#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1agg s ASP 2 N 0.00 4.98 -0.43 -1.84 -1.08 -1.26 -4.65 116.67 112.39 1agg s ASP 2 Ca 0.00 -0.56 -0.16 0.00 -0.52 0.00 0.00 52.55 51.31 1agg s ASP 2 Cb 0.00 -1.86 0.02 0.00 -1.46 0.00 0.00 42.92 39.62 1agg s ASP 2 CO 0.00 -0.13 0.59 0.59 0.52 0.00 0.00 175.17 176.74 1agg n ASN 3 N 4.86 -7.95 -4.35 -0.34 4.13 -1.26 -4.85 115.26 105.50 1agg n ASN 3 Ca -0.15 0.55 -0.32 0.00 1.68 0.00 0.00 54.58 56.34 1agg n ASN 3 Cb 0.49 -5.40 0.18 0.00 -1.54 0.00 0.00 39.78 33.51 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 -2.31 3.70 -0.98 0.00 1.01 -0.99 -4.81 121.20 116.83 1agg s ILE 5 Ca 0.59 -2.58 0.01 0.00 0.00 0.00 0.00 60.65 58.67 1agg s ILE 5 Cb -0.16 -3.44 0.08 0.00 0.01 0.00 0.00 42.46 38.94 1agg s ILE 5 CO 0.66 -0.82 0.64 0.00 0.00 0.00 0.00 174.94 175.42 1agg n ALA 6 N 3.95 2.63 -2.34 9.38 0.00 -1.26 -0.68 120.51 132.18 1agg n ALA 6 Ca 0.04 -0.18 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 1agg n ALA 6 Cb 0.39 -1.01 -0.05 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 -1.21 2.41 -0.20 0.00 2.02 -1.26 -4.93 118.70 115.53 1agg s GLU 7 Ca 0.05 -1.64 -0.02 0.00 0.02 0.00 0.00 54.97 53.38 1agg s GLU 7 Cb 0.04 -2.21 0.00 0.00 0.10 0.00 0.00 34.13 32.06 1agg s GLU 7 CO 0.02 -0.12 -0.10 -0.51 0.02 0.00 0.00 175.26 174.56 1agg s ASP 8 N -4.01 3.88 -1.30 -0.19 1.11 -1.26 -4.38 116.67 110.51 1agg s ASP 8 Ca 0.44 -0.48 -0.02 0.00 0.18 0.00 0.00 52.55 52.67 1agg s ASP 8 Cb -0.01 -1.64 -0.00 0.00 1.07 0.00 0.00 42.92 42.34 1agg s ASP 8 CO 0.25 -0.00 0.65 -1.22 1.18 0.00 0.00 175.17 176.04 1agg n TYR 9 N 4.66 -1.87 -0.31 4.23 4.01 0.03 -4.85 117.16 123.06 1agg n TYR 9 Ca -0.19 0.79 0.00 0.00 -0.16 0.00 0.00 57.90 58.33 1agg n TYR 9 Cb 0.51 -4.17 0.00 0.00 -0.31 0.00 0.00 39.34 35.37 1agg n TYR 9 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1agg n GLY 10 N -1.66 -2.00 3.80 2.72 0.00 -1.26 -4.53 105.19 102.26 1agg n GLY 10 Ca -0.28 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 43.90 1agg n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1agg s LYS 11 N -1.53 3.94 0.31 1.61 1.02 -1.26 -2.71 119.74 121.13 1agg s LYS 11 Ca 0.00 0.17 -0.03 0.00 0.02 0.00 0.00 55.97 56.13 1agg s LYS 11 Cb 0.00 -3.29 -0.01 0.00 -0.52 0.00 0.00 37.83 34.01 1agg s LYS 11 CO 0.00 0.53 0.41 0.00 -0.92 0.00 0.00 175.35 175.37 1agg s THR 13 N -3.39 0.09 -0.67 0.00 -4.23 -1.21 -3.02 115.64 103.21 1agg s THR 13 Ca 0.31 -0.72 -0.25 0.00 -1.18 0.00 0.00 61.69 59.85 1agg s THR 13 Cb 0.01 -0.54 0.04 0.00 1.34 0.00 0.00 72.50 73.35 1agg s THR 13 CO 0.18 -0.40 1.12 0.26 -0.54 0.00 0.00 174.62 175.25 1agg s TRP 14 N -1.60 2.52 0.00 3.99 0.51 -1.26 -3.32 118.94 119.77 1agg s TRP 14 Ca -0.13 -0.14 0.00 0.00 -2.12 0.00 0.00 56.10 53.71 1agg s TRP 14 Cb -0.06 -4.43 0.00 0.00 -0.81 0.00 0.00 33.47 28.17 1agg s TRP 14 CO 0.01 -1.78 0.00 0.41 -0.51 0.00 0.00 176.95 175.08 1agg n GLY 15 N 5.28 0.70 0.00 0.98 0.00 -1.26 -5.10 105.19 105.80 1agg n GLY 15 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.28 1.25 3.75 -0.02 0.00 -1.21 -5.13 105.19 103.55 1agg n GLY 16 Ca 0.00 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.49 4.21 0.51 2.61 2.01 -1.26 -4.45 115.64 118.79 1agg s THR 17 Ca 0.00 2.01 0.05 0.00 0.31 0.00 0.00 61.69 64.06 1agg s THR 17 Cb 0.00 -4.29 0.02 0.00 0.01 0.00 0.00 72.50 68.24 1agg s THR 17 CO 0.00 0.47 0.33 -0.54 -0.69 0.00 0.00 174.62 174.19 1agg s LYS 18 N -0.95 2.27 0.20 4.92 -0.14 -1.26 -3.36 119.74 121.42 1agg s LYS 18 Ca 0.41 -2.00 -0.28 0.00 -1.36 0.00 0.00 55.97 52.74 1agg s LYS 18 Cb -0.25 -2.04 -0.08 0.00 -1.68 0.00 0.00 37.83 33.78 1agg s LYS 18 CO 0.30 -0.48 0.86 0.00 -0.76 0.00 0.00 175.35 175.27 1agg n ARG 21 N -5.41 1.90 -2.21 0.00 1.85 -1.26 -4.80 116.66 106.73 1agg n ARG 21 Ca 0.00 -1.88 -0.03 0.00 -1.00 0.00 0.00 57.85 54.93 1agg n ARG 21 Cb 0.33 -1.74 0.02 0.00 -1.05 0.00 0.00 32.46 30.01 1agg n ARG 21 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1agg n GLY 22 N -0.15 -0.31 3.09 2.89 0.00 -1.18 -5.10 105.19 104.42 1agg n GLY 22 Ca 0.37 0.09 -0.17 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.32 0.69 0.92 1.61 1.81 -1.12 -5.06 118.95 114.48 1agg s ARG 23 Ca 0.10 -0.70 -0.15 0.00 -1.72 0.00 0.00 55.73 53.26 1agg s ARG 23 Cb -0.01 -0.60 0.17 0.00 -0.45 0.00 0.00 34.95 34.05 1agg s ARG 23 CO 0.32 0.14 1.28 -1.25 -0.68 0.00 0.00 175.30 175.11 1agg s PRO 24 N -1.25 0.98 -0.06 3.54 0.04 -1.26 -2.47 135.00 134.53 1agg s PRO 24 Ca -0.03 -0.31 0.02 0.00 0.04 0.00 0.00 61.00 60.72 1agg s PRO 24 Cb -0.08 -1.88 0.02 0.00 0.04 0.00 0.00 34.50 32.59 1agg s PRO 24 CO 0.01 -2.19 -0.09 0.00 0.04 0.00 0.00 177.00 174.76 1agg s ARG 26 N 0.74 3.04 0.95 0.00 0.52 -0.19 -4.91 118.95 119.11 1agg s ARG 26 Ca -0.13 -0.83 -0.13 0.00 -0.52 0.00 0.00 55.73 54.11 1agg s ARG 26 Cb -0.15 -2.52 0.16 0.00 0.52 0.00 0.00 34.95 32.97 1agg s ARG 26 CO 0.02 -0.09 1.15 0.00 0.02 0.00 0.00 175.30 176.41 1agg n SER 28 N -3.90 -1.69 -0.08 0.00 2.88 -1.25 -4.64 113.62 104.94 1agg n SER 28 Ca 0.08 -0.25 -0.11 0.00 -1.33 0.00 0.00 58.87 57.26 1agg n SER 28 Cb 0.59 -0.06 0.02 0.00 -0.75 0.00 0.00 64.21 64.01 1agg n SER 28 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1agg h MET 29 N 0.00 0.81 0.21 -1.46 2.86 -1.92 -3.31 114.93 112.11 1agg h MET 29 Ca -0.02 -0.44 -0.01 0.00 -2.06 0.00 0.00 59.70 57.17 1agg h MET 29 Cb 0.07 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.76 1agg h MET 29 CO 0.01 1.07 -0.10 0.82 1.06 0.00 0.00 176.91 179.77 1agg h ILE 30 N 0.65 0.31 0.00 -1.22 2.04 -1.98 -3.50 117.51 113.82 1agg h ILE 30 Ca 0.05 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1agg h ILE 30 Cb 0.99 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1agg h ILE 30 CO 0.09 0.09 0.00 0.61 0.00 0.00 0.00 178.15 178.94 1agg n GLY 31 N 0.89 2.22 3.87 5.37 0.00 -1.25 -5.14 105.19 111.15 1agg n GLY 31 Ca -0.05 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 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 4.73 -0.47 2.61 -4.23 -1.26 -4.54 115.64 112.48 1agg s THR 32 Ca 0.00 0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 61.28 1agg s THR 32 Cb 0.00 -3.86 -0.02 0.00 1.34 0.00 0.00 72.50 69.96 1agg s THR 32 CO 0.00 -1.07 0.43 -3.20 -0.54 0.00 0.00 174.62 170.24 1agg n ASN 33 N -2.58 -4.73 -4.72 3.99 2.85 -1.26 -4.55 115.26 104.26 1agg n ASN 33 Ca 0.05 -0.21 -0.29 0.00 -0.11 0.00 0.00 54.58 54.01 1agg n ASN 33 Cb 0.54 -3.11 0.15 0.00 1.24 0.00 0.00 39.78 38.60 1agg n ASN 33 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1agg n GLU 35 N -3.94 0.78 -2.38 0.00 1.02 -0.87 -1.38 120.64 113.86 1agg n GLU 35 Ca 0.06 -1.67 -0.26 0.00 -0.02 0.00 0.00 57.16 55.28 1agg n GLU 35 Cb 0.57 0.90 0.13 0.00 -0.02 0.00 0.00 31.44 33.02 1agg n GLU 35 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1agg n THR 37 N -3.13 0.00 -2.12 0.00 -2.24 -1.07 -2.86 114.28 102.86 1agg n THR 37 Ca 0.15 -0.10 -0.34 0.00 -2.27 0.00 0.00 64.05 61.48 1agg n THR 37 Cb 0.60 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.85 1agg n THR 37 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1agg s PRO 38 N -0.89 3.21 0.60 -0.78 0.04 -1.26 -0.79 135.00 135.11 1agg s PRO 38 Ca 0.17 1.55 -0.17 0.00 0.04 0.00 0.00 61.00 62.59 1agg s PRO 38 Cb -0.01 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 1agg s PRO 38 CO 0.33 -0.96 1.11 1.03 0.04 0.00 0.00 177.00 178.55 1agg s ARG 39 N -3.51 3.14 0.57 4.56 0.52 -1.26 -4.82 118.95 118.15 1agg s ARG 39 Ca 0.71 1.45 -0.21 0.00 -0.52 0.00 0.00 55.73 57.16 1agg s ARG 39 Cb -0.23 -1.99 -0.04 0.00 0.52 0.00 0.00 34.95 33.21 1agg s ARG 39 CO 0.31 -0.99 1.36 -0.48 0.02 0.00 0.00 175.30 175.51 1agg s LEU 40 N -4.32 3.79 0.06 2.53 2.34 -1.26 -4.25 118.68 117.57 1agg s LEU 40 Ca 0.69 2.76 0.00 0.00 0.06 0.00 0.00 54.13 57.64 1agg s LEU 40 Cb -0.21 -4.34 0.00 0.00 -0.56 0.00 0.00 46.19 41.08 1agg s LEU 40 CO 0.34 -1.70 0.00 -0.38 -1.06 0.00 0.00 176.35 173.55 1agg n ILE 41 N -1.23 -1.79 -1.74 1.48 2.08 -1.26 -2.04 119.36 114.85 1agg n ILE 41 Ca 0.12 0.44 -0.42 0.00 0.56 0.00 0.00 62.75 63.45 1agg n ILE 41 Cb 0.45 -1.40 -0.02 0.00 -0.75 0.00 0.00 39.64 37.92 1agg n ILE 41 CO 0.00 0.00 0.00 0.80 0.56 0.00 0.00 176.55 177.91 1agg n MET 42 N -0.34 2.77 -0.52 0.38 1.56 -1.26 -4.51 117.12 115.19 1agg n MET 42 Ca 0.00 0.99 0.00 0.00 -0.27 0.00 0.00 57.70 58.42 1agg n MET 42 Cb 0.00 -2.81 0.00 0.00 2.15 0.00 0.00 33.22 32.56 1agg n MET 42 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1agg n GLU 43 N 2.92 -1.47 -1.58 2.12 2.13 -1.26 -4.88 120.64 118.62 1agg n GLU 43 Ca 0.12 1.11 -0.38 0.00 0.66 0.00 0.00 57.16 58.66 1agg n GLU 43 Cb 0.36 -1.28 -0.03 0.00 0.27 0.00 0.00 31.44 30.76 1agg n GLU 43 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1agg s GLY 44 N -2.83 -0.11 0.27 8.31 0.00 -1.26 -4.63 107.32 107.06 1agg s GLY 44 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.99 1agg s GLY 44 CO 0.00 4.02 0.00 -0.10 0.00 0.00 0.00 173.10 177.02 1agg n LEU 45 N 14.46 -0.65 -2.07 0.66 0.00 -1.26 -4.93 117.00 123.21 1agg n LEU 45 Ca 0.34 0.48 -0.03 0.00 0.00 0.00 0.00 56.01 56.80 1agg n LEU 45 Cb 0.51 0.79 -0.02 0.00 0.00 0.00 0.00 43.42 44.70 1agg n LEU 45 CO 0.69 -0.62 -0.35 -0.24 0.00 0.00 0.00 177.39 176.87 1agg n SER 46 N -3.33 -1.20 -2.07 1.96 2.88 -0.87 -4.96 113.62 106.03 1agg n SER 46 Ca 0.00 0.71 -0.01 0.00 -1.33 0.00 0.00 58.87 58.24 1agg n SER 46 Cb 0.00 -3.24 -0.01 0.00 -0.75 0.00 0.00 64.21 60.21 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 0.88 -3.50 0.90 0.66 3.72 -1.23 -5.01 117.46 113.88 1agg n PHE 47 Ca -0.22 2.07 0.11 0.00 -0.05 0.00 0.00 57.45 59.36 1agg n PHE 47 Cb 0.34 -3.34 0.09 0.00 -0.94 0.00 0.00 39.48 35.63 1agg n PHE 47 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71