#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sq8 n LEU 1 N 0.00 0.00 -0.00 -0.89 4.77 -1.26 -2.90 117.00 116.72 1sq8 n LEU 1 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1sq8 n LEU 1 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1sq8 n LEU 1 CO 0.00 0.00 0.72 0.24 -1.33 0.00 0.00 177.39 177.02 1sq8 h MET 2 N 0.00 -0.26 -0.48 3.23 2.86 -1.88 0.26 114.93 118.66 1sq8 h MET 2 Ca 0.00 0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.75 1sq8 h MET 2 Cb 0.00 0.06 -0.10 0.00 0.06 0.00 0.00 31.60 31.62 1sq8 h MET 2 CO 0.00 -0.17 -0.27 0.78 1.06 0.00 0.00 176.91 178.31 1sq8 h GLY 3 N -0.27 -0.02 1.69 8.32 0.00 -1.73 0.50 103.07 111.56 1sq8 h GLY 3 Ca 0.10 0.35 -0.08 0.00 0.00 0.00 0.00 47.33 47.70 1sq8 h GLY 3 CO -0.29 -0.21 -0.23 0.83 0.00 0.00 0.00 176.54 176.64 1sq8 h GLU 4 N -0.16 0.37 -0.12 4.80 4.39 -1.37 -1.37 114.58 121.12 1sq8 h GLU 4 Ca 0.21 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 1sq8 h GLU 4 Cb 0.51 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1sq8 h GLU 4 CO -0.57 0.58 0.07 0.00 -1.16 0.00 0.00 179.01 177.93 1sq8 h ARG 5 N 0.33 0.16 0.48 2.33 3.08 0.11 0.25 114.38 121.12 1sq8 h ARG 5 Ca 0.05 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 1sq8 h ARG 5 Cb 0.59 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1sq8 h ARG 5 CO 0.04 0.14 -0.24 0.82 -1.07 0.00 0.00 179.97 179.67 1sq8 h ILE 6 N 0.13 0.52 -0.35 2.04 5.03 -0.96 -2.33 117.51 121.59 1sq8 h ILE 6 Ca 0.04 0.00 0.01 0.00 -0.12 0.00 0.00 64.86 64.79 1sq8 h ILE 6 Cb 0.02 0.52 -0.02 0.00 -3.03 0.00 0.00 36.82 34.31 1sq8 h ILE 6 CO -0.01 0.00 0.23 -0.09 -0.68 0.00 0.00 178.15 177.60 1sq8 h ARG 7 N -0.65 0.45 -0.15 2.37 1.12 -0.93 0.74 114.38 117.33 1sq8 h ARG 7 Ca -0.06 -0.03 -0.02 0.00 -1.11 0.00 0.00 59.98 58.76 1sq8 h ARG 7 Cb 0.50 -0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 30.35 1sq8 h ARG 7 CO 0.10 0.30 0.03 0.00 -3.11 0.00 0.00 179.97 177.30 1sq8 h ALA 8 N 1.14 0.20 -0.42 2.80 0.00 -0.59 -2.02 119.26 120.37 1sq8 h ALA 8 Ca 0.13 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1sq8 h ALA 8 Cb -0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1sq8 h ALA 8 CO -0.04 -0.16 -0.07 -0.09 0.00 0.00 0.00 179.25 178.89 1sq8 h ARG 9 N 0.04 0.72 -0.31 0.00 1.12 -1.02 0.60 114.38 115.54 1sq8 h ARG 9 Ca 0.05 -0.22 0.05 0.00 -1.11 0.00 0.00 59.98 58.75 1sq8 h ARG 9 Cb 0.27 -0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 30.11 1sq8 h ARG 9 CO 0.00 0.79 0.04 -0.09 -3.11 0.00 0.00 179.97 177.60 1sq8 h ARG 10 N 0.67 0.14 -0.18 0.20 2.43 -0.67 -1.94 114.38 115.03 1sq8 h ARG 10 Ca 0.12 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.18 1sq8 h ARG 10 Cb 0.52 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1sq8 h ARG 10 CO 0.03 0.09 -0.33 0.82 -1.51 0.00 0.00 179.97 179.07 1sq8 h ILE 11 N 0.14 1.28 -0.77 1.20 1.08 -0.72 0.18 117.51 119.91 1sq8 h ILE 11 Ca 0.15 -1.38 0.06 0.00 -0.39 0.00 0.00 64.86 63.30 1sq8 h ILE 11 Cb 0.17 1.51 -0.05 0.00 -3.07 0.00 0.00 36.82 35.39 1sq8 h ILE 11 CO -0.21 0.42 0.51 -0.61 -0.69 0.00 0.00 178.15 177.57 1sq8 h GLN 12 N 0.31 0.80 -0.00 2.37 4.15 -0.55 0.57 115.11 122.76 1sq8 h GLN 12 Ca 0.04 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1sq8 h GLN 12 Cb 0.74 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.25 1sq8 h GLN 12 CO 0.06 0.53 -0.10 -0.11 -1.93 0.00 0.00 178.83 177.28 1sq8 n LEU 13 N -4.48 0.52 0.00 -2.39 7.94 -0.70 -4.93 117.00 112.96 1sq8 n LEU 13 Ca 0.11 -0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 1sq8 n LEU 13 Cb 0.22 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 44.01 1sq8 n LEU 13 CO 0.33 0.09 0.00 0.61 -1.11 0.00 0.00 177.39 177.32 1sq8 n GLY 14 N 1.26 0.55 3.90 -3.96 0.00 0.19 -4.98 105.19 102.15 1sq8 n GLY 14 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1sq8 n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sq8 s LEU 15 N 0.00 3.18 0.57 0.99 1.43 -0.35 -4.89 118.68 119.61 1sq8 s LEU 15 Ca 0.00 0.96 0.01 0.00 -1.03 0.00 0.00 54.13 54.07 1sq8 s LEU 15 Cb 0.00 -3.82 0.04 0.00 0.03 0.00 0.00 46.19 42.44 1sq8 s LEU 15 CO 0.00 -1.07 0.80 0.54 0.23 0.00 0.00 176.35 176.85 1sq8 s ASN 16 N -4.28 5.18 0.16 2.29 2.20 -1.26 -4.50 114.94 114.72 1sq8 s ASN 16 Ca 0.55 -0.06 -0.11 0.00 -0.94 0.00 0.00 52.86 52.29 1sq8 s ASN 16 Cb -0.11 -0.76 0.01 0.00 -2.00 0.00 0.00 41.25 38.39 1sq8 s ASN 16 CO 0.48 -1.22 1.57 1.56 -2.94 0.00 0.00 177.10 176.55 1sq8 h GLN 17 N 0.01 0.97 -0.51 3.55 4.20 -1.97 -1.33 115.11 120.03 1sq8 h GLN 17 Ca -0.41 -0.38 -0.01 0.00 0.06 0.00 0.00 58.65 57.91 1sq8 h GLN 17 Cb 1.29 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.00 1sq8 h GLN 17 CO 0.51 1.05 0.28 0.00 -0.67 0.00 0.00 178.83 179.99 1sq8 h ALA 18 N 0.89 0.65 -0.47 3.87 0.00 -1.92 -0.94 119.26 121.35 1sq8 h ALA 18 Ca 0.12 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1sq8 h ALA 18 Cb 0.70 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1sq8 h ALA 18 CO 0.05 0.18 0.16 0.93 0.00 0.00 0.00 179.25 180.57 1sq8 h GLU 19 N 0.68 0.72 -0.69 0.00 4.39 -1.88 0.10 114.58 117.89 1sq8 h GLU 19 Ca 0.18 -0.14 0.02 0.00 0.34 0.00 0.00 59.36 59.76 1sq8 h GLU 19 Cb 0.05 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.55 1sq8 h GLU 19 CO -0.03 0.67 0.44 1.25 -1.16 0.00 0.00 179.01 180.18 1sq8 h LEU 20 N 0.62 0.73 0.32 1.33 5.85 -1.17 -2.93 115.31 120.06 1sq8 h LEU 20 Ca 0.15 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1sq8 h LEU 20 Cb 0.24 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1sq8 h LEU 20 CO -0.01 0.51 -0.24 0.00 -0.34 0.00 0.00 178.44 178.36 1sq8 h ALA 21 N 1.28 -0.55 -0.46 1.25 0.00 -0.31 -2.95 119.26 117.52 1sq8 h ALA 21 Ca 0.27 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1sq8 h ALA 21 Cb -0.01 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1sq8 h ALA 21 CO -0.09 -0.83 -0.10 1.96 0.00 0.00 0.00 179.25 180.18 1sq8 h GLN 22 N -0.56 0.83 0.00 0.00 4.20 -0.94 0.11 115.11 118.75 1sq8 h GLN 22 Ca -0.02 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1sq8 h GLN 22 Cb 0.49 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1sq8 h GLN 22 CO -0.01 0.90 0.00 1.17 -0.67 0.00 0.00 178.83 180.23 1sq8 n LYS 23 N -4.16 0.51 -0.10 1.46 0.00 -1.11 -2.28 118.16 112.48 1sq8 n LYS 23 Ca 0.01 0.03 -0.10 0.00 0.00 0.00 0.00 58.31 58.26 1sq8 n LYS 23 Cb 0.37 -1.50 -0.15 0.00 0.00 0.00 0.00 35.03 33.75 1sq8 n LYS 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1sq8 n VAL 24 N -1.19 1.33 0.00 3.15 0.31 -0.42 -4.92 118.33 116.59 1sq8 n VAL 24 Ca 0.14 -0.81 0.00 0.00 -0.01 0.00 0.00 64.34 63.67 1sq8 n VAL 24 Cb 0.16 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 1sq8 n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1sq8 n GLY 25 N 1.83 0.76 3.99 2.92 0.00 0.24 -4.88 105.19 110.05 1sq8 n GLY 25 Ca -0.32 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1sq8 n GLY 25 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sq8 s VAL 26 N -2.00 2.46 0.53 1.61 -7.23 -0.44 -4.93 120.40 110.40 1sq8 s VAL 26 Ca 0.00 -0.72 -0.06 0.00 -1.81 0.00 0.00 61.98 59.39 1sq8 s VAL 26 Cb 0.00 -2.74 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 1sq8 s VAL 26 CO 0.00 0.00 0.85 1.51 -0.31 0.00 0.00 175.10 177.15 1sq8 s ASP 27 N -4.55 6.00 0.30 4.85 1.47 -1.26 -3.71 116.67 119.77 1sq8 s ASP 27 Ca 0.61 0.88 0.06 0.00 1.18 0.00 0.00 52.55 55.27 1sq8 s ASP 27 Cb -0.08 -2.05 0.76 0.00 -0.34 0.00 0.00 42.92 41.21 1sq8 s ASP 27 CO 0.40 -0.79 1.75 -0.61 0.68 0.00 0.00 175.17 176.60 1sq8 h GLN 28 N 0.03 0.64 -0.70 2.11 4.15 -1.84 -1.59 115.11 117.91 1sq8 h GLN 28 Ca -0.46 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 58.94 1sq8 h GLN 28 Cb 1.22 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 28.73 1sq8 h GLN 28 CO 0.61 0.43 0.45 0.37 -1.93 0.00 0.00 178.83 178.76 1sq8 h GLN 29 N 0.66 0.88 -0.45 1.69 4.15 -1.94 -0.61 115.11 119.50 1sq8 h GLN 29 Ca 0.59 -0.05 0.10 0.00 0.77 0.00 0.00 58.65 60.05 1sq8 h GLN 29 Cb 0.99 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.45 1sq8 h GLN 29 CO -0.42 0.58 0.31 0.00 -1.93 0.00 0.00 178.83 177.37 1sq8 h ALA 30 N 1.28 2.18 -0.04 3.38 0.00 -1.67 0.18 119.26 124.56 1sq8 h ALA 30 Ca 0.27 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 1sq8 h ALA 30 Cb -0.05 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1sq8 h ALA 30 CO -0.08 -0.29 -0.49 0.82 0.00 0.00 0.00 179.25 179.21 1sq8 h ILE 31 N 0.19 1.42 -0.32 0.00 1.08 -1.22 -2.78 117.51 115.88 1sq8 h ILE 31 Ca 0.21 -1.93 0.06 0.00 -0.39 0.00 0.00 64.86 62.81 1sq8 h ILE 31 Cb 0.59 2.44 -0.06 0.00 -3.07 0.00 0.00 36.82 36.73 1sq8 h ILE 31 CO -0.03 0.56 -0.05 -0.08 -0.69 0.00 0.00 178.15 177.86 1sq8 h GLU 32 N -0.08 0.03 -0.83 2.37 4.81 -0.29 -0.02 114.58 120.56 1sq8 h GLU 32 Ca -0.05 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1sq8 h GLU 32 Cb 1.17 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.51 1sq8 h GLU 32 CO 0.10 0.02 0.41 -0.56 -0.73 0.00 0.00 179.01 178.25 1sq8 h GLN 33 N 0.03 1.18 -0.34 1.92 3.07 -0.77 -1.52 115.11 118.68 1sq8 h GLN 33 Ca 0.15 -0.16 -0.03 0.00 0.09 0.00 0.00 58.65 58.70 1sq8 h GLN 33 Cb 0.23 -0.22 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 1sq8 h GLN 33 CO -0.30 0.90 0.10 -0.07 0.09 0.00 0.00 178.83 179.55 1sq8 h LEU 34 N 1.18 0.50 -1.14 0.06 3.38 -1.04 0.36 115.31 118.61 1sq8 h LEU 34 Ca 0.29 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1sq8 h LEU 34 Cb 0.09 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1sq8 h LEU 34 CO -0.04 0.57 -0.22 -0.33 0.09 0.00 0.00 178.44 178.52 1sq8 h GLU 35 N 0.40 0.34 -0.00 1.13 5.08 -0.72 -0.09 114.58 120.71 1sq8 h GLU 35 Ca 0.11 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1sq8 h GLU 35 Cb 0.26 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1sq8 h GLU 35 CO -0.00 0.54 -0.06 0.27 -1.00 0.00 0.00 179.01 178.76 1sq8 n ASN 36 N -4.17 0.22 0.00 1.42 0.23 -0.60 -4.26 115.26 108.10 1sq8 n ASN 36 Ca -0.01 -0.33 0.00 0.00 -0.53 0.00 0.00 54.58 53.72 1sq8 n ASN 36 Cb 0.36 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 37.88 1sq8 n ASN 36 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1sq8 n GLY 37 N 1.29 0.75 0.13 4.83 0.00 -0.05 -4.96 105.19 107.19 1sq8 n GLY 37 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1sq8 n GLY 37 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1sq8 h LYS 38 N 3.08 0.00 -3.66 1.61 1.63 -0.53 -3.12 116.57 115.58 1sq8 h LYS 38 Ca 0.00 0.00 -0.74 0.00 -0.85 0.00 0.00 60.65 59.06 1sq8 h LYS 38 Cb 0.00 0.00 -0.31 0.00 -0.60 0.00 0.00 32.23 31.32 1sq8 h LYS 38 CO 0.00 0.00 -0.11 0.00 -3.45 0.00 0.00 179.45 175.89 1sq8 s ALA 39 N -3.26 3.89 0.20 5.00 0.00 -1.21 -4.91 121.76 121.48 1sq8 s ALA 39 Ca 0.06 -3.36 -0.10 0.00 0.00 0.00 0.00 51.96 48.56 1sq8 s ALA 39 Cb 0.10 -3.09 0.20 0.00 0.00 0.00 0.00 23.12 20.33 1sq8 s ALA 39 CO 0.48 -2.19 1.83 -0.22 0.00 0.00 0.00 175.76 175.66 1sq8 h LYS 40 N 7.27 0.74 -3.31 0.00 1.63 -1.91 -3.35 116.57 117.63 1sq8 h LYS 40 Ca 0.06 -0.04 -0.60 0.00 -0.85 0.00 0.00 60.65 59.22 1sq8 h LYS 40 Cb 0.98 -0.17 -0.40 0.00 -0.60 0.00 0.00 32.23 32.04 1sq8 h LYS 40 CO 0.75 0.49 -0.75 1.03 -3.45 0.00 0.00 179.45 177.51 1sq8 s ARG 41 N -6.11 1.00 0.61 1.90 3.00 -1.26 -4.95 118.95 113.13 1sq8 s ARG 41 Ca -0.13 -1.54 -0.17 0.00 0.00 0.00 0.00 55.73 53.89 1sq8 s ARG 41 Cb 0.15 -2.17 -0.02 0.00 0.00 0.00 0.00 34.95 32.91 1sq8 s ARG 41 CO 0.76 -1.07 1.15 -1.25 0.00 0.00 0.00 175.30 174.88 1sq8 s PRO 42 N 0.99 2.96 0.22 3.54 0.04 -1.26 -4.95 135.00 136.54 1sq8 s PRO 42 Ca 0.14 1.59 -0.08 0.00 0.04 0.00 0.00 61.00 62.69 1sq8 s PRO 42 Cb -0.21 -1.95 0.31 0.00 0.04 0.00 0.00 34.50 32.69 1sq8 s PRO 42 CO -0.12 -1.16 1.75 0.07 0.04 0.00 0.00 177.00 177.58 1sq8 h ARG 43 N 0.57 0.45 -0.40 4.56 0.11 -2.00 -2.68 114.38 115.00 1sq8 h ARG 43 Ca -0.49 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 59.57 1sq8 h ARG 43 Cb 1.27 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1sq8 h ARG 43 CO 0.55 0.30 0.00 1.97 0.10 0.00 0.00 179.97 182.89 1sq8 n PHE 44 N -4.96 0.46 -0.36 4.08 1.16 -1.26 -4.69 117.46 111.89 1sq8 n PHE 44 Ca 0.10 -0.21 0.06 0.00 -1.87 0.00 0.00 57.45 55.53 1sq8 n PHE 44 Cb 0.29 -0.05 0.13 0.00 -1.61 0.00 0.00 39.48 38.24 1sq8 n PHE 44 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 1sq8 h LEU 45 N 1.62 -0.94 -1.06 5.98 6.46 -1.86 -0.43 115.31 125.07 1sq8 h LEU 45 Ca 0.00 0.30 -0.09 0.00 -0.12 0.00 0.00 57.88 57.97 1sq8 h LEU 45 Cb 0.52 0.62 -0.01 0.00 -0.73 0.00 0.00 40.66 41.05 1sq8 h LEU 45 CO 0.04 -0.33 -0.25 1.55 -0.62 0.00 0.00 178.44 178.83 1sq8 h PRO 46 N -0.00 0.36 -0.10 5.25 0.13 -1.89 -0.02 132.00 135.74 1sq8 h PRO 46 Ca 0.47 -0.13 -0.03 0.00 -0.87 0.00 0.00 66.00 65.44 1sq8 h PRO 46 Cb 0.72 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 1sq8 h PRO 46 CO -1.02 0.60 -0.06 0.93 -0.23 0.00 0.00 178.00 178.22 1sq8 h GLU 47 N 0.33 0.21 -0.74 0.86 5.08 -1.50 -1.63 114.58 117.19 1sq8 h GLU 47 Ca 0.05 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1sq8 h GLU 47 Cb 0.62 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1sq8 h GLU 47 CO 0.04 0.59 0.27 1.25 -1.00 0.00 0.00 179.01 180.16 1sq8 h LEU 48 N -0.17 1.05 0.50 1.33 6.46 -1.08 0.73 115.31 124.13 1sq8 h LEU 48 Ca 0.02 -0.19 -0.02 0.00 -0.12 0.00 0.00 57.88 57.57 1sq8 h LEU 48 Cb 0.53 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 1sq8 h LEU 48 CO 0.02 0.95 -0.24 0.00 -0.62 0.00 0.00 178.44 178.55 1sq8 h ALA 49 N 1.13 -0.67 -0.70 1.25 0.00 -0.99 0.22 119.26 119.50 1sq8 h ALA 49 Ca 0.24 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1sq8 h ALA 49 Cb 0.25 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1sq8 h ALA 49 CO -0.02 -0.88 0.31 -0.09 0.00 0.00 0.00 179.25 178.58 1sq8 h ARG 50 N -0.67 1.03 0.00 0.00 1.12 -1.13 0.19 114.38 114.92 1sq8 h ARG 50 Ca -0.07 -0.17 -0.07 0.00 -1.11 0.00 0.00 59.98 58.56 1sq8 h ARG 50 Cb 0.51 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 30.29 1sq8 h ARG 50 CO 0.11 0.83 -0.35 0.00 -3.11 0.00 0.00 179.97 177.45 1sq8 h ALA 51 N 1.15 1.22 0.00 2.80 0.00 -0.76 -2.54 119.26 121.13 1sq8 h ALA 51 Ca 0.24 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1sq8 h ALA 51 Cb 0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1sq8 h ALA 51 CO -0.03 0.44 -0.41 1.25 0.00 0.00 0.00 179.25 180.50 1sq8 h LEU 52 N 0.00 0.00 -0.73 0.00 5.85 0.17 -3.48 115.31 117.12 1sq8 h LEU 52 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1sq8 h LEU 52 Cb 0.71 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1sq8 h LEU 52 CO 0.05 0.37 0.00 0.61 -0.34 0.00 0.00 178.44 179.12 1sq8 n GLY 53 N 1.20 0.97 3.36 3.75 0.00 0.51 -5.04 105.19 109.93 1sq8 n GLY 53 Ca 0.02 -0.51 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 1sq8 n GLY 53 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sq8 s VAL 54 N -2.73 0.37 0.53 1.61 -7.23 -0.36 -5.02 120.40 107.57 1sq8 s VAL 54 Ca 0.00 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 1sq8 s VAL 54 Cb 0.00 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 1sq8 s VAL 54 CO 0.00 0.00 0.87 0.00 -0.31 0.00 0.00 175.10 175.66 1sq8 s ALA 55 N -3.55 3.30 0.32 1.32 0.00 -1.26 -3.69 121.76 118.21 1sq8 s ALA 55 Ca 0.35 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.93 1sq8 s ALA 55 Cb 0.05 -2.75 0.54 0.00 0.00 0.00 0.00 23.12 20.96 1sq8 s ALA 55 CO 0.18 -0.48 1.97 0.28 0.00 0.00 0.00 175.76 177.70 1sq8 h VAL 56 N 0.03 1.19 -0.51 0.00 2.07 -1.91 0.89 116.25 118.00 1sq8 h VAL 56 Ca -0.46 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.59 1sq8 h VAL 56 Cb 1.20 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1sq8 h VAL 56 CO 0.62 0.20 0.09 -0.78 0.02 0.00 0.00 177.57 177.72 1sq8 h ASP 57 N 0.92 0.80 -0.94 0.57 1.82 -1.98 0.23 116.42 117.84 1sq8 h ASP 57 Ca 0.24 -0.25 -0.00 0.00 -0.39 0.00 0.00 57.03 56.62 1sq8 h ASP 57 Cb -0.04 -0.21 -0.05 0.00 0.68 0.00 0.00 39.33 39.72 1sq8 h ASP 57 CO -0.05 0.85 0.57 -0.25 -1.61 0.00 0.00 179.24 178.75 1sq8 h TRP 58 N 0.72 1.23 0.57 0.28 7.01 -1.86 0.15 115.95 124.05 1sq8 h TRP 58 Ca 0.16 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.13 1sq8 h TRP 58 Cb 0.38 -0.40 0.01 0.00 -2.10 0.00 0.00 29.16 27.04 1sq8 h TRP 58 CO 0.03 0.81 -0.28 -0.07 -2.79 0.00 0.00 178.44 176.15 1sq8 h LEU 59 N 1.29 -0.65 0.50 0.65 3.38 -0.11 0.90 115.31 121.27 1sq8 h LEU 59 Ca 0.34 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 1sq8 h LEU 59 Cb -0.06 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1sq8 h LEU 59 CO -0.06 -0.36 -0.30 -0.07 0.09 0.00 0.00 178.44 177.74 1sq8 h LEU 60 N -0.94 -0.76 0.00 1.67 3.38 -0.43 -3.38 115.31 114.84 1sq8 h LEU 60 Ca -0.08 0.04 -0.32 0.00 0.09 0.00 0.00 57.88 57.61 1sq8 h LEU 60 Cb 0.64 0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 1sq8 h LEU 60 CO 0.13 -0.48 -1.93 0.59 0.09 0.00 0.00 178.44 176.84 1sq8 n ASN 61 N -5.44 1.93 -0.65 -0.43 3.02 0.52 -4.84 115.26 109.37 1sq8 n ASN 61 Ca -0.12 0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1sq8 n ASN 61 Cb 0.34 -0.84 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 1sq8 n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1sq8 n GLY 62 N 1.34 0.88 2.66 7.41 0.00 0.31 -5.00 105.19 112.79 1sq8 n GLY 62 Ca -0.41 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1sq8 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32