#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8w s VAL 2 N 0.00 4.21 0.38 -4.37 1.01 -1.26 -5.08 120.40 115.29 1b8w s VAL 2 Ca 0.00 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.07 1b8w s VAL 2 Cb 0.00 -3.35 -0.06 0.00 0.00 0.00 0.00 36.38 32.96 1b8w s VAL 2 CO 0.00 -0.19 0.04 -1.58 0.00 0.00 0.00 175.10 173.37 1b8w s GLN 3 N 1.49 1.84 -0.31 2.72 2.00 -1.26 -5.13 119.66 121.01 1b8w s GLN 3 Ca 0.01 -2.05 0.00 0.00 -2.00 0.00 0.00 55.36 51.32 1b8w s GLN 3 Cb -0.19 -1.23 0.07 0.00 0.80 0.00 0.00 33.01 32.46 1b8w s GLN 3 CO 0.05 -0.16 0.01 -1.58 -0.50 0.00 0.00 175.29 173.11 1b8w s HIS 4 N -3.01 3.40 -0.07 1.67 5.65 -1.26 -5.09 115.29 116.58 1b8w s HIS 4 Ca 0.33 -2.28 0.02 0.00 0.25 0.00 0.00 55.06 53.39 1b8w s HIS 4 Cb 0.08 -2.37 0.01 0.00 -1.18 0.00 0.00 32.58 29.13 1b8w s HIS 4 CO 0.16 -0.88 -0.13 -0.98 -0.65 0.00 0.00 174.74 172.26 1b8w s ARG 5 N 1.13 1.78 0.41 2.88 3.03 -1.26 -5.12 118.95 121.80 1b8w s ARG 5 Ca -0.01 -0.43 -0.27 0.00 2.03 0.00 0.00 55.73 57.05 1b8w s ARG 5 Cb -0.20 -1.48 -0.10 0.00 -1.03 0.00 0.00 34.95 32.14 1b8w s ARG 5 CO -0.04 0.01 1.46 -2.14 -1.13 0.00 0.00 175.30 173.47 1b8w s PRO 6 N 0.73 3.91 0.04 3.89 0.02 -1.26 -4.82 135.00 137.51 1b8w s PRO 6 Ca -0.13 2.51 -0.14 0.00 0.02 0.00 0.00 61.00 63.26 1b8w s PRO 6 Cb -0.16 -2.82 -0.08 0.00 0.02 0.00 0.00 34.50 31.46 1b8w s PRO 6 CO 0.03 -0.67 0.32 2.89 -0.33 0.00 0.00 177.00 179.24 1b8w n ARG 7 N 0.15 0.00 -1.22 5.54 1.85 -1.25 -3.85 116.66 117.87 1b8w n ARG 7 Ca 0.03 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.59 1b8w n ARG 7 Cb 0.40 -0.50 0.15 0.00 -1.05 0.00 0.00 32.46 31.46 1b8w n ARG 7 CO 0.00 0.00 0.00 0.16 -0.01 0.00 0.00 177.63 177.78 1b8w s ASP 8 N -0.22 3.16 -0.18 2.89 -4.77 -1.26 0.24 116.67 116.53 1b8w s ASP 8 Ca 0.31 1.32 -0.25 0.00 -3.30 0.00 0.00 52.55 50.64 1b8w s ASP 8 Cb -0.45 -1.99 -0.22 0.00 -1.09 0.00 0.00 42.92 39.17 1b8w s ASP 8 CO 0.23 -2.81 0.45 0.00 0.70 0.00 0.00 175.17 173.74 1b8w h GLU 10 N -1.00 0.08 0.00 0.00 4.22 -1.82 0.21 114.58 116.27 1b8w h GLU 10 Ca -0.19 -0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.21 1b8w h GLU 10 Cb 1.15 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 1b8w h GLU 10 CO -0.12 0.12 -0.14 1.03 -2.18 0.00 0.00 179.01 177.72 1b8w h SER 11 N 0.08 0.00 -0.04 1.04 0.87 -1.91 -2.12 113.55 111.47 1b8w h SER 11 Ca 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1b8w h SER 11 Cb 0.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1b8w h SER 11 CO 0.00 0.14 0.00 2.30 -0.53 0.00 0.00 176.83 178.74 1b8w n ILE 12 N -3.39 0.02 -1.88 2.23 -5.35 -0.17 -4.96 119.36 105.86 1b8w n ILE 12 Ca -0.01 -0.51 0.00 0.00 -0.27 0.00 0.00 62.75 61.97 1b8w n ILE 12 Cb 0.33 1.47 0.00 0.00 -1.74 0.00 0.00 39.64 39.71 1b8w n ILE 12 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1b8w n ASN 13 N 1.35 -1.89 -3.17 7.28 5.15 -0.77 -5.09 115.26 118.12 1b8w n ASN 13 Ca 0.14 0.00 -0.18 0.00 -0.60 0.00 0.00 54.58 53.94 1b8w n ASN 13 Cb 0.60 -0.47 -0.05 0.00 -0.53 0.00 0.00 39.78 39.33 1b8w n ASN 13 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b8w n GLY 14 N -0.96 3.47 3.65 8.20 0.00 -0.12 -4.86 105.19 114.57 1b8w n GLY 14 Ca 0.00 -2.05 -0.24 0.00 0.00 0.00 0.00 46.02 43.73 1b8w n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b8w s VAL 15 N -2.66 2.79 -0.37 1.61 0.11 -0.92 -4.02 120.40 116.93 1b8w s VAL 15 Ca 0.16 -1.93 0.01 0.00 -2.93 0.00 0.00 61.98 57.28 1b8w s VAL 15 Cb 0.01 -2.82 0.11 0.00 -1.53 0.00 0.00 36.38 32.15 1b8w s VAL 15 CO 0.11 -0.22 0.12 0.00 -3.33 0.00 0.00 175.10 171.78 1b8w n ARG 17 N 4.39 3.58 -3.29 0.00 3.00 -0.15 -4.80 116.66 119.38 1b8w n ARG 17 Ca 0.01 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.48 1b8w n ARG 17 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.82 1b8w n ARG 17 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1b8w s HIS 18 N 1.94 3.67 -1.95 -0.14 2.46 -1.26 -0.91 115.29 119.09 1b8w s HIS 18 Ca 0.00 1.10 0.05 0.00 0.47 0.00 0.00 55.06 56.67 1b8w s HIS 18 Cb 0.00 -2.52 0.28 0.00 -0.13 0.00 0.00 32.58 30.21 1b8w s HIS 18 CO 0.00 0.39 0.78 0.36 -2.47 0.00 0.00 174.74 173.80 1b8w n LYS 19 N 2.67 0.14 -0.71 2.88 -0.00 0.38 -0.65 118.16 122.87 1b8w n LYS 19 Ca -0.09 0.02 0.05 0.00 -0.00 0.00 0.00 58.31 58.30 1b8w n LYS 19 Cb 0.51 -1.50 0.11 0.00 -0.00 0.00 0.00 35.03 34.15 1b8w n LYS 19 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1b8w n ASP 20 N -1.03 1.37 0.00 -5.58 2.03 -1.26 -5.01 116.55 107.07 1b8w n ASP 20 Ca 0.04 -2.90 0.00 0.00 0.52 0.00 0.00 54.79 52.45 1b8w n ASP 20 Cb 0.02 -0.39 0.00 0.00 -0.72 0.00 0.00 41.12 40.03 1b8w n ASP 20 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1b8w n THR 21 N -0.56 0.00 0.03 5.18 -1.04 0.18 -5.03 114.28 113.04 1b8w n THR 21 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1b8w n THR 21 Cb 0.81 -0.16 0.00 0.00 -1.82 0.00 0.00 70.33 69.16 1b8w n THR 21 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1b8w n VAL 22 N 0.00 0.00 -1.89 12.58 3.14 -1.26 -4.97 118.33 125.93 1b8w n VAL 22 Ca 0.00 0.00 0.05 0.00 -2.96 0.00 0.00 64.34 61.43 1b8w n VAL 22 Cb 0.00 0.00 0.13 0.00 -1.06 0.00 0.00 33.84 32.91 1b8w n VAL 22 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1b8w n ASN 23 N -2.48 1.44 -3.82 6.55 2.85 -1.26 -4.90 115.26 113.64 1b8w n ASN 23 Ca 0.00 -3.12 -0.40 0.00 -0.11 0.00 0.00 54.58 50.94 1b8w n ASN 23 Cb 0.00 -0.43 0.00 0.00 1.24 0.00 0.00 39.78 40.59 1b8w n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1b8w n ARG 25 N 0.87 0.00 -3.99 0.00 5.12 -1.26 -4.45 116.66 112.94 1b8w n ARG 25 Ca 0.32 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.94 1b8w n ARG 25 Cb 0.32 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.57 1b8w n ARG 25 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1b8w s GLU 26 N 0.00 3.17 -0.92 5.56 2.12 -1.23 -0.97 118.70 126.43 1b8w s GLU 26 Ca 0.00 -0.61 -0.05 0.00 0.36 0.00 0.00 54.97 54.67 1b8w s GLU 26 Cb 0.00 -2.87 0.23 0.00 0.26 0.00 0.00 34.13 31.75 1b8w s GLU 26 CO 0.00 0.56 0.83 0.42 -0.54 0.00 0.00 175.26 176.53 1b8w s ILE 27 N -1.53 4.86 0.00 -3.70 1.01 -0.02 -4.84 121.20 116.98 1b8w s ILE 27 Ca 0.32 -3.50 0.00 0.00 0.00 0.00 0.00 60.65 57.47 1b8w s ILE 27 Cb -0.12 -3.99 0.00 0.00 0.01 0.00 0.00 42.46 38.36 1b8w s ILE 27 CO 0.25 -1.08 0.88 0.49 0.00 0.00 0.00 174.94 175.48 1b8w n PHE 28 N 2.73 0.00 -0.06 3.97 3.01 -1.26 -0.92 117.46 124.93 1b8w n PHE 28 Ca 0.20 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.67 1b8w n PHE 28 Cb 0.39 -0.40 0.03 0.00 -0.01 0.00 0.00 39.48 39.48 1b8w n PHE 28 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1b8w n LEU 29 N -2.65 -0.05 -4.97 4.37 4.77 -1.26 -4.16 117.00 113.04 1b8w n LEU 29 Ca 0.00 0.28 -0.21 0.00 -0.03 0.00 0.00 56.01 56.05 1b8w n LEU 29 Cb 0.00 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1b8w n LEU 29 CO 0.00 -0.27 0.01 0.00 -1.33 0.00 0.00 177.39 175.80 1b8w s ALA 30 N -5.17 3.93 0.35 -1.18 0.00 -0.09 -3.84 121.76 115.76 1b8w s ALA 30 Ca -0.02 -1.21 0.00 0.00 0.00 0.00 0.00 51.96 50.73 1b8w s ALA 30 Cb 0.04 -1.79 0.00 0.00 0.00 0.00 0.00 23.12 21.38 1b8w s ALA 30 CO 0.13 0.16 0.02 -0.25 0.00 0.00 0.00 175.76 175.82 1b8w n ASP 31 N -1.50 2.91 -0.12 0.00 8.00 0.64 -4.57 116.55 121.92 1b8w n ASP 31 Ca -0.07 -2.51 0.00 0.00 0.71 0.00 0.00 54.79 52.92 1b8w n ASP 31 Cb 0.57 0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.89 1b8w n ASP 31 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b8w n TYR 33 N 0.00 0.00 0.00 0.00 4.02 -1.26 -4.73 117.16 115.19 1b8w n TYR 33 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1b8w n TYR 33 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1b8w n TYR 33 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1b8w n ASN 34 N 0.00 0.00 0.00 7.72 3.02 -1.26 -5.07 115.26 119.66 1b8w n ASN 34 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1b8w n ASN 34 Cb 0.08 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1b8w n ASN 34 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1b8w n ASP 35 N 0.00 0.00 -0.05 6.41 2.03 -1.26 -4.91 116.55 118.77 1b8w n ASP 35 Ca 0.00 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.33 1b8w n ASP 35 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 1b8w n ASP 35 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1b8w n GLY 36 N -0.22 2.14 3.70 0.27 0.00 -1.26 -5.04 105.19 104.78 1b8w n GLY 36 Ca 0.00 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 1b8w n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b8w s GLN 37 N -1.16 2.90 0.18 1.61 -1.52 -1.25 -0.47 119.66 119.95 1b8w s GLN 37 Ca 0.07 -0.53 0.01 0.00 -1.95 0.00 0.00 55.36 52.96 1b8w s GLN 37 Cb 0.06 -2.74 -0.00 0.00 -0.22 0.00 0.00 33.01 30.11 1b8w s GLN 37 CO 0.01 0.65 0.02 0.36 -0.25 0.00 0.00 175.29 176.08 1b8w n LYS 38 N 1.56 1.25 -3.34 2.91 -0.00 -0.09 -4.09 118.16 116.36 1b8w n LYS 38 Ca -0.15 -1.40 -0.33 0.00 -0.00 0.00 0.00 58.31 56.42 1b8w n LYS 38 Cb 0.53 0.52 -0.06 0.00 -0.00 0.00 0.00 35.03 36.02 1b8w n LYS 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1b8w n ARG 41 N 0.77 1.09 -0.28 0.00 1.74 -0.14 -2.15 116.66 117.68 1b8w n ARG 41 Ca -0.18 -0.44 0.00 0.00 -0.77 0.00 0.00 57.85 56.46 1b8w n ARG 41 Cb 0.58 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.41 1b8w n ARG 41 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74