#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d6b s MET 2 N 0.00 0.72 -1.01 6.28 -1.94 -1.26 -5.08 119.30 117.02 1d6b s MET 2 Ca 0.00 0.07 -0.02 0.00 -1.71 0.00 0.00 55.69 54.03 1d6b s MET 2 Cb 0.00 0.34 0.31 0.00 2.01 0.00 0.00 34.83 37.49 1d6b s MET 2 CO 0.00 -0.25 1.56 1.19 -0.01 0.00 0.00 175.02 177.51 1d6b n PHE 3 N 0.55 2.63 -2.96 -0.03 3.72 -1.26 -4.96 117.46 115.15 1d6b n PHE 3 Ca -0.11 -2.73 -0.44 0.00 -0.05 0.00 0.00 57.45 54.12 1d6b n PHE 3 Cb 0.59 -1.15 -0.03 0.00 -0.94 0.00 0.00 39.48 37.95 1d6b n PHE 3 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1d6b s PHE 4 N -3.47 3.11 -0.33 1.38 5.36 -1.26 -4.91 117.98 117.87 1d6b s PHE 4 Ca 0.36 -1.32 0.04 0.00 -0.96 0.00 0.00 56.93 55.04 1d6b s PHE 4 Cb 0.13 -4.23 0.17 0.00 -0.34 0.00 0.00 43.02 38.74 1d6b s PHE 4 CO -0.01 -1.46 0.46 -2.00 -1.46 0.00 0.00 175.22 170.75 1d6b s GLU 5 N 2.64 0.54 0.00 10.12 2.56 -1.26 -5.14 118.70 128.16 1d6b s GLU 5 Ca 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 54.97 55.18 1d6b s GLU 5 Cb -0.08 -0.26 0.00 0.00 2.00 0.00 0.00 34.13 35.79 1d6b s GLU 5 CO -0.07 -1.10 0.00 -1.33 -0.56 0.00 0.00 175.26 172.21 1d6b n MET 6 N 4.99 1.56 -3.94 4.30 2.81 -1.26 -4.88 117.12 120.71 1d6b n MET 6 Ca 0.05 0.00 -0.33 0.00 -1.81 0.00 0.00 57.70 55.61 1d6b n MET 6 Cb 0.50 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 32.87 1d6b n MET 6 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1d6b s GLN 7 N 0.00 1.94 -0.45 0.03 -1.52 -1.25 -4.68 119.66 113.73 1d6b s GLN 7 Ca 0.00 -1.66 -0.19 0.00 -1.95 0.00 0.00 55.36 51.56 1d6b s GLN 7 Cb 0.00 -3.26 -0.11 0.00 -0.22 0.00 0.00 33.01 29.42 1d6b s GLN 7 CO 0.00 -0.85 1.36 0.00 -0.25 0.00 0.00 175.29 175.54 1d6b n ALA 8 N 4.45 0.14 -0.16 6.09 0.00 -1.26 -1.30 120.51 128.47 1d6b n ALA 8 Ca -0.04 -0.07 0.18 0.00 0.00 0.00 0.00 53.44 53.51 1d6b n ALA 8 Cb 0.42 -1.19 0.28 0.00 0.00 0.00 0.00 19.45 18.96 1d6b n ALA 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d6b h TRP 10 N 0.00 0.30 -0.23 0.00 5.08 -1.82 0.19 115.95 119.48 1d6b h TRP 10 Ca 0.32 -0.21 0.07 0.00 1.08 0.00 0.00 58.89 60.14 1d6b h TRP 10 Cb 1.73 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 27.86 1d6b h TRP 10 CO 0.00 1.14 0.67 0.77 -1.28 0.00 0.00 178.44 179.74 1d6b h SER 11 N -0.62 0.00 -0.01 0.11 0.02 0.57 1.04 113.55 114.67 1d6b h SER 11 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1d6b h SER 11 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1d6b h SER 11 CO 0.08 0.00 -0.08 0.00 -1.14 0.00 0.00 176.83 175.69 1d6b n HIS 12 N -2.99 0.00 -2.78 3.45 1.44 -1.18 -5.03 115.22 108.13 1d6b n HIS 12 Ca 0.04 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.70 1d6b n HIS 12 Cb 0.76 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.88 1d6b n HIS 12 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1d6b n SER 13 N -0.12 -7.40 0.00 4.39 2.88 0.36 -5.06 113.62 108.67 1d6b n SER 13 Ca 0.03 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.92 1d6b n SER 13 Cb 0.13 -5.00 0.00 0.00 -0.75 0.00 0.00 64.21 58.59 1d6b n SER 13 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1d6b n GLY 14 N -0.67 5.19 2.99 0.46 0.00 -0.00 -4.95 105.19 108.21 1d6b n GLY 14 Ca 0.08 -1.59 -0.09 0.00 0.00 0.00 0.00 46.02 44.42 1d6b n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d6b s VAL 15 N 2.15 0.11 -0.30 1.61 1.01 -0.54 -4.92 120.40 119.52 1d6b s VAL 15 Ca 0.00 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.07 1d6b s VAL 15 Cb 0.00 -0.33 0.08 0.00 0.00 0.00 0.00 36.38 36.13 1d6b s VAL 15 CO 0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 175.10 174.55 1d6b n ARG 17 N 4.35 0.93 -2.14 0.00 5.12 -0.68 -4.87 116.66 119.37 1d6b n ARG 17 Ca -0.06 -2.79 -0.40 0.00 -1.93 0.00 0.00 57.85 52.68 1d6b n ARG 17 Cb 0.42 0.50 -0.01 0.00 -1.16 0.00 0.00 32.46 32.20 1d6b n ARG 17 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1d6b s ASP 18 N -3.39 6.56 0.44 0.55 1.01 -1.26 -0.95 116.67 119.63 1d6b s ASP 18 Ca 0.14 2.59 0.23 0.00 0.71 0.00 0.00 52.55 56.22 1d6b s ASP 18 Cb -0.01 -2.64 1.22 0.00 1.01 0.00 0.00 42.92 42.50 1d6b s ASP 18 CO 0.09 -0.67 1.80 0.07 0.21 0.00 0.00 175.17 176.66 1d6b h LYS 19 N 2.97 0.28 -0.67 8.23 2.10 -1.87 1.11 116.57 128.71 1d6b h LYS 19 Ca -0.49 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 1d6b h LYS 19 Cb 1.24 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1d6b h LYS 19 CO 0.64 0.18 0.00 0.45 -2.00 0.00 0.00 179.45 178.72 1d6b n SER 20 N -4.50 4.02 -4.62 7.07 2.88 -1.26 -4.92 113.62 112.29 1d6b n SER 20 Ca 0.24 -2.52 -0.43 0.00 -1.33 0.00 0.00 58.87 54.83 1d6b n SER 20 Cb 0.93 -0.57 -0.03 0.00 -0.75 0.00 0.00 64.21 63.79 1d6b n SER 20 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1d6b s GLU 21 N -2.05 3.61 0.00 -1.46 2.56 0.38 -4.82 118.70 116.92 1d6b s GLU 21 Ca 0.38 1.91 0.17 0.00 0.00 0.00 0.00 54.97 57.43 1d6b s GLU 21 Cb 0.27 -4.18 0.99 0.00 2.00 0.00 0.00 34.13 33.21 1d6b s GLU 21 CO 0.14 -1.53 1.45 0.54 -0.56 0.00 0.00 175.26 175.30 1d6b n ARG 22 N 8.05 0.46 -2.87 4.30 5.12 -1.26 -3.16 116.66 127.30 1d6b n ARG 22 Ca 0.23 0.03 -0.20 0.00 -1.93 0.00 0.00 57.85 55.98 1d6b n ARG 22 Cb 0.45 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.23 1d6b n ARG 22 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1d6b n ASN 23 N -1.08 2.77 -3.85 0.55 2.85 -1.26 -5.00 115.26 110.24 1d6b n ASN 23 Ca 0.12 -3.28 -0.30 0.00 -0.11 0.00 0.00 54.58 51.01 1d6b n ASN 23 Cb 0.08 -0.55 -0.14 0.00 1.24 0.00 0.00 39.78 40.40 1d6b n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1d6b s LYS 25 N 0.71 3.19 -0.81 0.00 1.02 -1.26 -4.80 119.74 117.79 1d6b s LYS 25 Ca 0.14 1.97 -0.29 0.00 0.02 0.00 0.00 55.97 57.81 1d6b s LYS 25 Cb -0.21 -4.34 -0.16 0.00 -0.52 0.00 0.00 37.83 32.59 1d6b s LYS 25 CO -0.09 -2.04 2.59 -2.30 -0.92 0.00 0.00 175.35 172.59 1d6b n PRO 26 N 8.68 0.40 -3.32 -1.68 -0.02 -1.26 -0.97 135.00 136.82 1d6b n PRO 26 Ca 0.29 -0.01 -0.46 0.00 -2.02 0.00 0.00 63.50 61.30 1d6b n PRO 26 Cb 0.45 -2.25 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1d6b n PRO 26 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1d6b s MET 27 N 8.72 3.87 1.12 -0.52 -1.94 -0.63 -4.82 119.30 125.11 1d6b s MET 27 Ca 1.21 -2.78 -0.16 0.00 -1.71 0.00 0.00 55.69 52.25 1d6b s MET 27 Cb -0.84 -4.50 0.21 0.00 2.01 0.00 0.00 34.83 31.71 1d6b s MET 27 CO 0.40 -1.28 0.42 0.00 -0.01 0.00 0.00 175.02 174.56 1d6b n ALA 28 N 3.47 -2.10 -3.71 3.03 0.00 -1.26 -4.15 120.51 115.79 1d6b n ALA 28 Ca 0.19 -1.26 -0.29 0.00 0.00 0.00 0.00 53.44 52.07 1d6b n ALA 28 Cb 0.44 -1.12 0.01 0.00 0.00 0.00 0.00 19.45 18.77 1d6b n ALA 28 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1d6b n TRP 29 N -4.73 -2.19 0.00 0.00 5.03 -1.26 -4.92 117.44 109.38 1d6b n TRP 29 Ca 0.07 0.91 0.00 0.00 3.03 0.00 0.00 57.50 61.50 1d6b n TRP 29 Cb 0.44 -2.42 0.00 0.00 -1.03 0.00 0.00 31.31 28.30 1d6b n TRP 29 CO 0.00 0.00 0.00 -2.37 -0.03 0.00 0.00 177.69 175.29 1d6b n THR 30 N -1.92 0.00 -4.67 -0.99 5.66 -1.24 -3.74 114.28 107.38 1d6b n THR 30 Ca -0.26 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.44 1d6b n THR 30 Cb 0.69 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.39 1d6b n THR 30 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1d6b s TYR 31 N -2.00 1.93 0.51 1.09 1.13 -0.42 -4.34 117.35 115.26 1d6b s TYR 31 Ca 0.00 -1.00 0.03 0.00 -1.41 0.00 0.00 57.07 54.70 1d6b s TYR 31 Cb 0.00 -1.51 -0.00 0.00 -1.10 0.00 0.00 41.96 39.35 1d6b s TYR 31 CO 0.00 0.13 0.15 0.00 -2.51 0.00 0.00 175.55 173.31 1d6b h GLU 33 N 1.17 0.00 -5.26 0.00 4.81 -1.96 -3.44 114.58 109.90 1d6b h GLU 33 Ca -0.42 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.15 1d6b h GLU 33 Cb 1.30 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 30.38 1d6b h GLU 33 CO 0.69 0.06 -0.81 1.21 -0.73 0.00 0.00 179.01 179.42 1d6b s ASN 34 N -6.24 3.60 0.00 1.04 3.04 -1.26 -4.97 114.94 110.15 1d6b s ASN 34 Ca 0.07 -0.46 0.00 0.00 0.04 0.00 0.00 52.86 52.51 1d6b s ASN 34 Cb 0.05 -1.54 0.00 0.00 -1.54 0.00 0.00 41.25 38.23 1d6b s ASN 34 CO 0.68 0.13 0.22 0.54 -3.04 0.00 0.00 177.10 175.62 1d6b n ARG 35 N 3.78 0.25 0.00 0.43 1.74 -1.26 -0.42 116.66 121.18 1d6b n ARG 35 Ca -0.19 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 1d6b n ARG 35 Cb 0.52 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.93 1d6b n ARG 35 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1d6b n ASN 36 N -0.28 0.14 -4.91 0.55 4.05 -1.26 -5.07 115.26 108.49 1d6b n ASN 36 Ca 0.00 -0.50 -0.33 0.00 0.45 0.00 0.00 54.58 54.20 1d6b n ASN 36 Cb 0.02 0.23 -0.05 0.00 1.23 0.00 0.00 39.78 41.21 1d6b n ASN 36 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 1d6b s GLN 37 N -0.23 3.45 0.14 1.20 0.74 0.44 -2.90 119.66 122.49 1d6b s GLN 37 Ca 0.00 -0.34 0.02 0.00 0.05 0.00 0.00 55.36 55.08 1d6b s GLN 37 Cb 0.00 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.99 1d6b s GLN 37 CO 0.00 0.65 0.28 0.15 -0.55 0.00 0.00 175.29 175.83 1d6b s LYS 38 N -2.10 3.45 -0.43 1.67 1.02 -0.13 -4.58 119.74 118.65 1d6b s LYS 38 Ca 0.30 -0.54 -0.06 0.00 0.02 0.00 0.00 55.97 55.69 1d6b s LYS 38 Cb -0.13 -2.96 0.11 0.00 -0.52 0.00 0.00 37.83 34.33 1d6b s LYS 38 CO 0.21 0.52 0.25 0.00 -0.92 0.00 0.00 175.35 175.42 1d6b n GLU 41 N -1.85 0.00 0.00 0.00 2.13 -0.14 -1.47 120.64 119.30 1d6b n GLU 41 Ca 0.08 0.29 0.01 0.00 0.66 0.00 0.00 57.16 58.20 1d6b n GLU 41 Cb 0.60 -1.19 0.01 0.00 0.27 0.00 0.00 31.44 31.13 1d6b n GLU 41 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70