#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 0.03 3.17 4.77 -1.26 -5.01 117.00 118.70 1sq8 n LEU 1 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 1sq8 n LEU 1 Cb 0.00 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1sq8 n LEU 1 CO 0.00 0.00 0.71 0.24 -1.33 0.00 0.00 177.39 177.01 1sq8 h MET 2 N 0.00 -0.32 -0.42 3.23 2.86 -1.86 0.39 114.93 118.81 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 0.07 -0.09 0.00 0.06 0.00 0.00 31.60 31.64 1sq8 h MET 2 CO 0.00 -0.21 -0.24 0.78 1.06 0.00 0.00 176.91 178.30 1sq8 h GLY 3 N -0.33 0.01 1.02 8.32 0.00 -1.75 0.42 103.07 110.76 1sq8 h GLY 3 Ca 0.08 0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.69 1sq8 h GLY 3 CO -0.25 -0.21 0.37 0.83 0.00 0.00 0.00 176.54 177.28 1sq8 h GLU 4 N -0.16 1.11 -0.13 4.80 4.39 -1.71 0.32 114.58 123.20 1sq8 h GLU 4 Ca 0.20 -0.17 0.04 0.00 0.34 0.00 0.00 59.36 59.77 1sq8 h GLU 4 Cb 0.47 -0.20 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 1sq8 h GLU 4 CO -0.52 0.87 -0.14 0.00 -1.16 0.00 0.00 179.01 178.06 1sq8 h ARG 5 N 1.09 -0.16 -0.18 2.33 3.08 -0.03 0.20 114.38 120.71 1sq8 h ARG 5 Ca 0.26 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 1sq8 h ARG 5 Cb 0.13 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1sq8 h ARG 5 CO -0.03 -0.11 0.10 0.82 -1.07 0.00 0.00 179.97 179.68 1sq8 h ILE 6 N -0.17 1.08 -0.31 2.04 2.04 -0.65 0.36 117.51 121.91 1sq8 h ILE 6 Ca 0.09 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1sq8 h ILE 6 Cb 0.30 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1sq8 h ILE 6 CO -0.23 0.08 0.14 -0.09 0.00 0.00 0.00 178.15 178.04 1sq8 h ARG 7 N 0.20 0.46 0.14 2.37 1.12 -0.51 -0.66 114.38 117.51 1sq8 h ARG 7 Ca 0.06 -0.08 -0.01 0.00 -1.11 0.00 0.00 59.98 58.85 1sq8 h ARG 7 Cb 0.04 -0.08 0.00 0.00 -0.01 0.00 0.00 29.97 29.92 1sq8 h ARG 7 CO -0.01 0.45 -0.07 0.00 -3.11 0.00 0.00 179.97 177.23 1sq8 h ALA 8 N 0.98 -0.19 -0.31 2.80 0.00 -0.50 -1.76 119.26 120.29 1sq8 h ALA 8 Ca 0.11 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1sq8 h ALA 8 Cb 0.16 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1sq8 h ALA 8 CO -0.01 -0.52 -0.16 -0.09 0.00 0.00 0.00 179.25 178.47 1sq8 h ARG 9 N -0.36 0.54 0.37 0.00 1.12 -0.88 0.15 114.38 115.32 1sq8 h ARG 9 Ca -0.02 -0.18 -0.01 0.00 -1.11 0.00 0.00 59.98 58.67 1sq8 h ARG 9 Cb 0.29 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 30.18 1sq8 h ARG 9 CO 0.03 0.69 -0.32 -0.09 -3.11 0.00 0.00 179.97 177.17 1sq8 h ARG 10 N 0.49 -0.67 -0.48 0.20 2.43 -1.00 -2.49 114.38 112.87 1sq8 h ARG 10 Ca 0.08 0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.33 1sq8 h ARG 10 Cb 0.57 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 1sq8 h ARG 10 CO 0.04 -0.45 0.32 0.82 -1.51 0.00 0.00 179.97 179.19 1sq8 h ILE 11 N -0.70 1.04 0.00 1.20 1.08 -0.89 -0.22 117.51 119.03 1sq8 h ILE 11 Ca -0.03 -0.18 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1sq8 h ILE 11 Cb 0.62 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 34.84 1sq8 h ILE 11 CO -0.03 0.09 0.00 1.67 -0.69 0.00 0.00 178.15 179.19 1sq8 n GLN 12 N -4.48 0.07 0.00 2.37 7.27 0.49 -0.66 117.38 122.45 1sq8 n GLN 12 Ca 0.05 0.43 0.04 0.00 0.07 0.00 0.00 57.00 57.60 1sq8 n GLN 12 Cb 0.16 -1.68 0.01 0.00 2.41 0.00 0.00 30.24 31.13 1sq8 n GLN 12 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1sq8 n LEU 13 N -1.83 1.18 -0.21 1.69 7.94 -0.32 -5.03 117.00 120.42 1sq8 n LEU 13 Ca 0.01 -0.81 -0.03 0.00 -1.11 0.00 0.00 56.01 54.08 1sq8 n LEU 13 Cb 0.11 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.05 1sq8 n LEU 13 CO 0.11 0.24 -0.03 0.61 -1.11 0.00 0.00 177.39 177.21 1sq8 n GLY 14 N 0.75 0.56 3.94 -3.96 0.00 0.17 -5.01 105.19 101.63 1sq8 n GLY 14 Ca 0.04 -0.27 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 1sq8 n GLY 14 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1sq8 s LEU 15 N -0.62 3.93 0.61 0.99 2.34 -1.13 -4.97 118.68 119.82 1sq8 s LEU 15 Ca 0.00 -0.23 -0.03 0.00 0.06 0.00 0.00 54.13 53.94 1sq8 s LEU 15 Cb 0.00 -2.60 0.04 0.00 -0.56 0.00 0.00 46.19 43.07 1sq8 s LEU 15 CO 0.00 -0.31 0.88 0.20 -1.06 0.00 0.00 176.35 176.06 1sq8 s ASN 16 N -4.06 5.14 0.13 1.48 0.01 -1.26 -4.44 114.94 111.93 1sq8 s ASN 16 Ca 0.41 0.26 -0.23 0.00 -0.71 0.00 0.00 52.86 52.60 1sq8 s ASN 16 Cb -0.08 -1.08 -0.03 0.00 0.41 0.00 0.00 41.25 40.47 1sq8 s ASN 16 CO 0.29 -1.30 1.66 1.56 -1.51 0.00 0.00 177.10 177.80 1sq8 h GLN 17 N -0.21 -0.21 -0.41 -0.60 4.20 -1.99 -1.83 115.11 114.05 1sq8 h GLN 17 Ca -0.44 0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.23 1sq8 h GLN 17 Cb 1.30 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.11 1sq8 h GLN 17 CO 0.57 -0.14 0.03 0.00 -0.67 0.00 0.00 178.83 178.61 1sq8 h ALA 18 N 0.79 1.28 -0.06 3.87 0.00 -1.94 0.16 119.26 123.37 1sq8 h ALA 18 Ca 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1sq8 h ALA 18 Cb 0.34 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1sq8 h ALA 18 CO -0.23 0.49 -0.02 0.93 0.00 0.00 0.00 179.25 180.42 1sq8 h GLU 19 N 0.61 0.11 -0.47 0.00 5.08 -1.93 -0.65 114.58 117.33 1sq8 h GLU 19 Ca 0.13 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1sq8 h GLU 19 Cb 0.34 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.54 1sq8 h GLU 19 CO 0.01 0.45 0.18 1.25 -1.00 0.00 0.00 179.01 179.91 1sq8 h LEU 20 N -0.24 0.21 -0.07 1.33 5.85 -0.95 -1.56 115.31 119.88 1sq8 h LEU 20 Ca 0.01 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.82 1sq8 h LEU 20 Cb 0.41 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 1sq8 h LEU 20 CO 0.01 0.15 -0.33 0.00 -0.34 0.00 0.00 178.44 177.93 1sq8 h ALA 21 N 1.30 -0.43 -0.11 1.25 0.00 -0.59 -0.78 119.26 119.90 1sq8 h ALA 21 Ca 0.22 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1sq8 h ALA 21 Cb 0.20 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1sq8 h ALA 21 CO -0.21 -0.82 -0.15 0.37 0.00 0.00 0.00 179.25 178.44 1sq8 h GLN 22 N -0.44 -0.19 0.00 0.00 5.75 -0.57 0.17 115.11 119.84 1sq8 h GLN 22 Ca 0.08 0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.54 1sq8 h GLN 22 Cb 0.56 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 1sq8 h GLN 22 CO -0.31 -0.12 -0.24 -0.22 -2.65 0.00 0.00 178.83 175.28 1sq8 h LYS 23 N -0.19 0.00 -0.03 1.69 3.11 -1.03 -1.74 116.57 118.38 1sq8 h LYS 23 Ca 0.09 0.00 -0.19 0.00 -2.81 0.00 0.00 60.65 57.73 1sq8 h LYS 23 Cb 0.32 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.54 1sq8 h LYS 23 CO -0.22 0.24 -0.82 0.28 -2.81 0.00 0.00 179.45 176.11 1sq8 h VAL 24 N 0.00 1.43 0.00 2.00 2.07 -0.77 -3.48 116.25 117.50 1sq8 h VAL 24 Ca -0.00 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 65.14 1sq8 h VAL 24 Cb 1.00 2.31 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 1sq8 h VAL 24 CO 0.03 0.70 0.00 0.61 0.02 0.00 0.00 177.57 178.93 1sq8 n GLY 25 N 0.74 1.15 3.97 2.17 0.00 0.33 -4.83 105.19 108.72 1sq8 n GLY 25 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 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 2.20 0.55 1.61 -7.23 0.31 -4.93 120.40 110.91 1sq8 s VAL 26 Ca 0.00 -1.19 -0.16 0.00 -1.81 0.00 0.00 61.98 58.82 1sq8 s VAL 26 Cb 0.00 -2.39 -0.06 0.00 0.56 0.00 0.00 36.38 34.49 1sq8 s VAL 26 CO 0.00 0.00 1.02 1.51 -0.31 0.00 0.00 175.10 177.32 1sq8 s ASP 27 N -4.44 6.26 0.26 4.85 1.47 -1.26 -3.89 116.67 119.92 1sq8 s ASP 27 Ca 0.51 1.69 -0.02 0.00 1.18 0.00 0.00 52.55 55.91 1sq8 s ASP 27 Cb -0.05 -2.52 0.46 0.00 -0.34 0.00 0.00 42.92 40.47 1sq8 s ASP 27 CO 0.32 -0.84 1.83 -0.61 0.68 0.00 0.00 175.17 176.55 1sq8 h GLN 28 N 0.74 0.88 -0.81 2.11 -0.00 -1.88 -0.91 115.11 115.25 1sq8 h GLN 28 Ca -0.47 -0.05 0.13 0.00 -0.00 0.00 0.00 58.65 58.26 1sq8 h GLN 28 Cb 1.20 -0.20 -0.09 0.00 0.00 0.00 0.00 27.48 28.39 1sq8 h GLN 28 CO 0.60 0.59 0.42 0.37 0.00 0.00 0.00 178.83 180.80 1sq8 h GLN 29 N 0.91 0.61 -0.81 1.69 -0.00 -1.95 -2.26 115.11 113.31 1sq8 h GLN 29 Ca 0.44 -0.04 0.14 0.00 -0.00 0.00 0.00 58.65 59.20 1sq8 h GLN 29 Cb 0.40 -0.14 -0.06 0.00 0.00 0.00 0.00 27.48 27.68 1sq8 h GLN 29 CO -0.25 0.40 0.53 0.00 0.00 0.00 0.00 178.83 179.52 1sq8 h ALA 30 N 1.52 1.98 -0.00 3.38 0.00 -1.53 0.82 119.26 125.42 1sq8 h ALA 30 Ca 0.43 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 55.11 1sq8 h ALA 30 Cb 0.56 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.27 1sq8 h ALA 30 CO -0.33 -0.19 -0.90 0.82 0.00 0.00 0.00 179.25 178.64 1sq8 h ILE 31 N 0.54 1.32 -0.35 0.00 1.08 -1.48 -2.59 117.51 116.05 1sq8 h ILE 31 Ca 0.40 -2.19 -0.00 0.00 -0.39 0.00 0.00 64.86 62.68 1sq8 h ILE 31 Cb 0.77 2.44 -0.02 0.00 -3.07 0.00 0.00 36.82 36.94 1sq8 h ILE 31 CO -0.15 0.67 0.21 -0.08 -0.69 0.00 0.00 178.15 178.11 1sq8 h GLU 32 N 0.24 0.47 -0.67 2.37 4.57 -1.13 -1.18 114.58 119.24 1sq8 h GLU 32 Ca -0.11 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 57.96 1sq8 h GLU 32 Cb 1.58 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 30.04 1sq8 h GLU 32 CO 0.18 0.35 0.16 -0.56 -1.18 0.00 0.00 179.01 177.96 1sq8 h GLN 33 N 0.46 1.07 -0.59 1.92 3.07 -0.98 -2.45 115.11 117.61 1sq8 h GLN 33 Ca 0.13 -0.25 -0.10 0.00 0.09 0.00 0.00 58.65 58.52 1sq8 h GLN 33 Cb -0.00 -0.15 -0.02 0.00 0.08 0.00 0.00 27.48 27.39 1sq8 h GLN 33 CO -0.02 0.94 -0.01 -0.07 0.09 0.00 0.00 178.83 179.76 1sq8 h LEU 34 N 1.02 1.01 -0.20 0.06 3.38 -1.00 0.32 115.31 119.89 1sq8 h LEU 34 Ca 0.21 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.95 1sq8 h LEU 34 Cb 0.35 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1sq8 h LEU 34 CO 0.00 1.07 -0.11 -0.33 0.09 0.00 0.00 178.44 179.15 1sq8 h GLU 35 N 0.94 -0.10 -0.49 1.13 5.08 -1.05 -1.92 114.58 118.17 1sq8 h GLU 35 Ca 0.17 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1sq8 h GLU 35 Cb 0.56 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1sq8 h GLU 35 CO 0.03 -0.07 0.00 0.27 -1.00 0.00 0.00 179.01 178.24 1sq8 n ASN 36 N -5.27 0.99 0.00 1.42 0.23 -0.80 -4.35 115.26 107.47 1sq8 n ASN 36 Ca -0.02 -2.05 0.00 0.00 -0.53 0.00 0.00 54.58 51.98 1sq8 n ASN 36 Cb 0.19 -0.28 0.00 0.00 -2.08 0.00 0.00 39.78 37.61 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 0.38 0.48 0.00 4.83 0.00 -0.53 -4.90 105.19 105.44 1sq8 n GLY 37 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 1sq8 n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sq8 n LYS 38 N -1.93 0.12 -3.92 1.61 4.76 0.10 -4.04 118.16 114.87 1sq8 n LYS 38 Ca 0.00 0.13 -0.30 0.00 -2.87 0.00 0.00 58.31 55.27 1sq8 n LYS 38 Cb 0.09 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 31.64 1sq8 n LYS 38 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1sq8 s ALA 39 N -2.83 2.53 0.00 7.82 0.00 -1.25 -4.92 121.76 123.10 1sq8 s ALA 39 Ca 0.14 -2.38 -0.13 0.00 0.00 0.00 0.00 51.96 49.58 1sq8 s ALA 39 Cb 0.13 -1.89 -0.07 0.00 0.00 0.00 0.00 23.12 21.29 1sq8 s ALA 39 CO 0.34 -1.74 0.83 -0.22 0.00 0.00 0.00 175.76 174.97 1sq8 h LYS 40 N 7.57 -0.47 -3.52 0.00 1.63 -1.96 -3.39 116.57 116.44 1sq8 h LYS 40 Ca -0.07 0.03 -0.67 0.00 -0.85 0.00 0.00 60.65 59.09 1sq8 h LYS 40 Cb 1.00 0.11 -0.38 0.00 -0.60 0.00 0.00 32.23 32.36 1sq8 h LYS 40 CO 0.52 -0.31 -0.49 0.50 -3.45 0.00 0.00 179.45 176.22 1sq8 s ARG 41 N -3.42 2.27 0.59 1.90 3.52 -1.26 -5.07 118.95 117.48 1sq8 s ARG 41 Ca -0.07 -2.56 -0.19 0.00 -0.13 0.00 0.00 55.73 52.78 1sq8 s ARG 41 Cb 0.01 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.83 1sq8 s ARG 41 CO 0.21 -1.14 1.22 -1.25 -0.81 0.00 0.00 175.30 173.53 1sq8 s PRO 42 N -0.15 2.98 0.35 5.12 0.04 -1.26 -4.91 135.00 137.16 1sq8 s PRO 42 Ca 0.17 1.87 0.05 0.00 0.04 0.00 0.00 61.00 63.13 1sq8 s PRO 42 Cb -0.23 -1.96 0.71 0.00 0.04 0.00 0.00 34.50 33.06 1sq8 s PRO 42 CO -0.02 -1.21 1.93 0.07 0.04 0.00 0.00 177.00 177.80 1sq8 h ARG 43 N 0.93 0.78 -0.47 4.56 0.11 -1.99 -2.09 114.38 116.22 1sq8 h ARG 43 Ca -0.50 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 59.53 1sq8 h ARG 43 Cb 1.30 -0.18 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1sq8 h ARG 43 CO 0.55 0.52 0.00 1.97 0.10 0.00 0.00 179.97 183.11 1sq8 n PHE 44 N -4.50 0.53 -0.25 4.08 1.16 -1.26 -4.62 117.46 112.59 1sq8 n PHE 44 Ca 0.13 -0.22 0.00 0.00 -1.87 0.00 0.00 57.45 55.49 1sq8 n PHE 44 Cb 0.28 -0.09 0.07 0.00 -1.61 0.00 0.00 39.48 38.13 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 1.64 -0.79 -1.13 5.98 5.85 -1.74 0.15 115.31 125.27 1sq8 h LEU 45 Ca 0.00 0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.89 1sq8 h LEU 45 Cb 0.61 0.49 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1sq8 h LEU 45 CO 0.06 -0.26 -0.26 1.55 -0.34 0.00 0.00 178.44 179.19 1sq8 h PRO 46 N -0.03 0.00 -0.06 5.25 0.13 -1.87 0.13 132.00 135.55 1sq8 h PRO 46 Ca 0.34 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.45 1sq8 h PRO 46 Cb 0.55 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 1sq8 h PRO 46 CO -0.76 0.26 -0.04 0.93 -0.23 0.00 0.00 178.00 178.16 1sq8 h GLU 47 N 0.00 0.13 -0.43 0.86 5.08 -1.34 -0.82 114.58 118.05 1sq8 h GLU 47 Ca -0.00 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1sq8 h GLU 47 Cb 0.75 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.96 1sq8 h GLU 47 CO 0.03 0.53 0.20 1.25 -1.00 0.00 0.00 179.01 180.02 1sq8 h LEU 48 N -0.27 0.28 0.40 1.33 6.46 -0.63 0.19 115.31 123.07 1sq8 h LEU 48 Ca 0.01 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.78 1sq8 h LEU 48 Cb 0.49 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.40 1sq8 h LEU 48 CO 0.01 0.20 -0.19 0.00 -0.62 0.00 0.00 178.44 177.84 1sq8 h ALA 49 N 1.24 -0.54 -0.54 1.25 0.00 -0.94 0.37 119.26 120.10 1sq8 h ALA 49 Ca 0.19 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1sq8 h ALA 49 Cb 0.11 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1sq8 h ALA 49 CO -0.15 -0.76 0.35 -0.09 0.00 0.00 0.00 179.25 178.60 1sq8 h ARG 50 N -0.63 0.69 -0.37 0.00 2.43 -0.92 0.10 114.38 115.69 1sq8 h ARG 50 Ca -0.06 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 58.94 1sq8 h ARG 50 Cb 0.46 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1sq8 h ARG 50 CO 0.09 0.46 -0.29 0.00 -1.51 0.00 0.00 179.97 178.72 1sq8 h ALA 51 N 1.21 0.79 0.00 2.80 0.00 -0.58 -2.32 119.26 121.16 1sq8 h ALA 51 Ca 0.20 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1sq8 h ALA 51 Cb -0.06 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1sq8 h ALA 51 CO -0.06 0.65 -0.14 1.25 0.00 0.00 0.00 179.25 180.95 1sq8 h LEU 52 N 0.67 0.00 -2.38 0.00 5.85 0.24 -3.48 115.31 116.21 1sq8 h LEU 52 Ca 0.08 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 1sq8 h LEU 52 Cb 0.83 0.00 0.09 0.00 0.37 0.00 0.00 40.66 41.95 1sq8 h LEU 52 CO 0.07 0.14 -0.39 0.61 -0.34 0.00 0.00 178.44 178.53 1sq8 n GLY 53 N -0.33 -0.01 3.30 3.75 0.00 0.24 -5.05 105.19 107.09 1sq8 n GLY 53 Ca -0.01 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.18 0.00 0.65 1.61 -7.23 -0.52 -5.03 120.40 106.70 1sq8 s VAL 54 Ca 0.13 -1.86 -0.13 0.00 -1.81 0.00 0.00 61.98 58.31 1sq8 s VAL 54 Cb -0.02 -2.44 -0.01 0.00 0.56 0.00 0.00 36.38 34.48 1sq8 s VAL 54 CO 0.35 0.00 1.06 0.00 -0.31 0.00 0.00 175.10 176.20 1sq8 s ALA 55 N -4.08 2.69 0.31 1.32 0.00 -1.26 -3.96 121.76 116.78 1sq8 s ALA 55 Ca 0.35 0.23 -0.01 0.00 0.00 0.00 0.00 51.96 52.53 1sq8 s ALA 55 Cb 0.05 -3.20 0.49 0.00 0.00 0.00 0.00 23.12 20.46 1sq8 s ALA 55 CO 0.12 -1.07 1.98 0.28 0.00 0.00 0.00 175.76 177.07 1sq8 h VAL 56 N -0.23 1.20 -0.11 0.00 2.07 -1.91 -0.04 116.25 117.23 1sq8 h VAL 56 Ca -0.45 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 66.61 1sq8 h VAL 56 Cb 1.22 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1sq8 h VAL 56 CO 0.57 0.19 -0.36 -0.78 0.02 0.00 0.00 177.57 177.21 1sq8 h ASP 57 N 1.05 0.23 -0.19 0.57 1.82 -1.93 0.15 116.42 118.13 1sq8 h ASP 57 Ca 0.28 -0.09 -0.03 0.00 -0.39 0.00 0.00 57.03 56.81 1sq8 h ASP 57 Cb -0.12 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 39.82 1sq8 h ASP 57 CO -0.06 0.58 -0.00 -0.25 -1.61 0.00 0.00 179.24 177.90 1sq8 h TRP 58 N 0.20 0.37 0.55 0.28 7.01 -1.08 0.27 115.95 123.54 1sq8 h TRP 58 Ca 0.02 -0.06 -0.02 0.00 2.11 0.00 0.00 58.89 60.94 1sq8 h TRP 58 Cb 0.73 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.68 1sq8 h TRP 58 CO 0.01 0.54 -0.49 -0.07 -2.79 0.00 0.00 178.44 175.64 1sq8 h LEU 59 N 0.09 -1.32 0.70 0.65 3.38 -0.58 0.01 115.31 118.23 1sq8 h LEU 59 Ca 0.05 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1sq8 h LEU 59 Cb 0.40 0.43 0.01 0.00 0.09 0.00 0.00 40.66 41.58 1sq8 h LEU 59 CO 0.01 -0.67 -0.34 -0.07 0.09 0.00 0.00 178.44 177.46 1sq8 h LEU 60 N -1.02 -0.82 0.00 1.67 3.38 -0.72 -3.40 115.31 114.40 1sq8 h LEU 60 Ca -0.07 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1sq8 h LEU 60 Cb 0.87 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1sq8 h LEU 60 CO -0.03 -0.58 -1.37 0.59 0.09 0.00 0.00 178.44 177.15 1sq8 n ASN 61 N -5.50 3.55 0.00 -0.43 3.02 0.88 -4.76 115.26 112.02 1sq8 n ASN 61 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 1sq8 n ASN 61 Cb 0.39 0.84 0.00 0.00 -0.61 0.00 0.00 39.78 40.40 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 2.48 0.84 0.00 7.41 0.00 -0.01 -4.98 105.19 110.93 1sq8 n GLY 62 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1sq8 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32