#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oi6 s GLN 2 N 0.00 2.85 0.05 2.12 -0.21 -0.77 -4.94 119.66 118.76 1oi6 s GLN 2 Ca 0.00 -0.55 0.09 0.00 0.02 0.00 0.00 55.36 54.92 1oi6 s GLN 2 Cb 0.00 -2.71 -0.03 0.00 1.00 0.00 0.00 33.01 31.27 1oi6 s GLN 2 CO 0.00 0.65 -0.23 0.00 -2.12 0.00 0.00 175.29 173.59 1oi6 s ALA 3 N -1.02 2.41 -0.04 6.09 0.00 -1.26 -0.49 121.76 127.46 1oi6 s ALA 3 Ca 0.18 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 1oi6 s ALA 3 Cb -0.11 -0.58 0.03 0.00 0.00 0.00 0.00 23.12 22.46 1oi6 s ALA 3 CO 0.08 0.55 0.03 0.50 0.00 0.00 0.00 175.76 176.92 1oi6 s ARG 4 N -1.40 0.13 0.11 0.00 3.52 -0.02 -4.99 118.95 116.29 1oi6 s ARG 4 Ca 0.13 0.21 -0.31 0.00 -0.13 0.00 0.00 55.73 55.63 1oi6 s ARG 4 Cb -0.10 -0.49 -0.07 0.00 -1.56 0.00 0.00 34.95 32.72 1oi6 s ARG 4 CO 0.04 -0.23 1.31 0.15 -0.81 0.00 0.00 175.30 175.76 1oi6 s LYS 5 N 1.53 4.37 0.77 5.12 1.02 -1.26 -0.97 119.74 130.32 1oi6 s LYS 5 Ca -0.03 1.96 -0.06 0.00 0.02 0.00 0.00 55.97 57.86 1oi6 s LYS 5 Cb -0.13 -3.27 0.13 0.00 -0.52 0.00 0.00 37.83 34.03 1oi6 s LYS 5 CO -0.03 -0.34 1.07 -0.51 -0.92 0.00 0.00 175.35 174.62 1oi6 s LEU 6 N 0.88 2.89 0.50 3.17 1.43 -0.55 -4.91 118.68 122.09 1oi6 s LEU 6 Ca 0.61 0.01 0.29 0.00 -1.03 0.00 0.00 54.13 54.01 1oi6 s LEU 6 Cb -0.34 -2.38 0.96 0.00 0.03 0.00 0.00 46.19 44.46 1oi6 s LEU 6 CO 0.31 -1.98 1.83 0.00 0.23 0.00 0.00 176.35 176.74 1oi6 h ALA 7 N -0.80 0.99 -2.45 4.21 0.00 -1.89 -3.41 119.26 115.93 1oi6 h ALA 7 Ca -0.41 -0.03 -0.60 0.00 0.00 0.00 0.00 54.91 53.87 1oi6 h ALA 7 Cb 1.27 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.96 1oi6 h ALA 7 CO 0.45 0.05 0.24 0.08 0.00 0.00 0.00 179.25 180.07 1oi6 s VAL 8 N -3.50 4.95 0.01 0.00 1.01 -1.26 -4.88 120.40 116.73 1oi6 s VAL 8 Ca 0.03 1.29 -0.35 0.00 0.00 0.00 0.00 61.98 62.95 1oi6 s VAL 8 Cb 0.08 -4.00 -0.14 0.00 0.00 0.00 0.00 36.38 32.32 1oi6 s VAL 8 CO 0.60 0.03 1.64 -0.67 0.00 0.00 0.00 175.10 176.69 1oi6 n ASP 9 N 5.57 2.80 0.00 3.32 -0.08 -1.26 -1.25 116.55 125.65 1oi6 n ASP 9 Ca 0.01 1.06 0.00 0.00 -1.51 0.00 0.00 54.79 54.35 1oi6 n ASP 9 Cb 0.49 -1.32 0.00 0.00 2.34 0.00 0.00 41.12 42.62 1oi6 n ASP 9 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1oi6 n GLY 10 N 3.62 2.79 3.77 0.27 0.00 -1.26 -4.91 105.19 109.47 1oi6 n GLY 10 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 1oi6 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oi6 s ALA 11 N -2.09 3.25 -0.01 4.61 0.00 -0.38 -4.63 121.76 122.51 1oi6 s ALA 11 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 1oi6 s ALA 11 Cb 0.00 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.89 1oi6 s ALA 11 CO 0.00 0.01 -0.00 0.42 0.00 0.00 0.00 175.76 176.19 1oi6 s ILE 12 N -1.44 0.09 -0.25 0.00 1.01 -1.07 -1.48 121.20 118.06 1oi6 s ILE 12 Ca 0.49 0.03 -0.10 0.00 0.00 0.00 0.00 60.65 61.07 1oi6 s ILE 12 Cb -0.24 -0.14 -0.05 0.00 0.01 0.00 0.00 42.46 42.04 1oi6 s ILE 12 CO 0.30 0.07 0.16 -0.70 0.00 0.00 0.00 174.94 174.77 1oi6 s GLU 13 N 0.45 3.99 -0.13 2.79 2.12 -0.15 -1.06 118.70 126.72 1oi6 s GLU 13 Ca -0.04 -0.31 -0.03 0.00 0.36 0.00 0.00 54.97 54.95 1oi6 s GLU 13 Cb -0.06 -3.54 -0.03 0.00 0.26 0.00 0.00 34.13 30.75 1oi6 s GLU 13 CO -0.01 -0.02 -0.02 -0.06 -0.54 0.00 0.00 175.26 174.61 1oi6 s PHE 14 N 1.29 3.08 -0.38 5.30 0.08 0.78 -0.84 117.98 127.29 1oi6 s PHE 14 Ca 0.07 -0.10 -0.02 0.00 0.12 0.00 0.00 56.93 57.00 1oi6 s PHE 14 Cb -0.14 -1.91 0.10 0.00 -0.57 0.00 0.00 43.02 40.50 1oi6 s PHE 14 CO 0.06 0.15 0.15 0.99 -0.10 0.00 0.00 175.22 176.47 1oi6 s THR 15 N -0.05 3.11 0.48 0.64 2.01 0.36 -0.78 115.64 121.41 1oi6 s THR 15 Ca 0.02 -1.97 -0.20 0.00 0.31 0.00 0.00 61.69 59.85 1oi6 s THR 15 Cb -0.13 -3.09 -0.09 0.00 0.01 0.00 0.00 72.50 69.20 1oi6 s THR 15 CO 0.02 -0.58 1.02 -2.16 -0.69 0.00 0.00 174.62 172.23 1oi6 s PRO 16 N 1.13 3.88 0.34 4.92 0.04 -1.26 -1.85 135.00 142.19 1oi6 s PRO 16 Ca 0.06 1.27 -0.27 0.00 0.04 0.00 0.00 61.00 62.11 1oi6 s PRO 16 Cb -0.22 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 32.12 1oi6 s PRO 16 CO -0.04 -0.35 1.06 0.50 0.04 0.00 0.00 177.00 178.20 1oi6 s ARG 17 N -3.32 4.42 -0.27 4.56 3.52 -1.26 -4.80 118.95 121.79 1oi6 s ARG 17 Ca 0.65 1.62 -0.18 0.00 -0.13 0.00 0.00 55.73 57.69 1oi6 s ARG 17 Cb -0.14 -2.86 -0.03 0.00 -1.56 0.00 0.00 34.95 30.36 1oi6 s ARG 17 CO 0.20 0.07 0.50 0.08 -0.81 0.00 0.00 175.30 175.34 1oi6 s VAL 18 N -1.43 5.07 -0.13 7.11 1.01 -1.26 -4.52 120.40 126.25 1oi6 s VAL 18 Ca 0.51 0.78 -0.07 0.00 0.00 0.00 0.00 61.98 63.20 1oi6 s VAL 18 Cb -0.26 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1oi6 s VAL 18 CO 0.33 0.05 0.12 -0.36 0.00 0.00 0.00 175.10 175.24 1oi6 s PHE 19 N 2.30 3.49 0.02 5.22 0.08 -0.33 -4.97 117.98 123.80 1oi6 s PHE 19 Ca 0.20 0.43 0.02 0.00 0.12 0.00 0.00 56.93 57.70 1oi6 s PHE 19 Cb -0.16 -1.97 -0.01 0.00 -0.57 0.00 0.00 43.02 40.31 1oi6 s PHE 19 CO 0.10 0.60 -0.07 0.00 -0.10 0.00 0.00 175.22 175.74 1oi6 s ALA 20 N -0.70 0.59 0.01 5.36 0.00 -1.26 -0.88 121.76 124.89 1oi6 s ALA 20 Ca 0.13 -0.51 -0.00 0.00 0.00 0.00 0.00 51.96 51.58 1oi6 s ALA 20 Cb -0.12 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.94 1oi6 s ALA 20 CO 0.03 0.08 0.01 -0.40 0.00 0.00 0.00 175.76 175.48 1oi6 n ASP 21 N 2.27 -0.04 0.29 0.00 5.68 -0.63 -5.01 116.55 119.11 1oi6 n ASP 21 Ca -0.17 -1.05 0.17 0.00 -0.50 0.00 0.00 54.79 53.23 1oi6 n ASP 21 Cb 0.56 0.07 0.87 0.00 -1.14 0.00 0.00 41.12 41.48 1oi6 n ASP 21 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1oi6 h ASP 22 N 0.06 0.00 1.44 -1.12 3.32 -2.04 -2.46 116.42 115.61 1oi6 h ASP 22 Ca -0.01 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1oi6 h ASP 22 Cb 0.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1oi6 h ASP 22 CO 0.01 0.05 -0.57 0.03 -1.72 0.00 0.00 179.24 177.04 1oi6 h ARG 23 N 0.00 0.00 0.00 3.56 3.08 -2.02 -3.50 114.38 115.50 1oi6 h ARG 23 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1oi6 h ARG 23 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1oi6 h ARG 23 CO 0.01 0.47 0.00 0.41 -1.07 0.00 0.00 179.97 179.78 1oi6 n GLY 24 N 1.24 -0.06 3.09 0.04 0.00 -0.93 -5.14 105.19 103.43 1oi6 n GLY 24 Ca 0.01 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.08 1oi6 n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oi6 s LEU 25 N 0.00 2.39 -0.09 0.99 1.43 -1.26 -1.60 118.68 120.53 1oi6 s LEU 25 Ca 0.00 -0.78 -0.05 0.00 -1.03 0.00 0.00 54.13 52.27 1oi6 s LEU 25 Cb 0.00 -0.02 0.04 0.00 0.03 0.00 0.00 46.19 46.25 1oi6 s LEU 25 CO 0.00 -0.39 0.22 -0.22 0.23 0.00 0.00 176.35 176.19 1oi6 s LEU 26 N -2.32 0.50 0.16 1.79 2.96 -0.06 -4.99 118.68 116.73 1oi6 s LEU 26 Ca -0.00 0.46 0.06 0.00 -0.22 0.00 0.00 54.13 54.43 1oi6 s LEU 26 Cb -0.01 0.63 -0.04 0.00 0.50 0.00 0.00 46.19 47.26 1oi6 s LEU 26 CO -0.04 -0.16 -0.13 0.27 -1.32 0.00 0.00 176.35 174.98 1oi6 s ILE 27 N 1.23 1.41 -0.57 6.68 -4.36 -1.26 -1.18 121.20 123.15 1oi6 s ILE 27 Ca -0.09 -2.04 0.01 0.00 -0.26 0.00 0.00 60.65 58.27 1oi6 s ILE 27 Cb -0.11 -1.85 0.14 0.00 1.25 0.00 0.00 42.46 41.90 1oi6 s ILE 27 CO -0.08 -0.62 0.34 -0.76 0.24 0.00 0.00 174.94 174.06 1oi6 s LEU 28 N -3.06 4.66 0.30 0.37 1.43 -1.26 -5.00 118.68 116.12 1oi6 s LEU 28 Ca 0.17 -2.99 0.02 0.00 -1.03 0.00 0.00 54.13 50.30 1oi6 s LEU 28 Cb -0.00 -1.72 0.47 0.00 0.03 0.00 0.00 46.19 44.96 1oi6 s LEU 28 CO 0.03 -0.28 1.80 -0.65 0.23 0.00 0.00 176.35 177.49 1oi6 h PRO 29 N 6.65 0.60 -5.24 1.29 0.11 -1.99 -3.40 132.00 130.01 1oi6 h PRO 29 Ca -0.05 -0.16 -0.67 0.00 0.11 0.00 0.00 66.00 65.23 1oi6 h PRO 29 Cb 0.91 -0.07 -0.30 0.00 0.11 0.00 0.00 31.00 31.65 1oi6 h PRO 29 CO 0.70 0.67 -0.81 -0.47 -0.21 0.00 0.00 178.00 177.88 1oi6 s TYR 30 N -4.85 2.75 -0.07 0.65 5.04 -1.26 -4.78 117.35 114.83 1oi6 s TYR 30 Ca -0.08 -0.98 -0.02 0.00 -2.44 0.00 0.00 57.07 53.56 1oi6 s TYR 30 Cb 0.15 -1.85 0.03 0.00 0.35 0.00 0.00 41.96 40.64 1oi6 s TYR 30 CO 0.79 -0.42 0.01 -0.65 -1.34 0.00 0.00 175.55 173.94 1oi6 s GLN 31 N 0.65 0.46 0.20 4.97 -0.21 -1.26 -5.06 119.66 119.41 1oi6 s GLN 31 Ca -0.09 0.16 -0.10 0.00 0.02 0.00 0.00 55.36 55.35 1oi6 s GLN 31 Cb -0.16 -0.89 0.18 0.00 1.00 0.00 0.00 33.01 33.14 1oi6 s GLN 31 CO 0.02 -0.32 1.85 1.49 -2.12 0.00 0.00 175.29 176.22 1oi6 h GLU 32 N 8.35 0.83 -0.31 2.91 4.81 -1.99 -1.24 114.58 127.94 1oi6 h GLU 32 Ca -0.18 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.99 1oi6 h GLU 32 Cb 1.12 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 1oi6 h GLU 32 CO 0.24 0.55 0.14 1.49 -0.73 0.00 0.00 179.01 180.70 1oi6 h GLU 33 N 0.86 0.45 -0.67 1.92 4.81 -1.99 0.60 114.58 120.55 1oi6 h GLU 33 Ca 0.27 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 1oi6 h GLU 33 Cb 0.00 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1oi6 h GLU 33 CO -0.10 0.43 0.29 0.00 -0.73 0.00 0.00 179.01 178.90 1oi6 h ALA 34 N 0.99 0.87 -0.16 2.92 0.00 -1.89 -2.20 119.26 119.80 1oi6 h ALA 34 Ca 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1oi6 h ALA 34 Cb 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1oi6 h ALA 34 CO -0.01 0.47 0.08 0.35 0.00 0.00 0.00 179.25 180.14 1oi6 h PHE 35 N 0.95 0.23 -0.94 0.00 3.57 -0.89 -1.99 116.94 117.86 1oi6 h PHE 35 Ca 0.23 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.73 1oi6 h PHE 35 Cb 0.18 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1oi6 h PHE 35 CO 0.01 0.25 0.62 0.28 -2.23 0.00 0.00 178.31 177.25 1oi6 h VAL 36 N 0.14 1.24 -0.64 1.41 2.07 -0.81 0.17 116.25 119.83 1oi6 h VAL 36 Ca 0.06 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1oi6 h VAL 36 Cb 0.11 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 29.71 1oi6 h VAL 36 CO -0.01 0.23 0.36 -0.08 0.02 0.00 0.00 177.57 178.10 1oi6 h GLU 37 N 1.27 0.88 0.18 1.57 4.81 -1.26 0.17 114.58 122.20 1oi6 h GLU 37 Ca 0.34 -0.09 -0.31 0.00 -0.13 0.00 0.00 59.36 59.17 1oi6 h GLU 37 Cb -0.14 -0.18 0.02 0.00 0.63 0.00 0.00 28.75 29.08 1oi6 h GLU 37 CO -0.08 0.65 -1.39 0.00 -0.73 0.00 0.00 179.01 177.46 1oi6 h ALA 38 N 1.18 0.00 0.01 2.92 0.00 -0.89 -3.38 119.26 119.10 1oi6 h ALA 38 Ca 0.23 -0.91 -0.35 0.00 0.00 0.00 0.00 54.91 53.88 1oi6 h ALA 38 Cb 0.02 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 1oi6 h ALA 38 CO -0.04 0.87 -2.20 1.58 0.00 0.00 0.00 179.25 179.46 1oi6 n HIS 39 N -3.61 0.32 0.00 0.00 -0.00 0.54 -5.02 115.22 107.46 1oi6 n HIS 39 Ca -0.13 0.11 0.00 0.00 -0.00 0.00 0.00 57.72 57.69 1oi6 n HIS 39 Cb 1.06 -1.06 0.00 0.00 -0.00 0.00 0.00 29.99 30.00 1oi6 n HIS 39 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1oi6 n GLY 40 N 1.75 0.40 3.82 1.57 0.00 0.60 -5.04 105.19 108.29 1oi6 n GLY 40 Ca -0.30 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.67 1oi6 n GLY 40 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oi6 s GLY 41 N -1.61 -0.07 0.86 -0.02 0.00 -1.24 -4.86 107.32 100.38 1oi6 s GLY 41 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 44.72 44.39 1oi6 s GLY 41 CO 0.00 0.07 1.12 2.56 0.00 0.00 0.00 173.10 176.86 1oi6 s PRO 42 N -3.40 1.58 0.64 2.90 0.04 -1.23 -3.97 135.00 131.56 1oi6 s PRO 42 Ca 0.13 0.41 -0.18 0.00 0.04 0.00 0.00 61.00 61.40 1oi6 s PRO 42 Cb -0.04 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 1oi6 s PRO 42 CO 0.06 -1.92 1.26 -0.11 0.04 0.00 0.00 177.00 176.33 1oi6 n LEU 43 N -3.60 5.78 -4.42 -3.56 7.94 -1.26 -4.55 117.00 113.32 1oi6 n LEU 43 Ca 0.07 0.83 -0.37 0.00 -1.11 0.00 0.00 56.01 55.43 1oi6 n LEU 43 Cb 0.58 -1.54 0.05 0.00 0.53 0.00 0.00 43.42 43.05 1oi6 n LEU 43 CO 0.57 -1.07 -0.07 2.22 -1.11 0.00 0.00 177.39 177.93 1oi6 n PHE 44 N -1.86 -1.17 -1.71 1.96 1.16 -1.26 -4.86 117.46 109.71 1oi6 n PHE 44 Ca 0.15 0.36 -0.43 0.00 -1.87 0.00 0.00 57.45 55.67 1oi6 n PHE 44 Cb 0.48 -1.88 -0.03 0.00 -1.61 0.00 0.00 39.48 36.44 1oi6 n PHE 44 CO 0.00 0.00 0.00 -2.13 -1.87 0.00 0.00 176.76 172.76 1oi6 n ARG 45 N -0.21 2.58 -2.87 3.97 0.63 -1.26 -4.94 116.66 114.57 1oi6 n ARG 45 Ca 0.10 0.93 -0.42 0.00 -0.92 0.00 0.00 57.85 57.53 1oi6 n ARG 45 Cb 0.49 -2.73 -0.04 0.00 0.45 0.00 0.00 32.46 30.63 1oi6 n ARG 45 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1oi6 s VAL 46 N 0.70 4.71 -0.05 5.15 1.01 -1.26 -4.45 120.40 126.22 1oi6 s VAL 46 Ca 0.72 1.25 0.13 0.00 0.00 0.00 0.00 61.98 64.08 1oi6 s VAL 46 Cb -0.55 -4.22 -0.21 0.00 0.00 0.00 0.00 36.38 31.40 1oi6 s VAL 46 CO 0.39 -0.35 0.74 0.00 0.00 0.00 0.00 175.10 175.89 1oi6 h ALA 47 N 8.20 0.73 -1.83 5.51 0.00 -1.36 -3.49 119.26 127.01 1oi6 h ALA 47 Ca -0.24 -1.30 -0.00 0.00 0.00 0.00 0.00 54.91 53.37 1oi6 h ALA 47 Cb 1.09 0.40 -0.21 0.00 0.00 0.00 0.00 17.79 19.07 1oi6 h ALA 47 CO 0.93 1.43 0.30 -1.14 0.00 0.00 0.00 179.25 180.77 1oi6 s GLN 48 N -2.67 0.82 0.29 0.00 0.74 -1.22 -4.67 119.66 112.94 1oi6 s GLN 48 Ca -0.04 0.43 0.11 0.00 0.05 0.00 0.00 55.36 55.91 1oi6 s GLN 48 Cb 0.08 0.39 -0.05 0.00 1.10 0.00 0.00 33.01 34.53 1oi6 s GLN 48 CO 0.82 -0.21 -0.13 0.95 -0.55 0.00 0.00 175.29 176.17 1oi6 s THR 49 N -0.66 2.69 -0.01 -0.34 -4.23 -1.26 -1.14 115.64 110.69 1oi6 s THR 49 Ca -0.05 -2.26 0.04 0.00 -1.18 0.00 0.00 61.69 58.25 1oi6 s THR 49 Cb -0.02 -2.48 -0.01 0.00 1.34 0.00 0.00 72.50 71.33 1oi6 s THR 49 CO 0.04 -0.37 -0.14 -0.63 -0.54 0.00 0.00 174.62 172.98 1oi6 s ILE 50 N -2.48 1.14 -0.28 2.99 1.01 -0.50 -4.98 121.20 118.11 1oi6 s ILE 50 Ca 0.31 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.37 1oi6 s ILE 50 Cb -0.04 -0.95 0.08 0.00 0.01 0.00 0.00 42.46 41.55 1oi6 s ILE 50 CO 0.16 0.32 -0.03 -2.28 0.00 0.00 0.00 174.94 173.12 1oi6 s HIS 51 N -0.32 3.00 -0.14 3.97 5.65 -1.26 -1.41 115.29 124.79 1oi6 s HIS 51 Ca 0.05 -2.30 -0.01 0.00 0.25 0.00 0.00 55.06 53.05 1oi6 s HIS 51 Cb -0.06 -2.09 -0.02 0.00 -1.18 0.00 0.00 32.58 29.23 1oi6 s HIS 51 CO -0.00 -0.87 -0.11 0.45 -0.65 0.00 0.00 174.74 173.56 1oi6 s SER 52 N 1.18 4.20 -0.06 9.88 0.15 -0.35 -4.98 113.70 123.73 1oi6 s SER 52 Ca -0.00 -0.28 0.04 0.00 0.70 0.00 0.00 55.95 56.40 1oi6 s SER 52 Cb -0.19 -1.65 -0.02 0.00 -1.71 0.00 0.00 66.02 62.44 1oi6 s SER 52 CO -0.08 0.16 -0.17 -0.32 1.20 0.00 0.00 173.24 174.03 1oi6 s MET 53 N 0.39 2.56 0.02 5.44 1.75 -1.26 -0.69 119.30 127.51 1oi6 s MET 53 Ca -0.09 -0.75 0.03 0.00 -1.25 0.00 0.00 55.69 53.63 1oi6 s MET 53 Cb -0.15 -2.34 -0.02 0.00 2.84 0.00 0.00 34.83 35.16 1oi6 s MET 53 CO 0.05 0.54 -0.09 -1.12 -0.65 0.00 0.00 175.02 173.75 1oi6 s SER 54 N -0.53 1.04 0.71 1.11 0.01 -0.05 -4.95 113.70 111.03 1oi6 s SER 54 Ca 0.07 -0.34 -0.13 0.00 1.31 0.00 0.00 55.95 56.86 1oi6 s SER 54 Cb -0.11 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.08 1oi6 s SER 54 CO 0.01 -0.02 1.10 -0.54 0.41 0.00 0.00 173.24 174.21 1oi6 s LYS 55 N -0.85 2.56 0.30 12.44 1.02 -1.26 -1.85 119.74 132.11 1oi6 s LYS 55 Ca -0.01 1.31 -0.30 0.00 0.02 0.00 0.00 55.97 56.99 1oi6 s LYS 55 Cb -0.06 -1.93 -0.12 0.00 -0.52 0.00 0.00 37.83 35.21 1oi6 s LYS 55 CO 0.00 -1.42 1.59 -2.13 -0.92 0.00 0.00 175.35 172.47 1oi6 n ARG 56 N -2.87 2.71 -0.32 1.68 0.63 -1.23 -1.86 116.66 115.41 1oi6 n ARG 56 Ca 0.10 0.96 0.00 0.00 -0.92 0.00 0.00 57.85 57.99 1oi6 n ARG 56 Cb 0.52 -2.74 0.00 0.00 0.45 0.00 0.00 32.46 30.69 1oi6 n ARG 56 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1oi6 n GLY 57 N 1.96 1.38 3.76 5.14 0.00 0.04 -4.86 105.19 112.60 1oi6 n GLY 57 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1oi6 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oi6 s VAL 58 N -2.96 2.59 -0.18 1.61 1.01 -0.78 -1.70 120.40 119.99 1oi6 s VAL 58 Ca 0.00 0.53 0.01 0.00 0.00 0.00 0.00 61.98 62.52 1oi6 s VAL 58 Cb 0.00 -3.34 0.03 0.00 0.00 0.00 0.00 36.38 33.06 1oi6 s VAL 58 CO 0.00 0.10 -0.17 -0.69 0.00 0.00 0.00 175.10 174.34 1oi6 s VAL 59 N -0.49 1.93 -0.14 2.92 1.01 -0.65 -1.24 120.40 123.74 1oi6 s VAL 59 Ca 0.55 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1oi6 s VAL 59 Cb -0.42 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 1oi6 s VAL 59 CO 0.49 0.45 -0.06 -0.13 0.00 0.00 0.00 175.10 175.84 1oi6 s ARG 60 N 1.32 3.56 0.00 2.72 0.52 -0.51 -4.58 118.95 121.99 1oi6 s ARG 60 Ca 0.03 -0.56 0.00 0.00 -0.52 0.00 0.00 55.73 54.68 1oi6 s ARG 60 Cb -0.14 -2.83 0.00 0.00 0.52 0.00 0.00 34.95 32.50 1oi6 s ARG 60 CO -0.11 0.26 0.00 0.41 0.02 0.00 0.00 175.30 175.87 1oi6 n GLY 61 N 3.47 0.72 3.71 -3.53 0.00 -1.26 -1.31 105.19 106.99 1oi6 n GLY 61 Ca -0.18 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.23 1oi6 n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oi6 s ILE 62 N -0.83 4.83 -0.06 -0.61 1.01 -0.13 -4.28 121.20 121.13 1oi6 s ILE 62 Ca 0.00 2.00 0.02 0.00 0.00 0.00 0.00 60.65 62.66 1oi6 s ILE 62 Cb 0.00 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.15 1oi6 s ILE 62 CO 0.00 0.19 -0.10 -1.00 0.00 0.00 0.00 174.94 174.04 1oi6 s HIS 63 N 0.83 2.85 0.14 3.97 3.76 0.16 -0.70 115.29 126.28 1oi6 s HIS 63 Ca 0.50 -0.07 -0.09 0.00 -0.15 0.00 0.00 55.06 55.25 1oi6 s HIS 63 Cb -0.21 -1.69 -0.00 0.00 1.11 0.00 0.00 32.58 31.79 1oi6 s HIS 63 CO 0.27 0.26 0.26 1.52 -0.85 0.00 0.00 174.74 176.20 1oi6 s TYR 64 N -0.73 0.27 -0.11 1.40 -0.85 -0.71 -1.31 117.35 115.30 1oi6 s TYR 64 Ca 0.11 -0.65 -0.04 0.00 -0.52 0.00 0.00 57.07 55.97 1oi6 s TYR 64 Cb -0.11 -0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.16 1oi6 s TYR 64 CO 0.01 -0.66 0.05 0.99 -1.52 0.00 0.00 175.55 174.42 1oi6 s THR 65 N -3.92 4.72 0.20 -3.49 2.01 -1.26 -0.95 115.64 112.96 1oi6 s THR 65 Ca 0.12 -0.08 -0.32 0.00 0.31 0.00 0.00 61.69 61.71 1oi6 s THR 65 Cb 0.04 -3.03 -0.14 0.00 0.01 0.00 0.00 72.50 69.37 1oi6 s THR 65 CO -0.05 0.59 1.37 0.52 -0.69 0.00 0.00 174.62 176.36 1oi6 n VAL 66 N 2.30 0.75 -3.88 3.82 0.31 0.25 -4.56 118.33 117.31 1oi6 n VAL 66 Ca -0.19 -0.19 -0.26 0.00 -0.01 0.00 0.00 64.34 63.69 1oi6 n VAL 66 Cb 0.54 -1.30 -0.17 0.00 -0.91 0.00 0.00 33.84 32.00 1oi6 n VAL 66 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1oi6 s THR 67 N 0.07 0.94 0.79 2.52 2.01 -1.26 -0.85 115.64 119.87 1oi6 s THR 67 Ca 0.72 -0.26 -0.12 0.00 0.31 0.00 0.00 61.69 62.34 1oi6 s THR 67 Cb -0.72 -0.99 0.07 0.00 0.01 0.00 0.00 72.50 70.88 1oi6 s THR 67 CO 0.48 0.33 1.15 -2.16 -0.69 0.00 0.00 174.62 173.74 1oi6 s PRO 68 N 1.74 1.85 0.20 4.92 0.04 -1.26 -4.61 135.00 137.88 1oi6 s PRO 68 Ca 0.05 1.53 0.11 0.00 0.04 0.00 0.00 61.00 62.73 1oi6 s PRO 68 Cb -0.13 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 1oi6 s PRO 68 CO -0.08 -2.01 1.39 -1.00 0.04 0.00 0.00 177.00 175.34 1oi6 h PRO 69 N -0.96 0.00 -1.11 0.56 0.13 -1.80 -3.52 132.00 125.30 1oi6 h PRO 69 Ca -0.45 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.79 1oi6 h PRO 69 Cb 1.27 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.34 1oi6 h PRO 69 CO 0.48 0.77 -0.35 0.41 -0.23 0.00 0.00 178.00 179.07 1oi6 n GLY 70 N 1.16 -2.53 2.98 1.56 0.00 -0.03 -5.03 105.19 103.31 1oi6 n GLY 70 Ca 0.01 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 1oi6 n GLY 70 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oi6 s THR 71 N -2.92 -0.03 0.12 2.61 2.01 -1.26 -4.78 115.64 111.39 1oi6 s THR 71 Ca 0.00 0.11 0.02 0.00 0.31 0.00 0.00 61.69 62.13 1oi6 s THR 71 Cb 0.00 -0.25 -0.04 0.00 0.01 0.00 0.00 72.50 72.22 1oi6 s THR 71 CO 0.00 0.04 0.22 0.00 -0.69 0.00 0.00 174.62 174.19 1oi6 s ALA 72 N 0.76 3.87 0.05 7.40 0.00 -1.26 -4.04 121.76 128.54 1oi6 s ALA 72 Ca -0.06 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 50.87 1oi6 s ALA 72 Cb -0.07 -1.69 -0.03 0.00 0.00 0.00 0.00 23.12 21.33 1oi6 s ALA 72 CO -0.04 0.63 -0.00 0.15 0.00 0.00 0.00 175.76 176.49 1oi6 s LYS 73 N -2.95 0.57 -0.07 0.00 1.02 -0.69 -1.50 119.74 116.12 1oi6 s LYS 73 Ca 0.34 -1.04 -0.02 0.00 0.02 0.00 0.00 55.97 55.27 1oi6 s LYS 73 Cb -0.11 0.20 0.03 0.00 -0.52 0.00 0.00 37.83 37.43 1oi6 s LYS 73 CO 0.27 -0.11 0.02 -0.47 -0.92 0.00 0.00 175.35 174.13 1oi6 s TYR 74 N -3.33 0.53 0.03 3.18 5.04 -0.55 -0.96 117.35 121.28 1oi6 s TYR 74 Ca 0.01 -0.08 0.04 0.00 -2.44 0.00 0.00 57.07 54.60 1oi6 s TYR 74 Cb 0.04 -0.73 -0.02 0.00 0.35 0.00 0.00 41.96 41.60 1oi6 s TYR 74 CO -0.08 -0.30 -0.12 0.54 -1.34 0.00 0.00 175.55 174.24 1oi6 s VAL 75 N 2.02 0.97 0.13 3.14 0.11 -0.25 -1.02 120.40 125.50 1oi6 s VAL 75 Ca 0.05 -0.84 -0.09 0.00 -2.93 0.00 0.00 61.98 58.17 1oi6 s VAL 75 Cb -0.12 -0.88 -0.01 0.00 -1.53 0.00 0.00 36.38 33.85 1oi6 s VAL 75 CO -0.05 0.04 0.24 -0.72 -3.33 0.00 0.00 175.10 171.28 1oi6 s TYR 76 N -0.72 0.30 -0.44 1.54 -0.85 -0.64 -0.62 117.35 115.93 1oi6 s TYR 76 Ca 0.01 -0.69 -0.18 0.00 -0.52 0.00 0.00 57.07 55.69 1oi6 s TYR 76 Cb -0.07 -0.06 0.03 0.00 0.38 0.00 0.00 41.96 42.24 1oi6 s TYR 76 CO 0.01 -0.65 0.48 0.00 -1.52 0.00 0.00 175.55 173.87 1oi6 n ALA 78 N 5.70 2.97 -3.60 0.00 0.00 0.04 -4.86 120.51 120.76 1oi6 n ALA 78 Ca -0.07 -0.26 -0.12 0.00 0.00 0.00 0.00 53.44 52.98 1oi6 n ALA 78 Cb 0.47 -1.27 -0.06 0.00 0.00 0.00 0.00 19.45 18.58 1oi6 n ALA 78 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1oi6 s ARG 79 N -2.83 0.68 3.38 0.00 3.52 -1.22 -4.91 118.95 117.58 1oi6 s ARG 79 Ca 0.17 0.51 0.00 0.00 -0.13 0.00 0.00 55.73 56.29 1oi6 s ARG 79 Cb 0.19 0.33 0.00 0.00 -1.56 0.00 0.00 34.95 33.90 1oi6 s ARG 79 CO 0.58 -0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.34 1oi6 n GLY 80 N 1.73 -0.09 3.33 8.12 0.00 -1.26 -0.78 105.19 116.24 1oi6 n GLY 80 Ca -0.13 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 1oi6 n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oi6 s LYS 81 N 0.00 0.46 0.06 1.61 2.20 -1.26 -3.88 119.74 118.93 1oi6 s LYS 81 Ca 0.00 0.82 0.03 0.00 -0.36 0.00 0.00 55.97 56.45 1oi6 s LYS 81 Cb 0.00 0.04 -0.03 0.00 -1.51 0.00 0.00 37.83 36.33 1oi6 s LYS 81 CO 0.00 -0.14 -0.09 0.00 -0.36 0.00 0.00 175.35 174.76 1oi6 s ALA 82 N 1.24 0.76 -0.44 3.13 0.00 0.20 -0.37 121.76 126.29 1oi6 s ALA 82 Ca -0.08 -0.92 -0.15 0.00 0.00 0.00 0.00 51.96 50.81 1oi6 s ALA 82 Cb -0.07 0.04 0.04 0.00 0.00 0.00 0.00 23.12 23.13 1oi6 s ALA 82 CO -0.11 -0.03 0.34 1.41 0.00 0.00 0.00 175.76 177.37 1oi6 s MET 83 N -2.05 2.98 -0.04 0.00 1.75 -0.34 -0.52 119.30 121.09 1oi6 s MET 83 Ca -0.04 -1.14 -0.18 0.00 -1.25 0.00 0.00 55.69 53.08 1oi6 s MET 83 Cb -0.07 -4.04 -0.05 0.00 2.84 0.00 0.00 34.83 33.51 1oi6 s MET 83 CO -0.00 -0.87 0.49 0.34 -0.65 0.00 0.00 175.02 174.33 1oi6 s ASP 84 N 2.05 6.83 -0.07 1.11 2.15 -0.14 -1.65 116.67 126.94 1oi6 s ASP 84 Ca 0.05 0.98 0.01 0.00 0.43 0.00 0.00 52.55 54.03 1oi6 s ASP 84 Cb -0.21 -2.30 0.02 0.00 -0.30 0.00 0.00 42.92 40.13 1oi6 s ASP 84 CO 0.09 0.16 -0.10 -0.63 -0.17 0.00 0.00 175.17 174.52 1oi6 s ILE 85 N -0.28 1.00 -0.13 4.11 1.01 0.57 -0.55 121.20 126.94 1oi6 s ILE 85 Ca 0.27 -0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 1oi6 s ILE 85 Cb -0.17 -0.95 -0.03 0.00 0.01 0.00 0.00 42.46 41.33 1oi6 s ILE 85 CO 0.14 0.33 -0.06 0.54 0.00 0.00 0.00 174.94 175.89 1oi6 s VAL 86 N 0.94 3.73 -0.13 2.92 0.11 -0.48 -1.36 120.40 126.13 1oi6 s VAL 86 Ca -0.10 -0.43 0.01 0.00 -2.93 0.00 0.00 61.98 58.53 1oi6 s VAL 86 Cb -0.15 -2.59 0.02 0.00 -1.53 0.00 0.00 36.38 32.12 1oi6 s VAL 86 CO 0.01 0.53 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.51 1oi6 s ILE 87 N -0.01 1.64 -0.66 7.04 1.09 -0.39 -1.19 121.20 128.72 1oi6 s ILE 87 Ca -0.00 -0.71 -0.25 0.00 -1.10 0.00 0.00 60.65 58.59 1oi6 s ILE 87 Cb -0.13 -1.50 0.05 0.00 -1.06 0.00 0.00 42.46 39.81 1oi6 s ILE 87 CO 0.03 0.47 1.10 -0.62 -0.10 0.00 0.00 174.94 175.82 1oi6 s ASP 88 N 1.13 6.22 -0.07 3.58 -1.08 0.25 -0.86 116.67 125.84 1oi6 s ASP 88 Ca -0.03 -0.58 0.16 0.00 -0.52 0.00 0.00 52.55 51.59 1oi6 s ASP 88 Cb -0.14 -2.49 0.54 0.00 -1.46 0.00 0.00 42.92 39.37 1oi6 s ASP 88 CO -0.05 -1.56 1.46 2.30 0.52 0.00 0.00 175.17 177.84 1oi6 n ILE 89 N 6.21 1.48 -2.90 4.11 -5.35 -1.26 -0.70 119.36 120.95 1oi6 n ILE 89 Ca 0.01 -1.20 -0.43 0.00 -0.27 0.00 0.00 62.75 60.86 1oi6 n ILE 89 Cb 0.47 0.26 -0.05 0.00 -1.74 0.00 0.00 39.64 38.59 1oi6 n ILE 89 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1oi6 s ARG 90 N -1.56 3.40 0.19 6.28 0.52 -1.26 -4.16 118.95 122.35 1oi6 s ARG 90 Ca 0.40 -0.13 -0.32 0.00 -0.52 0.00 0.00 55.73 55.16 1oi6 s ARG 90 Cb 0.25 -3.98 -0.12 0.00 0.52 0.00 0.00 34.95 31.62 1oi6 s ARG 90 CO 0.21 -1.26 1.76 0.08 0.02 0.00 0.00 175.30 176.10 1oi6 s VAL 91 N 3.58 2.12 0.00 3.52 1.01 -0.10 -1.19 120.40 129.33 1oi6 s VAL 91 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1oi6 s VAL 91 Cb -0.12 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1oi6 s VAL 91 CO 0.22 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1oi6 n GLY 92 N 4.05 0.83 3.77 4.51 0.00 -1.26 -0.47 105.19 116.63 1oi6 n GLY 92 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1oi6 n GLY 92 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1oi6 s SER 93 N -2.91 6.38 0.19 1.61 0.15 -0.34 -4.88 113.70 113.91 1oi6 s SER 93 Ca 0.00 2.24 0.18 0.00 0.70 0.00 0.00 55.95 59.07 1oi6 s SER 93 Cb 0.00 -2.60 0.83 0.00 -1.71 0.00 0.00 66.02 62.54 1oi6 s SER 93 CO 0.00 -0.77 1.55 -0.81 1.20 0.00 0.00 173.24 174.42 1oi6 n PRO 94 N -0.30 0.12 -0.20 5.44 -0.04 -1.26 -2.25 135.00 136.51 1oi6 n PRO 94 Ca 0.06 0.46 0.09 0.00 -0.04 0.00 0.00 63.50 64.07 1oi6 n PRO 94 Cb 0.48 -1.78 0.15 0.00 -0.04 0.00 0.00 33.50 32.31 1oi6 n PRO 94 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1oi6 n THR 95 N -2.01 1.87 -1.59 0.52 -2.24 -1.26 -5.06 114.28 104.52 1oi6 n THR 95 Ca 0.01 -2.38 -0.49 0.00 -2.27 0.00 0.00 64.05 58.93 1oi6 n THR 95 Cb 0.13 -0.21 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 1oi6 n THR 95 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1oi6 n PHE 96 N -1.32 1.42 0.00 4.78 7.35 -0.95 -2.13 117.46 126.62 1oi6 n PHE 96 Ca 0.16 0.64 0.00 0.00 -0.76 0.00 0.00 57.45 57.49 1oi6 n PHE 96 Cb 0.66 -2.31 0.00 0.00 0.35 0.00 0.00 39.48 38.18 1oi6 n PHE 96 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1oi6 n GLY 97 N 2.12 2.24 3.88 7.13 0.00 0.12 -5.02 105.19 115.66 1oi6 n GLY 97 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1oi6 n GLY 97 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oi6 s GLN 98 N -0.33 3.66 0.21 1.61 -0.21 -0.90 -4.84 119.66 118.86 1oi6 s GLN 98 Ca 0.00 0.55 0.02 0.00 0.02 0.00 0.00 55.36 55.95 1oi6 s GLN 98 Cb 0.00 -2.24 -0.05 0.00 1.00 0.00 0.00 33.01 31.72 1oi6 s GLN 98 CO 0.00 -0.31 0.02 1.67 -2.12 0.00 0.00 175.29 174.55 1oi6 s TRP 99 N -2.81 1.38 0.07 0.91 1.48 -1.26 -0.58 118.94 118.13 1oi6 s TRP 99 Ca 0.52 -1.01 -0.05 0.00 -1.06 0.00 0.00 56.10 54.50 1oi6 s TRP 99 Cb -0.10 -0.80 -0.02 0.00 -1.16 0.00 0.00 33.47 31.39 1oi6 s TRP 99 CO 0.44 -0.18 0.08 0.34 -4.06 0.00 0.00 176.95 173.57 1oi6 s ASP 100 N -3.24 0.29 0.03 -2.66 -1.08 -0.33 -4.82 116.67 104.85 1oi6 s ASP 100 Ca 0.28 -0.79 0.04 0.00 -0.52 0.00 0.00 52.55 51.55 1oi6 s ASP 100 Cb 0.06 0.27 -0.02 0.00 -1.46 0.00 0.00 42.92 41.77 1oi6 s ASP 100 CO 0.07 -0.65 -0.11 -0.94 0.52 0.00 0.00 175.17 174.06 1oi6 s SER 101 N -2.81 1.27 -0.09 -0.34 1.04 -1.26 -1.38 113.70 110.14 1oi6 s SER 101 Ca 0.05 -0.38 0.01 0.00 0.48 0.00 0.00 55.95 56.10 1oi6 s SER 101 Cb 0.06 -0.08 0.02 0.00 0.10 0.00 0.00 66.02 66.12 1oi6 s SER 101 CO -0.10 0.00 -0.08 -0.69 0.98 0.00 0.00 173.24 173.35 1oi6 s VAL 102 N -0.76 0.96 -0.20 5.02 1.01 0.29 -4.97 120.40 121.75 1oi6 s VAL 102 Ca -0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 1oi6 s VAL 102 Cb -0.07 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.36 1oi6 s VAL 102 CO 0.01 0.34 1.04 -0.22 0.00 0.00 0.00 175.10 176.27 1oi6 s LEU 103 N 1.28 4.14 -0.31 3.92 2.96 -1.26 -0.97 118.68 128.43 1oi6 s LEU 103 Ca -0.03 1.43 -0.04 0.00 -0.22 0.00 0.00 54.13 55.27 1oi6 s LEU 103 Cb -0.14 -3.54 0.04 0.00 0.50 0.00 0.00 46.19 43.05 1oi6 s LEU 103 CO -0.03 -0.62 0.04 -0.04 -1.32 0.00 0.00 176.35 174.38 1oi6 s MET 104 N 2.94 2.53 0.38 1.98 -1.94 0.32 -4.71 119.30 120.81 1oi6 s MET 104 Ca 0.45 -1.21 0.05 0.00 -1.71 0.00 0.00 55.69 53.27 1oi6 s MET 104 Cb -0.16 -3.30 -0.03 0.00 2.01 0.00 0.00 34.83 33.36 1oi6 s MET 104 CO 0.09 -0.63 0.18 0.16 -0.01 0.00 0.00 175.02 174.81 1oi6 s ASP 105 N 1.32 2.37 0.14 3.03 1.47 -1.26 -0.62 116.67 123.12 1oi6 s ASP 105 Ca -0.03 -1.70 0.25 0.00 1.18 0.00 0.00 52.55 52.24 1oi6 s ASP 105 Cb -0.20 0.53 0.44 0.00 -0.34 0.00 0.00 42.92 43.35 1oi6 s ASP 105 CO 0.01 -0.97 1.41 0.00 0.68 0.00 0.00 175.17 176.29 1oi6 n GLN 106 N -0.81 0.29 0.03 2.11 1.13 -1.25 -3.46 117.38 115.42 1oi6 n GLN 106 Ca -0.02 0.11 -0.22 0.00 -1.94 0.00 0.00 57.00 54.94 1oi6 n GLN 106 Cb 0.64 -1.71 -0.14 0.00 0.11 0.00 0.00 30.24 29.14 1oi6 n GLN 106 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 1oi6 h GLN 107 N 0.00 0.29 -2.30 -1.09 5.75 -1.97 -3.39 115.11 112.40 1oi6 h GLN 107 Ca 0.00 -0.49 -0.59 0.00 -0.15 0.00 0.00 58.65 57.42 1oi6 h GLN 107 Cb 0.74 0.18 -0.40 0.00 1.07 0.00 0.00 27.48 29.07 1oi6 h GLN 107 CO 0.00 1.24 -0.82 -0.25 -2.65 0.00 0.00 178.83 176.34 1oi6 n ASP 108 N -3.88 1.78 -4.66 -0.69 8.00 -1.26 -4.99 116.55 110.85 1oi6 n ASP 108 Ca -0.23 -2.99 -0.40 0.00 0.71 0.00 0.00 54.79 51.88 1oi6 n ASP 108 Cb 0.93 -0.66 0.03 0.00 -0.02 0.00 0.00 41.12 41.40 1oi6 n ASP 108 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1oi6 n PRO 109 N 1.52 1.47 -3.96 -0.24 -0.02 -1.22 -4.53 135.00 128.01 1oi6 n PRO 109 Ca 0.25 0.54 -0.13 0.00 -2.02 0.00 0.00 63.50 62.14 1oi6 n PRO 109 Cb 0.45 -2.28 -0.14 0.00 -0.02 0.00 0.00 33.50 31.52 1oi6 n PRO 109 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1oi6 s ARG 110 N -2.43 0.17 0.17 -0.52 0.52 -1.26 -4.03 118.95 111.57 1oi6 s ARG 110 Ca 0.67 -0.15 0.08 0.00 -0.52 0.00 0.00 55.73 55.81 1oi6 s ARG 110 Cb -0.48 -0.10 -0.04 0.00 0.52 0.00 0.00 34.95 34.85 1oi6 s ARG 110 CO 0.53 0.02 -0.07 0.00 0.02 0.00 0.00 175.30 175.80 1oi6 s ALA 111 N -0.27 3.01 -0.04 2.13 0.00 0.04 -4.37 121.76 122.26 1oi6 s ALA 111 Ca -0.02 -1.43 0.03 0.00 0.00 0.00 0.00 51.96 50.54 1oi6 s ALA 111 Cb -0.02 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.29 1oi6 s ALA 111 CO -0.00 0.48 -0.13 0.08 0.00 0.00 0.00 175.76 176.19 1oi6 s VAL 112 N -1.67 1.10 -0.21 0.00 1.01 0.21 -0.15 120.40 120.69 1oi6 s VAL 112 Ca 0.25 -0.52 -0.17 0.00 0.00 0.00 0.00 61.98 61.54 1oi6 s VAL 112 Cb -0.09 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1oi6 s VAL 112 CO 0.16 0.33 0.45 -0.47 0.00 0.00 0.00 175.10 175.57 1oi6 s TYR 113 N 0.22 3.36 -0.34 5.22 6.14 -0.22 -1.09 117.35 130.63 1oi6 s TYR 113 Ca -0.05 0.67 -0.08 0.00 0.64 0.00 0.00 57.07 58.24 1oi6 s TYR 113 Cb -0.11 -2.59 0.03 0.00 0.42 0.00 0.00 41.96 39.70 1oi6 s TYR 113 CO 0.02 -0.07 0.14 -0.51 0.64 0.00 0.00 175.55 175.76 1oi6 s LEU 114 N 1.53 4.37 0.94 6.97 1.43 -0.13 -2.61 118.68 131.18 1oi6 s LEU 114 Ca 0.21 -1.00 -0.10 0.00 -1.03 0.00 0.00 54.13 52.21 1oi6 s LEU 114 Cb -0.15 -1.93 0.16 0.00 0.03 0.00 0.00 46.19 44.30 1oi6 s LEU 114 CO 0.09 -0.32 1.13 -2.84 0.23 0.00 0.00 176.35 174.64 1oi6 s PRO 115 N 1.48 0.79 0.26 1.29 0.02 -1.26 -1.70 135.00 135.88 1oi6 s PRO 115 Ca 0.00 1.44 -0.30 0.00 0.02 0.00 0.00 61.00 62.16 1oi6 s PRO 115 Cb -0.19 -1.71 -0.14 0.00 0.02 0.00 0.00 34.50 32.48 1oi6 s PRO 115 CO 0.04 -2.75 1.21 0.28 -0.33 0.00 0.00 177.00 175.45 1oi6 n VAL 116 N -4.31 1.50 0.00 3.83 0.31 -1.26 -2.95 118.33 115.45 1oi6 n VAL 116 Ca 0.10 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1oi6 n VAL 116 Cb 0.52 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 1oi6 n VAL 116 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1oi6 n GLY 117 N 1.54 1.40 3.92 2.92 0.00 -1.26 -4.79 105.19 108.92 1oi6 n GLY 117 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1oi6 n GLY 117 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1oi6 s VAL 118 N -2.38 4.30 0.21 1.61 -7.23 -1.15 -4.28 120.40 111.48 1oi6 s VAL 118 Ca 0.00 0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.18 1oi6 s VAL 118 Cb 0.00 -3.65 -0.04 0.00 0.56 0.00 0.00 36.38 33.25 1oi6 s VAL 118 CO 0.00 -0.62 0.39 -0.83 -0.31 0.00 0.00 175.10 173.73 1oi6 s GLY 119 N -4.20 1.69 -0.02 2.32 0.00 -0.04 -4.66 107.32 102.41 1oi6 s GLY 119 Ca 0.50 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 44.34 1oi6 s GLY 119 CO 0.44 -0.86 -0.06 -1.58 0.00 0.00 0.00 173.10 171.03 1oi6 s HIS 120 N -1.91 0.65 0.08 1.90 2.46 -0.43 -1.26 115.29 116.79 1oi6 s HIS 120 Ca 0.38 -0.14 -0.06 0.00 0.47 0.00 0.00 55.06 55.71 1oi6 s HIS 120 Cb -0.11 -0.46 -0.02 0.00 -0.13 0.00 0.00 32.58 31.86 1oi6 s HIS 120 CO 0.30 -0.06 0.12 0.00 -2.47 0.00 0.00 174.74 172.63 1oi6 s ALA 121 N 0.12 0.07 0.11 1.58 0.00 -0.47 -0.67 121.76 122.50 1oi6 s ALA 121 Ca -0.01 -0.86 -0.18 0.00 0.00 0.00 0.00 51.96 50.91 1oi6 s ALA 121 Cb -0.06 0.46 0.04 0.00 0.00 0.00 0.00 23.12 23.57 1oi6 s ALA 121 CO -0.00 -0.48 0.45 -0.59 0.00 0.00 0.00 175.76 175.14 1oi6 s PHE 122 N -3.90 -0.29 -0.10 0.00 -0.71 -0.43 -0.32 117.98 112.24 1oi6 s PHE 122 Ca 0.07 0.09 0.04 0.00 -1.04 0.00 0.00 56.93 56.09 1oi6 s PHE 122 Cb 0.06 0.31 -0.00 0.00 -1.21 0.00 0.00 43.02 42.18 1oi6 s PHE 122 CO -0.09 -0.69 -0.24 0.54 -1.34 0.00 0.00 175.22 173.40 1oi6 s VAL 123 N -3.40 2.02 -0.16 -2.49 0.11 -0.66 -1.43 120.40 114.40 1oi6 s VAL 123 Ca 0.00 -1.00 -0.28 0.00 -2.93 0.00 0.00 61.98 57.77 1oi6 s VAL 123 Cb 0.01 -1.75 -0.01 0.00 -1.53 0.00 0.00 36.38 33.10 1oi6 s VAL 123 CO -0.09 0.55 0.98 0.00 -3.33 0.00 0.00 175.10 173.21 1oi6 s ALA 124 N 0.32 3.52 -0.98 1.54 0.00 -0.37 -1.19 121.76 124.59 1oi6 s ALA 124 Ca -0.18 0.24 0.22 0.00 0.00 0.00 0.00 51.96 52.24 1oi6 s ALA 124 Cb -0.18 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1oi6 s ALA 124 CO 0.08 -0.75 1.06 1.28 0.00 0.00 0.00 175.76 177.43 1oi6 n LEU 125 N 5.46 0.83 -4.06 0.00 4.77 0.50 -0.78 117.00 123.73 1oi6 n LEU 125 Ca 0.09 -0.33 -0.10 0.00 -0.03 0.00 0.00 56.01 55.64 1oi6 n LEU 125 Cb 0.48 -0.08 -0.11 0.00 -2.33 0.00 0.00 43.42 41.38 1oi6 n LEU 125 CO 0.51 0.20 -0.38 -1.61 -1.33 0.00 0.00 177.39 174.79 1oi6 s GLU 126 N -3.01 0.52 0.76 3.23 2.02 -1.22 -4.85 118.70 116.15 1oi6 s GLU 126 Ca 0.09 -0.90 -0.14 0.00 0.02 0.00 0.00 54.97 54.04 1oi6 s GLU 126 Cb 0.16 -0.03 0.05 0.00 0.10 0.00 0.00 34.13 34.42 1oi6 s GLU 126 CO 0.82 -0.03 1.22 -0.51 0.02 0.00 0.00 175.26 176.78 1oi6 s ASP 127 N -2.05 3.94 -1.40 -0.19 1.01 -1.26 -3.47 116.67 113.25 1oi6 s ASP 127 Ca -0.05 2.40 -0.02 0.00 0.71 0.00 0.00 52.55 55.59 1oi6 s ASP 127 Cb -0.04 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1oi6 s ASP 127 CO -0.03 -2.43 0.28 0.47 0.21 0.00 0.00 175.17 173.66 1oi6 n ASP 128 N -2.91 -5.29 -4.68 0.27 8.00 -0.94 -4.79 116.55 106.21 1oi6 n ASP 128 Ca 0.14 -0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 1oi6 n ASP 128 Cb 0.50 -4.24 -0.03 0.00 -0.02 0.00 0.00 41.12 37.33 1oi6 n ASP 128 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1oi6 s THR 129 N -2.99 4.83 -0.19 -3.53 2.01 -0.77 -4.21 115.64 110.80 1oi6 s THR 129 Ca 0.14 1.85 -0.03 0.00 0.31 0.00 0.00 61.69 63.95 1oi6 s THR 129 Cb -0.06 -4.23 -0.02 0.00 0.01 0.00 0.00 72.50 68.20 1oi6 s THR 129 CO 0.17 0.02 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.38 1oi6 s VAL 130 N 2.04 3.53 -0.17 3.82 1.01 0.04 -0.87 120.40 129.80 1oi6 s VAL 130 Ca 0.44 -0.46 -0.06 0.00 0.00 0.00 0.00 61.98 61.89 1oi6 s VAL 130 Cb -0.17 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1oi6 s VAL 130 CO 0.15 0.46 0.03 -0.04 0.00 0.00 0.00 175.10 175.70 1oi6 s MET 131 N 0.94 3.83 -0.14 2.72 -1.94 0.13 -0.78 119.30 124.06 1oi6 s MET 131 Ca -0.00 -0.40 0.02 0.00 -1.71 0.00 0.00 55.69 53.60 1oi6 s MET 131 Cb -0.15 -3.09 0.01 0.00 2.01 0.00 0.00 34.83 33.61 1oi6 s MET 131 CO 0.01 0.29 -0.21 0.45 -0.01 0.00 0.00 175.02 175.55 1oi6 s SER 132 N 0.28 3.22 0.06 3.03 0.15 0.12 -1.21 113.70 119.35 1oi6 s SER 132 Ca 0.01 -0.57 0.07 0.00 0.70 0.00 0.00 55.95 56.16 1oi6 s SER 132 Cb -0.13 -1.46 -0.03 0.00 -1.71 0.00 0.00 66.02 62.69 1oi6 s SER 132 CO 0.01 0.09 -0.20 -0.31 1.20 0.00 0.00 173.24 174.03 1oi6 s TYR 133 N 0.77 1.74 -0.11 3.44 2.02 -0.50 -1.61 117.35 123.11 1oi6 s TYR 133 Ca -0.08 -0.39 -0.02 0.00 -0.37 0.00 0.00 57.07 56.22 1oi6 s TYR 133 Cb -0.16 -1.01 -0.03 0.00 -0.40 0.00 0.00 41.96 40.36 1oi6 s TYR 133 CO -0.01 0.12 -0.04 -1.64 -1.57 0.00 0.00 175.55 172.42 1oi6 s MET 134 N -1.41 3.16 0.10 -0.62 -1.94 -0.19 -1.41 119.30 116.99 1oi6 s MET 134 Ca 0.06 -0.50 0.10 0.00 -1.71 0.00 0.00 55.69 53.64 1oi6 s MET 134 Cb -0.09 -2.77 -0.03 0.00 2.01 0.00 0.00 34.83 33.95 1oi6 s MET 134 CO 0.02 0.52 -0.25 -0.51 -0.01 0.00 0.00 175.02 174.79 1oi6 s LEU 135 N -0.40 2.26 0.05 -0.03 1.43 -0.30 -1.49 118.68 120.22 1oi6 s LEU 135 Ca 0.06 -0.67 0.28 0.00 -1.03 0.00 0.00 54.13 52.77 1oi6 s LEU 135 Cb -0.12 -1.14 1.05 0.00 0.03 0.00 0.00 46.19 46.01 1oi6 s LEU 135 CO 0.02 0.17 1.83 -1.54 0.23 0.00 0.00 176.35 177.07 1oi6 n SER 136 N 1.25 0.25 -3.71 2.29 3.41 -0.56 -1.19 113.62 115.35 1oi6 n SER 136 Ca -0.18 0.44 -0.14 0.00 -0.26 0.00 0.00 58.87 58.73 1oi6 n SER 136 Cb 0.53 -0.48 -0.09 0.00 -0.26 0.00 0.00 64.21 63.91 1oi6 n SER 136 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1oi6 s ARG 137 N -3.03 0.62 0.43 4.33 3.52 -1.26 -4.42 118.95 119.14 1oi6 s ARG 137 Ca 0.13 0.32 -0.24 0.00 -0.13 0.00 0.00 55.73 55.81 1oi6 s ARG 137 Cb 0.17 0.29 -0.08 0.00 -1.56 0.00 0.00 34.95 33.77 1oi6 s ARG 137 CO 0.57 -0.13 1.14 -1.12 -0.81 0.00 0.00 175.30 174.95 1oi6 s SER 138 N -0.41 6.39 0.13 -2.12 0.01 -1.26 -4.74 113.70 111.70 1oi6 s SER 138 Ca -0.05 2.26 -0.31 0.00 1.31 0.00 0.00 55.95 59.15 1oi6 s SER 138 Cb -0.03 -2.60 -0.10 0.00 0.21 0.00 0.00 66.02 63.50 1oi6 s SER 138 CO 0.03 -0.76 1.66 -0.47 0.41 0.00 0.00 173.24 174.10 1oi6 s TYR 139 N -1.53 2.68 -0.18 2.43 5.04 -1.26 -5.00 117.35 119.53 1oi6 s TYR 139 Ca 0.61 0.38 0.00 0.00 -2.44 0.00 0.00 57.07 55.62 1oi6 s TYR 139 Cb -0.28 -4.01 0.04 0.00 0.35 0.00 0.00 41.96 38.06 1oi6 s TYR 139 CO 0.34 -3.93 -0.10 0.08 -1.34 0.00 0.00 175.55 170.60 1oi6 s VAL 140 N 1.89 1.50 0.26 3.14 1.01 -1.26 -5.05 120.40 121.89 1oi6 s VAL 140 Ca 0.74 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.88 1oi6 s VAL 140 Cb -0.44 -1.55 0.23 0.00 0.00 0.00 0.00 36.38 34.62 1oi6 s VAL 140 CO 0.32 0.24 1.76 0.74 0.00 0.00 0.00 175.10 178.16 1oi6 h THR 141 N 6.30 0.73 0.00 3.92 2.02 -1.94 -0.13 112.91 123.82 1oi6 h THR 141 Ca -0.30 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 1oi6 h THR 141 Cb 1.11 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1oi6 h THR 141 CO 0.47 0.11 -0.04 1.56 0.37 0.00 0.00 175.52 177.99 1oi6 h GLN 142 N 0.60 0.00 -0.02 6.66 7.50 -2.03 -1.91 115.11 125.91 1oi6 h GLN 142 Ca 0.45 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.60 1oi6 h GLN 142 Cb 0.62 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.15 1oi6 h GLN 142 CO -0.36 0.04 -0.04 -0.25 -1.50 0.00 0.00 178.83 176.72 1oi6 n ASP 143 N -3.22 2.41 -4.34 1.46 8.00 -0.08 -4.86 116.55 115.93 1oi6 n ASP 143 Ca -0.01 -1.78 -0.43 0.00 0.71 0.00 0.00 54.79 53.28 1oi6 n ASP 143 Cb 0.24 0.04 -0.08 0.00 -0.02 0.00 0.00 41.12 41.30 1oi6 n ASP 143 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1oi6 s GLU 144 N -2.05 2.86 0.39 -1.24 0.41 -0.72 -0.59 118.70 117.76 1oi6 s GLU 144 Ca 0.30 -1.43 0.08 0.00 -0.41 0.00 0.00 54.97 53.51 1oi6 s GLU 144 Cb 0.20 -4.04 -0.02 0.00 -1.78 0.00 0.00 34.13 28.48 1oi6 s GLU 144 CO 0.34 -1.04 0.34 -0.51 -0.49 0.00 0.00 175.26 173.89 1oi6 s LEU 145 N 1.57 3.42 0.06 1.80 1.43 -0.13 -4.96 118.68 121.87 1oi6 s LEU 145 Ca 0.04 -0.70 0.02 0.00 -1.03 0.00 0.00 54.13 52.46 1oi6 s LEU 145 Cb -0.25 -2.05 -0.03 0.00 0.03 0.00 0.00 46.19 43.89 1oi6 s LEU 145 CO 0.05 -0.56 -0.08 0.00 0.23 0.00 0.00 176.35 175.99 1oi6 s ALA 146 N -2.43 0.75 0.13 4.21 0.00 -1.26 -1.75 121.76 121.41 1oi6 s ALA 146 Ca 0.46 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.53 1oi6 s ALA 146 Cb -0.03 0.06 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1oi6 s ALA 146 CO 0.27 -0.06 -0.14 -0.51 0.00 0.00 0.00 175.76 175.33 1oi6 s LEU 147 N -1.98 2.43 -0.08 0.00 1.43 0.12 -4.36 118.68 116.23 1oi6 s LEU 147 Ca -0.03 -0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 51.93 1oi6 s LEU 147 Cb -0.06 -0.55 -0.05 0.00 0.03 0.00 0.00 46.19 45.55 1oi6 s LEU 147 CO -0.01 -0.16 1.68 -0.55 0.23 0.00 0.00 176.35 177.55 1oi6 s SER 148 N -2.58 6.56 0.44 2.29 0.15 0.51 -0.96 113.70 120.11 1oi6 s SER 148 Ca 0.11 2.13 0.24 0.00 0.70 0.00 0.00 55.95 59.14 1oi6 s SER 148 Cb -0.04 -2.53 0.62 0.00 -1.71 0.00 0.00 66.02 62.36 1oi6 s SER 148 CO 0.03 -1.03 1.70 0.00 1.20 0.00 0.00 173.24 175.15 1oi6 h ALA 149 N 10.00 0.95 -0.00 5.45 0.00 -1.84 -3.17 119.26 130.63 1oi6 h ALA 149 Ca -0.39 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1oi6 h ALA 149 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1oi6 h ALA 149 CO 0.96 0.15 -0.21 1.28 0.00 0.00 0.00 179.25 181.44 1oi6 n LEU 150 N -3.16 0.62 -4.65 0.00 4.77 -1.26 -4.46 117.00 108.85 1oi6 n LEU 150 Ca 0.02 -0.04 -0.65 0.00 -0.03 0.00 0.00 56.01 55.31 1oi6 n LEU 150 Cb 0.50 -0.20 -0.10 0.00 -2.33 0.00 0.00 43.42 41.29 1oi6 n LEU 150 CO 0.33 0.12 1.28 -0.67 -1.33 0.00 0.00 177.39 177.13 1oi6 n ASP 151 N -0.98 1.23 0.28 -1.43 4.64 -1.20 -4.81 116.55 114.29 1oi6 n ASP 151 Ca 0.12 1.07 0.13 0.00 -1.38 0.00 0.00 54.79 54.73 1oi6 n ASP 151 Cb 0.31 -0.91 0.82 0.00 -1.04 0.00 0.00 41.12 40.31 1oi6 n ASP 151 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1oi6 h PRO 152 N 6.04 0.00 0.00 -0.67 0.11 -1.93 -1.34 132.00 134.21 1oi6 h PRO 152 Ca -0.37 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.69 1oi6 h PRO 152 Cb 1.37 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.48 1oi6 h PRO 152 CO 1.00 0.00 -0.22 0.00 -0.21 0.00 0.00 178.00 178.57 1oi6 h ALA 153 N 1.99 1.45 0.04 -0.75 0.00 -2.00 -3.20 119.26 116.80 1oi6 h ALA 153 Ca 0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 54.91 54.39 1oi6 h ALA 153 Cb 0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1oi6 h ALA 153 CO -0.00 0.27 -1.89 1.28 0.00 0.00 0.00 179.25 178.91 1oi6 n LEU 154 N -4.01 1.47 -3.69 0.00 4.77 -0.53 -5.01 117.00 110.00 1oi6 n LEU 154 Ca -0.02 0.29 -0.25 0.00 -0.03 0.00 0.00 56.01 56.00 1oi6 n LEU 154 Cb 0.29 -0.27 0.06 0.00 -2.33 0.00 0.00 43.42 41.18 1oi6 n LEU 154 CO 0.35 0.57 0.16 0.61 -1.33 0.00 0.00 177.39 177.76 1oi6 n GLY 155 N 1.75 -0.49 3.76 -0.72 0.00 -1.06 -4.94 105.19 103.48 1oi6 n GLY 155 Ca -0.24 0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 1oi6 n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oi6 s LEU 156 N -7.15 3.94 -1.48 0.99 1.43 -1.26 -4.88 118.68 110.27 1oi6 s LEU 156 Ca 0.50 2.66 -0.13 0.00 -1.03 0.00 0.00 54.13 56.13 1oi6 s LEU 156 Cb -0.23 -4.21 0.02 0.00 0.03 0.00 0.00 46.19 41.80 1oi6 s LEU 156 CO 0.77 -1.33 2.37 -0.81 0.23 0.00 0.00 176.35 177.58 1oi6 n PRO 157 N -0.74 3.10 -0.00 1.29 -0.04 -1.26 -4.64 135.00 132.72 1oi6 n PRO 157 Ca 0.09 -2.58 0.03 0.00 -0.04 0.00 0.00 63.50 61.00 1oi6 n PRO 157 Cb 0.45 -3.15 0.03 0.00 -0.04 0.00 0.00 33.50 30.78 1oi6 n PRO 157 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1oi6 n ILE 158 N 4.62 0.00 -3.86 0.52 -5.35 -1.26 -4.92 119.36 109.11 1oi6 n ILE 158 Ca 0.57 -0.50 -0.36 0.00 -0.27 0.00 0.00 62.75 62.20 1oi6 n ILE 158 Cb 0.35 1.13 -0.13 0.00 -1.74 0.00 0.00 39.64 39.24 1oi6 n ILE 158 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1oi6 s ASP 159 N -0.51 4.63 -0.02 7.28 -1.08 -1.26 -4.93 116.67 120.78 1oi6 s ASP 159 Ca 0.07 -0.32 0.03 0.00 -0.52 0.00 0.00 52.55 51.81 1oi6 s ASP 159 Cb 0.05 -1.81 0.04 0.00 -1.46 0.00 0.00 42.92 39.75 1oi6 s ASP 159 CO 0.08 -0.02 0.96 2.30 0.52 0.00 0.00 175.17 179.01 1oi6 n ILE 160 N 4.82 0.99 0.00 4.11 -5.35 -1.26 -4.98 119.36 117.68 1oi6 n ILE 160 Ca -0.17 -1.05 0.00 0.00 -0.27 0.00 0.00 62.75 61.26 1oi6 n ILE 160 Cb 0.51 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.86 1oi6 n ILE 160 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1oi6 n GLY 161 N -0.57 0.93 3.36 3.28 0.00 -1.26 -5.10 105.19 105.83 1oi6 n GLY 161 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1oi6 n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oi6 s VAL 162 N -2.00 1.94 0.11 1.61 0.11 -1.26 -5.09 120.40 115.82 1oi6 s VAL 162 Ca 0.00 -2.06 -0.31 0.00 -2.93 0.00 0.00 61.98 56.68 1oi6 s VAL 162 Cb 0.00 -1.98 -0.10 0.00 -1.53 0.00 0.00 36.38 32.77 1oi6 s VAL 162 CO 0.00 -0.37 1.80 -0.70 -3.33 0.00 0.00 175.10 172.50 1oi6 s GLU 163 N -3.08 4.15 0.50 1.54 2.56 -1.26 -4.90 118.70 118.21 1oi6 s GLU 163 Ca 0.20 2.54 -0.23 0.00 0.00 0.00 0.00 54.97 57.48 1oi6 s GLU 163 Cb -0.05 -3.62 -0.07 0.00 2.00 0.00 0.00 34.13 32.40 1oi6 s GLU 163 CO 0.08 -0.83 1.33 -2.30 -0.56 0.00 0.00 175.26 172.98 1oi6 n PRO 164 N 5.75 1.82 -3.72 4.30 -0.02 -1.26 -4.90 135.00 136.96 1oi6 n PRO 164 Ca 0.17 0.66 -0.38 0.00 -2.02 0.00 0.00 63.50 61.93 1oi6 n PRO 164 Cb 0.39 -2.52 -0.12 0.00 -0.02 0.00 0.00 33.50 31.23 1oi6 n PRO 164 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1oi6 s ILE 165 N -1.26 4.10 -0.01 4.25 1.01 -0.69 -4.98 121.20 123.62 1oi6 s ILE 165 Ca 0.67 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.55 1oi6 s ILE 165 Cb -0.44 -3.19 -0.00 0.00 0.01 0.00 0.00 42.46 38.84 1oi6 s ILE 165 CO 0.53 -0.03 -0.05 -0.69 0.00 0.00 0.00 174.94 174.69 1oi6 s VAL 166 N 1.50 0.45 0.74 2.92 1.01 -1.26 -1.63 120.40 124.13 1oi6 s VAL 166 Ca 0.02 -0.22 -0.13 0.00 0.00 0.00 0.00 61.98 61.65 1oi6 s VAL 166 Cb -0.18 -0.39 0.05 0.00 0.00 0.00 0.00 36.38 35.85 1oi6 s VAL 166 CO 0.04 0.14 1.12 -0.94 0.00 0.00 0.00 175.10 175.45 1oi6 s SER 167 N 0.00 4.48 0.25 3.32 1.04 -1.26 -4.84 113.70 116.69 1oi6 s SER 167 Ca 0.00 2.00 -0.04 0.00 0.48 0.00 0.00 55.95 58.39 1oi6 s SER 167 Cb -0.04 -2.55 0.35 0.00 0.10 0.00 0.00 66.02 63.89 1oi6 s SER 167 CO -0.00 -2.06 1.87 0.44 0.98 0.00 0.00 173.24 174.47 1oi6 h ASP 168 N -0.71 0.97 -0.57 7.02 3.32 -2.01 -0.18 116.42 124.26 1oi6 h ASP 168 Ca -0.45 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.53 1oi6 h ASP 168 Cb 1.25 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.58 1oi6 h ASP 168 CO 0.51 0.63 0.07 0.08 -1.72 0.00 0.00 179.24 178.81 1oi6 h ARG 169 N 1.11 0.99 -0.25 3.56 0.11 -1.98 -2.23 114.38 115.68 1oi6 h ARG 169 Ca 0.40 -0.26 -0.11 0.00 0.10 0.00 0.00 59.98 60.10 1oi6 h ARG 169 Cb 0.13 -0.12 -0.01 0.00 1.11 0.00 0.00 29.97 31.08 1oi6 h ARG 169 CO -0.16 0.93 -0.32 -0.44 0.10 0.00 0.00 179.97 180.08 1oi6 h ASP 170 N 0.93 0.55 -0.38 0.08 3.32 -1.73 -2.92 116.42 116.27 1oi6 h ASP 170 Ca 0.18 -0.22 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 1oi6 h ASP 170 Cb 0.44 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1oi6 h ASP 170 CO 0.01 0.84 0.05 0.03 -1.72 0.00 0.00 179.24 178.46 1oi6 h ARG 171 N 0.46 0.72 -0.41 3.56 3.08 -0.46 -2.82 114.38 118.51 1oi6 h ARG 171 Ca 0.05 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1oi6 h ARG 171 Cb 0.79 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1oi6 h ARG 171 CO 0.06 0.69 0.00 1.33 -1.07 0.00 0.00 179.97 180.99 1oi6 n VAL 172 N -4.26 0.53 -1.82 2.04 0.24 -0.99 -4.97 118.33 109.10 1oi6 n VAL 172 Ca 0.03 -0.72 -0.39 0.00 -2.04 0.00 0.00 64.34 61.21 1oi6 n VAL 172 Cb 0.25 0.82 0.02 0.00 -1.47 0.00 0.00 33.84 33.46 1oi6 n VAL 172 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1oi6 s ALA 173 N -1.47 3.16 0.68 2.33 0.00 -1.06 -5.00 121.76 120.41 1oi6 s ALA 173 Ca 0.39 1.42 -0.11 0.00 0.00 0.00 0.00 51.96 53.66 1oi6 s ALA 173 Cb 0.22 -3.58 -0.00 0.00 0.00 0.00 0.00 23.12 19.77 1oi6 s ALA 173 CO 0.31 -1.19 1.06 0.96 0.00 0.00 0.00 175.76 176.90 1oi6 s ILE 174 N -1.23 4.09 0.75 0.00 -4.36 -1.26 -3.79 121.20 115.39 1oi6 s ILE 174 Ca 0.63 0.68 -0.11 0.00 -0.26 0.00 0.00 60.65 61.59 1oi6 s ILE 174 Cb -0.43 -3.56 0.04 0.00 1.25 0.00 0.00 42.46 39.77 1oi6 s ILE 174 CO 0.54 -0.88 1.08 0.42 0.24 0.00 0.00 174.94 176.33 1oi6 s THR 175 N -3.16 3.57 0.18 8.37 -4.23 -1.26 -0.36 115.64 118.74 1oi6 s THR 175 Ca 0.57 0.51 -0.17 0.00 -1.18 0.00 0.00 61.69 61.42 1oi6 s THR 175 Cb -0.12 -3.11 0.12 0.00 1.34 0.00 0.00 72.50 70.73 1oi6 s THR 175 CO 0.54 -0.67 1.65 0.25 -0.54 0.00 0.00 174.62 175.85 1oi6 h LEU 176 N -0.98 -0.50 -0.67 4.79 6.46 -1.95 0.16 115.31 122.62 1oi6 h LEU 176 Ca -0.44 0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.40 1oi6 h LEU 176 Cb 1.23 0.31 -0.03 0.00 -0.73 0.00 0.00 40.66 41.44 1oi6 h LEU 176 CO 0.54 -0.18 0.18 0.00 -0.62 0.00 0.00 178.44 178.36 1oi6 h ALA 177 N 1.37 0.88 -0.47 1.25 0.00 -1.99 -0.55 119.26 119.74 1oi6 h ALA 177 Ca 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1oi6 h ALA 177 Cb 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1oi6 h ALA 177 CO -0.48 0.58 0.18 1.49 0.00 0.00 0.00 179.25 181.02 1oi6 h GLU 178 N 0.99 0.70 -0.72 0.00 4.81 -1.79 -2.12 114.58 116.45 1oi6 h GLU 178 Ca 0.21 -0.13 0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1oi6 h GLU 178 Cb 0.34 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 1oi6 h GLU 178 CO -0.00 0.64 0.47 0.00 -0.73 0.00 0.00 179.01 179.39 1oi6 h ALA 179 N 1.03 1.59 -0.38 2.92 0.00 -0.39 -0.80 119.26 123.23 1oi6 h ALA 179 Ca 0.16 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1oi6 h ALA 179 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1oi6 h ALA 179 CO -0.01 0.34 0.18 0.37 0.00 0.00 0.00 179.25 180.13 1oi6 h GLN 180 N 0.87 0.55 -0.38 0.00 4.15 -0.88 -1.04 115.11 118.39 1oi6 h GLN 180 Ca 0.29 -0.08 -0.06 0.00 0.77 0.00 0.00 58.65 59.56 1oi6 h GLN 180 Cb 0.06 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 1oi6 h GLN 180 CO -0.08 0.50 -0.03 0.00 -1.93 0.00 0.00 178.83 177.28 1oi6 h ARG 181 N 0.48 0.61 0.00 1.69 3.08 -0.68 -1.97 114.38 117.59 1oi6 h ARG 181 Ca 0.13 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1oi6 h ARG 181 Cb 0.13 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1oi6 h ARG 181 CO -0.02 0.66 0.00 1.04 -1.07 0.00 0.00 179.97 180.58 1oi6 n GLN 182 N -4.24 0.14 -1.05 0.04 6.02 -0.38 -4.92 117.38 112.99 1oi6 n GLN 182 Ca 0.02 0.08 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1oi6 n GLN 182 Cb 0.28 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1oi6 n GLN 182 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1oi6 n GLY 183 N 0.90 0.48 0.87 1.08 0.00 -0.71 -4.95 105.19 102.87 1oi6 n GLY 183 Ca 0.08 -0.92 0.12 0.00 0.00 0.00 0.00 46.02 45.30 1oi6 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oi6 n LEU 184 N 0.00 2.75 -4.90 0.99 4.77 -0.48 -4.97 117.00 115.17 1oi6 n LEU 184 Ca 0.00 -0.92 -0.31 0.00 -0.03 0.00 0.00 56.01 54.75 1oi6 n LEU 184 Cb 0.09 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1oi6 n LEU 184 CO 0.00 0.46 0.04 -0.76 -1.33 0.00 0.00 177.39 175.81 1oi6 s LEU 185 N -2.05 4.25 0.62 2.23 1.43 -1.26 -4.96 118.68 118.94 1oi6 s LEU 185 Ca 0.28 0.59 -0.19 0.00 -1.03 0.00 0.00 54.13 53.78 1oi6 s LEU 185 Cb 0.20 -3.33 -0.02 0.00 0.03 0.00 0.00 46.19 43.07 1oi6 s LEU 185 CO 0.33 0.03 1.25 -2.65 0.23 0.00 0.00 176.35 175.53 1oi6 n PRO 186 N -0.05 1.19 -3.43 1.29 -0.02 -1.26 -4.82 135.00 127.90 1oi6 n PRO 186 Ca -0.02 0.46 -0.38 0.00 -2.02 0.00 0.00 63.50 61.53 1oi6 n PRO 186 Cb 0.52 -2.47 -0.06 0.00 -0.02 0.00 0.00 33.50 31.47 1oi6 n PRO 186 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1oi6 s ASP 187 N -1.26 6.81 0.12 2.55 2.15 -1.26 -0.93 116.67 124.85 1oi6 s ASP 187 Ca 0.79 0.96 -0.20 0.00 0.43 0.00 0.00 52.55 54.53 1oi6 s ASP 187 Cb -0.39 -2.27 -0.07 0.00 -0.30 0.00 0.00 42.92 39.88 1oi6 s ASP 187 CO 0.43 0.24 1.76 0.22 -0.17 0.00 0.00 175.17 177.66 1oi6 h TYR 188 N 5.16 0.16 -0.49 -5.34 3.20 -0.98 0.01 116.97 118.69 1oi6 h TYR 188 Ca -0.49 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.40 1oi6 h TYR 188 Cb 1.21 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.40 1oi6 h TYR 188 CO 0.68 0.09 0.32 1.15 -1.64 0.00 0.00 178.16 178.76 1oi6 h THR 189 N 0.18 1.11 -0.40 1.81 2.02 -1.91 -0.16 112.91 115.56 1oi6 h THR 189 Ca 0.07 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 1oi6 h THR 189 Cb 0.01 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1oi6 h THR 189 CO -0.04 0.12 0.17 0.74 0.37 0.00 0.00 175.52 176.88 1oi6 h THR 190 N 0.65 1.18 -0.58 3.16 2.02 -1.93 -1.57 112.91 115.85 1oi6 h THR 190 Ca 0.19 -0.55 0.02 0.00 0.77 0.00 0.00 66.41 66.84 1oi6 h THR 190 Cb -0.05 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1oi6 h THR 190 CO -0.05 0.20 0.36 0.28 0.37 0.00 0.00 175.52 176.68 1oi6 h SER 191 N 0.50 0.59 -0.36 4.18 0.02 -0.65 -1.68 113.55 116.15 1oi6 h SER 191 Ca 0.13 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 1oi6 h SER 191 Cb 0.16 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 1oi6 h SER 191 CO -0.01 0.41 0.02 1.56 -1.14 0.00 0.00 176.83 177.67 1oi6 h GLN 192 N 0.71 0.71 -0.28 3.45 1.08 -0.78 -0.42 115.11 119.58 1oi6 h GLN 192 Ca 0.23 -0.17 -0.03 0.00 -1.45 0.00 0.00 58.65 57.23 1oi6 h GLN 192 Cb 0.00 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 1oi6 h GLN 192 CO -0.09 0.71 0.07 0.93 -0.95 0.00 0.00 178.83 179.50 1oi6 h GLU 193 N 0.67 0.44 -0.22 1.46 5.08 -0.83 -0.35 114.58 120.83 1oi6 h GLU 193 Ca 0.14 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1oi6 h GLU 193 Cb 0.38 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1oi6 h GLU 193 CO 0.01 0.52 0.14 0.82 -1.00 0.00 0.00 179.01 179.50 1oi6 h ILE 194 N 0.28 1.06 -0.76 3.13 2.04 -1.08 -2.31 117.51 119.88 1oi6 h ILE 194 Ca 0.09 -0.12 0.03 0.00 1.00 0.00 0.00 64.86 65.86 1oi6 h ILE 194 Cb 0.27 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.05 1oi6 h ILE 194 CO -0.00 0.06 0.48 -0.08 0.00 0.00 0.00 178.15 178.61 1oi6 h GLU 195 N 0.30 0.90 -0.78 2.37 4.81 -0.87 -1.14 114.58 120.16 1oi6 h GLU 195 Ca 0.08 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 1oi6 h GLU 195 Cb -0.03 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 1oi6 h GLU 195 CO -0.02 0.60 0.31 0.00 -0.73 0.00 0.00 179.01 179.17 1oi6 h ARG 196 N 0.93 1.17 -0.79 1.92 3.08 -0.82 -1.97 114.38 117.91 1oi6 h ARG 196 Ca 0.31 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 1oi6 h ARG 196 Cb 0.03 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 1oi6 h ARG 196 CO -0.12 0.94 0.32 0.00 -1.07 0.00 0.00 179.97 180.05 1oi6 h ARG 197 N 1.14 1.17 -0.37 0.04 3.08 -0.85 -2.58 114.38 116.02 1oi6 h ARG 197 Ca 0.26 -0.21 -0.10 0.00 0.07 0.00 0.00 59.98 60.01 1oi6 h ARG 197 Cb 0.21 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 1oi6 h ARG 197 CO -0.02 0.94 -0.18 -0.07 -1.07 0.00 0.00 179.97 179.57 1oi6 h LEU 198 N 1.14 0.69 -3.12 3.04 3.38 -0.80 -3.27 115.31 116.37 1oi6 h LEU 198 Ca 0.26 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1oi6 h LEU 198 Cb 0.20 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1oi6 h LEU 198 CO -0.02 0.87 -0.13 0.35 0.09 0.00 0.00 178.44 179.60 1oi6 n THR 199 N -4.14 2.17 -2.16 0.22 -2.24 -0.78 -4.15 114.28 103.20 1oi6 n THR 199 Ca 0.01 -2.49 -0.38 0.00 -2.27 0.00 0.00 64.05 58.91 1oi6 n THR 199 Cb 0.39 -0.26 -0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1oi6 n THR 199 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oi6 s ALA 200 N -3.02 3.05 0.03 6.98 0.00 -0.98 -3.56 121.76 124.26 1oi6 s ALA 200 Ca 0.38 1.05 -0.20 0.00 0.00 0.00 0.00 51.96 53.19 1oi6 s ALA 200 Cb 0.34 -3.43 -0.15 0.00 0.00 0.00 0.00 23.12 19.88 1oi6 s ALA 200 CO 0.01 -0.76 1.31 0.28 0.00 0.00 0.00 175.76 176.60 1oi6 h VAL 201 N 2.03 1.36 0.00 0.00 2.07 -1.89 -3.42 116.25 116.40 1oi6 h VAL 201 Ca -0.49 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 65.60 1oi6 h VAL 201 Cb 1.25 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.00 1oi6 h VAL 201 CO 0.61 0.42 0.00 -2.65 0.02 0.00 0.00 177.57 175.97