#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sq8 s LEU 1 N 0.00 2.73 0.01 -0.89 1.02 -1.26 -4.93 118.68 115.36 1sq8 s LEU 1 Ca 0.00 0.88 -0.25 0.00 0.02 0.00 0.00 54.13 54.78 1sq8 s LEU 1 Cb 0.00 -3.52 -0.17 0.00 0.02 0.00 0.00 46.19 42.52 1sq8 s LEU 1 CO 0.00 -1.61 1.26 0.24 0.02 0.00 0.00 176.35 176.26 1sq8 h MET 2 N -0.80 -0.36 -0.54 1.70 2.86 -1.90 0.24 114.93 116.12 1sq8 h MET 2 Ca -0.45 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.31 1sq8 h MET 2 Cb 1.29 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 32.96 1sq8 h MET 2 CO 0.64 -0.04 0.08 0.78 1.06 0.00 0.00 176.91 179.43 1sq8 h GLY 3 N -0.71 0.64 1.18 8.32 0.00 -1.80 -0.43 103.07 110.27 1sq8 h GLY 3 Ca -0.04 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 1sq8 h GLY 3 CO 0.06 -0.11 0.14 0.83 0.00 0.00 0.00 176.54 177.46 1sq8 h GLU 4 N 0.21 1.01 -0.13 4.80 4.39 -1.73 -1.18 114.58 121.95 1sq8 h GLU 4 Ca 0.28 -0.24 0.02 0.00 0.34 0.00 0.00 59.36 59.76 1sq8 h GLU 4 Cb 0.40 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1sq8 h GLU 4 CO -0.39 0.91 -0.00 0.00 -1.16 0.00 0.00 179.01 178.37 1sq8 h ARG 5 N 0.96 0.04 0.13 2.33 3.08 0.35 0.26 114.38 121.53 1sq8 h ARG 5 Ca 0.20 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 1sq8 h ARG 5 Cb 0.37 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1sq8 h ARG 5 CO 0.00 0.03 -0.07 0.82 -1.07 0.00 0.00 179.97 179.68 1sq8 h ILE 6 N 0.04 0.84 -0.44 2.04 2.04 -0.88 -0.08 117.51 121.07 1sq8 h ILE 6 Ca 0.06 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.97 1sq8 h ILE 6 Cb 0.07 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 36.95 1sq8 h ILE 6 CO -0.10 0.00 0.17 -0.09 0.00 0.00 0.00 178.15 178.13 1sq8 h ARG 7 N -0.19 0.34 -0.15 2.37 1.12 -1.06 -0.14 114.38 116.67 1sq8 h ARG 7 Ca -0.01 -0.02 -0.01 0.00 -1.11 0.00 0.00 59.98 58.83 1sq8 h ARG 7 Cb 0.16 -0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.03 1sq8 h ARG 7 CO 0.02 0.23 0.06 0.00 -3.11 0.00 0.00 179.97 177.17 1sq8 h ALA 8 N 1.28 0.19 -0.53 2.80 0.00 -0.20 -1.22 119.26 121.58 1sq8 h ALA 8 Ca 0.21 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1sq8 h ALA 8 Cb 0.18 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1sq8 h ALA 8 CO -0.20 -0.23 0.09 -0.09 0.00 0.00 0.00 179.25 178.82 1sq8 h ARG 9 N 0.10 0.84 0.16 0.00 1.12 -0.75 0.24 114.38 116.08 1sq8 h ARG 9 Ca 0.05 -0.19 -0.01 0.00 -1.11 0.00 0.00 59.98 58.72 1sq8 h ARG 9 Cb 0.15 -0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.00 1sq8 h ARG 9 CO -0.01 0.78 -0.08 -0.09 -3.11 0.00 0.00 179.97 177.47 1sq8 h ARG 10 N 0.80 -0.21 -0.28 0.20 2.43 -0.68 -1.96 114.38 114.67 1sq8 h ARG 10 Ca 0.17 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.33 1sq8 h ARG 10 Cb 0.35 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 1sq8 h ARG 10 CO 0.01 0.01 0.06 0.82 -1.51 0.00 0.00 179.97 179.35 1sq8 h ILE 11 N -0.40 1.14 -0.65 1.20 1.08 -1.02 0.49 117.51 119.36 1sq8 h ILE 11 Ca -0.02 -0.51 0.01 0.00 -0.39 0.00 0.00 64.86 63.95 1sq8 h ILE 11 Cb 0.31 0.87 -0.03 0.00 -3.07 0.00 0.00 36.82 34.90 1sq8 h ILE 11 CO 0.04 0.18 0.43 -0.61 -0.69 0.00 0.00 178.15 177.50 1sq8 h GLN 12 N 0.40 0.83 -0.00 2.37 4.15 -0.33 0.25 115.11 122.79 1sq8 h GLN 12 Ca 0.10 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1sq8 h GLN 12 Cb 0.18 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 27.68 1sq8 h GLN 12 CO -0.00 0.55 -0.16 -0.11 -1.93 0.00 0.00 178.83 177.18 1sq8 n LEU 13 N -4.44 0.33 -0.53 -2.39 7.94 -0.55 -4.94 117.00 112.42 1sq8 n LEU 13 Ca 0.07 0.15 -0.07 0.00 -1.11 0.00 0.00 56.01 55.05 1sq8 n LEU 13 Cb 0.06 -0.28 -0.03 0.00 0.53 0.00 0.00 43.42 43.69 1sq8 n LEU 13 CO 0.36 0.07 -0.07 0.61 -1.11 0.00 0.00 177.39 177.25 1sq8 n GLY 14 N 1.38 0.80 3.91 -3.96 0.00 0.08 -5.00 105.19 102.40 1sq8 n GLY 14 Ca 0.11 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.58 3.26 0.51 0.99 1.43 -0.61 -4.92 118.68 117.76 1sq8 s LEU 15 Ca 0.00 0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 53.97 1sq8 s LEU 15 Cb 0.00 -3.75 0.01 0.00 0.03 0.00 0.00 46.19 42.48 1sq8 s LEU 15 CO 0.00 -0.99 0.75 0.20 0.23 0.00 0.00 176.35 176.54 1sq8 s ASN 16 N -4.26 5.65 0.24 2.29 0.01 -1.26 -4.47 114.94 113.13 1sq8 s ASN 16 Ca 0.53 0.33 -0.05 0.00 -0.71 0.00 0.00 52.86 52.96 1sq8 s ASN 16 Cb -0.11 -1.44 0.39 0.00 0.41 0.00 0.00 41.25 40.50 1sq8 s ASN 16 CO 0.47 -0.89 1.77 1.56 -1.51 0.00 0.00 177.10 178.50 1sq8 h GLN 17 N 0.18 0.59 -0.91 -0.60 4.20 -1.98 -0.79 115.11 115.81 1sq8 h GLN 17 Ca -0.45 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.22 1sq8 h GLN 17 Cb 1.26 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.87 1sq8 h GLN 17 CO 0.57 0.39 0.54 0.00 -0.67 0.00 0.00 178.83 179.66 1sq8 h ALA 18 N 1.47 1.24 0.00 3.87 0.00 -1.93 0.38 119.26 124.29 1sq8 h ALA 18 Ca 0.38 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 1sq8 h ALA 18 Cb 0.44 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1sq8 h ALA 18 CO -0.30 0.64 -0.26 0.93 0.00 0.00 0.00 179.25 180.27 1sq8 h GLU 19 N 1.25 0.17 -0.51 0.00 4.39 -1.76 -2.09 114.58 116.03 1sq8 h GLU 19 Ca 0.32 -0.19 0.07 0.00 0.34 0.00 0.00 59.36 59.91 1sq8 h GLU 19 Cb -0.04 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 1sq8 h GLU 19 CO -0.06 0.93 0.19 1.25 -1.16 0.00 0.00 179.01 180.16 1sq8 h LEU 20 N -0.52 0.20 0.11 1.33 5.85 -1.05 -0.43 115.31 120.80 1sq8 h LEU 20 Ca -0.03 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1sq8 h LEU 20 Cb 1.03 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 1sq8 h LEU 20 CO 0.05 0.14 -0.51 0.00 -0.34 0.00 0.00 178.44 177.78 1sq8 h ALA 21 N 1.34 -0.94 -0.66 1.25 0.00 -0.92 -0.43 119.26 118.90 1sq8 h ALA 21 Ca 0.25 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1sq8 h ALA 21 Cb 0.26 0.86 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 1sq8 h ALA 21 CO -0.24 -1.10 0.42 1.96 0.00 0.00 0.00 179.25 180.29 1sq8 h GLN 22 N -0.73 0.82 0.00 0.00 4.20 -1.00 0.17 115.11 118.57 1sq8 h GLN 22 Ca 0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1sq8 h GLN 22 Cb 0.75 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1sq8 h GLN 22 CO -0.29 0.54 0.00 1.17 -0.67 0.00 0.00 178.83 179.59 1sq8 n LYS 23 N -4.66 0.50 -0.09 1.46 0.00 -0.20 -2.29 118.16 112.87 1sq8 n LYS 23 Ca 0.06 0.04 -0.16 0.00 0.00 0.00 0.00 58.31 58.24 1sq8 n LYS 23 Cb 0.05 -1.50 -0.13 0.00 0.00 0.00 0.00 35.03 33.45 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 1.53 0.00 3.15 0.31 -0.20 -4.84 118.33 117.09 1sq8 n VAL 24 Ca 0.14 -0.66 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 1sq8 n VAL 24 Cb 0.16 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 31.83 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 2.06 1.05 3.71 2.92 0.00 0.42 -4.86 105.19 110.49 1sq8 n GLY 25 Ca -0.39 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.42 1sq8 n GLY 25 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1sq8 n VAL 26 N -0.50 0.00 -2.81 1.61 0.24 -0.12 -4.94 118.33 111.80 1sq8 n VAL 26 Ca 0.00 -1.93 -0.30 0.00 -2.04 0.00 0.00 64.34 60.07 1sq8 n VAL 26 Cb 0.00 -0.37 -0.03 0.00 -1.47 0.00 0.00 33.84 31.97 1sq8 n VAL 26 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1sq8 s ASP 27 N -4.32 6.51 0.22 -1.34 -4.77 -1.26 -3.73 116.67 107.97 1sq8 s ASP 27 Ca 0.49 1.15 -0.08 0.00 -3.30 0.00 0.00 52.55 50.81 1sq8 s ASP 27 Cb -0.04 -2.33 0.28 0.00 -1.09 0.00 0.00 42.92 39.74 1sq8 s ASP 27 CO 0.31 -0.42 1.80 -0.61 0.70 0.00 0.00 175.17 176.95 1sq8 h GLN 28 N 1.19 0.67 -0.70 2.11 4.15 -1.85 -2.08 115.11 118.58 1sq8 h GLN 28 Ca -0.47 -0.04 0.07 0.00 0.77 0.00 0.00 58.65 58.98 1sq8 h GLN 28 Cb 1.19 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 28.67 1sq8 h GLN 28 CO 0.64 0.44 0.38 0.37 -1.93 0.00 0.00 178.83 178.73 1sq8 h GLN 29 N 0.69 0.67 -0.40 1.69 5.75 -1.94 -1.41 115.11 120.15 1sq8 h GLN 29 Ca 0.32 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.81 1sq8 h GLN 29 Cb 0.24 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.62 1sq8 h GLN 29 CO -0.21 0.44 0.27 0.00 -2.65 0.00 0.00 178.83 176.68 1sq8 h ALA 30 N 1.38 1.84 -0.10 3.38 0.00 -1.77 -0.37 119.26 123.63 1sq8 h ALA 30 Ca 0.33 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 1sq8 h ALA 30 Cb 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1sq8 h ALA 30 CO -0.21 0.11 -0.17 0.82 0.00 0.00 0.00 179.25 179.79 1sq8 h ILE 31 N 0.43 1.39 -0.10 0.00 1.08 -1.14 -2.84 117.51 116.33 1sq8 h ILE 31 Ca 0.16 -1.45 0.03 0.00 -0.39 0.00 0.00 64.86 63.22 1sq8 h ILE 31 Cb 0.12 2.11 -0.03 0.00 -3.07 0.00 0.00 36.82 35.95 1sq8 h ILE 31 CO -0.04 0.41 -0.08 -0.08 -0.69 0.00 0.00 178.15 177.67 1sq8 h GLU 32 N -0.16 -0.09 -0.34 2.37 4.57 -0.55 0.54 114.58 120.93 1sq8 h GLU 32 Ca 0.01 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.16 1sq8 h GLU 32 Cb 0.75 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.34 1sq8 h GLU 32 CO 0.04 -0.06 0.07 -0.56 -1.18 0.00 0.00 179.01 177.32 1sq8 h GLN 33 N -0.09 0.49 -0.16 1.92 3.07 -1.21 -0.04 115.11 119.08 1sq8 h GLN 33 Ca 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 58.65 58.68 1sq8 h GLN 33 Cb 0.19 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 27.66 1sq8 h GLN 33 CO -0.16 0.46 -0.08 -0.07 0.09 0.00 0.00 178.83 179.07 1sq8 h LEU 34 N 0.48 0.35 -1.40 0.06 3.38 -1.04 0.16 115.31 117.31 1sq8 h LEU 34 Ca 0.11 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1sq8 h LEU 34 Cb 0.20 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1sq8 h LEU 34 CO -0.00 0.69 -0.30 -0.33 0.09 0.00 0.00 178.44 178.59 1sq8 h GLU 35 N 0.01 0.00 0.00 1.13 5.08 -0.69 -1.30 114.58 118.81 1sq8 h GLU 35 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1sq8 h GLU 35 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1sq8 h GLU 35 CO 0.02 0.30 0.00 -0.91 -1.00 0.00 0.00 179.01 177.43 1sq8 h ASN 36 N 0.00 0.00 0.00 1.42 2.35 -0.87 -3.38 115.58 115.10 1sq8 h ASN 36 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1sq8 h ASN 36 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1sq8 h ASN 36 CO 0.04 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.43 1sq8 n GLY 37 N -0.25 0.43 0.10 2.83 0.00 -0.49 -4.98 105.19 102.84 1sq8 n GLY 37 Ca 0.00 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 1sq8 n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sq8 h LYS 38 N 0.33 -0.12 -5.83 1.61 1.57 -0.87 -3.40 116.57 109.86 1sq8 h LYS 38 Ca 0.00 0.01 -0.59 0.00 -1.87 0.00 0.00 60.65 58.20 1sq8 h LYS 38 Cb 0.00 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.25 1sq8 h LYS 38 CO 0.00 0.41 0.50 0.00 -0.57 0.00 0.00 179.45 179.79 1sq8 s ALA 39 N -3.38 3.65 0.00 3.86 0.00 -1.17 -4.96 121.76 119.76 1sq8 s ALA 39 Ca -0.14 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.73 1sq8 s ALA 39 Cb -0.00 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1sq8 s ALA 39 CO 0.52 -0.92 0.11 1.17 0.00 0.00 0.00 175.76 176.63 1sq8 n LYS 40 N 5.99 0.00 -3.42 0.00 0.00 -1.26 -4.70 118.16 114.76 1sq8 n LYS 40 Ca 0.06 0.38 -0.44 0.00 0.00 0.00 0.00 58.31 58.32 1sq8 n LYS 40 Cb 0.47 -0.95 -0.07 0.00 0.00 0.00 0.00 35.03 34.49 1sq8 n LYS 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1sq8 s ARG 41 N -0.99 2.76 0.64 1.64 0.52 -1.26 -5.03 118.95 117.23 1sq8 s ARG 41 Ca 0.00 -1.71 -0.15 0.00 -0.52 0.00 0.00 55.73 53.35 1sq8 s ARG 41 Cb 0.00 -4.12 -0.01 0.00 0.52 0.00 0.00 34.95 31.34 1sq8 s ARG 41 CO 0.00 -1.25 1.09 -1.25 0.02 0.00 0.00 175.30 173.91 1sq8 s PRO 42 N 1.49 2.94 0.31 3.54 0.04 -1.26 -4.96 135.00 137.10 1sq8 s PRO 42 Ca 0.04 1.33 -0.01 0.00 0.04 0.00 0.00 61.00 62.40 1sq8 s PRO 42 Cb -0.28 -1.97 0.48 0.00 0.04 0.00 0.00 34.50 32.76 1sq8 s PRO 42 CO 0.02 -1.13 1.96 0.07 0.04 0.00 0.00 177.00 177.95 1sq8 h ARG 43 N 0.11 1.00 -0.70 4.56 0.11 -2.02 -2.31 114.38 115.14 1sq8 h ARG 43 Ca -0.47 -0.08 0.00 0.00 0.10 0.00 0.00 59.98 59.54 1sq8 h ARG 43 Cb 1.24 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 32.10 1sq8 h ARG 43 CO 0.55 0.69 0.00 1.97 0.10 0.00 0.00 179.97 183.28 1sq8 n PHE 44 N -4.40 0.54 -0.28 4.08 1.16 -1.26 -4.64 117.46 112.65 1sq8 n PHE 44 Ca 0.08 -0.20 0.05 0.00 -1.87 0.00 0.00 57.45 55.51 1sq8 n PHE 44 Cb 0.05 -0.16 0.14 0.00 -1.61 0.00 0.00 39.48 37.90 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 1.22 -0.59 -0.97 5.98 5.85 -1.79 0.13 115.31 125.13 1sq8 h LEU 45 Ca 0.00 0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 1sq8 h LEU 45 Cb 0.77 0.45 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 1sq8 h LEU 45 CO 0.11 -0.25 -0.51 1.55 -0.34 0.00 0.00 178.44 179.00 1sq8 h PRO 46 N 0.03 0.00 -0.37 5.25 0.13 -1.88 -0.07 132.00 135.10 1sq8 h PRO 46 Ca 0.41 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.42 1sq8 h PRO 46 Cb 0.70 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 1sq8 h PRO 46 CO -0.78 0.51 -0.27 0.93 -0.23 0.00 0.00 178.00 178.16 1sq8 h GLU 47 N 0.00 0.83 0.48 0.86 3.07 -1.25 0.63 114.58 119.19 1sq8 h GLU 47 Ca -0.01 -0.40 -0.02 0.00 -0.50 0.00 0.00 59.36 58.43 1sq8 h GLU 47 Cb 0.91 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 1sq8 h GLU 47 CO 0.07 1.04 -0.26 1.25 -1.40 0.00 0.00 179.01 179.71 1sq8 h LEU 48 N 0.62 -0.62 -0.53 1.33 5.85 -0.78 -1.29 115.31 119.89 1sq8 h LEU 48 Ca 0.07 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1sq8 h LEU 48 Cb 0.84 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1sq8 h LEU 48 CO 0.07 -0.42 0.30 0.00 -0.34 0.00 0.00 178.44 178.05 1sq8 h ALA 49 N -0.17 0.68 0.03 1.25 0.00 -0.84 0.35 119.26 120.55 1sq8 h ALA 49 Ca -0.06 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1sq8 h ALA 49 Cb 0.54 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1sq8 h ALA 49 CO 0.08 0.19 -0.21 0.00 0.00 0.00 0.00 179.25 179.32 1sq8 h ARG 50 N 0.71 -0.33 -0.60 0.00 3.08 -0.89 0.26 114.38 116.60 1sq8 h ARG 50 Ca 0.19 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.19 1sq8 h ARG 50 Cb 0.03 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 1sq8 h ARG 50 CO -0.03 -0.22 0.09 0.00 -1.07 0.00 0.00 179.97 178.74 1sq8 h ALA 51 N 0.52 1.02 0.00 0.04 0.00 -0.79 -1.38 119.26 118.67 1sq8 h ALA 51 Ca 0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1sq8 h ALA 51 Cb 0.41 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1sq8 h ALA 51 CO -0.17 0.62 -0.13 1.25 0.00 0.00 0.00 179.25 180.82 1sq8 h LEU 52 N 0.92 0.00 -1.30 0.00 5.85 -0.01 -3.47 115.31 117.30 1sq8 h LEU 52 Ca 0.19 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1sq8 h LEU 52 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1sq8 h LEU 52 CO 0.01 0.13 -0.01 0.61 -0.34 0.00 0.00 178.44 178.84 1sq8 n GLY 53 N -0.47 0.78 3.20 3.75 0.00 0.70 -5.05 105.19 108.09 1sq8 n GLY 53 Ca -0.01 -0.60 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.01 0.13 0.55 1.61 -7.23 -0.01 -5.01 120.40 107.43 1sq8 s VAL 54 Ca 0.01 -1.97 -0.17 0.00 -1.81 0.00 0.00 61.98 58.04 1sq8 s VAL 54 Cb -0.00 -2.36 -0.06 0.00 0.56 0.00 0.00 36.38 34.52 1sq8 s VAL 54 CO 0.01 -0.17 1.03 0.00 -0.31 0.00 0.00 175.10 175.67 1sq8 s ALA 55 N -4.05 2.85 0.40 1.32 0.00 -1.26 -3.86 121.76 117.15 1sq8 s ALA 55 Ca 0.34 0.37 0.07 0.00 0.00 0.00 0.00 51.96 52.73 1sq8 s ALA 55 Cb 0.07 -3.20 0.82 0.00 0.00 0.00 0.00 23.12 20.81 1sq8 s ALA 55 CO 0.09 -0.57 2.04 0.28 0.00 0.00 0.00 175.76 177.60 1sq8 h VAL 56 N 0.76 1.12 -0.93 0.00 2.07 -1.91 -0.56 116.25 116.80 1sq8 h VAL 56 Ca -0.47 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 66.81 1sq8 h VAL 56 Cb 1.21 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 1sq8 h VAL 56 CO 0.59 0.12 0.61 -0.78 0.02 0.00 0.00 177.57 178.13 1sq8 h ASP 57 N 0.57 1.05 -0.45 0.57 1.82 -1.99 0.13 116.42 118.11 1sq8 h ASP 57 Ca 0.15 -0.02 -0.06 0.00 -0.39 0.00 0.00 57.03 56.70 1sq8 h ASP 57 Cb -0.03 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 39.71 1sq8 h ASP 57 CO -0.03 0.75 0.03 -0.25 -1.61 0.00 0.00 179.24 178.13 1sq8 h TRP 58 N 1.23 0.84 -0.32 0.28 7.01 -1.71 0.76 115.95 124.03 1sq8 h TRP 58 Ca 0.35 -0.13 0.04 0.00 2.11 0.00 0.00 58.89 61.26 1sq8 h TRP 58 Cb -0.10 -0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 26.70 1sq8 h TRP 58 CO -0.00 0.80 0.08 -0.07 -2.79 0.00 0.00 178.44 176.46 1sq8 h LEU 59 N 0.63 0.04 0.01 0.65 3.38 -0.23 0.29 115.31 120.08 1sq8 h LEU 59 Ca 0.13 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1sq8 h LEU 59 Cb 0.45 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1sq8 h LEU 59 CO 0.02 0.06 -0.00 -0.07 0.09 0.00 0.00 178.44 178.53 1sq8 h LEU 60 N 0.20 -0.01 0.00 1.67 3.38 -0.65 -3.41 115.31 116.50 1sq8 h LEU 60 Ca 0.15 -0.27 -0.42 0.00 0.09 0.00 0.00 57.88 57.43 1sq8 h LEU 60 Cb 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 1sq8 h LEU 60 CO -0.19 0.26 -2.50 0.59 0.09 0.00 0.00 178.44 176.70 1sq8 n ASN 61 N -4.96 1.97 -0.94 -0.43 3.02 0.25 -4.89 115.26 109.27 1sq8 n ASN 61 Ca -0.08 0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1sq8 n ASN 61 Cb 0.15 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.71 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 1.77 0.05 0.00 7.41 0.00 0.10 -4.72 105.19 109.80 1sq8 n GLY 62 Ca -0.50 -0.38 0.08 0.00 0.00 0.00 0.00 46.02 45.22 1sq8 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32