#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 -1.23 -0.20 0.00 0.00 -1.25 -4.84 120.51 112.98 2bds n ALA 2 Ca 0.00 -0.37 -0.10 0.00 0.00 0.00 0.00 53.44 52.97 2bds n ALA 2 Cb 0.00 -1.99 0.13 0.00 0.00 0.00 0.00 19.45 17.59 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 -1.97 2.02 -2.21 0.00 -0.04 -1.26 -3.86 135.00 127.69 2bds n PRO 3 Ca 0.10 -1.70 -0.42 0.00 -0.04 0.00 0.00 63.50 61.44 2bds n PRO 3 Cb 0.51 -1.72 -0.03 0.00 -0.04 0.00 0.00 33.50 32.22 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 2.12 2.93 0.44 0.00 0.08 -1.26 0.36 117.98 122.64 2bds s PHE 5 Ca 0.64 0.97 0.02 0.00 0.12 0.00 0.00 56.93 58.69 2bds s PHE 5 Cb -0.32 -3.25 -0.01 0.00 -0.57 0.00 0.00 43.02 38.87 2bds s PHE 5 CO 0.27 -1.74 0.09 0.00 -0.10 0.00 0.00 175.22 173.75 2bds s SER 7 N -3.57 6.84 0.00 0.00 1.04 -1.26 -2.63 113.70 114.12 2bds s SER 7 Ca 0.13 2.31 0.00 0.00 0.48 0.00 0.00 55.95 58.87 2bds s SER 7 Cb 0.01 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2bds s SER 7 CO 0.09 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.47 2bds n GLY 8 N 0.80 1.18 2.71 7.32 0.00 -1.26 -4.88 105.19 111.05 2bds n GLY 8 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 0.45 0.00 1.61 1.02 -1.08 -5.13 119.74 116.61 2bds s LYS 9 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 55.97 55.84 2bds s LYS 9 Cb 0.00 -1.64 0.00 0.00 -0.52 0.00 0.00 37.83 35.67 2bds s LYS 9 CO 0.00 -0.54 0.00 -0.35 -0.92 0.00 0.00 175.35 173.54 2bds n PRO 10 N 5.15 0.26 0.00 -1.68 -0.04 -1.26 -1.88 135.00 135.54 2bds n PRO 10 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2bds n PRO 10 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 2bds n PRO 10 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bds n GLY 11 N 4.27 1.69 3.48 0.55 0.00 -1.26 -4.72 105.19 109.21 2bds n GLY 11 Ca 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.59 2bds n GLY 11 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bds s ARG 12 N 0.00 1.12 0.01 1.61 3.52 -1.26 -4.58 118.95 119.38 2bds s ARG 12 Ca 0.00 -0.08 -0.05 0.00 -0.13 0.00 0.00 55.73 55.48 2bds s ARG 12 Cb 0.00 0.52 -0.01 0.00 -1.56 0.00 0.00 34.95 33.91 2bds s ARG 12 CO 0.00 -0.42 0.08 0.20 -0.81 0.00 0.00 175.30 174.35 2bds s GLY 13 N -1.90 0.11 -0.06 8.12 0.00 1.11 -4.60 107.32 110.10 2bds s GLY 13 Ca -0.05 -0.29 -0.30 0.00 0.00 0.00 0.00 44.72 44.08 2bds s GLY 13 CO -0.01 -0.41 1.14 0.99 0.00 0.00 0.00 173.10 174.82 2bds s ASP 14 N -1.42 7.11 -0.44 1.64 1.11 -0.43 -2.69 116.67 121.56 2bds s ASP 14 Ca -0.15 1.74 -0.24 0.00 0.18 0.00 0.00 52.55 54.09 2bds s ASP 14 Cb -0.08 -2.56 0.02 0.00 1.07 0.00 0.00 42.92 41.37 2bds s ASP 14 CO 0.01 -0.53 0.81 -0.22 1.18 0.00 0.00 175.17 176.41 2bds s LEU 15 N 2.07 4.18 0.59 1.23 0.20 -1.26 0.14 118.68 125.84 2bds s LEU 15 Ca 0.54 0.02 0.05 0.00 0.69 0.00 0.00 54.13 55.42 2bds s LEU 15 Cb -0.23 -3.02 0.08 0.00 -0.43 0.00 0.00 46.19 42.59 2bds s LEU 15 CO 0.21 -0.91 0.82 0.26 -0.29 0.00 0.00 176.35 176.45 2bds s TRP 16 N 3.34 1.93 0.00 5.38 0.52 0.81 -4.74 118.94 126.18 2bds s TRP 16 Ca 0.31 -0.41 0.00 0.00 0.02 0.00 0.00 56.10 56.03 2bds s TRP 16 Cb -0.12 -2.58 0.00 0.00 -1.15 0.00 0.00 33.47 29.62 2bds s TRP 16 CO 0.22 -1.17 0.00 -0.89 0.02 0.00 0.00 176.95 175.13 2bds n ILE 17 N -2.39 0.00 -1.26 2.03 5.41 -1.26 -2.04 119.36 119.85 2bds n ILE 17 Ca 0.13 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.51 2bds n ILE 17 Cb 0.61 -0.74 -0.08 0.00 -0.71 0.00 0.00 39.64 38.72 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 2.81 -3.67 1.39 -0.00 -0.28 -2.40 117.00 114.86 2bds n LEU 18 Ca 0.00 -2.59 -0.30 0.00 -0.00 0.00 0.00 56.01 53.13 2bds n LEU 18 Cb 0.00 -1.19 -0.14 0.00 -0.00 0.00 0.00 43.42 42.09 2bds n LEU 18 CO 0.00 -1.47 -0.31 -0.13 -0.00 0.00 0.00 177.39 175.48 2bds s ARG 19 N 6.22 0.71 0.00 1.47 0.52 -1.26 -4.96 118.95 121.65 2bds s ARG 19 Ca 0.65 -1.18 0.00 0.00 -0.52 0.00 0.00 55.73 54.68 2bds s ARG 19 Cb 0.09 -1.83 0.00 0.00 0.52 0.00 0.00 34.95 33.73 2bds s ARG 19 CO 0.19 -1.05 0.64 0.41 0.02 0.00 0.00 175.30 175.50 2bds n GLY 20 N 4.59 -0.20 3.05 -3.53 0.00 -1.26 -4.48 105.19 103.36 2bds n GLY 20 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.28 0.40 -0.05 2.61 -4.23 -1.26 -5.07 115.64 105.76 2bds s THR 21 Ca 0.00 -1.18 -0.02 0.00 -1.18 0.00 0.00 61.69 59.31 2bds s THR 21 Cb 0.00 -0.69 -0.04 0.00 1.34 0.00 0.00 72.50 73.11 2bds s THR 21 CO 0.00 -0.52 0.08 0.00 -0.54 0.00 0.00 174.62 173.64 2bds n PRO 23 N 1.59 1.57 0.00 0.00 -0.01 -1.26 -4.88 135.00 132.01 2bds n PRO 23 Ca -0.16 0.57 0.14 0.00 -0.01 0.00 0.00 63.50 64.03 2bds n PRO 23 Cb 0.53 -2.29 0.50 0.00 -0.01 0.00 0.00 33.50 32.24 2bds n PRO 23 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2bds n GLY 24 N 0.98 -0.44 0.22 -1.23 0.00 -1.26 -3.69 105.19 99.77 2bds n GLY 24 Ca 0.09 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.84 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 4.91 0.00 1.29 -0.02 0.00 -1.97 -3.14 103.07 104.14 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 -0.43 -1.72 0.00 0.00 0.00 176.54 174.39 2bds n TYR 26 N -3.06 0.26 -0.52 5.60 4.02 -1.24 -4.93 117.16 117.29 2bds n TYR 26 Ca 0.04 0.08 0.00 0.00 -0.01 0.00 0.00 57.90 58.00 2bds n TYR 26 Cb 0.51 -0.48 0.00 0.00 -0.02 0.00 0.00 39.34 39.35 2bds n TYR 26 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bds n GLY 27 N 1.43 0.76 3.27 2.72 0.00 -1.19 -5.04 105.19 107.14 2bds n GLY 27 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.10 -2.26 0.00 1.61 4.01 -1.26 -4.89 117.16 112.28 2bds n TYR 28 Ca 0.00 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 2bds n TYR 28 Cb 0.00 -1.51 0.00 0.00 -0.31 0.00 0.00 39.34 37.52 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 -5.05 0.00 -3.64 -0.72 -2.24 -1.18 -4.97 114.28 96.48 2bds n THR 29 Ca 0.06 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.47 2bds n THR 29 Cb 0.55 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.71 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 -1.37 6.45 0.10 3.42 1.04 -1.16 -5.00 113.70 117.18 2bds s SER 30 Ca 0.00 0.53 -0.25 0.00 0.48 0.00 0.00 55.95 56.70 2bds s SER 30 Cb 0.00 -2.15 0.07 0.00 0.10 0.00 0.00 66.02 64.04 2bds s SER 30 CO 0.00 0.22 0.62 0.54 0.98 0.00 0.00 173.24 175.60 2bds s ASN 31 N -0.13 -0.59 -0.01 7.02 6.03 -1.26 0.15 114.94 126.15 2bds s ASN 31 Ca 0.16 0.20 0.04 0.00 -1.03 0.00 0.00 52.86 52.23 2bds s ASN 31 Cb -0.13 0.58 -0.03 0.00 -3.03 0.00 0.00 41.25 38.64 2bds s ASN 31 CO 0.04 -0.87 -0.12 0.00 -2.03 0.00 0.00 177.10 174.12 2bds s TYR 33 N -0.88 2.61 -0.43 0.00 1.51 -1.26 -1.97 117.35 116.93 2bds s TYR 33 Ca 0.14 -1.30 0.05 0.00 -1.01 0.00 0.00 57.07 54.95 2bds s TYR 33 Cb -0.11 -1.78 0.17 0.00 -0.11 0.00 0.00 41.96 40.14 2bds s TYR 33 CO 0.04 -0.59 0.44 0.15 -1.11 0.00 0.00 175.55 174.48 2bds s LYS 34 N 0.80 0.90 0.89 -0.62 1.02 -0.87 -5.00 119.74 116.86 2bds s LYS 34 Ca -0.08 -1.66 -0.17 0.00 0.02 0.00 0.00 55.97 54.08 2bds s LYS 34 Cb -0.16 -0.97 -0.15 0.00 -0.52 0.00 0.00 37.83 36.03 2bds s LYS 34 CO -0.01 -1.34 -0.65 1.87 -0.92 0.00 0.00 175.35 174.29 2bds n TRP 35 N 3.09 -4.71 0.92 3.18 -0.00 -1.26 -2.06 117.44 116.60 2bds n TRP 35 Ca 0.24 0.07 0.00 0.00 -0.00 0.00 0.00 57.50 57.81 2bds n TRP 35 Cb 0.49 -1.49 0.00 0.00 -0.00 0.00 0.00 31.31 30.31 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 2.26 0.92 -1.81 5.87 -0.04 -1.26 -4.97 135.00 135.97 2bds n PRO 36 Ca 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2bds n PRO 36 Cb 0.54 -1.10 -0.00 0.00 -0.04 0.00 0.00 33.50 32.90 2bds n PRO 36 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2bds n ASN 37 N 0.48 -0.03 -3.65 3.54 3.02 -0.87 -1.13 115.26 116.62 2bds n ASN 37 Ca 0.00 -1.05 -0.15 0.00 -0.03 0.00 0.00 54.58 53.34 2bds n ASN 37 Cb 0.43 0.06 -0.07 0.00 -0.61 0.00 0.00 39.78 39.58 2bds n ASN 37 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2bds s ILE 38 N -2.27 0.03 0.25 2.41 2.07 -0.87 -2.06 121.20 120.77 2bds s ILE 38 Ca 0.01 -0.26 0.11 0.00 -1.41 0.00 0.00 60.65 59.10 2bds s ILE 38 Cb 0.00 -0.80 -0.05 0.00 0.13 0.00 0.00 42.46 41.75 2bds s ILE 38 CO 0.01 -0.14 -0.12 0.00 -1.91 0.00 0.00 174.94 172.78 2bds s TYR 41 N -0.99 2.49 0.64 0.00 1.51 0.41 -1.31 117.35 120.10 2bds s TYR 41 Ca 0.00 -0.54 -0.12 0.00 -1.01 0.00 0.00 57.07 55.39 2bds s TYR 41 Cb -0.09 -1.58 -0.02 0.00 -0.11 0.00 0.00 41.96 40.17 2bds s TYR 41 CO 0.02 0.48 1.05 -1.25 -1.11 0.00 0.00 175.55 174.73 2bds s PRO 42 N -3.69 3.25 0.00 -1.71 0.04 -1.24 -3.00 135.00 128.65 2bds s PRO 42 Ca 0.35 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2bds s PRO 42 Cb 0.04 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2bds s PRO 42 CO 0.18 -0.85 0.44 -2.39 0.04 0.00 0.00 177.00 174.42