#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 5.21 -0.62 -2.13 0.11 -1.26 -5.07 120.40 116.65 1b8w s VAL 2 Ca 0.00 -0.62 0.01 0.00 -2.93 0.00 0.00 61.98 58.44 1b8w s VAL 2 Cb 0.00 -3.80 0.16 0.00 -1.53 0.00 0.00 36.38 31.20 1b8w s VAL 2 CO 0.00 -0.30 0.41 -1.10 -3.33 0.00 0.00 175.10 170.78 1b8w s GLN 3 N -3.73 2.39 0.03 1.54 -1.52 -1.26 -4.86 119.66 112.25 1b8w s GLN 3 Ca 0.37 -2.73 0.22 0.00 -1.95 0.00 0.00 55.36 51.27 1b8w s GLN 3 Cb -0.10 -3.56 -0.25 0.00 -0.22 0.00 0.00 33.01 28.88 1b8w s GLN 3 CO 0.30 -1.17 0.63 1.58 -0.25 0.00 0.00 175.29 176.39 1b8w n HIS 4 N 3.05 0.25 -3.83 0.91 -0.00 -1.26 -4.75 115.22 109.60 1b8w n HIS 4 Ca 0.09 0.07 -0.30 0.00 0.46 0.00 0.00 57.72 58.04 1b8w n HIS 4 Cb 0.35 -0.61 -0.14 0.00 -0.12 0.00 0.00 29.99 29.47 1b8w n HIS 4 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1b8w s ARG 5 N -3.47 1.33 0.12 1.57 1.81 -1.26 -5.01 118.95 114.04 1b8w s ARG 5 Ca -0.06 -1.88 -0.29 0.00 -1.72 0.00 0.00 55.73 51.78 1b8w s ARG 5 Cb 0.13 -2.63 -0.08 0.00 -0.45 0.00 0.00 34.95 31.93 1b8w s ARG 5 CO 0.88 -1.06 1.60 -1.35 -0.68 0.00 0.00 175.30 174.68 1b8w h PRO 6 N 7.18 -0.55 -1.45 3.54 0.11 -1.98 -3.46 132.00 135.39 1b8w h PRO 6 Ca -0.06 0.04 0.17 0.00 0.11 0.00 0.00 66.00 66.25 1b8w h PRO 6 Cb 0.96 0.12 -0.23 0.00 0.11 0.00 0.00 31.00 31.97 1b8w h PRO 6 CO 0.53 -0.36 0.72 -0.98 -0.21 0.00 0.00 178.00 177.69 1b8w s ARG 7 N -5.95 0.40 0.00 1.05 1.70 -1.26 -5.09 118.95 109.80 1b8w s ARG 7 Ca -0.16 0.02 0.00 0.00 -0.47 0.00 0.00 55.73 55.12 1b8w s ARG 7 Cb 0.08 0.19 0.00 0.00 -0.57 0.00 0.00 34.95 34.65 1b8w s ARG 7 CO 0.64 -0.14 0.00 -0.25 -1.08 0.00 0.00 175.30 174.47 1b8w n ASP 8 N 0.42 0.00 -0.02 -2.89 9.92 -1.26 -1.42 116.55 121.30 1b8w n ASP 8 Ca -0.05 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.17 1b8w n ASP 8 Cb 0.59 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 41.05 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 -0.07 0.00 0.00 0.00 4.22 -1.79 0.45 114.58 117.39 1b8w h GLU 10 Ca -0.11 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.33 1b8w h GLU 10 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1b8w h GLU 10 CO -0.04 0.35 0.00 0.45 -2.18 0.00 0.00 179.01 177.59 1b8w n SER 11 N -3.73 0.00 0.00 1.04 2.88 -1.26 -2.13 113.62 110.42 1b8w n SER 11 Ca -0.01 -0.58 0.00 0.00 -1.33 0.00 0.00 58.87 56.95 1b8w n SER 11 Cb 0.44 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 1b8w n SER 11 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1b8w n ILE 12 N -1.05 0.16 -2.10 2.46 -0.00 -0.85 -5.00 119.36 112.98 1b8w n ILE 12 Ca 0.15 -0.47 0.00 0.00 -0.00 0.00 0.00 62.75 62.44 1b8w n ILE 12 Cb 0.09 1.10 0.00 0.00 -0.00 0.00 0.00 39.64 40.83 1b8w n ILE 12 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 1b8w n ASN 13 N -0.08 -1.91 -2.88 7.28 4.05 -0.91 -5.08 115.26 115.72 1b8w n ASN 13 Ca 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 54.58 54.89 1b8w n ASN 13 Cb 0.11 -0.48 -0.04 0.00 1.23 0.00 0.00 39.78 40.60 1b8w n ASN 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1b8w n GLY 14 N -0.77 3.66 3.58 8.20 0.00 0.09 -4.81 105.19 115.13 1b8w n GLY 14 Ca 0.00 -2.06 -0.24 0.00 0.00 0.00 0.00 46.02 43.72 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 -2.33 3.10 -0.60 1.61 0.11 -0.79 -4.06 120.40 117.44 1b8w s VAL 15 Ca 0.10 -2.02 -0.04 0.00 -2.93 0.00 0.00 61.98 57.09 1b8w s VAL 15 Cb 0.00 -2.63 0.16 0.00 -1.53 0.00 0.00 36.38 32.39 1b8w s VAL 15 CO 0.07 -0.33 0.43 0.00 -3.33 0.00 0.00 175.10 171.94 1b8w n ARG 17 N 3.80 3.64 -3.18 0.00 5.12 -0.18 -4.84 116.66 121.03 1b8w n ARG 17 Ca 0.06 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.69 1b8w n ARG 17 Cb 0.39 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.66 1b8w n ARG 17 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1b8w s HIS 18 N 2.36 3.48 -2.05 -1.55 2.46 -1.26 -1.37 115.29 117.36 1b8w s HIS 18 Ca 0.00 0.77 0.30 0.00 0.47 0.00 0.00 55.06 56.60 1b8w s HIS 18 Cb 0.00 -2.21 1.57 0.00 -0.13 0.00 0.00 32.58 31.81 1b8w s HIS 18 CO 0.00 0.08 2.04 0.36 -2.47 0.00 0.00 174.74 174.75 1b8w n LYS 19 N -1.07 1.10 -0.97 2.88 2.85 -1.25 -3.28 118.16 118.42 1b8w n LYS 19 Ca -0.00 -0.28 0.05 0.00 -1.05 0.00 0.00 58.31 57.02 1b8w n LYS 19 Cb 0.54 -1.49 0.10 0.00 -0.65 0.00 0.00 35.03 33.52 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 -0.70 1.27 0.00 -5.58 -0.08 -1.26 -5.02 116.55 105.18 1b8w n ASP 20 Ca 0.21 -2.79 0.00 0.00 -1.51 0.00 0.00 54.79 50.69 1b8w n ASP 20 Cb 0.20 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.28 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 -0.29 0.00 0.04 5.18 -1.04 -1.20 -5.04 114.28 111.93 1b8w n THR 21 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1b8w n THR 21 Cb 0.90 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 69.22 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 -2.12 12.58 3.14 -1.26 -4.98 118.33 125.69 1b8w n VAL 22 Ca 0.00 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.34 1b8w n VAL 22 Cb 0.00 0.00 0.09 0.00 -1.06 0.00 0.00 33.84 32.87 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 -2.65 2.44 -3.70 6.55 2.85 -1.26 -4.90 115.26 114.59 1b8w n ASN 23 Ca 0.00 -3.14 -0.36 0.00 -0.11 0.00 0.00 54.58 50.97 1b8w n ASN 23 Cb 0.00 -0.42 -0.03 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 0.94 0.00 -3.91 0.00 5.12 -1.26 -4.45 116.66 113.10 1b8w n ARG 25 Ca 0.29 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.92 1b8w n ARG 25 Cb 0.36 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.62 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 3.45 -0.71 5.56 2.12 -1.24 -1.49 118.70 126.39 1b8w s GLU 26 Ca 0.00 -0.47 0.00 0.00 0.36 0.00 0.00 54.97 54.86 1b8w s GLU 26 Cb 0.00 -3.00 0.18 0.00 0.26 0.00 0.00 34.13 31.57 1b8w s GLU 26 CO 0.00 0.56 0.53 0.42 -0.54 0.00 0.00 175.26 176.23 1b8w s ILE 27 N -1.61 3.57 0.02 -3.70 1.01 -0.13 -4.83 121.20 115.53 1b8w s ILE 27 Ca 0.35 -3.58 -0.05 0.00 0.00 0.00 0.00 60.65 57.37 1b8w s ILE 27 Cb -0.12 -3.30 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 1b8w s ILE 27 CO 0.28 -0.96 1.09 -0.26 0.00 0.00 0.00 174.94 175.09 1b8w h PHE 28 N 6.28 -0.28 -0.70 3.97 0.04 -1.98 0.26 116.94 124.53 1b8w h PHE 28 Ca 0.06 0.02 0.24 0.00 2.80 0.00 0.00 57.97 61.09 1b8w h PHE 28 Cb 0.86 0.14 -0.13 0.00 2.20 0.00 0.00 35.95 39.02 1b8w h PHE 28 CO 0.68 -0.07 0.18 1.28 -0.60 0.00 0.00 178.31 179.78 1b8w n LEU 29 N -3.21 0.07 -4.91 1.54 4.32 -1.26 -4.22 117.00 109.33 1b8w n LEU 29 Ca -0.00 1.17 -0.31 0.00 -0.02 0.00 0.00 56.01 56.85 1b8w n LEU 29 Cb 0.05 -0.49 -0.04 0.00 -1.62 0.00 0.00 43.42 41.32 1b8w n LEU 29 CO -0.01 -1.24 -0.11 0.00 -1.22 0.00 0.00 177.39 174.81 1b8w s ALA 30 N -5.35 3.96 0.41 -1.18 0.00 0.08 -4.66 121.76 115.01 1b8w s ALA 30 Ca -0.08 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.12 1b8w s ALA 30 Cb 0.22 -1.90 0.01 0.00 0.00 0.00 0.00 23.12 21.45 1b8w s ALA 30 CO 0.54 0.79 0.08 -0.25 0.00 0.00 0.00 175.76 176.93 1b8w n ASP 31 N 0.30 2.92 -0.97 0.00 9.92 0.93 -4.44 116.55 125.21 1b8w n ASP 31 Ca -0.05 -2.69 0.00 0.00 -0.53 0.00 0.00 54.79 51.52 1b8w n ASP 31 Cb 0.51 0.20 0.00 0.00 -0.64 0.00 0.00 41.12 41.19 1b8w n ASP 31 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1b8w n TYR 33 N -0.47 0.00 0.07 0.00 4.01 -1.26 -4.61 117.16 114.90 1b8w n TYR 33 Ca 0.00 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.79 1b8w n TYR 33 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 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 -1.97 -3.48 115.58 120.20 1b8w h ASN 34 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1b8w h ASN 34 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1b8w h ASN 34 CO 0.00 0.34 0.00 -0.67 -1.65 0.00 0.00 177.43 175.45 1b8w n ASP 35 N -2.82 0.00 -0.25 5.81 2.03 -1.26 -4.69 116.55 115.37 1b8w n ASP 35 Ca -0.05 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.29 1b8w n ASP 35 Cb 0.72 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 41.14 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 -0.37 -0.61 3.73 0.27 0.00 -1.26 -5.02 105.19 101.93 1b8w n GLY 36 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.72 2.57 0.51 1.61 -0.21 -1.26 -3.87 119.66 118.29 1b8w s GLN 37 Ca 0.08 -1.27 0.01 0.00 0.02 0.00 0.00 55.36 54.20 1b8w s GLN 37 Cb 0.06 -2.34 -0.00 0.00 1.00 0.00 0.00 33.01 31.73 1b8w s GLN 37 CO 0.11 0.36 0.04 -1.59 -2.12 0.00 0.00 175.29 172.08 1b8w s LYS 38 N -3.76 2.18 0.23 2.91 -2.85 -0.47 -4.01 119.74 113.96 1b8w s LYS 38 Ca 0.33 -2.41 -0.12 0.00 -1.00 0.00 0.00 55.97 52.77 1b8w s LYS 38 Cb -0.07 -1.28 -0.07 0.00 -2.06 0.00 0.00 37.83 34.35 1b8w s LYS 38 CO 0.22 -0.45 0.58 0.00 0.10 0.00 0.00 175.35 175.81 1b8w n ARG 41 N 1.40 2.11 0.00 0.00 1.74 -0.56 -1.89 116.66 119.47 1b8w n ARG 41 Ca -0.23 -1.55 0.00 0.00 -0.77 0.00 0.00 57.85 55.30 1b8w n ARG 41 Cb 0.56 -2.53 0.00 0.00 -1.02 0.00 0.00 32.46 29.47 1b8w n ARG 41 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74