#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 2.98 0.00 -2.13 0.11 -1.26 -4.92 120.40 115.18 1b8w s VAL 2 Ca 0.00 -1.96 0.00 0.00 -2.93 0.00 0.00 61.98 57.09 1b8w s VAL 2 Cb 0.00 -2.79 0.00 0.00 -1.53 0.00 0.00 36.38 32.06 1b8w s VAL 2 CO 0.00 -0.29 0.00 0.00 -3.33 0.00 0.00 175.10 171.48 1b8w n GLN 3 N -0.92 0.00 0.00 1.54 1.13 -1.26 -4.60 117.38 113.27 1b8w n GLN 3 Ca -0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 1b8w n GLN 3 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.96 1b8w n GLN 3 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1b8w n HIS 4 N 0.00 0.00 -3.30 1.08 8.25 -1.26 -5.13 115.22 114.86 1b8w n HIS 4 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 1b8w n HIS 4 Cb 0.00 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 1b8w n HIS 4 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1b8w s ARG 5 N 0.99 4.21 0.31 -0.41 6.06 -1.26 -5.04 118.95 123.81 1b8w s ARG 5 Ca 0.00 0.62 -0.29 0.00 -2.50 0.00 0.00 55.73 53.56 1b8w s ARG 5 Cb 0.00 -3.31 -0.13 0.00 0.06 0.00 0.00 34.95 31.57 1b8w s ARG 5 CO 0.00 0.46 1.34 -2.30 -2.50 0.00 0.00 175.30 172.30 1b8w n PRO 6 N 2.47 2.14 -0.45 5.12 -0.02 -1.26 -4.76 135.00 138.24 1b8w n PRO 6 Ca -0.09 0.75 -0.17 0.00 -2.02 0.00 0.00 63.50 61.97 1b8w n PRO 6 Cb 0.51 -2.37 -0.02 0.00 -0.02 0.00 0.00 33.50 31.60 1b8w n PRO 6 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1b8w n ARG 7 N 1.09 0.00 -1.15 -0.52 1.85 -1.22 -2.91 116.66 113.80 1b8w n ARG 7 Ca 0.07 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.57 1b8w n ARG 7 Cb 0.35 -0.41 0.08 0.00 -1.05 0.00 0.00 32.46 31.43 1b8w n ARG 7 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1b8w n ASP 8 N 0.51 -1.26 -0.05 2.89 9.92 -1.26 -0.32 116.55 126.99 1b8w n ASP 8 Ca 0.06 0.53 -0.12 0.00 -0.53 0.00 0.00 54.79 54.73 1b8w n ASP 8 Cb 0.04 -1.23 -0.11 0.00 -0.64 0.00 0.00 41.12 39.18 1b8w n ASP 8 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1b8w h GLU 10 N -0.91 0.00 0.00 0.00 4.57 -1.80 -0.08 114.58 116.36 1b8w h GLU 10 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1b8w h GLU 10 Cb 0.77 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.36 1b8w h GLU 10 CO 0.00 0.32 0.00 0.43 -1.18 0.00 0.00 179.01 178.58 1b8w n SER 11 N -3.76 0.00 -0.46 1.04 7.64 -1.25 -2.15 113.62 114.68 1b8w n SER 11 Ca -0.01 0.36 0.05 0.00 1.01 0.00 0.00 58.87 60.28 1b8w n SER 11 Cb 0.41 -0.44 0.08 0.00 -1.01 0.00 0.00 64.21 63.25 1b8w n SER 11 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1b8w n ILE 12 N -1.44 0.44 -2.05 0.44 -6.64 -0.85 -4.97 119.36 104.29 1b8w n ILE 12 Ca 0.06 -0.72 0.00 0.00 -1.77 0.00 0.00 62.75 60.32 1b8w n ILE 12 Cb 0.20 0.90 0.00 0.00 -1.44 0.00 0.00 39.64 39.30 1b8w n ILE 12 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 1b8w n ASN 13 N 0.47 -1.22 -4.82 7.28 5.15 -0.91 -5.07 115.26 116.14 1b8w n ASN 13 Ca 0.08 0.00 -0.24 0.00 -0.60 0.00 0.00 54.58 53.81 1b8w n ASN 13 Cb 0.31 -0.48 -0.04 0.00 -0.53 0.00 0.00 39.78 39.04 1b8w n ASN 13 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1b8w s GLY 14 N -2.96 2.31 0.12 8.20 0.00 -0.10 -4.69 107.32 110.20 1b8w s GLY 14 Ca 0.00 -1.78 0.05 0.00 0.00 0.00 0.00 44.72 42.99 1b8w s GLY 14 CO 0.00 -1.86 0.05 0.54 0.00 0.00 0.00 173.10 171.83 1b8w s VAL 15 N -2.61 4.22 -0.52 1.40 0.11 -0.81 -4.01 120.40 118.18 1b8w s VAL 15 Ca 0.40 -1.01 -0.07 0.00 -2.93 0.00 0.00 61.98 58.37 1b8w s VAL 15 Cb 0.00 -3.06 0.13 0.00 -1.53 0.00 0.00 36.38 31.92 1b8w s VAL 15 CO 0.23 0.04 0.37 0.00 -3.33 0.00 0.00 175.10 172.41 1b8w n ARG 17 N 4.47 3.19 -3.12 0.00 0.63 -0.53 -4.88 116.66 116.43 1b8w n ARG 17 Ca -0.02 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.54 1b8w n ARG 17 Cb 0.41 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.26 1b8w n ARG 17 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1b8w s HIS 18 N 1.19 3.76 -2.00 -0.14 2.46 -1.26 -1.31 115.29 117.99 1b8w s HIS 18 Ca 0.00 1.42 0.08 0.00 0.47 0.00 0.00 55.06 57.03 1b8w s HIS 18 Cb 0.00 -2.62 0.50 0.00 -0.13 0.00 0.00 32.58 30.32 1b8w s HIS 18 CO 0.00 0.45 0.94 0.36 -2.47 0.00 0.00 174.74 174.02 1b8w n LYS 19 N 1.21 0.47 -0.64 2.88 2.85 -1.25 -1.83 118.16 121.85 1b8w n LYS 19 Ca -0.05 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.24 1b8w n LYS 19 Cb 0.50 -1.27 0.05 0.00 -0.65 0.00 0.00 35.03 33.66 1b8w n LYS 19 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1b8w n ASP 20 N -0.77 0.83 0.00 -5.58 2.03 -1.26 -5.01 116.55 106.78 1b8w n ASP 20 Ca 0.06 -2.38 0.00 0.00 0.52 0.00 0.00 54.79 52.99 1b8w n ASP 20 Cb 0.03 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.13 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 -0.27 0.00 0.03 5.18 -1.04 -0.76 -5.00 114.28 112.42 1b8w n THR 21 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1b8w n THR 21 Cb 0.78 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 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 -2.50 12.58 3.14 -1.26 -4.98 118.33 125.30 1b8w n VAL 22 Ca 0.00 0.00 -0.05 0.00 -2.96 0.00 0.00 64.34 61.33 1b8w n VAL 22 Cb 0.00 0.00 0.05 0.00 -1.06 0.00 0.00 33.84 32.83 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 -2.95 2.27 -3.72 6.55 2.85 -1.26 -4.94 115.26 114.06 1b8w n ASN 23 Ca 0.00 -2.56 -0.34 0.00 -0.11 0.00 0.00 54.58 51.57 1b8w n ASN 23 Cb 0.00 -0.42 -0.04 0.00 1.24 0.00 0.00 39.78 40.56 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 1.16 0.00 -3.93 0.00 0.00 -1.26 -4.54 116.66 108.09 1b8w n ARG 25 Ca 0.28 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.79 1b8w n ARG 25 Cb 0.37 0.00 -0.05 0.00 -0.00 0.00 0.00 32.46 32.78 1b8w n ARG 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 1b8w s GLU 26 N 0.00 3.40 -1.06 2.89 2.12 -1.23 -1.51 118.70 123.30 1b8w s GLU 26 Ca 0.00 -0.34 -0.09 0.00 0.36 0.00 0.00 54.97 54.90 1b8w s GLU 26 Cb 0.00 -3.07 0.27 0.00 0.26 0.00 0.00 34.13 31.59 1b8w s GLU 26 CO 0.00 0.67 1.04 0.42 -0.54 0.00 0.00 175.26 176.86 1b8w s ILE 27 N -1.31 5.83 0.04 -3.70 1.01 0.13 -4.86 121.20 118.35 1b8w s ILE 27 Ca 0.27 -3.35 -0.09 0.00 0.00 0.00 0.00 60.65 57.48 1b8w s ILE 27 Cb -0.13 -4.52 -0.02 0.00 0.01 0.00 0.00 42.46 37.80 1b8w s ILE 27 CO 0.18 -1.16 1.16 -0.26 0.00 0.00 0.00 174.94 174.86 1b8w h PHE 28 N 6.75 -0.54 -0.72 3.97 -1.00 -1.97 0.12 116.94 123.55 1b8w h PHE 28 Ca 0.17 0.03 0.22 0.00 2.81 0.00 0.00 57.97 61.20 1b8w h PHE 28 Cb 0.89 0.27 -0.13 0.00 3.61 0.00 0.00 35.95 40.58 1b8w h PHE 28 CO 0.79 -0.12 0.09 1.28 -1.61 0.00 0.00 178.31 178.74 1b8w n LEU 29 N -3.60 -0.01 -4.88 1.54 4.77 -1.26 -4.21 117.00 109.35 1b8w n LEU 29 Ca 0.00 1.21 -0.36 0.00 -0.03 0.00 0.00 56.01 56.84 1b8w n LEU 29 Cb 0.08 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.65 1b8w n LEU 29 CO -0.03 -1.26 -0.11 0.00 -1.33 0.00 0.00 177.39 174.66 1b8w s ALA 30 N -5.51 3.87 0.57 -1.18 0.00 0.03 -3.46 121.76 116.08 1b8w s ALA 30 Ca -0.09 -0.61 0.09 0.00 0.00 0.00 0.00 51.96 51.35 1b8w s ALA 30 Cb 0.22 -2.01 0.08 0.00 0.00 0.00 0.00 23.12 21.41 1b8w s ALA 30 CO 0.56 0.65 0.74 -0.51 0.00 0.00 0.00 175.76 177.20 1b8w s ASP 31 N -1.44 5.03 0.00 0.00 1.11 0.57 -4.42 116.67 117.52 1b8w s ASP 31 Ca 0.22 -0.91 0.00 0.00 0.18 0.00 0.00 52.55 52.05 1b8w s ASP 31 Cb -0.13 0.32 0.00 0.00 1.07 0.00 0.00 42.92 44.18 1b8w s ASP 31 CO 0.12 -1.31 0.00 0.00 1.18 0.00 0.00 175.17 175.15 1b8w n TYR 33 N 0.00 0.00 0.15 0.00 4.01 -1.26 -4.53 117.16 115.53 1b8w n TYR 33 Ca 0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1b8w n TYR 33 Cb 0.00 0.01 0.02 0.00 -0.31 0.00 0.00 39.34 39.06 1b8w n TYR 33 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 1b8w h ASN 34 N 0.00 0.00 0.00 7.72 2.35 -1.98 -3.48 115.58 120.19 1b8w h ASN 34 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1b8w h ASN 34 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1b8w h ASN 34 CO 0.00 0.01 0.00 -0.67 -1.65 0.00 0.00 177.43 175.12 1b8w n ASP 35 N -2.66 0.00 -0.45 5.81 -0.08 -1.26 -4.63 116.55 113.28 1b8w n ASP 35 Ca 0.00 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.33 1b8w n ASP 35 Cb 0.54 0.00 0.08 0.00 2.34 0.00 0.00 41.12 44.08 1b8w n ASP 35 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1b8w n GLY 36 N 0.00 0.79 3.46 0.27 0.00 -1.26 -5.00 105.19 103.45 1b8w n GLY 36 Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.88 1.66 0.53 1.61 -0.21 -1.26 -3.80 119.66 117.33 1b8w s GLN 37 Ca 0.15 -1.27 0.02 0.00 0.02 0.00 0.00 55.36 54.28 1b8w s GLN 37 Cb 0.09 -2.03 0.02 0.00 1.00 0.00 0.00 33.01 32.09 1b8w s GLN 37 CO 0.13 0.46 0.15 0.36 -2.12 0.00 0.00 175.29 174.27 1b8w n LYS 38 N 0.74 0.71 -3.20 2.91 -0.00 -0.43 -4.04 118.16 114.85 1b8w n LYS 38 Ca -0.16 -3.68 -0.30 0.00 -0.00 0.00 0.00 58.31 54.17 1b8w n LYS 38 Cb 0.53 0.77 -0.04 0.00 -0.00 0.00 0.00 35.03 36.30 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 1.52 1.44 0.00 0.00 1.74 -0.57 -1.92 116.66 118.88 1b8w n ARG 41 Ca -0.23 -1.50 0.00 0.00 -0.77 0.00 0.00 57.85 55.35 1b8w n ARG 41 Cb 0.55 -2.62 0.00 0.00 -1.02 0.00 0.00 32.46 29.37 1b8w n ARG 41 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74