#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1agg n ASP 2 N 0.00 -4.63 -1.83 1.62 2.03 -1.26 -4.74 116.55 107.74 1agg n ASP 2 Ca 0.00 0.53 -0.21 0.00 0.52 0.00 0.00 54.79 55.63 1agg n ASP 2 Cb 0.00 -2.53 -0.07 0.00 -0.72 0.00 0.00 41.12 37.80 1agg n ASP 2 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1agg n ASN 3 N 0.72 -5.64 -3.79 1.67 4.13 -1.26 -4.97 115.26 106.12 1agg n ASN 3 Ca 0.00 0.36 -0.12 0.00 1.68 0.00 0.00 54.58 56.51 1agg n ASN 3 Cb 0.00 -4.88 -0.06 0.00 -1.54 0.00 0.00 39.78 33.30 1agg n ASN 3 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1agg s ILE 5 N -3.73 4.30 -0.82 0.00 1.01 -0.93 -4.85 121.20 116.18 1agg s ILE 5 Ca 0.29 -2.31 0.00 0.00 0.00 0.00 0.00 60.65 58.62 1agg s ILE 5 Cb 0.01 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.70 1agg s ILE 5 CO 0.13 -0.86 0.57 0.00 0.00 0.00 0.00 174.94 174.78 1agg n ALA 6 N 4.25 2.45 -2.56 9.38 0.00 -1.26 -0.75 120.51 132.02 1agg n ALA 6 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.22 1agg n ALA 6 Cb 0.41 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.78 1agg n ALA 6 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1agg s GLU 7 N -0.82 2.09 -0.21 0.00 2.02 -1.26 -4.89 118.70 115.63 1agg s GLU 7 Ca 0.00 -1.62 -0.03 0.00 0.02 0.00 0.00 54.97 53.33 1agg s GLU 7 Cb 0.00 -1.99 -0.01 0.00 0.10 0.00 0.00 34.13 32.23 1agg s GLU 7 CO 0.00 0.26 -0.05 -0.51 0.02 0.00 0.00 175.26 174.98 1agg s ASP 8 N -3.66 4.30 -1.23 -0.19 1.01 -1.26 -4.35 116.67 111.29 1agg s ASP 8 Ca 0.33 -0.37 -0.07 0.00 0.71 0.00 0.00 52.55 53.14 1agg s ASP 8 Cb -0.04 -1.73 0.01 0.00 1.01 0.00 0.00 42.92 42.17 1agg s ASP 8 CO 0.19 0.01 1.07 -1.22 0.21 0.00 0.00 175.17 175.42 1agg n TYR 9 N 4.61 -2.56 -3.51 4.23 4.01 -0.46 -4.92 117.16 118.55 1agg n TYR 9 Ca -0.18 0.92 -0.35 0.00 -0.16 0.00 0.00 57.90 58.14 1agg n TYR 9 Cb 0.51 -4.73 -0.05 0.00 -0.31 0.00 0.00 39.34 34.76 1agg n TYR 9 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1agg s GLY 10 N -3.43 2.37 -0.11 2.72 0.00 -1.26 -4.60 107.32 103.01 1agg s GLY 10 Ca 0.46 -0.31 -0.30 0.00 0.00 0.00 0.00 44.72 44.58 1agg s GLY 10 CO 0.67 -0.08 1.38 -1.59 0.00 0.00 0.00 173.10 173.48 1agg s LYS 11 N -1.96 4.23 0.40 2.90 -2.85 -1.26 -0.85 119.74 120.36 1agg s LYS 11 Ca 0.35 1.84 0.04 0.00 -1.00 0.00 0.00 55.97 57.20 1agg s LYS 11 Cb -0.14 -3.79 -0.03 0.00 -2.06 0.00 0.00 37.83 31.81 1agg s LYS 11 CO 0.19 -0.71 0.13 0.00 0.10 0.00 0.00 175.35 175.05 1agg s THR 13 N -3.22 0.13 -0.77 0.00 -4.23 -1.21 -2.37 115.64 103.97 1agg s THR 13 Ca 0.25 -1.11 -0.24 0.00 -1.18 0.00 0.00 61.69 59.41 1agg s THR 13 Cb 0.03 -0.72 0.06 0.00 1.34 0.00 0.00 72.50 73.21 1agg s THR 13 CO 0.15 -0.61 1.17 0.26 -0.54 0.00 0.00 174.62 175.04 1agg s TRP 14 N -2.29 2.55 0.00 3.99 0.52 -1.26 -3.30 118.94 119.15 1agg s TRP 14 Ca -0.08 -0.48 0.00 0.00 0.02 0.00 0.00 56.10 55.56 1agg s TRP 14 Cb -0.04 -4.48 0.00 0.00 -1.15 0.00 0.00 33.47 27.81 1agg s TRP 14 CO -0.04 -1.84 0.00 0.41 0.02 0.00 0.00 176.95 175.51 1agg n GLY 15 N 5.58 0.87 0.00 0.98 0.00 -1.26 -5.12 105.19 106.24 1agg n GLY 15 Ca 0.07 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1agg n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1agg n GLY 16 N 0.00 1.39 3.76 -0.02 0.00 -1.21 -5.13 105.19 103.98 1agg n GLY 16 Ca 0.00 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 1agg n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1agg s THR 17 N -1.25 4.34 0.54 2.61 2.01 -1.26 -4.91 115.64 117.71 1agg s THR 17 Ca 0.00 1.86 0.06 0.00 0.31 0.00 0.00 61.69 63.92 1agg s THR 17 Cb 0.00 -4.22 0.04 0.00 0.01 0.00 0.00 72.50 68.33 1agg s THR 17 CO 0.00 0.47 0.43 -0.54 -0.69 0.00 0.00 174.62 174.29 1agg s LYS 18 N -0.85 2.27 0.31 4.92 -0.14 -1.26 -3.28 119.74 121.70 1agg s LYS 18 Ca 0.39 -1.97 -0.27 0.00 -1.36 0.00 0.00 55.97 52.77 1agg s LYS 18 Cb -0.24 -2.15 -0.10 0.00 -1.68 0.00 0.00 37.83 33.67 1agg s LYS 18 CO 0.28 -0.61 0.97 0.00 -0.76 0.00 0.00 175.35 175.23 1agg n ARG 21 N -5.24 1.60 -3.13 0.00 1.74 -1.26 -4.82 116.66 105.55 1agg n ARG 21 Ca 0.11 -1.38 -0.14 0.00 -0.77 0.00 0.00 57.85 55.67 1agg n ARG 21 Cb 0.40 -1.54 0.07 0.00 -1.02 0.00 0.00 32.46 30.37 1agg n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1agg n GLY 22 N -0.11 -0.78 3.31 -0.13 0.00 -1.08 -4.65 105.19 101.74 1agg n GLY 22 Ca 0.27 0.38 -0.32 0.00 0.00 0.00 0.00 46.02 46.36 1agg n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1agg s ARG 23 N -4.50 2.78 0.93 1.61 1.81 -1.00 -5.03 118.95 115.54 1agg s ARG 23 Ca 0.31 -0.83 -0.15 0.00 -1.72 0.00 0.00 55.73 53.34 1agg s ARG 23 Cb -0.04 -2.30 0.17 0.00 -0.45 0.00 0.00 34.95 32.33 1agg s ARG 23 CO 0.66 0.35 1.25 -1.25 -0.68 0.00 0.00 175.30 175.64 1agg s PRO 24 N -0.07 0.93 0.10 3.54 0.04 -1.26 -2.47 135.00 135.80 1agg s PRO 24 Ca -0.05 -0.18 0.10 0.00 0.04 0.00 0.00 61.00 60.91 1agg s PRO 24 Cb -0.14 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1agg s PRO 24 CO 0.04 -2.26 -0.27 0.00 0.04 0.00 0.00 177.00 174.56 1agg s ARG 26 N -1.75 2.75 0.84 0.00 3.52 -0.56 -4.93 118.95 118.83 1agg s ARG 26 Ca 0.13 -0.74 -0.12 0.00 -0.13 0.00 0.00 55.73 54.87 1agg s ARG 26 Cb -0.10 -2.39 0.09 0.00 -1.56 0.00 0.00 34.95 31.00 1agg s ARG 26 CO 0.04 -0.19 1.14 0.00 -0.81 0.00 0.00 175.30 175.49 1agg n SER 28 N -3.47 -0.60 -0.11 0.00 2.88 -1.25 -4.75 113.62 106.31 1agg n SER 28 Ca 0.07 -0.36 -0.11 0.00 -1.33 0.00 0.00 58.87 57.14 1agg n SER 28 Cb 0.59 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.02 1agg n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1agg h MET 29 N 0.00 0.61 -0.09 -1.46 -0.00 -1.91 -3.20 114.93 108.88 1agg h MET 29 Ca 0.00 -0.22 -0.24 0.00 -0.00 0.00 0.00 59.70 59.24 1agg h MET 29 Cb 0.00 -0.04 0.01 0.00 -0.00 0.00 0.00 31.60 31.57 1agg h MET 29 CO 0.00 0.77 -0.89 -0.84 -0.00 0.00 0.00 176.91 175.95 1agg h ILE 30 N 0.40 1.28 0.00 -0.10 3.07 -1.97 -3.49 117.51 116.70 1agg h ILE 30 Ca 0.09 -2.09 0.00 0.00 1.55 0.00 0.00 64.86 64.41 1agg h ILE 30 Cb 0.52 2.15 0.00 0.00 -0.27 0.00 0.00 36.82 39.22 1agg h ILE 30 CO 0.03 0.66 0.00 0.61 -1.05 0.00 0.00 178.15 178.39 1agg n GLY 31 N 0.85 3.64 3.91 0.16 0.00 -1.21 -5.11 105.19 107.43 1agg n GLY 31 Ca -0.09 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.70 1agg n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1agg s THR 32 N 0.00 4.96 -0.50 2.61 -4.23 -1.26 -4.56 115.64 112.66 1agg s THR 32 Ca 0.00 0.10 -0.03 0.00 -1.18 0.00 0.00 61.69 60.58 1agg s THR 32 Cb 0.00 -3.81 0.00 0.00 1.34 0.00 0.00 72.50 70.03 1agg s THR 32 CO 0.00 -0.61 0.50 0.59 -0.54 0.00 0.00 174.62 174.57 1agg n ASN 33 N -1.68 -6.34 -4.68 3.99 4.13 -1.26 -4.62 115.26 104.80 1agg n ASN 33 Ca -0.01 0.04 -0.29 0.00 1.68 0.00 0.00 54.58 56.01 1agg n ASN 33 Cb 0.55 -4.23 0.17 0.00 -1.54 0.00 0.00 39.78 34.74 1agg n ASN 33 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1agg s GLU 35 N -4.95 0.74 0.76 0.00 4.04 -1.14 -1.54 118.70 116.61 1agg s GLU 35 Ca 0.65 -1.17 -0.11 0.00 0.04 0.00 0.00 54.97 54.38 1agg s GLU 35 Cb -0.19 0.26 0.05 0.00 0.02 0.00 0.00 34.13 34.27 1agg s GLU 35 CO 0.58 -0.18 1.08 0.00 -1.84 0.00 0.00 175.26 174.89 1agg s THR 37 N -2.99 0.33 -0.06 0.00 -1.32 -1.12 -1.35 115.64 109.13 1agg s THR 37 Ca 0.60 -0.16 -0.30 0.00 -1.21 0.00 0.00 61.69 60.63 1agg s THR 37 Cb -0.16 -0.29 -0.03 0.00 -1.51 0.00 0.00 72.50 70.51 1agg s THR 37 CO 0.56 0.10 1.24 -2.16 -2.21 0.00 0.00 174.62 172.15 1agg s PRO 38 N 0.02 4.32 0.00 7.08 0.04 -1.26 -4.64 135.00 140.57 1agg s PRO 38 Ca 0.00 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1agg s PRO 38 Cb -0.03 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.92 1agg s PRO 38 CO -0.00 -0.51 0.00 0.54 0.04 0.00 0.00 177.00 177.07 1agg n ARG 39 N 5.45 0.00 -3.60 4.56 5.12 -1.26 -5.07 116.66 121.87 1agg n ARG 39 Ca 0.12 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.75 1agg n ARG 39 Cb 0.46 0.00 -0.15 0.00 -1.16 0.00 0.00 32.46 31.60 1agg n ARG 39 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1agg s LEU 40 N 0.00 0.81 0.09 0.55 1.02 -1.26 -5.14 118.68 114.75 1agg s LEU 40 Ca 0.00 -1.18 -0.30 0.00 0.02 0.00 0.00 54.13 52.67 1agg s LEU 40 Cb 0.00 -0.43 -0.06 0.00 0.02 0.00 0.00 46.19 45.72 1agg s LEU 40 CO 0.00 -0.41 1.11 0.27 0.02 0.00 0.00 176.35 177.34 1agg s ILE 41 N 2.01 4.16 -0.02 -0.59 -4.36 -1.26 -5.00 121.20 116.15 1agg s ILE 41 Ca 0.07 1.65 -0.01 0.00 -0.26 0.00 0.00 60.65 62.10 1agg s ILE 41 Cb -0.16 -4.06 -0.00 0.00 1.25 0.00 0.00 42.46 39.48 1agg s ILE 41 CO -0.28 0.18 -0.03 0.23 0.24 0.00 0.00 174.94 175.29 1agg n MET 42 N 3.37 0.07 -0.86 0.37 2.81 -1.26 -5.12 117.12 116.49 1agg n MET 42 Ca 0.06 0.29 0.00 0.00 -1.81 0.00 0.00 57.70 56.24 1agg n MET 42 Cb 0.47 -0.88 0.00 0.00 -0.71 0.00 0.00 33.22 32.10 1agg n MET 42 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1agg n GLU 43 N -2.60 -2.19 0.00 0.03 0.00 -1.26 -5.11 120.64 109.50 1agg n GLU 43 Ca -0.01 1.65 0.00 0.00 0.00 0.00 0.00 57.16 58.80 1agg n GLU 43 Cb 0.04 -1.72 0.00 0.00 0.00 0.00 0.00 31.44 29.76 1agg n GLU 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1agg n GLY 44 N 0.14 0.03 3.08 8.31 0.00 -1.26 -4.98 105.19 110.51 1agg n GLY 44 Ca 0.00 0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1agg n GLY 44 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1agg s LEU 45 N -1.32 5.15 0.00 0.99 1.98 -1.26 -4.86 118.68 119.37 1agg s LEU 45 Ca 0.00 -2.95 0.00 0.00 -2.89 0.00 0.00 54.13 48.29 1agg s LEU 45 Cb 0.00 -1.83 0.00 0.00 0.66 0.00 0.00 46.19 45.02 1agg s LEU 45 CO 0.00 -0.34 0.00 -0.24 -1.89 0.00 0.00 176.35 173.88 1agg n SER 46 N 3.34 0.00 -2.47 3.68 2.88 -1.26 -4.77 113.62 115.02 1agg n SER 46 Ca 0.09 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.61 1agg n SER 46 Cb 0.37 0.05 -0.01 0.00 -0.75 0.00 0.00 64.21 63.87 1agg n SER 46 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1agg n PHE 47 N -1.81 -3.43 -1.46 0.66 3.72 -1.26 -3.85 117.46 110.03 1agg n PHE 47 Ca 0.00 1.66 0.00 0.00 -0.05 0.00 0.00 57.45 59.06 1agg n PHE 47 Cb 0.00 -3.56 0.00 0.00 -0.94 0.00 0.00 39.48 34.98 1agg n PHE 47 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71