#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8w n VAL 2 N 0.00 0.00 -2.37 -2.13 0.24 -1.26 -4.90 118.33 107.91 1b8w n VAL 2 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.28 1b8w n VAL 2 Cb 0.00 -1.13 0.00 0.00 -1.47 0.00 0.00 33.84 31.24 1b8w n VAL 2 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1b8w n GLN 3 N -0.70 -1.11 -2.30 7.34 7.27 -1.26 -4.92 117.38 121.70 1b8w n GLN 3 Ca 0.00 1.28 -0.41 0.00 0.07 0.00 0.00 57.00 57.94 1b8w n GLN 3 Cb 0.00 -4.03 0.00 0.00 2.41 0.00 0.00 30.24 28.63 1b8w n GLN 3 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1b8w n HIS 4 N -0.92 2.67 -4.13 3.69 8.25 -1.26 -4.93 115.22 118.57 1b8w n HIS 4 Ca 0.04 -2.74 -0.15 0.00 -0.26 0.00 0.00 57.72 54.60 1b8w n HIS 4 Cb 0.39 -1.70 -0.12 0.00 1.12 0.00 0.00 29.99 29.67 1b8w n HIS 4 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1b8w s ARG 5 N -1.37 0.63 0.00 -0.41 3.00 -1.26 -5.12 118.95 114.41 1b8w s ARG 5 Ca 0.45 -0.73 0.00 0.00 0.00 0.00 0.00 55.73 55.45 1b8w s ARG 5 Cb 0.14 -0.50 0.00 0.00 0.00 0.00 0.00 34.95 34.59 1b8w s ARG 5 CO -0.05 0.11 0.00 -2.30 0.00 0.00 0.00 175.30 173.06 1b8w n PRO 6 N 1.67 0.00 -4.42 3.54 -0.02 -1.26 -4.89 135.00 129.62 1b8w n PRO 6 Ca -0.21 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.06 1b8w n PRO 6 Cb 0.55 -0.27 -0.16 0.00 -0.02 0.00 0.00 33.50 33.61 1b8w n PRO 6 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1b8w s ARG 7 N 0.00 1.08 0.47 -0.52 1.70 -1.26 -5.02 118.95 115.40 1b8w s ARG 7 Ca 0.00 -0.32 -0.23 0.00 -0.47 0.00 0.00 55.73 54.71 1b8w s ARG 7 Cb 0.00 -0.99 -0.08 0.00 -0.57 0.00 0.00 34.95 33.31 1b8w s ARG 7 CO 0.00 0.10 1.15 -0.25 -1.08 0.00 0.00 175.30 175.22 1b8w n ASP 8 N 3.40 1.87 0.03 -2.89 9.92 -1.26 0.20 116.55 127.81 1b8w n ASP 8 Ca -0.19 1.01 -0.13 0.00 -0.53 0.00 0.00 54.79 54.95 1b8w n ASP 8 Cb 0.54 -1.45 -0.09 0.00 -0.64 0.00 0.00 41.12 39.48 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 -0.41 0.08 0.00 0.00 4.22 -1.78 0.18 114.58 116.87 1b8w h GLU 10 Ca -0.01 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.41 1b8w h GLU 10 Cb 0.37 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1b8w h GLU 10 CO 0.01 0.36 0.00 -1.13 -2.18 0.00 0.00 179.01 176.07 1b8w n SER 11 N -4.18 0.15 -0.63 1.04 3.41 -1.17 -2.12 113.62 110.12 1b8w n SER 11 Ca -0.02 0.53 0.07 0.00 -0.26 0.00 0.00 58.87 59.19 1b8w n SER 11 Cb 0.35 -0.57 0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1b8w n SER 11 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1b8w n ILE 12 N -1.66 0.40 -2.29 -1.33 -6.64 -0.69 -4.96 119.36 102.18 1b8w n ILE 12 Ca 0.04 -0.70 0.00 0.00 -1.77 0.00 0.00 62.75 60.32 1b8w n ILE 12 Cb 0.22 0.97 0.00 0.00 -1.44 0.00 0.00 39.64 39.39 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 0.75 -1.71 -4.61 7.28 5.15 -0.90 -5.07 115.26 116.14 1b8w n ASN 13 Ca 0.10 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.81 1b8w n ASN 13 Cb 0.39 -0.48 -0.11 0.00 -0.53 0.00 0.00 39.78 39.05 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 -2.95 2.50 0.21 8.20 0.00 -0.03 -4.77 107.32 110.48 1b8w s GLY 14 Ca 0.00 -2.12 0.05 0.00 0.00 0.00 0.00 44.72 42.65 1b8w s GLY 14 CO 0.00 -2.07 0.24 0.54 0.00 0.00 0.00 173.10 171.81 1b8w s VAL 15 N -2.79 4.83 -0.46 1.40 0.11 -0.91 -3.82 120.40 118.76 1b8w s VAL 15 Ca 0.33 -1.10 -0.03 0.00 -2.93 0.00 0.00 61.98 58.25 1b8w s VAL 15 Cb 0.09 -3.56 0.12 0.00 -1.53 0.00 0.00 36.38 31.50 1b8w s VAL 15 CO 0.16 -0.25 0.26 0.00 -3.33 0.00 0.00 175.10 171.94 1b8w n ARG 17 N 4.29 1.09 -2.64 0.00 3.00 -0.51 -4.88 116.66 117.01 1b8w n ARG 17 Ca 0.00 -0.90 -0.42 0.00 -0.00 0.00 0.00 57.85 56.54 1b8w n ARG 17 Cb 0.40 0.02 -0.03 0.00 0.00 0.00 0.00 32.46 32.85 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 -0.38 3.59 -1.76 -0.14 2.46 -1.26 -0.91 115.29 116.89 1b8w s HIS 18 Ca 0.12 1.60 0.00 0.00 0.47 0.00 0.00 55.06 57.25 1b8w s HIS 18 Cb -0.01 -3.20 0.00 0.00 -0.13 0.00 0.00 32.58 29.24 1b8w s HIS 18 CO 0.08 -0.32 0.12 0.36 -2.47 0.00 0.00 174.74 172.50 1b8w n LYS 19 N 4.00 0.00 -0.62 2.88 0.00 -0.83 0.99 118.16 124.58 1b8w n LYS 19 Ca 0.07 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.39 1b8w n LYS 19 Cb 0.50 -1.14 0.02 0.00 -0.00 0.00 0.00 35.03 34.41 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 -0.58 0.35 0.00 -5.58 -0.08 -1.26 -4.94 116.55 104.46 1b8w n ASP 20 Ca 0.00 -2.11 0.00 0.00 -1.51 0.00 0.00 54.79 51.17 1b8w n ASP 20 Cb 0.00 -0.24 0.00 0.00 2.34 0.00 0.00 41.12 43.22 1b8w n ASP 20 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1b8w n THR 21 N -0.05 0.00 0.02 5.18 -1.04 0.28 -5.01 114.28 113.66 1b8w n THR 21 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1b8w n THR 21 Cb 0.76 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 69.15 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 -2.21 12.58 3.14 -1.26 -4.98 118.33 125.59 1b8w n VAL 22 Ca 0.00 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.30 1b8w n VAL 22 Cb 0.00 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 32.85 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 -2.43 2.83 -3.64 6.55 2.85 -1.26 -4.91 115.26 115.25 1b8w n ASN 23 Ca 0.00 -3.08 -0.34 0.00 -0.11 0.00 0.00 54.58 51.04 1b8w n ASN 23 Cb 0.00 -0.41 -0.04 0.00 1.24 0.00 0.00 39.78 40.57 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 0.93 0.00 -4.02 0.00 3.00 -1.26 -4.51 116.66 110.80 1b8w n ARG 25 Ca 0.29 0.00 -0.26 0.00 -0.01 0.00 0.00 57.85 57.87 1b8w n ARG 25 Cb 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.79 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 3.16 -0.87 5.56 2.12 -1.23 -1.36 118.70 126.08 1b8w s GLU 26 Ca 0.00 -0.75 -0.11 0.00 0.36 0.00 0.00 54.97 54.47 1b8w s GLU 26 Cb 0.00 -2.79 0.23 0.00 0.26 0.00 0.00 34.13 31.82 1b8w s GLU 26 CO 0.00 0.49 0.81 0.42 -0.54 0.00 0.00 175.26 176.44 1b8w s ILE 27 N -1.77 5.41 -1.17 -3.70 1.01 -0.12 -4.83 121.20 116.04 1b8w s ILE 27 Ca 0.33 -2.82 0.00 0.00 0.00 0.00 0.00 60.65 58.16 1b8w s ILE 27 Cb -0.10 -4.34 0.00 0.00 0.01 0.00 0.00 42.46 38.03 1b8w s ILE 27 CO 0.26 -1.05 0.00 0.49 0.00 0.00 0.00 174.94 174.64 1b8w n PHE 28 N 3.54 0.00 -0.01 3.97 3.01 -1.26 -0.97 117.46 125.74 1b8w n PHE 28 Ca 0.16 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.60 1b8w n PHE 28 Cb 0.44 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.90 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 -0.07 2.07 -4.86 4.37 4.77 -1.26 -5.03 117.00 116.99 1b8w n LEU 29 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 1b8w n LEU 29 Cb 0.00 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 40.95 1b8w n LEU 29 CO 0.00 0.38 -0.15 0.00 -1.33 0.00 0.00 177.39 176.29 1b8w s ALA 30 N -2.05 3.84 0.54 -1.18 0.00 -0.15 -4.14 121.76 118.63 1b8w s ALA 30 Ca -0.03 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 51.37 1b8w s ALA 30 Cb 0.01 -2.03 0.05 0.00 0.00 0.00 0.00 23.12 21.16 1b8w s ALA 30 CO 0.05 0.56 0.74 -0.51 0.00 0.00 0.00 175.76 176.60 1b8w s ASP 31 N -0.87 5.22 0.00 0.00 1.11 0.13 -4.10 116.67 118.16 1b8w s ASP 31 Ca 0.15 -0.42 0.00 0.00 0.18 0.00 0.00 52.55 52.46 1b8w s ASP 31 Cb -0.12 -0.37 0.00 0.00 1.07 0.00 0.00 42.92 43.50 1b8w s ASP 31 CO 0.04 -1.17 0.00 0.00 1.18 0.00 0.00 175.17 175.22 1b8w n TYR 33 N 0.00 0.00 0.28 0.00 4.01 -1.26 -4.60 117.16 115.59 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 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.09 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 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1b8w h ASN 34 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1b8w h ASN 34 CO 0.00 0.04 0.00 -0.67 -1.65 0.00 0.00 177.43 175.15 1b8w n ASP 35 N -2.49 0.00 -0.06 5.81 2.03 -1.26 -4.62 116.55 115.96 1b8w n ASP 35 Ca 0.01 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.36 1b8w n ASP 35 Cb 0.51 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.88 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 -1.69 0.14 3.59 0.27 0.00 -1.26 -5.00 105.19 101.24 1b8w n GLY 36 Ca 0.00 -0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.51 2.39 0.41 1.61 -0.21 -1.26 -1.96 119.66 119.13 1b8w s GLN 37 Ca 0.04 -0.85 0.03 0.00 0.02 0.00 0.00 55.36 54.60 1b8w s GLN 37 Cb 0.06 -2.42 0.03 0.00 1.00 0.00 0.00 33.01 31.67 1b8w s GLN 37 CO 0.26 0.56 0.25 0.36 -2.12 0.00 0.00 175.29 174.61 1b8w n LYS 38 N 1.16 0.91 -3.36 2.91 2.85 -0.09 -4.03 118.16 118.52 1b8w n LYS 38 Ca -0.14 -2.63 -0.32 0.00 -1.05 0.00 0.00 58.31 54.17 1b8w n LYS 38 Cb 0.52 0.37 -0.06 0.00 -0.65 0.00 0.00 35.03 35.21 1b8w n LYS 38 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1b8w n ARG 41 N 1.25 1.78 0.00 0.00 1.74 -0.46 -2.14 116.66 118.82 1b8w n ARG 41 Ca -0.21 -1.39 0.00 0.00 -0.77 0.00 0.00 57.85 55.47 1b8w n ARG 41 Cb 0.56 -2.45 0.00 0.00 -1.02 0.00 0.00 32.46 29.54 1b8w n ARG 41 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74