.00 55.95 55.96 2bds s SER 30 Cb 0.00 -2.19 0.00 0.00 0.10 0.00 0.00 66.02 63.94 2bds s SER 30 CO 0.00 -0.36 0.18 0.54 0.98 0.00 0.00 173.24 174.58 2bds s ASN 31 N 1.74 0.04 0.10 7.02 6.03 -1.26 -0.96 114.94 127.65 2bds s ASN 31 Ca 0.10 -0.35 -0.03 0.00 -1.03 0.00 0.00 52.86 51.55 2bds s ASN 31 Cb -0.17 0.28 -0.05 0.00 -3.03 0.00 0.00 41.25 38.28 2bds s ASN 31 CO 0.12 -0.53 0.30 0.00 -2.03 0.00 0.00 177.10 174.96 2bds s TYR 33 N -1.57 1.15 -0.49 0.00 1.51 -1.26 -2.26 117.35 114.43 2bds s TYR 33 Ca 0.37 -0.50 0.07 0.00 -1.01 0.00 0.00 57.07 56.00 2bds s TYR 33 Cb -0.13 -1.06 0.23 0.00 -0.11 0.00 0.00 41.96 40.90 2bds s TYR 33 CO 0.25 -0.44 0.56 1.63 -1.11 0.00 0.00 175.55 176.45 2bds n LYS 34 N 5.03 1.28 -1.21 -0.62 4.76 -0.83 -4.98 118.16 121.58 2bds n LYS 34 Ca -0.10 -3.75 -0.37 0.00 -2.87 0.00 0.00 58.31 51.21 2bds n LYS 34 Cb 0.50 -1.67 0.04 0.00 -1.84 0.00 0.00 35.03 32.06 2bds n LYS 34 CO 0.00 0.00 0.00 1.87 -1.37 0.00 0.00 177.40 177.90 2bds n TRP 35 N 1.46 -2.25 0.76 2.13 -0.00 -1.26 -1.34 117.44 116.94 2bds n TRP 35 Ca 0.25 0.32 0.08 0.00 -0.00 0.00 0.00 57.50 58.14 2bds n TRP 35 Cb 0.47 -1.76 0.40 0.00 -0.00 0.00 0.00 31.31 30.43 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 0.57 0.24 -2.75 5.87 -0.04 -1.26 -4.99 135.00 132.64 2bds n PRO 36 Ca 0.07 0.13 -0.22 0.00 -0.04 0.00 0.00 63.50 63.44 2bds n PRO 36 Cb 0.50 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.56 2bds n PRO 36 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2bds s ASN 37 N -2.55 4.55 -0.25 3.54 0.02 -0.45 0.76 114.94 120.56 2bds s ASN 37 Ca 0.15 -0.58 -0.24 0.00 -1.02 0.00 0.00 52.86 51.17 2bds s ASN 37 Cb 0.11 0.18 0.07 0.00 0.02 0.00 0.00 41.25 41.63 2bds s ASN 37 CO 0.24 -1.73 0.68 -0.51 0.02 0.00 0.00 177.10 175.80 2bds s ILE 38 N -2.99 0.00 -0.21 0.60 2.07 0.11 -1.97 121.20 118.80 2bds s ILE 38 Ca 0.65 -0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.91 2bds s ILE 38 Cb -0.05 -0.95 0.03 0.00 0.13 0.00 0.00 42.46 41.63 2bds s ILE 38 CO 0.43 -0.00 -0.17 0.00 -1.91 0.00 0.00 174.94 173.29 2bds s TYR 41 N -1.33 2.55 0.63 0.00 1.51 -0.13 -0.76 117.35 119.81 2bds s TYR 41 Ca 0.30 -0.56 -0.11 0.00 -1.01 0.00 0.00 57.07 55.69 2bds s TYR 41 Cb -0.14 -1.71 -0.04 0.00 -0.11 0.00 0.00 41.96 39.97 2bds s TYR 41 CO 0.17 0.39 1.03 -1.25 -1.11 0.00 0.00 175.55 174.78 2bds s PRO 42 N -3.76 3.53 0.00 -1.71 0.04 -1.19 -3.54 135.00 128.37 2bds s PRO 42 Ca 0.37 0.76 0.02 0.00 0.04 0.00 0.00 61.00 62.18 2bds s PRO 42 Cb 0.04 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.52 2bds s PRO 42 CO 0.20 -0.62 0.55 -2.39 0.04 0.00 0.00 177.00 174.78