#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 -3.40 -1.06 0.00 0.00 -1.25 -3.49 120.51 111.31 2bds n ALA 2 Ca 0.00 -0.14 -0.14 0.00 0.00 0.00 0.00 53.44 53.16 2bds n ALA 2 Cb 0.00 -1.33 -0.15 0.00 0.00 0.00 0.00 19.45 17.97 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 1.62 2.03 -2.42 0.00 -0.04 -1.23 -1.37 135.00 133.60 2bds n PRO 3 Ca 0.06 -1.17 -0.41 0.00 -0.04 0.00 0.00 63.50 61.95 2bds n PRO 3 Cb 0.47 -2.00 -0.04 0.00 -0.04 0.00 0.00 33.50 31.90 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 -0.79 1.85 0.00 0.00 0.40 -1.26 0.33 117.98 118.51 2bds s PHE 5 Ca 0.47 0.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.27 2bds s PHE 5 Cb -0.33 -3.87 0.00 0.00 0.51 0.00 0.00 43.02 39.33 2bds s PHE 5 CO 0.40 -2.56 0.00 0.00 0.70 0.00 0.00 175.22 173.76 2bds s SER 7 N -0.88 6.38 0.00 0.00 0.01 -1.26 -2.64 113.70 115.31 2bds s SER 7 Ca 0.00 0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.79 2bds s SER 7 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2bds s SER 7 CO 0.00 -1.45 0.00 0.61 0.41 0.00 0.00 173.24 172.81 2bds n GLY 8 N 5.06 1.01 3.18 3.44 0.00 -1.26 -5.01 105.19 111.61 2bds n GLY 8 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.25 2.68 0.00 1.61 1.02 -1.08 -5.11 119.74 118.61 2bds s LYS 9 Ca 0.00 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 54.90 2bds s LYS 9 Cb 0.00 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 2bds s LYS 9 CO 0.00 -0.47 0.00 -0.35 -0.92 0.00 0.00 175.35 173.61 2bds n PRO 10 N 4.64 0.74 0.00 -1.68 -0.04 -1.26 -2.20 135.00 135.20 2bds n PRO 10 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2bds n PRO 10 Cb 0.46 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 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 2.65 1.68 3.83 0.55 0.00 -1.26 -4.65 105.19 107.98 2bds n GLY 11 Ca 0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 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 1.92 0.12 1.61 1.70 -1.26 -4.55 118.95 118.49 2bds s ARG 12 Ca 0.00 -1.20 -0.21 0.00 -0.47 0.00 0.00 55.73 53.84 2bds s ARG 12 Cb 0.00 0.56 0.06 0.00 -0.57 0.00 0.00 34.95 34.99 2bds s ARG 12 CO 0.00 -0.90 0.53 0.20 -1.08 0.00 0.00 175.30 174.06 2bds s GLY 13 N -3.11 -0.48 -0.14 3.88 0.00 0.99 -4.52 107.32 103.94 2bds s GLY 13 Ca 0.16 0.41 -0.29 0.00 0.00 0.00 0.00 44.72 44.99 2bds s GLY 13 CO 0.09 0.10 1.11 0.99 0.00 0.00 0.00 173.10 175.39 2bds s ASP 14 N -2.52 7.11 -0.64 1.64 1.01 -0.72 -0.91 116.67 121.64 2bds s ASP 14 Ca -0.00 1.59 -0.21 0.00 0.71 0.00 0.00 52.55 54.64 2bds s ASP 14 Cb -0.00 -2.55 0.09 0.00 1.01 0.00 0.00 42.92 41.47 2bds s ASP 14 CO -0.09 -0.60 0.84 -0.22 0.21 0.00 0.00 175.17 175.31 2bds s LEU 15 N 2.64 4.92 -0.11 1.23 0.20 -0.47 0.48 118.68 127.57 2bds s LEU 15 Ca 0.50 -1.26 -0.30 0.00 0.69 0.00 0.00 54.13 53.77 2bds s LEU 15 Cb -0.20 -2.36 -0.02 0.00 -0.43 0.00 0.00 46.19 43.18 2bds s LEU 15 CO 0.15 -1.26 1.21 0.26 -0.29 0.00 0.00 176.35 176.42 2bds s TRP 16 N 3.31 3.06 -0.97 5.38 0.52 0.81 -3.92 118.94 127.12 2bds s TRP 16 Ca 0.17 1.15 0.25 0.00 0.02 0.00 0.00 56.10 57.69 2bds s TRP 16 Cb -0.20 -3.44 0.49 0.00 -1.15 0.00 0.00 33.47 29.17 2bds s TRP 16 CO 0.07 -1.41 1.40 -0.89 0.02 0.00 0.00 176.95 176.15 2bds n ILE 17 N 4.98 0.02 -2.98 2.03 5.41 -1.26 0.19 119.36 127.75 2bds n ILE 17 Ca 0.12 -0.02 -0.16 0.00 1.00 0.00 0.00 62.75 63.69 2bds n ILE 17 Cb 0.46 0.23 -0.01 0.00 -0.71 0.00 0.00 39.64 39.60 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 -1.54 -1.47 -3.52 1.39 4.77 -1.08 -3.39 117.00 112.16 2bds n LEU 18 Ca 0.05 -3.95 -0.09 0.00 -0.03 0.00 0.00 56.01 52.00 2bds n LEU 18 Cb 0.34 0.73 -0.03 0.00 -2.33 0.00 0.00 43.42 42.14 2bds n LEU 18 CO 0.35 2.02 0.72 -0.13 -1.33 0.00 0.00 177.39 179.02 2bds s ARG 19 N -0.14 0.75 -0.11 3.23 0.52 -0.74 -5.00 118.95 117.46 2bds s ARG 19 Ca 0.33 -0.21 0.11 0.00 -0.52 0.00 0.00 55.73 55.44 2bds s ARG 19 Cb 0.18 0.35 -0.15 0.00 0.52 0.00 0.00 34.95 35.84 2bds s ARG 19 CO -0.17 -0.32 0.06 0.41 0.02 0.00 0.00 175.30 175.30 2bds n GLY 20 N -0.07 -0.60 3.23 -3.53 0.00 -1.26 -4.48 105.19 98.47 2bds n GLY 20 Ca -0.08 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.34 1.33 0.32 2.61 -4.23 -1.26 -4.99 115.64 107.07 2bds s THR 21 Ca -0.06 -1.54 -0.08 0.00 -1.18 0.00 0.00 61.69 58.83 2bds s THR 21 Cb 0.04 -1.37 -0.06 0.00 1.34 0.00 0.00 72.50 72.44 2bds s THR 21 CO 0.50 -0.28 0.63 0.00 -0.54 0.00 0.00 174.62 174.94 2bds n PRO 23 N -0.86 -3.68 -0.02 0.00 -0.04 -1.26 -4.96 135.00 124.17 2bds n PRO 23 Ca 0.00 -1.11 0.03 0.00 -0.04 0.00 0.00 63.50 62.37 2bds n PRO 23 Cb 0.54 -1.58 0.04 0.00 -0.04 0.00 0.00 33.50 32.46 2bds n PRO 23 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bds n GLY 24 N -4.07 3.28 0.25 0.55 0.00 -1.26 -4.56 105.19 99.37 2bds n GLY 24 Ca 0.11 -0.29 0.06 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.72 -0.11 0.09 -0.02 0.00 -1.26 -4.44 105.19 98.73 2bds n GLY 25 Ca 0.04 -0.37 -0.06 0.00 0.00 0.00 0.00 46.02 45.63 2bds n GLY 25 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bds n TYR 26 N -0.35 0.30 0.00 1.61 4.02 -1.26 -4.99 117.16 116.49 2bds n TYR 26 Ca 0.05 0.11 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 2bds n TYR 26 Cb 0.26 -0.99 0.00 0.00 -0.02 0.00 0.00 39.34 38.59 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 1.62 0.50 3.35 2.72 0.00 -1.26 -5.06 105.19 107.05 2bds n GLY 27 Ca -0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.88 -1.32 0.00 1.61 4.01 -1.26 -4.87 117.16 113.45 2bds n TYR 28 Ca 0.00 0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.86 2bds n TYR 28 Cb 0.00 -1.65 0.00 0.00 -0.31 0.00 0.00 39.34 37.38 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 -4.34 0.00 -3.33 -0.72 -2.24 -1.24 -5.01 114.28 97.40 2bds n THR 29 Ca 0.03 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.38 2bds n THR 29 Cb 0.59 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.73 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 -1.33 6.20 -0.06 3.42 1.04 -1.22 -5.02 113.70 116.74 2bds s SER 30 Ca 0.00 -0.53 -0.16 0.00 0.48 0.00 0.00 55.95 55.75 2bds s SER 30 Cb 0.00 -2.22 0.03 0.00 0.10 0.00 0.00 66.02 63.93 2bds s SER 30 CO 0.00 -0.52 0.37 0.54 0.98 0.00 0.00 173.24 174.61 2bds s ASN 31 N 1.79 -0.30 -0.11 7.02 2.20 -1.26 -0.49 114.94 123.79 2bds s ASN 31 Ca 0.13 0.36 -0.09 0.00 -0.94 0.00 0.00 52.86 52.32 2bds s ASN 31 Cb -0.17 0.49 -0.04 0.00 -2.00 0.00 0.00 41.25 39.52 2bds s ASN 31 CO 0.13 -0.37 0.20 0.00 -2.94 0.00 0.00 177.10 174.12 2bds s TYR 33 N -0.78 2.54 -0.48 0.00 2.02 -1.26 -2.34 117.35 117.05 2bds s TYR 33 Ca 0.16 -0.68 0.07 0.00 -0.37 0.00 0.00 57.07 56.24 2bds s TYR 33 Cb -0.13 -1.65 0.18 0.00 -0.40 0.00 0.00 41.96 39.96 2bds s TYR 33 CO 0.05 -0.19 0.65 -1.59 -1.57 0.00 0.00 175.55 172.90 2bds s LYS 34 N -0.09 0.99 0.92 -0.62 0.00 -1.09 -5.00 119.74 114.85 2bds s LYS 34 Ca -0.05 -1.02 -0.15 0.00 0.00 0.00 0.00 55.97 54.75 2bds s LYS 34 Cb -0.14 -0.21 -0.05 0.00 0.00 0.00 0.00 37.83 37.43 2bds s LYS 34 CO 0.04 -1.30 -0.05 0.91 0.00 0.00 0.00 175.35 174.95 2bds n TRP 35 N 3.27 -2.83 1.42 1.78 7.02 -1.26 -1.96 117.44 124.88 2bds n TRP 35 Ca 0.18 0.16 0.05 0.00 -1.02 0.00 0.00 57.50 56.87 2bds n TRP 35 Cb 0.55 -1.67 0.33 0.00 -2.42 0.00 0.00 31.31 28.10 2bds n TRP 35 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 2bds n PRO 36 N 0.08 0.71 -0.50 -0.99 -0.04 -1.26 -4.96 135.00 128.04 2bds n PRO 36 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2bds n PRO 36 Cb 0.54 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 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 -0.74 1.44 -3.65 3.54 5.03 -0.83 -1.79 115.26 118.26 2bds n ASN 37 Ca 0.08 -0.29 -0.03 0.00 0.87 0.00 0.00 54.58 55.21 2bds n ASN 37 Cb 0.04 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 38.74 2bds n ASN 37 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2bds s ILE 38 N 0.78 0.00 -0.26 2.41 2.07 0.51 -2.66 121.20 124.05 2bds s ILE 38 Ca 0.00 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.25 2bds s ILE 38 Cb 0.00 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.64 2bds s ILE 38 CO 0.00 0.00 -0.09 0.00 -1.91 0.00 0.00 174.94 172.94 2bds s TYR 41 N -1.91 2.20 0.61 0.00 1.51 0.36 -1.76 117.35 118.36 2bds s TYR 41 Ca 0.54 -0.77 -0.13 0.00 -1.01 0.00 0.00 57.07 55.70 2bds s TYR 41 Cb -0.12 -1.45 -0.03 0.00 -0.11 0.00 0.00 41.96 40.25 2bds s TYR 41 CO 0.17 0.26 1.03 -1.25 -1.11 0.00 0.00 175.55 174.66 2bds s PRO 42 N -3.77 3.44 0.00 -1.71 0.04 -1.19 -3.45 135.00 128.36 2bds s PRO 42 Ca 0.34 0.95 0.07 0.00 0.04 0.00 0.00 61.00 62.40 2bds s PRO 42 Cb 0.08 -2.06 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2bds s PRO 42 CO 0.16 -0.70 0.72 -2.39 0.04 0.00 0.00 177.00 174.83