#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 2.50 0.01 2.12 -0.21 -0.71 -4.95 119.66 118.42 1oi6 s GLN 2 Ca 0.00 -0.78 0.08 0.00 0.02 0.00 0.00 55.36 54.68 1oi6 s GLN 2 Cb 0.00 -2.49 -0.02 0.00 1.00 0.00 0.00 33.01 31.50 1oi6 s GLN 2 CO 0.00 0.58 -0.24 0.00 -2.12 0.00 0.00 175.29 173.51 1oi6 s ALA 3 N -1.09 1.99 -0.04 6.09 0.00 -1.26 -0.08 121.76 127.38 1oi6 s ALA 3 Ca 0.19 -1.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.06 1oi6 s ALA 3 Cb -0.11 -0.46 0.03 0.00 0.00 0.00 0.00 23.12 22.57 1oi6 s ALA 3 CO 0.10 0.48 0.05 0.50 0.00 0.00 0.00 175.76 176.89 1oi6 s ARG 4 N -0.82 -0.04 0.13 0.00 3.52 0.14 -5.00 118.95 116.88 1oi6 s ARG 4 Ca 0.09 0.32 -0.31 0.00 -0.13 0.00 0.00 55.73 55.71 1oi6 s ARG 4 Cb -0.09 -0.47 -0.08 0.00 -1.56 0.00 0.00 34.95 32.75 1oi6 s ARG 4 CO 0.00 -0.29 1.32 0.15 -0.81 0.00 0.00 175.30 175.67 1oi6 s LYS 5 N 1.88 4.37 0.78 5.12 1.02 -1.26 -0.77 119.74 130.88 1oi6 s LYS 5 Ca 0.01 2.00 -0.10 0.00 0.02 0.00 0.00 55.97 57.90 1oi6 s LYS 5 Cb -0.12 -3.25 0.08 0.00 -0.52 0.00 0.00 37.83 34.01 1oi6 s LYS 5 CO -0.03 -0.33 1.13 -0.51 -0.92 0.00 0.00 175.35 174.69 1oi6 s LEU 6 N 0.69 2.61 0.33 3.17 1.43 -0.52 -4.90 118.68 121.50 1oi6 s LEU 6 Ca 0.61 0.66 0.17 0.00 -1.03 0.00 0.00 54.13 54.53 1oi6 s LEU 6 Cb -0.35 -3.19 0.49 0.00 0.03 0.00 0.00 46.19 43.16 1oi6 s LEU 6 CO 0.32 -1.82 1.64 0.00 0.23 0.00 0.00 176.35 176.73 1oi6 h ALA 7 N -0.91 0.90 -2.22 4.21 0.00 -1.91 -3.41 119.26 115.92 1oi6 h ALA 7 Ca -0.45 -0.41 -0.56 0.00 0.00 0.00 0.00 54.91 53.48 1oi6 h ALA 7 Cb 1.32 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 1oi6 h ALA 7 CO 0.64 0.57 0.74 0.08 0.00 0.00 0.00 179.25 181.28 1oi6 s VAL 8 N -3.44 4.45 0.08 0.00 1.01 -1.26 -4.90 120.40 116.34 1oi6 s VAL 8 Ca 0.01 1.75 -0.33 0.00 0.00 0.00 0.00 61.98 63.40 1oi6 s VAL 8 Cb 0.10 -4.12 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 1oi6 s VAL 8 CO 0.71 -0.07 1.72 -0.67 0.00 0.00 0.00 175.10 176.80 1oi6 n ASP 9 N 5.73 3.40 0.00 3.32 -0.08 -1.26 -1.56 116.55 126.10 1oi6 n ASP 9 Ca 0.11 1.03 0.00 0.00 -1.51 0.00 0.00 54.79 54.43 1oi6 n ASP 9 Cb 0.46 -1.44 0.00 0.00 2.34 0.00 0.00 41.12 42.49 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 3.88 2.69 3.77 0.27 0.00 -1.26 -4.91 105.19 109.63 1oi6 n GLY 10 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.08 3.25 -0.02 4.61 0.00 -0.60 -4.65 121.76 122.27 1oi6 s ALA 11 Ca 0.00 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.72 1oi6 s ALA 11 Cb 0.00 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.85 1oi6 s ALA 11 CO 0.00 -0.12 -0.02 0.42 0.00 0.00 0.00 175.76 176.04 1oi6 s ILE 12 N -1.41 0.24 -0.22 0.00 1.01 -1.02 -1.43 121.20 118.37 1oi6 s ILE 12 Ca 0.50 -0.04 -0.10 0.00 0.00 0.00 0.00 60.65 61.01 1oi6 s ILE 12 Cb -0.26 -0.26 -0.05 0.00 0.01 0.00 0.00 42.46 41.90 1oi6 s ILE 12 CO 0.33 0.11 0.14 -0.70 0.00 0.00 0.00 174.94 174.82 1oi6 s GLU 13 N 0.44 4.11 -0.12 2.79 2.12 0.05 -1.04 118.70 127.05 1oi6 s GLU 13 Ca -0.04 -0.26 -0.01 0.00 0.36 0.00 0.00 54.97 55.02 1oi6 s GLU 13 Cb -0.07 -3.47 -0.03 0.00 0.26 0.00 0.00 34.13 30.83 1oi6 s GLU 13 CO -0.01 0.17 -0.07 -0.06 -0.54 0.00 0.00 175.26 174.75 1oi6 s PHE 14 N 0.73 2.93 -0.37 5.30 0.08 0.58 -0.69 117.98 126.54 1oi6 s PHE 14 Ca 0.07 -0.26 0.00 0.00 0.12 0.00 0.00 56.93 56.86 1oi6 s PHE 14 Cb -0.12 -1.84 0.10 0.00 -0.57 0.00 0.00 43.02 40.59 1oi6 s PHE 14 CO 0.02 0.06 0.13 0.99 -0.10 0.00 0.00 175.22 176.31 1oi6 s THR 15 N -0.08 2.85 0.58 0.64 2.01 0.89 -0.55 115.64 121.97 1oi6 s THR 15 Ca 0.00 -2.14 -0.17 0.00 0.31 0.00 0.00 61.69 59.69 1oi6 s THR 15 Cb -0.13 -2.99 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 1oi6 s THR 15 CO 0.03 -0.62 1.08 -2.16 -0.69 0.00 0.00 174.62 172.26 1oi6 s PRO 16 N 1.05 3.31 0.40 4.92 0.04 -1.26 -1.74 135.00 141.73 1oi6 s PRO 16 Ca 0.09 1.35 -0.24 0.00 0.04 0.00 0.00 61.00 62.23 1oi6 s PRO 16 Cb -0.21 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 1oi6 s PRO 16 CO -0.06 -0.84 1.10 1.03 0.04 0.00 0.00 177.00 178.28 1oi6 s ARG 17 N -3.77 4.09 -0.26 4.56 0.52 -1.26 -4.82 118.95 118.01 1oi6 s ARG 17 Ca 0.67 1.64 -0.11 0.00 -0.52 0.00 0.00 55.73 57.41 1oi6 s ARG 17 Cb -0.18 -2.58 -0.05 0.00 0.52 0.00 0.00 34.95 32.66 1oi6 s ARG 17 CO 0.33 -0.23 0.17 0.08 0.02 0.00 0.00 175.30 175.67 1oi6 s VAL 18 N -1.56 5.32 -0.17 3.52 1.01 -1.26 -4.55 120.40 122.71 1oi6 s VAL 18 Ca 0.58 0.17 -0.10 0.00 0.00 0.00 0.00 61.98 62.63 1oi6 s VAL 18 Cb -0.26 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1oi6 s VAL 18 CO 0.32 0.30 0.16 -0.36 0.00 0.00 0.00 175.10 175.51 1oi6 s PHE 19 N 1.42 3.48 0.05 5.22 0.08 -0.01 -4.96 117.98 123.26 1oi6 s PHE 19 Ca 0.07 0.43 0.07 0.00 0.12 0.00 0.00 56.93 57.62 1oi6 s PHE 19 Cb -0.15 -2.12 -0.03 0.00 -0.57 0.00 0.00 43.02 40.16 1oi6 s PHE 19 CO 0.08 0.42 -0.18 0.00 -0.10 0.00 0.00 175.22 175.43 1oi6 s ALA 20 N -0.05 1.56 0.08 5.36 0.00 -1.26 -0.67 121.76 126.79 1oi6 s ALA 20 Ca 0.11 -1.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 1oi6 s ALA 20 Cb -0.12 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.74 1oi6 s ALA 20 CO 0.01 0.33 0.14 -0.40 0.00 0.00 0.00 175.76 175.83 1oi6 n ASP 21 N 1.75 -0.39 0.15 0.00 5.75 -0.49 -5.01 116.55 118.31 1oi6 n ASP 21 Ca -0.18 -1.42 0.12 0.00 -0.01 0.00 0.00 54.79 53.31 1oi6 n ASP 21 Cb 0.54 0.69 0.53 0.00 -1.03 0.00 0.00 41.12 41.84 1oi6 n ASP 21 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 1oi6 h ASP 22 N 0.46 0.00 0.89 -1.12 2.03 -2.04 -2.66 116.42 113.98 1oi6 h ASP 22 Ca -0.07 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.09 1oi6 h ASP 22 Cb 0.28 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.76 1oi6 h ASP 22 CO 0.09 0.00 -1.19 0.03 -1.03 0.00 0.00 179.24 177.14 1oi6 h ARG 23 N 0.00 0.00 0.00 4.15 3.08 -2.02 -3.50 114.38 116.09 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 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1oi6 h ARG 23 CO 0.00 0.30 0.00 0.41 -1.07 0.00 0.00 179.97 179.61 1oi6 n GLY 24 N 1.34 -0.12 3.17 0.04 0.00 -1.00 -5.14 105.19 103.48 1oi6 n GLY 24 Ca -0.06 -0.69 -0.11 0.00 0.00 0.00 0.00 46.02 45.16 1oi6 n GLY 24 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1oi6 s LEU 25 N 0.00 1.77 -0.10 0.99 0.05 -1.26 -1.40 118.68 118.74 1oi6 s LEU 25 Ca 0.00 -1.22 -0.06 0.00 0.05 0.00 0.00 54.13 52.90 1oi6 s LEU 25 Cb 0.00 0.25 0.04 0.00 -2.05 0.00 0.00 46.19 44.43 1oi6 s LEU 25 CO 0.00 -0.72 0.23 -0.22 -0.55 0.00 0.00 176.35 175.09 1oi6 s LEU 26 N -3.08 0.62 0.18 1.48 2.96 0.15 -4.99 118.68 116.00 1oi6 s LEU 26 Ca 0.25 0.48 0.06 0.00 -0.22 0.00 0.00 54.13 54.71 1oi6 s LEU 26 Cb 0.07 0.70 -0.05 0.00 0.50 0.00 0.00 46.19 47.42 1oi6 s LEU 26 CO 0.03 -0.14 -0.13 0.27 -1.32 0.00 0.00 176.35 175.06 1oi6 s ILE 27 N 0.99 1.52 -0.51 6.68 -4.36 -1.26 -0.83 121.20 123.42 1oi6 s ILE 27 Ca -0.07 -2.15 0.04 0.00 -0.26 0.00 0.00 60.65 58.21 1oi6 s ILE 27 Cb -0.08 -1.96 0.13 0.00 1.25 0.00 0.00 42.46 41.79 1oi6 s ILE 27 CO -0.06 -0.65 0.25 -0.76 0.24 0.00 0.00 174.94 173.96 1oi6 s LEU 28 N -3.24 4.34 0.31 0.37 1.43 -1.26 -4.99 118.68 115.64 1oi6 s LEU 28 Ca 0.20 -2.99 0.03 0.00 -1.03 0.00 0.00 54.13 50.35 1oi6 s LEU 28 Cb 0.00 -1.64 0.52 0.00 0.03 0.00 0.00 46.19 45.10 1oi6 s LEU 28 CO 0.04 -0.24 1.81 -0.65 0.23 0.00 0.00 176.35 177.54 1oi6 h PRO 29 N 6.54 0.51 -5.42 1.29 0.11 -1.99 -3.40 132.00 129.63 1oi6 h PRO 29 Ca -0.08 -0.14 -0.67 0.00 0.11 0.00 0.00 66.00 65.22 1oi6 h PRO 29 Cb 0.90 -0.06 -0.29 0.00 0.11 0.00 0.00 31.00 31.66 1oi6 h PRO 29 CO 0.68 0.62 -0.82 -0.47 -0.21 0.00 0.00 178.00 177.80 1oi6 s TYR 30 N -4.76 2.69 -0.04 0.65 5.04 -1.26 -4.79 117.35 114.87 1oi6 s TYR 30 Ca -0.07 -0.78 -0.00 0.00 -2.44 0.00 0.00 57.07 53.78 1oi6 s TYR 30 Cb 0.15 -1.77 0.03 0.00 0.35 0.00 0.00 41.96 40.72 1oi6 s TYR 30 CO 0.78 -0.27 0.00 -0.65 -1.34 0.00 0.00 175.55 174.07 1oi6 s GLN 31 N 0.26 0.40 0.19 4.97 -0.21 -1.26 -5.06 119.66 118.95 1oi6 s GLN 31 Ca -0.12 0.10 -0.12 0.00 0.02 0.00 0.00 55.36 55.23 1oi6 s GLN 31 Cb -0.16 -0.66 0.12 0.00 1.00 0.00 0.00 33.01 33.31 1oi6 s GLN 31 CO 0.07 -0.20 1.83 1.05 -2.12 0.00 0.00 175.29 175.92 1oi6 h GLU 32 N 7.69 0.72 -0.25 2.91 4.11 -1.99 -0.88 114.58 126.88 1oi6 h GLU 32 Ca -0.32 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.05 1oi6 h GLU 32 Cb 1.13 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1oi6 h GLU 32 CO 0.37 0.47 0.06 0.93 0.07 0.00 0.00 179.01 180.92 1oi6 h GLU 33 N 0.74 0.41 -0.52 1.06 5.08 -1.99 -0.02 114.58 119.33 1oi6 h GLU 33 Ca 0.23 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1oi6 h GLU 33 Cb -0.01 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1oi6 h GLU 33 CO -0.09 0.50 0.07 0.00 -1.00 0.00 0.00 179.01 178.49 1oi6 h ALA 34 N 0.89 1.14 0.06 3.43 0.00 -1.91 -1.06 119.26 121.80 1oi6 h ALA 34 Ca 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1oi6 h ALA 34 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1oi6 h ALA 34 CO 0.00 0.57 -0.03 0.35 0.00 0.00 0.00 179.25 180.14 1oi6 h PHE 35 N 0.79 -0.07 -0.80 0.00 3.57 -0.96 -2.46 116.94 117.01 1oi6 h PHE 35 Ca 0.16 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.69 1oi6 h PHE 35 Cb 0.38 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 1oi6 h PHE 35 CO 0.02 0.17 0.52 0.28 -2.23 0.00 0.00 178.31 177.07 1oi6 h VAL 36 N -0.30 1.14 -0.81 1.41 2.07 -0.78 0.84 116.25 119.82 1oi6 h VAL 36 Ca -0.01 -0.35 0.11 0.00 0.82 0.00 0.00 66.70 67.27 1oi6 h VAL 36 Cb 0.27 0.03 -0.08 0.00 -1.52 0.00 0.00 31.29 29.99 1oi6 h VAL 36 CO 0.01 0.19 0.43 -0.33 0.02 0.00 0.00 177.57 177.89 1oi6 h GLU 37 N 1.02 0.68 0.10 1.57 5.08 -1.08 0.14 114.58 122.09 1oi6 h GLU 37 Ca 0.32 -0.04 -0.30 0.00 -1.00 0.00 0.00 59.36 58.33 1oi6 h GLU 37 Cb -0.02 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 1oi6 h GLU 37 CO -0.10 0.45 -1.57 0.00 -1.00 0.00 0.00 179.01 176.79 1oi6 h ALA 38 N 1.48 0.36 0.00 3.43 0.00 -0.94 -3.40 119.26 120.19 1oi6 h ALA 38 Ca 0.41 -1.17 -0.37 0.00 0.00 0.00 0.00 54.91 53.78 1oi6 h ALA 38 Cb 0.45 0.32 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 1oi6 h ALA 38 CO -0.29 1.22 -2.36 1.58 0.00 0.00 0.00 179.25 179.41 1oi6 n HIS 39 N -3.40 0.05 -0.30 0.00 -0.00 0.24 -5.02 115.22 106.79 1oi6 n HIS 39 Ca -0.17 0.02 0.00 0.00 -0.00 0.00 0.00 57.72 57.57 1oi6 n HIS 39 Cb 1.04 -1.01 0.00 0.00 -0.00 0.00 0.00 29.99 30.02 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 0.78 3.70 1.57 0.00 0.50 -5.04 105.19 108.43 1oi6 n GLY 40 Ca -0.32 0.00 -0.03 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 -1.75 -0.30 0.88 -0.02 0.00 -1.25 -4.92 107.32 99.97 1oi6 s GLY 41 Ca 0.00 0.38 -0.12 0.00 0.00 0.00 0.00 44.72 44.97 1oi6 s GLY 41 CO 0.00 0.07 1.13 2.56 0.00 0.00 0.00 173.10 176.86 1oi6 s PRO 42 N -3.04 1.36 0.68 2.90 0.04 -1.23 -4.02 135.00 131.70 1oi6 s PRO 42 Ca 0.12 0.35 -0.17 0.00 0.04 0.00 0.00 61.00 61.34 1oi6 s PRO 42 Cb 0.00 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 1oi6 s PRO 42 CO -0.00 -2.06 0.96 -0.11 0.04 0.00 0.00 177.00 175.83 1oi6 n LEU 43 N -3.68 3.62 -4.49 -3.56 7.94 -1.26 -4.51 117.00 111.05 1oi6 n LEU 43 Ca 0.07 0.71 -0.37 0.00 -1.11 0.00 0.00 56.01 55.32 1oi6 n LEU 43 Cb 0.59 -1.40 0.06 0.00 0.53 0.00 0.00 43.42 43.20 1oi6 n LEU 43 CO 0.57 -1.98 0.14 2.22 -1.11 0.00 0.00 177.39 177.24 1oi6 n PHE 44 N -2.24 -0.53 -1.75 1.96 1.16 -1.26 -4.79 117.46 110.01 1oi6 n PHE 44 Ca 0.13 0.37 -0.42 0.00 -1.87 0.00 0.00 57.45 55.67 1oi6 n PHE 44 Cb 0.49 -1.95 -0.01 0.00 -1.61 0.00 0.00 39.48 36.40 1oi6 n PHE 44 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1oi6 n ARG 45 N -0.76 2.64 -3.10 3.97 5.12 -1.26 -4.94 116.66 118.34 1oi6 n ARG 45 Ca 0.11 0.93 -0.41 0.00 -1.93 0.00 0.00 57.85 56.55 1oi6 n ARG 45 Cb 0.49 -2.67 -0.06 0.00 -1.16 0.00 0.00 32.46 29.06 1oi6 n ARG 45 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1oi6 s VAL 46 N -0.59 4.94 -0.10 1.55 1.01 -1.26 -4.46 120.40 121.49 1oi6 s VAL 46 Ca 0.59 0.98 0.16 0.00 0.00 0.00 0.00 61.98 63.71 1oi6 s VAL 46 Cb -0.50 -3.99 -0.17 0.00 0.00 0.00 0.00 36.38 31.73 1oi6 s VAL 46 CO 0.57 -0.09 0.76 0.00 0.00 0.00 0.00 175.10 176.33 1oi6 n ALA 47 N 5.85 1.81 -3.55 5.51 0.00 -0.27 -5.00 120.51 124.85 1oi6 n ALA 47 Ca -0.00 -0.62 -0.13 0.00 0.00 0.00 0.00 53.44 52.69 1oi6 n ALA 47 Cb 0.49 -0.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.98 1oi6 n ALA 47 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1oi6 s GLN 48 N -2.83 0.77 0.30 0.00 0.74 -1.22 -4.59 119.66 112.82 1oi6 s GLN 48 Ca -0.04 0.14 0.11 0.00 0.05 0.00 0.00 55.36 55.62 1oi6 s GLN 48 Cb 0.08 0.36 -0.05 0.00 1.10 0.00 0.00 33.01 34.50 1oi6 s GLN 48 CO 0.82 -0.25 -0.12 0.95 -0.55 0.00 0.00 175.29 176.14 1oi6 s THR 49 N -1.33 2.63 -0.02 -0.34 -4.23 -1.26 -1.14 115.64 109.94 1oi6 s THR 49 Ca -0.04 -2.22 0.03 0.00 -1.18 0.00 0.00 61.69 58.28 1oi6 s THR 49 Cb -0.00 -2.53 -0.00 0.00 1.34 0.00 0.00 72.50 71.30 1oi6 s THR 49 CO 0.03 -0.33 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.04 1oi6 s ILE 50 N -2.50 0.92 -0.25 2.99 1.01 -0.62 -4.97 121.20 117.78 1oi6 s ILE 50 Ca 0.31 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.51 1oi6 s ILE 50 Cb -0.03 -0.79 0.07 0.00 0.01 0.00 0.00 42.46 41.72 1oi6 s ILE 50 CO 0.17 0.27 -0.04 -2.28 0.00 0.00 0.00 174.94 173.06 1oi6 s HIS 51 N -0.06 2.60 -0.15 3.97 5.65 -1.26 -1.33 115.29 124.72 1oi6 s HIS 51 Ca 0.01 -1.95 -0.01 0.00 0.25 0.00 0.00 55.06 53.36 1oi6 s HIS 51 Cb -0.07 -1.76 -0.01 0.00 -1.18 0.00 0.00 32.58 29.56 1oi6 s HIS 51 CO 0.00 -0.81 -0.12 0.45 -0.65 0.00 0.00 174.74 173.61 1oi6 s SER 52 N 1.32 4.06 -0.09 9.88 0.15 -0.50 -4.98 113.70 123.54 1oi6 s SER 52 Ca -0.04 -0.34 0.01 0.00 0.70 0.00 0.00 55.95 56.28 1oi6 s SER 52 Cb -0.19 -1.63 -0.02 0.00 -1.71 0.00 0.00 66.02 62.46 1oi6 s SER 52 CO -0.07 0.13 -0.12 -0.32 1.20 0.00 0.00 173.24 174.06 1oi6 s MET 53 N 0.55 2.97 0.05 5.44 1.75 -1.26 -0.70 119.30 128.11 1oi6 s MET 53 Ca -0.07 -0.65 0.05 0.00 -1.25 0.00 0.00 55.69 53.76 1oi6 s MET 53 Cb -0.15 -2.55 -0.02 0.00 2.84 0.00 0.00 34.83 34.94 1oi6 s MET 53 CO 0.03 0.45 -0.13 -1.12 -0.65 0.00 0.00 175.02 173.60 1oi6 s SER 54 N -0.25 1.55 0.64 1.11 0.01 0.37 -4.94 113.70 112.19 1oi6 s SER 54 Ca 0.02 -0.52 -0.13 0.00 1.31 0.00 0.00 55.95 56.63 1oi6 s SER 54 Cb -0.13 -0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.02 1oi6 s SER 54 CO 0.03 -0.04 1.05 -0.54 0.41 0.00 0.00 173.24 174.15 1oi6 s LYS 55 N -1.41 3.21 0.25 12.44 1.02 -1.26 -1.84 119.74 132.14 1oi6 s LYS 55 Ca -0.01 1.00 -0.31 0.00 0.02 0.00 0.00 55.97 56.67 1oi6 s LYS 55 Cb -0.09 -2.03 -0.12 0.00 -0.52 0.00 0.00 37.83 35.08 1oi6 s LYS 55 CO 0.02 -0.88 1.65 -2.13 -0.92 0.00 0.00 175.35 173.09 1oi6 n ARG 56 N -2.63 2.70 -0.28 1.68 0.63 -1.22 -2.08 116.66 115.45 1oi6 n ARG 56 Ca 0.08 0.97 0.00 0.00 -0.92 0.00 0.00 57.85 57.97 1oi6 n ARG 56 Cb 0.53 -2.78 0.00 0.00 0.45 0.00 0.00 32.46 30.67 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 3.08 1.15 3.75 5.14 0.00 0.00 -4.89 105.19 113.43 1oi6 n GLY 57 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.81 2.39 -0.15 1.61 1.01 -0.89 -1.97 120.40 119.60 1oi6 s VAL 58 Ca 0.00 0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.34 1oi6 s VAL 58 Cb 0.00 -3.22 0.02 0.00 0.00 0.00 0.00 36.38 33.18 1oi6 s VAL 58 CO 0.00 0.06 -0.20 -0.69 0.00 0.00 0.00 175.10 174.27 1oi6 s VAL 59 N -0.20 1.97 -0.09 2.92 1.01 -0.61 -1.07 120.40 124.32 1oi6 s VAL 59 Ca 0.59 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1oi6 s VAL 59 Cb -0.44 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 1oi6 s VAL 59 CO 0.48 0.53 -0.13 -0.13 0.00 0.00 0.00 175.10 175.84 1oi6 s ARG 60 N 1.07 2.98 0.00 2.72 0.52 -0.60 -4.53 118.95 121.12 1oi6 s ARG 60 Ca -0.01 -0.69 0.00 0.00 -0.52 0.00 0.00 55.73 54.51 1oi6 s ARG 60 Cb -0.14 -2.52 0.00 0.00 0.52 0.00 0.00 34.95 32.81 1oi6 s ARG 60 CO -0.07 0.41 0.00 0.41 0.02 0.00 0.00 175.30 176.07 1oi6 n GLY 61 N 2.95 0.65 3.70 -3.53 0.00 -1.26 -1.23 105.19 106.47 1oi6 n GLY 61 Ca -0.18 -2.25 -0.41 0.00 0.00 0.00 0.00 46.02 43.18 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 -0.71 4.92 -0.11 -0.61 1.01 -0.11 -4.19 121.20 121.39 1oi6 s ILE 62 Ca 0.00 1.81 -0.02 0.00 0.00 0.00 0.00 60.65 62.44 1oi6 s ILE 62 Cb 0.00 -4.21 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 1oi6 s ILE 62 CO 0.00 0.15 -0.04 -1.00 0.00 0.00 0.00 174.94 174.05 1oi6 s HIS 63 N 1.21 3.02 0.15 3.97 3.76 -0.01 -0.96 115.29 126.44 1oi6 s HIS 63 Ca 0.45 -0.09 -0.08 0.00 -0.15 0.00 0.00 55.06 55.19 1oi6 s HIS 63 Cb -0.19 -1.84 -0.01 0.00 1.11 0.00 0.00 32.58 31.65 1oi6 s HIS 63 CO 0.22 0.19 0.24 1.52 -0.85 0.00 0.00 174.74 176.06 1oi6 s TYR 64 N -0.28 0.45 -0.09 1.40 -0.85 -0.83 -1.61 117.35 115.55 1oi6 s TYR 64 Ca 0.05 -0.82 -0.02 0.00 -0.52 0.00 0.00 57.07 55.75 1oi6 s TYR 64 Cb -0.13 -0.12 -0.03 0.00 0.38 0.00 0.00 41.96 42.06 1oi6 s TYR 64 CO 0.02 -0.68 -0.00 0.99 -1.52 0.00 0.00 175.55 174.36 1oi6 s THR 65 N -3.97 4.26 0.20 -3.49 2.01 -1.26 -0.94 115.64 112.44 1oi6 s THR 65 Ca 0.17 -0.26 -0.33 0.00 0.31 0.00 0.00 61.69 61.58 1oi6 s THR 65 Cb 0.04 -2.79 -0.14 0.00 0.01 0.00 0.00 72.50 69.61 1oi6 s THR 65 CO -0.00 0.60 1.38 0.52 -0.69 0.00 0.00 174.62 176.42 1oi6 n VAL 66 N 2.26 0.66 -3.91 3.82 0.31 0.19 -4.53 118.33 117.14 1oi6 n VAL 66 Ca -0.18 -0.17 -0.28 0.00 -0.01 0.00 0.00 64.34 63.70 1oi6 n VAL 66 Cb 0.53 -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 0.15 1.14 0.79 2.52 2.01 -1.26 -0.87 115.64 120.12 1oi6 s THR 67 Ca 0.73 -0.56 -0.11 0.00 0.31 0.00 0.00 61.69 62.05 1oi6 s THR 67 Cb -0.73 -1.26 0.07 0.00 0.01 0.00 0.00 72.50 70.60 1oi6 s THR 67 CO 0.48 0.21 1.11 -2.16 -0.69 0.00 0.00 174.62 173.57 1oi6 s PRO 68 N 1.63 2.01 0.23 4.92 0.04 -1.26 -4.65 135.00 137.93 1oi6 s PRO 68 Ca 0.02 1.31 0.13 0.00 0.04 0.00 0.00 61.00 62.50 1oi6 s PRO 68 Cb -0.14 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 1oi6 s PRO 68 CO -0.08 -1.85 1.40 -1.00 0.04 0.00 0.00 177.00 175.51 1oi6 h PRO 69 N -1.14 0.00 -0.61 0.56 0.13 -1.82 -3.52 132.00 125.60 1oi6 h PRO 69 Ca -0.44 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1oi6 h PRO 69 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 1oi6 h PRO 69 CO 0.49 0.64 -0.20 0.41 -0.23 0.00 0.00 178.00 179.11 1oi6 n GLY 70 N 1.26 -2.52 2.91 1.56 0.00 -0.05 -5.02 105.19 103.32 1oi6 n GLY 70 Ca 0.01 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.88 -0.04 0.09 2.61 2.01 -1.26 -4.80 115.64 111.38 1oi6 s THR 71 Ca 0.00 0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.15 1oi6 s THR 71 Cb 0.00 -0.18 -0.04 0.00 0.01 0.00 0.00 72.50 72.29 1oi6 s THR 71 CO 0.00 0.06 0.20 0.00 -0.69 0.00 0.00 174.62 174.19 1oi6 s ALA 72 N 0.83 3.89 0.04 7.40 0.00 -1.26 -4.03 121.76 128.64 1oi6 s ALA 72 Ca -0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.93 1oi6 s ALA 72 Cb -0.09 -1.72 -0.03 0.00 0.00 0.00 0.00 23.12 21.29 1oi6 s ALA 72 CO -0.04 0.72 0.01 0.15 0.00 0.00 0.00 175.76 176.60 1oi6 s LYS 73 N -2.72 0.54 -0.05 0.00 1.02 -0.72 -1.62 119.74 116.18 1oi6 s LYS 73 Ca 0.34 -0.95 -0.01 0.00 0.02 0.00 0.00 55.97 55.37 1oi6 s LYS 73 Cb -0.12 0.19 0.03 0.00 -0.52 0.00 0.00 37.83 37.41 1oi6 s LYS 73 CO 0.27 -0.11 0.02 -0.47 -0.92 0.00 0.00 175.35 174.14 1oi6 s TYR 74 N -2.99 0.40 0.02 3.18 5.04 -0.48 -0.93 117.35 121.58 1oi6 s TYR 74 Ca -0.02 0.00 0.04 0.00 -2.44 0.00 0.00 57.07 54.66 1oi6 s TYR 74 Cb 0.01 -0.62 -0.02 0.00 0.35 0.00 0.00 41.96 41.69 1oi6 s TYR 74 CO -0.07 -0.24 -0.13 0.54 -1.34 0.00 0.00 175.55 174.32 1oi6 s VAL 75 N 1.84 0.99 0.18 3.14 0.11 -0.25 -0.90 120.40 125.50 1oi6 s VAL 75 Ca 0.02 -0.78 -0.09 0.00 -2.93 0.00 0.00 61.98 58.20 1oi6 s VAL 75 Cb -0.12 -0.87 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 1oi6 s VAL 75 CO -0.04 0.09 0.30 -0.72 -3.33 0.00 0.00 175.10 171.40 1oi6 s TYR 76 N -0.62 0.46 -0.38 1.54 -0.85 -0.52 -0.79 117.35 116.19 1oi6 s TYR 76 Ca 0.02 -0.81 -0.15 0.00 -0.52 0.00 0.00 57.07 55.61 1oi6 s TYR 76 Cb -0.06 -0.07 0.00 0.00 0.38 0.00 0.00 41.96 42.21 1oi6 s TYR 76 CO 0.00 -0.75 0.33 0.00 -1.52 0.00 0.00 175.55 173.61 1oi6 n ALA 78 N 5.28 3.49 -3.60 0.00 0.00 0.13 -4.85 120.51 120.96 1oi6 n ALA 78 Ca -0.10 -0.38 -0.13 0.00 0.00 0.00 0.00 53.44 52.82 1oi6 n ALA 78 Cb 0.48 -1.10 -0.07 0.00 0.00 0.00 0.00 19.45 18.77 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 -2.86 0.78 3.38 0.00 3.52 -1.22 -4.92 118.95 117.64 1oi6 s ARG 79 Ca 0.15 0.64 0.00 0.00 -0.13 0.00 0.00 55.73 56.38 1oi6 s ARG 79 Cb 0.18 0.38 0.00 0.00 -1.56 0.00 0.00 34.95 33.95 1oi6 s ARG 79 CO 0.66 -0.15 0.00 0.41 -0.81 0.00 0.00 175.30 175.40 1oi6 n GLY 80 N 1.94 -0.07 3.28 8.12 0.00 -1.26 -0.94 105.19 116.26 1oi6 n GLY 80 Ca -0.14 -1.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 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 0.42 0.05 1.61 2.20 -1.26 -3.91 119.74 118.84 1oi6 s LYS 81 Ca 0.00 0.74 0.01 0.00 -0.36 0.00 0.00 55.97 56.36 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 -0.13 -0.06 0.00 -0.36 0.00 0.00 175.35 174.79 1oi6 s ALA 82 N 1.11 0.53 -0.44 3.13 0.00 -0.04 -0.57 121.76 125.48 1oi6 s ALA 82 Ca -0.07 -0.86 -0.14 0.00 0.00 0.00 0.00 51.96 50.89 1oi6 s ALA 82 Cb -0.07 0.10 0.06 0.00 0.00 0.00 0.00 23.12 23.21 1oi6 s ALA 82 CO -0.10 -0.11 0.34 1.41 0.00 0.00 0.00 175.76 177.30 1oi6 s MET 83 N -2.10 2.92 0.14 0.00 1.75 -0.55 -0.48 119.30 120.98 1oi6 s MET 83 Ca -0.06 -1.27 -0.21 0.00 -1.25 0.00 0.00 55.69 52.90 1oi6 s MET 83 Cb -0.06 -4.02 -0.07 0.00 2.84 0.00 0.00 34.83 33.51 1oi6 s MET 83 CO -0.02 -0.93 0.66 0.34 -0.65 0.00 0.00 175.02 174.42 1oi6 s ASP 84 N 2.25 7.13 -0.05 1.11 2.15 -0.23 -1.78 116.67 127.26 1oi6 s ASP 84 Ca 0.04 1.39 0.01 0.00 0.43 0.00 0.00 52.55 54.42 1oi6 s ASP 84 Cb -0.22 -2.40 0.02 0.00 -0.30 0.00 0.00 42.92 40.01 1oi6 s ASP 84 CO 0.07 0.19 -0.05 -0.63 -0.17 0.00 0.00 175.17 174.58 1oi6 s ILE 85 N -1.24 0.57 -0.11 4.11 1.01 0.36 -0.56 121.20 125.34 1oi6 s ILE 85 Ca 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 60.65 60.86 1oi6 s ILE 85 Cb -0.20 -0.60 -0.02 0.00 0.01 0.00 0.00 42.46 41.65 1oi6 s ILE 85 CO 0.21 0.24 -0.08 0.54 0.00 0.00 0.00 174.94 175.85 1oi6 s VAL 86 N 1.01 3.51 -0.10 2.92 0.11 -0.31 -1.45 120.40 126.08 1oi6 s VAL 86 Ca -0.10 -0.52 0.03 0.00 -2.93 0.00 0.00 61.98 58.46 1oi6 s VAL 86 Cb -0.14 -2.47 0.01 0.00 -1.53 0.00 0.00 36.38 32.24 1oi6 s VAL 86 CO -0.00 0.54 -0.18 -0.63 -3.33 0.00 0.00 175.10 171.50 1oi6 s ILE 87 N -0.07 1.62 -0.62 7.04 1.09 -0.17 -1.31 121.20 128.78 1oi6 s ILE 87 Ca -0.00 -0.74 -0.23 0.00 -1.10 0.00 0.00 60.65 58.58 1oi6 s ILE 87 Cb -0.13 -1.44 0.06 0.00 -1.06 0.00 0.00 42.46 39.88 1oi6 s ILE 87 CO 0.03 0.46 0.96 -0.62 -0.10 0.00 0.00 174.94 175.67 1oi6 s ASP 88 N 0.69 6.23 -0.13 3.58 -1.08 0.11 -0.59 116.67 125.48 1oi6 s ASP 88 Ca -0.13 -0.76 0.16 0.00 -0.52 0.00 0.00 52.55 51.30 1oi6 s ASP 88 Cb -0.16 -2.43 0.59 0.00 -1.46 0.00 0.00 42.92 39.46 1oi6 s ASP 88 CO 0.03 -1.37 1.50 2.30 0.52 0.00 0.00 175.17 178.15 1oi6 n ILE 89 N 6.02 1.94 -2.94 4.11 -5.35 -1.26 -0.28 119.36 121.59 1oi6 n ILE 89 Ca -0.02 -1.41 -0.43 0.00 -0.27 0.00 0.00 62.75 60.62 1oi6 n ILE 89 Cb 0.46 0.03 -0.05 0.00 -1.74 0.00 0.00 39.64 38.34 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 -2.12 3.40 0.17 6.28 0.52 -1.26 -4.05 118.95 121.90 1oi6 s ARG 90 Ca 0.43 -0.11 -0.32 0.00 -0.52 0.00 0.00 55.73 55.21 1oi6 s ARG 90 Cb 0.30 -3.95 -0.11 0.00 0.52 0.00 0.00 34.95 31.71 1oi6 s ARG 90 CO 0.17 -1.17 1.67 0.08 0.02 0.00 0.00 175.30 176.06 1oi6 s VAL 91 N 3.40 2.37 0.00 3.52 1.01 0.09 -1.20 120.40 129.59 1oi6 s VAL 91 Ca 0.30 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.50 1oi6 s VAL 91 Cb -0.12 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1oi6 s VAL 91 CO 0.22 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1oi6 n GLY 92 N 3.92 0.81 3.76 4.51 0.00 -1.26 -0.76 105.19 116.16 1oi6 n GLY 92 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.09 5.59 0.38 1.61 0.15 -0.34 -4.88 113.70 114.12 1oi6 s SER 93 Ca 0.00 2.53 0.27 0.00 0.70 0.00 0.00 55.95 59.45 1oi6 s SER 93 Cb 0.00 -2.62 1.33 0.00 -1.71 0.00 0.00 66.02 63.02 1oi6 s SER 93 CO 0.00 -1.33 1.82 1.55 1.20 0.00 0.00 173.24 176.48 1oi6 h PRO 94 N 1.58 0.00 -0.02 5.44 0.13 -1.97 -1.96 132.00 135.20 1oi6 h PRO 94 Ca -0.50 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1oi6 h PRO 94 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 1oi6 h PRO 94 CO 0.58 0.00 -0.11 0.25 -0.23 0.00 0.00 178.00 178.49 1oi6 n THR 95 N -2.47 1.98 -1.61 1.56 -2.24 -1.26 -5.06 114.28 105.19 1oi6 n THR 95 Ca -0.00 -2.47 -0.47 0.00 -2.27 0.00 0.00 64.05 58.84 1oi6 n THR 95 Cb 0.13 -0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.09 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 -1.33 1.59 -0.10 4.78 7.35 -0.74 -1.67 117.46 127.33 1oi6 n PHE 96 Ca 0.17 0.60 0.00 0.00 -0.76 0.00 0.00 57.45 57.46 1oi6 n PHE 96 Cb 0.67 -2.34 0.00 0.00 0.35 0.00 0.00 39.48 38.16 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 2.03 2.25 3.89 7.13 0.00 0.61 -5.02 105.19 116.08 1oi6 n GLY 97 Ca 0.14 0.00 -0.29 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 -0.19 3.62 0.17 1.61 -0.21 -0.67 -4.83 119.66 119.15 1oi6 s GLN 98 Ca 0.00 0.32 0.03 0.00 0.02 0.00 0.00 55.36 55.74 1oi6 s GLN 98 Cb 0.00 -2.36 -0.05 0.00 1.00 0.00 0.00 33.01 31.61 1oi6 s GLN 98 CO 0.00 -0.19 -0.04 1.67 -2.12 0.00 0.00 175.29 174.61 1oi6 s TRP 99 N -2.67 1.28 0.08 0.91 1.48 -1.26 -0.71 118.94 118.06 1oi6 s TRP 99 Ca 0.49 -0.89 -0.04 0.00 -1.06 0.00 0.00 56.10 54.61 1oi6 s TRP 99 Cb -0.10 -0.70 -0.03 0.00 -1.16 0.00 0.00 33.47 31.47 1oi6 s TRP 99 CO 0.42 -0.06 0.07 0.34 -4.06 0.00 0.00 176.95 173.66 1oi6 s ASP 100 N -3.19 0.33 0.03 -2.66 -1.08 -0.43 -4.82 116.67 104.85 1oi6 s ASP 100 Ca 0.21 -0.94 0.01 0.00 -0.52 0.00 0.00 52.55 51.31 1oi6 s ASP 100 Cb 0.05 0.27 -0.02 0.00 -1.46 0.00 0.00 42.92 41.76 1oi6 s ASP 100 CO 0.03 -0.68 -0.05 -0.94 0.52 0.00 0.00 175.17 174.05 1oi6 s SER 101 N -2.93 0.52 -0.07 -0.34 1.04 -1.26 -1.16 113.70 109.49 1oi6 s SER 101 Ca 0.11 -0.44 -0.01 0.00 0.48 0.00 0.00 55.95 56.09 1oi6 s SER 101 Cb 0.07 0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.26 1oi6 s SER 101 CO -0.07 -0.20 -0.02 -0.69 0.98 0.00 0.00 173.24 173.24 1oi6 s VAL 102 N -1.16 0.48 -0.13 5.02 1.01 0.28 -4.98 120.40 120.92 1oi6 s VAL 102 Ca -0.10 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.60 1oi6 s VAL 102 Cb -0.08 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 1oi6 s VAL 102 CO -0.00 0.26 1.24 -0.22 0.00 0.00 0.00 175.10 176.38 1oi6 s LEU 103 N 1.67 4.21 -0.28 3.92 2.96 -1.26 -1.07 118.68 128.83 1oi6 s LEU 103 Ca 0.01 1.73 -0.02 0.00 -0.22 0.00 0.00 54.13 55.62 1oi6 s LEU 103 Cb -0.13 -3.54 0.04 0.00 0.50 0.00 0.00 46.19 43.06 1oi6 s LEU 103 CO -0.04 -0.71 -0.02 -0.04 -1.32 0.00 0.00 176.35 174.22 1oi6 s MET 104 N 3.12 2.62 0.26 1.98 -1.94 0.37 -4.73 119.30 120.97 1oi6 s MET 104 Ca 0.55 -1.14 0.05 0.00 -1.71 0.00 0.00 55.69 53.44 1oi6 s MET 104 Cb -0.23 -3.12 -0.02 0.00 2.01 0.00 0.00 34.83 33.47 1oi6 s MET 104 CO 0.17 -0.53 0.16 -0.40 -0.01 0.00 0.00 175.02 174.41 1oi6 n ASP 105 N 4.66 0.15 0.06 3.03 5.68 -1.26 -0.86 116.55 128.00 1oi6 n ASP 105 Ca -0.14 -2.58 0.11 0.00 -0.50 0.00 0.00 54.79 51.68 1oi6 n ASP 105 Cb 0.45 1.03 0.04 0.00 -1.14 0.00 0.00 41.12 41.50 1oi6 n ASP 105 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1oi6 n GLN 106 N -0.54 0.40 0.12 0.11 1.13 -1.25 -3.32 117.38 114.02 1oi6 n GLN 106 Ca 0.02 0.04 -0.19 0.00 -1.94 0.00 0.00 57.00 54.93 1oi6 n GLN 106 Cb 0.44 -1.68 -0.14 0.00 0.11 0.00 0.00 30.24 28.96 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 0.38 -2.17 -1.09 5.75 -1.97 -3.39 115.11 112.62 1oi6 h GLN 107 Ca 0.00 -0.64 -0.58 0.00 -0.15 0.00 0.00 58.65 57.28 1oi6 h GLN 107 Cb 0.83 0.24 -0.40 0.00 1.07 0.00 0.00 27.48 29.22 1oi6 h GLN 107 CO 0.00 1.30 -0.91 -0.25 -2.65 0.00 0.00 178.83 176.32 1oi6 n ASP 108 N -3.61 1.28 -4.72 -0.69 8.00 -1.26 -5.03 116.55 110.52 1oi6 n ASP 108 Ca -0.12 -2.90 -0.41 0.00 0.71 0.00 0.00 54.79 52.07 1oi6 n ASP 108 Cb 1.05 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 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 1.47 2.15 -4.09 -0.24 -0.02 -1.21 -4.45 135.00 128.61 1oi6 n PRO 109 Ca 0.25 0.76 -0.14 0.00 -2.02 0.00 0.00 63.50 62.35 1oi6 n PRO 109 Cb 0.48 -2.43 -0.13 0.00 -0.02 0.00 0.00 33.50 31.40 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 -2.08 0.42 0.20 -0.52 0.52 -1.26 -4.04 118.95 112.18 1oi6 s ARG 110 Ca 0.58 -0.42 0.10 0.00 -0.52 0.00 0.00 55.73 55.46 1oi6 s ARG 110 Cb -0.52 -0.29 -0.04 0.00 0.52 0.00 0.00 34.95 34.61 1oi6 s ARG 110 CO 0.61 0.07 -0.12 0.00 0.02 0.00 0.00 175.30 175.88 1oi6 s ALA 111 N -0.69 2.89 -0.04 2.13 0.00 0.28 -4.30 121.76 122.03 1oi6 s ALA 111 Ca -0.04 -1.55 0.03 0.00 0.00 0.00 0.00 51.96 50.41 1oi6 s ALA 111 Cb -0.05 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.43 1oi6 s ALA 111 CO -0.00 0.43 -0.13 0.08 0.00 0.00 0.00 175.76 176.14 1oi6 s VAL 112 N -1.82 1.09 -0.19 0.00 1.01 0.03 -0.31 120.40 120.21 1oi6 s VAL 112 Ca 0.25 -0.52 -0.16 0.00 0.00 0.00 0.00 61.98 61.55 1oi6 s VAL 112 Cb -0.08 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 1oi6 s VAL 112 CO 0.15 0.33 0.39 -0.47 0.00 0.00 0.00 175.10 175.50 1oi6 s TYR 113 N 0.16 3.39 -0.34 5.22 6.14 -0.20 -1.09 117.35 130.62 1oi6 s TYR 113 Ca -0.04 0.63 -0.06 0.00 0.64 0.00 0.00 57.07 58.24 1oi6 s TYR 113 Cb -0.10 -2.51 0.05 0.00 0.42 0.00 0.00 41.96 39.81 1oi6 s TYR 113 CO 0.01 0.02 0.10 -0.51 0.64 0.00 0.00 175.55 175.82 1oi6 s LEU 114 N 1.21 4.37 1.00 6.97 1.43 -0.11 -2.42 118.68 131.13 1oi6 s LEU 114 Ca 0.19 -1.25 -0.13 0.00 -1.03 0.00 0.00 54.13 51.91 1oi6 s LEU 114 Cb -0.15 -1.85 0.12 0.00 0.03 0.00 0.00 46.19 44.35 1oi6 s LEU 114 CO 0.08 -0.35 0.70 -2.65 0.23 0.00 0.00 176.35 174.36 1oi6 n PRO 115 N 4.77 -0.86 -1.64 1.29 -0.02 -1.26 -1.75 135.00 135.52 1oi6 n PRO 115 Ca -0.12 -0.21 -0.46 0.00 -2.02 0.00 0.00 63.50 60.70 1oi6 n PRO 115 Cb 0.44 -2.06 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 1oi6 n PRO 115 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1oi6 n VAL 116 N -4.15 1.06 -0.30 -1.45 0.31 -1.26 -2.95 118.33 109.58 1oi6 n VAL 116 Ca 0.07 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1oi6 n VAL 116 Cb 0.54 -1.25 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 1.98 1.12 3.94 2.92 0.00 -1.26 -4.77 105.19 109.11 1oi6 n GLY 117 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.83 3.69 0.09 1.61 -7.23 -1.15 -4.15 120.40 110.43 1oi6 s VAL 118 Ca 0.00 -0.26 0.01 0.00 -1.81 0.00 0.00 61.98 59.92 1oi6 s VAL 118 Cb 0.00 -3.42 -0.04 0.00 0.56 0.00 0.00 36.38 33.48 1oi6 s VAL 118 CO 0.00 -0.37 0.23 -0.83 -0.31 0.00 0.00 175.10 173.82 1oi6 s GLY 119 N -4.28 2.02 -0.02 2.32 0.00 0.24 -4.62 107.32 102.98 1oi6 s GLY 119 Ca 0.52 -0.91 0.05 0.00 0.00 0.00 0.00 44.72 44.38 1oi6 s GLY 119 CO 0.42 -0.90 -0.17 -1.58 0.00 0.00 0.00 173.10 170.86 1oi6 s HIS 120 N -1.58 1.61 0.11 1.90 2.46 -0.63 -1.00 115.29 118.16 1oi6 s HIS 120 Ca 0.35 -0.37 -0.06 0.00 0.47 0.00 0.00 55.06 55.45 1oi6 s HIS 120 Cb -0.12 -1.06 -0.02 0.00 -0.13 0.00 0.00 32.58 31.25 1oi6 s HIS 120 CO 0.28 -0.08 0.16 0.00 -2.47 0.00 0.00 174.74 172.62 1oi6 s ALA 121 N -0.23 0.15 0.12 1.58 0.00 -0.53 -0.83 121.76 122.02 1oi6 s ALA 121 Ca 0.03 -0.94 -0.19 0.00 0.00 0.00 0.00 51.96 50.86 1oi6 s ALA 121 Cb -0.09 0.62 0.05 0.00 0.00 0.00 0.00 23.12 23.70 1oi6 s ALA 121 CO 0.00 -0.52 0.47 -0.59 0.00 0.00 0.00 175.76 175.12 1oi6 s PHE 122 N -3.93 -0.33 -0.06 0.00 -0.71 -0.37 -0.49 117.98 112.09 1oi6 s PHE 122 Ca 0.12 0.09 0.06 0.00 -1.04 0.00 0.00 56.93 56.16 1oi6 s PHE 122 Cb 0.05 0.35 -0.01 0.00 -1.21 0.00 0.00 43.02 42.20 1oi6 s PHE 122 CO -0.06 -0.73 -0.23 0.54 -1.34 0.00 0.00 175.22 173.40 1oi6 s VAL 123 N -3.57 2.19 -0.20 -2.49 0.11 -0.73 -1.55 120.40 114.17 1oi6 s VAL 123 Ca 0.01 -1.02 -0.28 0.00 -2.93 0.00 0.00 61.98 57.77 1oi6 s VAL 123 Cb 0.01 -1.81 -0.00 0.00 -1.53 0.00 0.00 36.38 33.05 1oi6 s VAL 123 CO -0.11 0.57 0.96 0.00 -3.33 0.00 0.00 175.10 173.19 1oi6 s ALA 124 N -0.17 3.60 -0.80 1.54 0.00 -0.24 -1.48 121.76 124.22 1oi6 s ALA 124 Ca -0.03 0.14 0.24 0.00 0.00 0.00 0.00 51.96 52.31 1oi6 s ALA 124 Cb -0.14 -3.43 0.30 0.00 0.00 0.00 0.00 23.12 19.86 1oi6 s ALA 124 CO 0.04 -0.87 1.26 1.28 0.00 0.00 0.00 175.76 177.46 1oi6 n LEU 125 N 5.82 0.61 -4.02 0.00 4.77 0.26 -0.82 117.00 123.62 1oi6 n LEU 125 Ca 0.09 0.03 -0.08 0.00 -0.03 0.00 0.00 56.01 56.01 1oi6 n LEU 125 Cb 0.47 -0.18 -0.11 0.00 -2.33 0.00 0.00 43.42 41.28 1oi6 n LEU 125 CO 0.51 0.06 -0.36 -1.61 -1.33 0.00 0.00 177.39 174.66 1oi6 s GLU 126 N -3.10 0.43 0.85 3.23 2.02 -1.23 -4.85 118.70 116.05 1oi6 s GLU 126 Ca 0.08 -0.84 -0.12 0.00 0.02 0.00 0.00 54.97 54.10 1oi6 s GLU 126 Cb 0.16 0.14 0.11 0.00 0.10 0.00 0.00 34.13 34.63 1oi6 s GLU 126 CO 0.74 -0.07 1.19 -0.51 0.02 0.00 0.00 175.26 176.63 1oi6 s ASP 127 N -2.02 3.33 -1.40 -0.19 1.01 -1.26 -3.45 116.67 112.69 1oi6 s ASP 127 Ca -0.07 2.32 -0.07 0.00 0.71 0.00 0.00 52.55 55.44 1oi6 s ASP 127 Cb -0.03 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.32 1oi6 s ASP 127 CO -0.04 -2.84 0.89 0.47 0.21 0.00 0.00 175.17 173.86 1oi6 n ASP 128 N -3.63 -6.13 -4.64 0.27 8.00 -0.93 -4.79 116.55 104.69 1oi6 n ASP 128 Ca 0.13 -0.41 -0.41 0.00 0.71 0.00 0.00 54.79 54.81 1oi6 n ASP 128 Cb 0.51 -4.85 -0.05 0.00 -0.02 0.00 0.00 41.12 36.71 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 -3.24 4.93 -0.21 -3.53 2.01 -0.77 -4.08 115.64 110.74 1oi6 s THR 129 Ca 0.44 1.33 -0.07 0.00 0.31 0.00 0.00 61.69 63.71 1oi6 s THR 129 Cb -0.19 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.27 1oi6 s THR 129 CO 0.55 0.00 0.05 -0.69 -0.69 0.00 0.00 174.62 173.84 1oi6 s VAL 130 N 2.53 4.37 -0.18 3.82 1.01 -0.12 -0.48 120.40 131.35 1oi6 s VAL 130 Ca 0.31 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 1oi6 s VAL 130 Cb -0.16 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1oi6 s VAL 130 CO 0.08 0.40 0.00 -0.04 0.00 0.00 0.00 175.10 175.55 1oi6 s MET 131 N 1.04 3.73 -0.14 2.72 -1.94 0.12 -0.69 119.30 124.14 1oi6 s MET 131 Ca 0.03 -0.48 0.02 0.00 -1.71 0.00 0.00 55.69 53.56 1oi6 s MET 131 Cb -0.14 -3.05 0.00 0.00 2.01 0.00 0.00 34.83 33.65 1oi6 s MET 131 CO 0.03 0.17 -0.20 0.45 -0.01 0.00 0.00 175.02 175.46 1oi6 s SER 132 N 0.59 3.32 0.07 3.03 0.15 -0.16 -1.41 113.70 119.29 1oi6 s SER 132 Ca -0.01 -0.54 0.07 0.00 0.70 0.00 0.00 55.95 56.17 1oi6 s SER 132 Cb -0.14 -1.48 -0.03 0.00 -1.71 0.00 0.00 66.02 62.66 1oi6 s SER 132 CO 0.02 0.10 -0.19 -0.31 1.20 0.00 0.00 173.24 174.07 1oi6 s TYR 133 N 0.69 1.61 -0.10 3.44 2.02 -0.44 -1.43 117.35 123.14 1oi6 s TYR 133 Ca -0.09 -0.40 -0.00 0.00 -0.37 0.00 0.00 57.07 56.21 1oi6 s TYR 133 Cb -0.16 -0.92 -0.03 0.00 -0.40 0.00 0.00 41.96 40.45 1oi6 s TYR 133 CO 0.01 0.12 -0.08 -1.64 -1.57 0.00 0.00 175.55 172.40 1oi6 s MET 134 N -1.52 3.04 0.10 -0.62 -1.94 -0.08 -1.58 119.30 116.70 1oi6 s MET 134 Ca 0.05 -0.57 0.10 0.00 -1.71 0.00 0.00 55.69 53.56 1oi6 s MET 134 Cb -0.09 -2.66 -0.04 0.00 2.01 0.00 0.00 34.83 34.06 1oi6 s MET 134 CO 0.03 0.50 -0.27 -0.51 -0.01 0.00 0.00 175.02 174.76 1oi6 s LEU 135 N -0.36 2.27 0.21 -0.03 1.43 -0.29 -1.39 118.68 120.52 1oi6 s LEU 135 Ca 0.05 -0.70 0.26 0.00 -1.03 0.00 0.00 54.13 52.71 1oi6 s LEU 135 Cb -0.12 -1.23 0.83 0.00 0.03 0.00 0.00 46.19 45.70 1oi6 s LEU 135 CO 0.02 0.20 1.78 -1.54 0.23 0.00 0.00 176.35 177.04 1oi6 n SER 136 N 1.20 0.79 -3.71 2.29 3.41 -0.64 -1.12 113.62 115.84 1oi6 n SER 136 Ca -0.18 0.58 -0.14 0.00 -0.26 0.00 0.00 58.87 58.87 1oi6 n SER 136 Cb 0.53 -0.79 -0.08 0.00 -0.26 0.00 0.00 64.21 63.60 1oi6 n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oi6 s ARG 137 N -3.11 0.69 0.44 4.33 1.70 -1.26 -4.44 118.95 117.30 1oi6 s ARG 137 Ca 0.10 0.12 -0.25 0.00 -0.47 0.00 0.00 55.73 55.23 1oi6 s ARG 137 Cb 0.12 0.32 -0.08 0.00 -0.57 0.00 0.00 34.95 34.74 1oi6 s ARG 137 CO 0.58 -0.17 1.36 -1.12 -1.08 0.00 0.00 175.30 174.87 1oi6 s SER 138 N -0.85 6.00 0.06 -2.89 0.01 -1.26 -4.70 113.70 110.06 1oi6 s SER 138 Ca -0.09 2.76 -0.31 0.00 1.31 0.00 0.00 55.95 59.63 1oi6 s SER 138 Cb -0.04 -2.64 -0.08 0.00 0.21 0.00 0.00 66.02 63.47 1oi6 s SER 138 CO 0.04 -1.08 1.65 -0.47 0.41 0.00 0.00 173.24 173.80 1oi6 s TYR 139 N -1.26 2.37 -0.18 2.43 5.04 -1.26 -4.99 117.35 119.50 1oi6 s TYR 139 Ca 0.61 0.31 0.01 0.00 -2.44 0.00 0.00 57.07 55.56 1oi6 s TYR 139 Cb -0.40 -3.96 0.03 0.00 0.35 0.00 0.00 41.96 37.98 1oi6 s TYR 139 CO 0.51 -3.85 -0.18 0.08 -1.34 0.00 0.00 175.55 170.77 1oi6 s VAL 140 N 2.79 1.98 0.25 3.14 1.01 -1.26 -5.03 120.40 123.28 1oi6 s VAL 140 Ca 0.74 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 1oi6 s VAL 140 Cb -0.39 -1.84 0.23 0.00 0.00 0.00 0.00 36.38 34.38 1oi6 s VAL 140 CO 0.32 0.45 1.75 0.74 0.00 0.00 0.00 175.10 178.37 1oi6 h THR 141 N 6.06 0.71 0.00 3.92 2.02 -1.94 -0.49 112.91 123.19 1oi6 h THR 141 Ca -0.41 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1oi6 h THR 141 Cb 1.13 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1oi6 h THR 141 CO 0.60 0.10 0.00 1.56 0.37 0.00 0.00 175.52 178.15 1oi6 h GLN 142 N 0.56 0.00 -0.02 6.66 7.50 -2.02 -2.37 115.11 125.40 1oi6 h GLN 142 Ca 0.44 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.59 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 -0.37 0.00 -0.12 -0.25 -1.50 0.00 0.00 178.83 176.59 1oi6 n ASP 143 N -2.72 2.49 -4.49 1.46 8.00 -0.21 -4.92 116.55 116.15 1oi6 n ASP 143 Ca 0.01 -1.77 -0.39 0.00 0.71 0.00 0.00 54.79 53.34 1oi6 n ASP 143 Cb 0.25 0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 41.34 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 -2.13 3.48 0.36 -1.24 0.41 -0.90 -0.64 118.70 118.05 1oi6 s GLU 144 Ca 0.27 -0.64 0.08 0.00 -0.41 0.00 0.00 54.97 54.28 1oi6 s GLU 144 Cb 0.20 -3.67 -0.05 0.00 -1.78 0.00 0.00 34.13 28.83 1oi6 s GLU 144 CO 0.37 -0.40 0.09 -0.51 -0.49 0.00 0.00 175.26 174.32 1oi6 s LEU 145 N 1.67 3.08 0.03 1.80 1.43 -0.11 -4.99 118.68 121.59 1oi6 s LEU 145 Ca 0.06 -0.98 0.01 0.00 -1.03 0.00 0.00 54.13 52.19 1oi6 s LEU 145 Cb -0.17 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 1oi6 s LEU 145 CO 0.08 -0.34 -0.06 0.00 0.23 0.00 0.00 176.35 176.27 1oi6 s ALA 146 N -2.53 0.39 0.16 4.21 0.00 -1.26 -1.97 121.76 120.77 1oi6 s ALA 146 Ca 0.37 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.71 1oi6 s ALA 146 Cb 0.01 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 1oi6 s ALA 146 CO 0.21 -0.08 -0.19 -0.51 0.00 0.00 0.00 175.76 175.19 1oi6 s LEU 147 N -1.56 2.43 -0.09 0.00 1.43 -0.13 -4.25 118.68 116.49 1oi6 s LEU 147 Ca -0.12 -0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 51.84 1oi6 s LEU 147 Cb -0.10 -0.84 -0.05 0.00 0.03 0.00 0.00 46.19 45.23 1oi6 s LEU 147 CO -0.00 -0.02 1.74 -0.55 0.23 0.00 0.00 176.35 177.75 1oi6 s SER 148 N -2.60 6.46 0.43 2.29 0.15 0.44 -0.93 113.70 119.94 1oi6 s SER 148 Ca 0.15 2.13 0.23 0.00 0.70 0.00 0.00 55.95 59.16 1oi6 s SER 148 Cb -0.06 -2.53 0.59 0.00 -1.71 0.00 0.00 66.02 62.31 1oi6 s SER 148 CO 0.06 -1.11 1.69 0.00 1.20 0.00 0.00 173.24 175.08 1oi6 h ALA 149 N 10.46 0.93 -0.02 5.45 0.00 -1.84 -3.27 119.26 130.98 1oi6 h ALA 149 Ca -0.40 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1oi6 h ALA 149 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1oi6 h ALA 149 CO 0.96 0.20 -0.12 1.28 0.00 0.00 0.00 179.25 181.57 1oi6 n LEU 150 N -3.19 1.72 -4.33 0.00 4.77 -1.26 -4.56 117.00 110.15 1oi6 n LEU 150 Ca 0.02 -0.56 -0.55 0.00 -0.03 0.00 0.00 56.01 54.89 1oi6 n LEU 150 Cb 0.51 -0.03 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 1oi6 n LEU 150 CO 0.34 0.30 1.82 -0.67 -1.33 0.00 0.00 177.39 177.84 1oi6 n ASP 151 N 0.17 1.06 0.21 -1.43 4.64 -1.23 -4.81 116.55 115.15 1oi6 n ASP 151 Ca 0.15 0.53 0.18 0.00 -1.38 0.00 0.00 54.79 54.26 1oi6 n ASP 151 Cb 0.41 -1.01 0.84 0.00 -1.04 0.00 0.00 41.12 40.33 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 10.44 0.00 -0.65 -0.67 0.11 -1.94 -2.02 132.00 137.27 1oi6 h PRO 152 Ca -0.14 0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.09 1oi6 h PRO 152 Cb 1.38 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.40 1oi6 h PRO 152 CO 1.11 0.00 0.19 0.00 -0.21 0.00 0.00 178.00 179.09 1oi6 h ALA 153 N 1.72 0.83 -0.06 -0.75 0.00 -1.99 -2.94 119.26 116.07 1oi6 h ALA 153 Ca 0.09 0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.89 1oi6 h ALA 153 Cb 0.55 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1oi6 h ALA 153 CO -0.00 -0.27 -0.90 -0.07 0.00 0.00 0.00 179.25 178.01 1oi6 h LEU 154 N 0.32 0.78 -0.88 0.00 3.38 -1.74 -3.48 115.31 113.69 1oi6 h LEU 154 Ca 0.35 -0.57 -0.38 0.00 0.09 0.00 0.00 57.88 57.36 1oi6 h LEU 154 Cb 0.52 -0.24 0.14 0.00 0.09 0.00 0.00 40.66 41.17 1oi6 h LEU 154 CO -0.40 1.37 -0.66 0.61 0.09 0.00 0.00 178.44 179.45 1oi6 n GLY 155 N 0.87 -0.49 3.73 0.83 0.00 -1.11 -4.96 105.19 104.06 1oi6 n GLY 155 Ca -0.08 0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 -7.08 3.46 -1.40 0.99 1.43 -1.26 -4.86 118.68 109.96 1oi6 s LEU 156 Ca 0.55 2.42 -0.12 0.00 -1.03 0.00 0.00 54.13 55.96 1oi6 s LEU 156 Cb -0.24 -4.60 0.08 0.00 0.03 0.00 0.00 46.19 41.46 1oi6 s LEU 156 CO 0.71 -2.03 2.15 -0.81 0.23 0.00 0.00 176.35 176.59 1oi6 n PRO 157 N -2.25 3.21 -0.01 1.29 -0.04 -1.26 -4.53 135.00 131.41 1oi6 n PRO 157 Ca 0.14 -2.93 0.01 0.00 -0.04 0.00 0.00 63.50 60.68 1oi6 n PRO 157 Cb 0.50 -3.12 0.01 0.00 -0.04 0.00 0.00 33.50 30.85 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 4.32 0.55 -3.65 0.52 -6.64 -1.26 -4.85 119.36 108.35 1oi6 n ILE 158 Ca 0.49 -0.77 -0.38 0.00 -1.77 0.00 0.00 62.75 60.32 1oi6 n ILE 158 Cb 0.37 0.74 -0.12 0.00 -1.44 0.00 0.00 39.64 39.19 1oi6 n ILE 158 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1oi6 s ASP 159 N -0.60 5.64 -0.03 7.28 -1.08 -1.26 -4.90 116.67 121.72 1oi6 s ASP 159 Ca 0.02 -0.27 0.05 0.00 -0.52 0.00 0.00 52.55 51.83 1oi6 s ASP 159 Cb 0.01 -2.03 0.07 0.00 -1.46 0.00 0.00 42.92 39.51 1oi6 s ASP 159 CO 0.02 -0.11 0.93 2.30 0.52 0.00 0.00 175.17 178.83 1oi6 n ILE 160 N 5.01 0.89 0.00 4.11 -5.35 -1.26 -4.99 119.36 117.77 1oi6 n ILE 160 Ca -0.14 -0.98 0.00 0.00 -0.27 0.00 0.00 62.75 61.35 1oi6 n ILE 160 Cb 0.51 0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.83 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 1.05 3.42 3.28 0.00 -1.26 -5.08 105.19 106.03 1oi6 n GLY 161 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1oi6 n GLY 161 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1oi6 s VAL 162 N -2.00 1.28 0.02 1.61 -7.23 -1.26 -5.10 120.40 107.72 1oi6 s VAL 162 Ca 0.00 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 57.83 1oi6 s VAL 162 Cb 0.00 -2.60 -0.06 0.00 0.56 0.00 0.00 36.38 34.28 1oi6 s VAL 162 CO 0.00 -0.15 1.36 -0.70 -0.31 0.00 0.00 175.10 175.29 1oi6 s GLU 163 N -3.84 4.31 0.41 4.82 2.56 -1.26 -4.98 118.70 120.72 1oi6 s GLU 163 Ca 0.33 1.93 -0.25 0.00 0.00 0.00 0.00 54.97 56.98 1oi6 s GLU 163 Cb 0.07 -3.49 -0.11 0.00 2.00 0.00 0.00 34.13 32.60 1oi6 s GLU 163 CO 0.13 -0.50 1.11 -2.30 -0.56 0.00 0.00 175.26 173.14 1oi6 n PRO 164 N 4.97 1.57 -3.56 4.30 -0.02 -1.26 -4.92 135.00 136.08 1oi6 n PRO 164 Ca 0.12 0.56 -0.40 0.00 -2.02 0.00 0.00 63.50 61.76 1oi6 n PRO 164 Cb 0.44 -2.15 -0.11 0.00 -0.02 0.00 0.00 33.50 31.66 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 -1.22 4.98 0.00 4.25 1.01 -0.83 -4.97 121.20 124.42 1oi6 s ILE 165 Ca 0.62 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.82 1oi6 s ILE 165 Cb -0.55 -3.63 -0.01 0.00 0.01 0.00 0.00 42.46 38.28 1oi6 s ILE 165 CO 0.58 -0.09 -0.07 -0.69 0.00 0.00 0.00 174.94 174.66 1oi6 s VAL 166 N 1.66 0.58 0.93 2.92 1.01 -1.26 -1.57 120.40 124.66 1oi6 s VAL 166 Ca 0.05 -0.39 -0.12 0.00 0.00 0.00 0.00 61.98 61.52 1oi6 s VAL 166 Cb -0.18 -0.50 0.15 0.00 0.00 0.00 0.00 36.38 35.85 1oi6 s VAL 166 CO 0.09 0.11 1.10 -0.94 0.00 0.00 0.00 175.10 175.46 1oi6 s SER 167 N -0.31 3.24 0.13 3.32 1.04 -1.26 -4.83 113.70 115.03 1oi6 s SER 167 Ca 0.02 1.27 -0.19 0.00 0.48 0.00 0.00 55.95 57.53 1oi6 s SER 167 Cb -0.03 -1.94 -0.01 0.00 0.10 0.00 0.00 66.02 64.13 1oi6 s SER 167 CO -0.00 -2.76 1.72 0.44 0.98 0.00 0.00 173.24 173.63 1oi6 h ASP 168 N -1.63 -0.06 -0.84 7.02 3.32 -2.01 -0.58 116.42 121.64 1oi6 h ASP 168 Ca -0.51 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.56 1oi6 h ASP 168 Cb 1.31 0.08 -0.04 0.00 0.22 0.00 0.00 39.33 40.90 1oi6 h ASP 168 CO 0.57 -0.00 0.42 -0.09 -1.72 0.00 0.00 179.24 178.42 1oi6 h ARG 169 N 0.09 1.19 -0.07 3.56 2.43 -1.99 -2.22 114.38 117.38 1oi6 h ARG 169 Ca 0.11 -0.17 -0.22 0.00 -0.81 0.00 0.00 59.98 58.88 1oi6 h ARG 169 Cb 0.13 -0.22 0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1oi6 h ARG 169 CO -0.17 0.91 -0.87 -0.44 -1.51 0.00 0.00 179.97 177.89 1oi6 h ASP 170 N 1.18 0.73 -0.87 -3.80 3.32 -1.80 -3.06 116.42 112.11 1oi6 h ASP 170 Ca 0.29 -0.53 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 1oi6 h ASP 170 Cb 0.10 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 1oi6 h ASP 170 CO -0.04 1.31 0.51 -0.09 -1.72 0.00 0.00 179.24 179.22 1oi6 h ARG 171 N 0.37 1.20 -0.02 3.56 2.43 -0.70 -2.91 114.38 118.31 1oi6 h ARG 171 Ca -0.07 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1oi6 h ARG 171 Cb 1.49 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1oi6 h ARG 171 CO 0.16 0.85 0.00 1.33 -1.51 0.00 0.00 179.97 180.81 1oi6 n VAL 172 N -4.35 0.01 -1.74 0.20 0.24 -0.87 -4.96 118.33 106.85 1oi6 n VAL 172 Ca 0.10 -0.34 -0.40 0.00 -2.04 0.00 0.00 64.34 61.65 1oi6 n VAL 172 Cb 0.07 0.83 0.01 0.00 -1.47 0.00 0.00 33.84 33.29 1oi6 n VAL 172 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1oi6 n ALA 173 N 0.57 1.84 -1.34 2.33 0.00 -1.10 -4.98 120.51 117.84 1oi6 n ALA 173 Ca 0.17 0.26 -0.30 0.00 0.00 0.00 0.00 53.44 53.57 1oi6 n ALA 173 Cb 0.44 -2.36 0.10 0.00 0.00 0.00 0.00 19.45 17.63 1oi6 n ALA 173 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1oi6 s ILE 174 N -1.18 3.17 0.67 0.00 -4.36 -1.26 -3.93 121.20 114.31 1oi6 s ILE 174 Ca 0.60 0.38 -0.11 0.00 -0.26 0.00 0.00 60.65 61.26 1oi6 s ILE 174 Cb -0.47 -2.95 -0.01 0.00 1.25 0.00 0.00 42.46 40.28 1oi6 s ILE 174 CO 0.58 -0.50 1.06 0.42 0.24 0.00 0.00 174.94 176.75 1oi6 s THR 175 N -2.98 4.13 0.21 8.37 -4.23 -1.26 -0.42 115.64 119.46 1oi6 s THR 175 Ca 0.61 0.69 -0.13 0.00 -1.18 0.00 0.00 61.69 61.69 1oi6 s THR 175 Cb -0.16 -3.61 0.23 0.00 1.34 0.00 0.00 72.50 70.30 1oi6 s THR 175 CO 0.56 -0.90 1.63 0.25 -0.54 0.00 0.00 174.62 175.61 1oi6 h LEU 176 N -0.55 -0.54 -0.86 4.79 6.46 -1.94 0.22 115.31 122.89 1oi6 h LEU 176 Ca -0.44 0.19 -0.09 0.00 -0.12 0.00 0.00 57.88 57.41 1oi6 h LEU 176 Cb 1.22 0.38 -0.02 0.00 -0.73 0.00 0.00 40.66 41.50 1oi6 h LEU 176 CO 0.61 -0.20 -0.12 0.00 -0.62 0.00 0.00 178.44 178.11 1oi6 h ALA 177 N 1.63 1.04 -0.49 1.25 0.00 -1.99 -0.29 119.26 120.40 1oi6 h ALA 177 Ca 0.31 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1oi6 h ALA 177 Cb 0.48 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1oi6 h ALA 177 CO -0.64 0.58 -0.19 1.49 0.00 0.00 0.00 179.25 180.49 1oi6 h GLU 178 N 0.64 0.99 -0.65 0.00 4.57 -1.78 -1.75 114.58 116.60 1oi6 h GLU 178 Ca 0.11 -0.41 -0.05 0.00 -1.18 0.00 0.00 59.36 57.83 1oi6 h GLU 178 Cb 0.58 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.10 1oi6 h GLU 178 CO 0.04 1.08 0.21 0.00 -1.18 0.00 0.00 179.01 179.16 1oi6 h ALA 179 N 0.91 0.85 -0.37 2.92 0.00 -0.65 -1.94 119.26 120.99 1oi6 h ALA 179 Ca 0.12 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1oi6 h ALA 179 Cb 0.76 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1oi6 h ALA 179 CO 0.06 0.52 0.16 0.37 0.00 0.00 0.00 179.25 180.37 1oi6 h GLN 180 N 0.94 0.33 -0.64 0.00 4.15 -0.86 -1.39 115.11 117.64 1oi6 h GLN 180 Ca 0.21 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.60 1oi6 h GLN 180 Cb 0.29 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 1oi6 h GLN 180 CO -0.01 0.22 0.34 -0.09 -1.93 0.00 0.00 178.83 177.36 1oi6 h ARG 181 N 0.34 0.88 0.00 1.69 2.43 -0.93 -1.91 114.38 116.89 1oi6 h ARG 181 Ca 0.16 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1oi6 h ARG 181 Cb 0.10 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1oi6 h ARG 181 CO -0.13 0.66 0.00 1.04 -1.51 0.00 0.00 179.97 180.03 1oi6 n GLN 182 N -4.37 0.42 -1.19 0.20 6.02 -0.76 -4.91 117.38 112.78 1oi6 n GLN 182 Ca 0.06 0.03 -0.02 0.00 -0.01 0.00 0.00 57.00 57.06 1oi6 n GLN 182 Cb 0.11 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.86 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 0.99 0.48 0.18 1.08 0.00 -0.72 -4.95 105.19 102.25 1oi6 n GLY 183 Ca 0.13 -0.98 0.12 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.20 1.04 -4.86 0.99 4.77 -0.57 -4.94 117.00 113.23 1oi6 n LEU 184 Ca -0.02 -0.31 -0.32 0.00 -0.03 0.00 0.00 56.01 55.33 1oi6 n LEU 184 Cb 0.12 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1oi6 n LEU 184 CO 0.03 0.21 0.35 -0.76 -1.33 0.00 0.00 177.39 175.89 1oi6 s LEU 185 N -2.73 4.09 0.65 2.23 1.43 -1.25 -4.90 118.68 118.20 1oi6 s LEU 185 Ca 0.17 1.16 -0.18 0.00 -1.03 0.00 0.00 54.13 54.24 1oi6 s LEU 185 Cb 0.18 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.44 1oi6 s LEU 185 CO 0.64 -0.16 1.25 -2.65 0.23 0.00 0.00 176.35 175.66 1oi6 n PRO 186 N -0.31 1.06 -3.39 1.29 -0.02 -1.26 -4.81 135.00 127.57 1oi6 n PRO 186 Ca 0.02 0.42 -0.38 0.00 -2.02 0.00 0.00 63.50 61.54 1oi6 n PRO 186 Cb 0.53 -2.49 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 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 -1.38 6.93 0.09 2.55 2.15 -1.26 -0.73 116.67 125.02 1oi6 s ASP 187 Ca 0.82 1.11 -0.20 0.00 0.43 0.00 0.00 52.55 54.71 1oi6 s ASP 187 Cb -0.38 -2.30 -0.08 0.00 -0.30 0.00 0.00 42.92 39.85 1oi6 s ASP 187 CO 0.41 0.29 1.63 0.22 -0.17 0.00 0.00 175.17 177.55 1oi6 h TYR 188 N 4.69 0.32 -0.14 -5.34 3.20 -1.15 -0.48 116.97 118.07 1oi6 h TYR 188 Ca -0.50 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.34 1oi6 h TYR 188 Cb 1.22 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.38 1oi6 h TYR 188 CO 0.69 0.37 0.07 1.15 -1.64 0.00 0.00 178.16 178.80 1oi6 h THR 189 N 0.18 1.11 -0.63 1.81 2.02 -1.93 -0.36 112.91 115.11 1oi6 h THR 189 Ca 0.07 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 66.95 1oi6 h THR 189 Cb 0.19 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 1oi6 h THR 189 CO -0.00 0.10 0.38 0.74 0.37 0.00 0.00 175.52 177.11 1oi6 h THR 190 N 0.10 1.06 -0.44 3.16 2.02 -1.94 -1.17 112.91 115.70 1oi6 h THR 190 Ca 0.05 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.97 1oi6 h THR 190 Cb 0.11 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 1oi6 h THR 190 CO -0.01 0.13 0.27 0.28 0.37 0.00 0.00 175.52 176.57 1oi6 h SER 191 N 0.74 0.52 -0.01 4.18 0.02 -0.75 -1.75 113.55 116.49 1oi6 h SER 191 Ca 0.26 -0.05 -0.11 0.00 -0.84 0.00 0.00 61.79 61.05 1oi6 h SER 191 Cb 0.05 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 1oi6 h SER 191 CO -0.11 0.42 -0.31 1.56 -1.14 0.00 0.00 176.83 177.24 1oi6 h GLN 192 N 0.58 0.47 -0.19 3.45 4.20 -0.75 -0.29 115.11 122.58 1oi6 h GLN 192 Ca 0.16 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 1oi6 h GLN 192 Cb -0.01 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1oi6 h GLN 192 CO -0.03 0.72 0.11 0.93 -0.67 0.00 0.00 178.83 179.89 1oi6 h GLU 193 N 0.40 0.26 -0.26 1.46 5.08 -0.84 -0.23 114.58 120.45 1oi6 h GLU 193 Ca 0.05 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1oi6 h GLU 193 Cb 0.74 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1oi6 h GLU 193 CO 0.06 0.23 0.13 0.82 -1.00 0.00 0.00 179.01 179.25 1oi6 h ILE 194 N 0.22 1.14 -0.78 3.13 2.04 -1.12 -2.60 117.51 119.54 1oi6 h ILE 194 Ca 0.07 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.59 1oi6 h ILE 194 Cb 0.04 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 1oi6 h ILE 194 CO -0.01 0.14 0.48 -0.08 0.00 0.00 0.00 178.15 178.68 1oi6 h GLU 195 N 0.29 0.90 -0.01 2.37 4.81 -0.83 0.26 114.58 122.37 1oi6 h GLU 195 Ca 0.09 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1oi6 h GLU 195 Cb 0.10 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1oi6 h GLU 195 CO -0.01 0.59 -0.32 0.00 -0.73 0.00 0.00 179.01 178.54 1oi6 h ARG 196 N 0.92 0.02 -0.20 1.92 3.08 -0.87 -1.51 114.38 117.74 1oi6 h ARG 196 Ca 0.32 -0.01 -0.18 0.00 0.07 0.00 0.00 59.98 60.19 1oi6 h ARG 196 Cb 0.07 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1oi6 h ARG 196 CO -0.13 0.34 -0.58 0.00 -1.07 0.00 0.00 179.97 178.53 1oi6 h ARG 197 N 0.01 0.74 -0.39 0.04 3.08 -0.94 -2.28 114.38 114.65 1oi6 h ARG 197 Ca -0.00 -0.53 -0.06 0.00 0.07 0.00 0.00 59.98 59.45 1oi6 h ARG 197 Cb 0.58 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1oi6 h ARG 197 CO 0.04 1.15 -0.02 -0.07 -1.07 0.00 0.00 179.97 180.00 1oi6 h LEU 198 N 0.46 0.60 -3.33 3.04 3.38 -0.52 -3.01 115.31 115.94 1oi6 h LEU 198 Ca -0.02 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 1oi6 h LEU 198 Cb 1.20 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.74 1oi6 h LEU 198 CO 0.12 0.69 0.01 0.35 0.09 0.00 0.00 178.44 179.70 1oi6 n THR 199 N -4.24 2.42 -2.08 0.22 -2.24 -0.61 -4.07 114.28 103.69 1oi6 n THR 199 Ca 0.02 -2.15 -0.37 0.00 -2.27 0.00 0.00 64.05 59.29 1oi6 n THR 199 Cb 0.28 -0.29 0.02 0.00 -2.10 0.00 0.00 70.33 68.24 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 -2.98 2.76 -0.08 6.98 0.00 -0.86 -3.49 121.76 124.09 1oi6 s ALA 200 Ca 0.44 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 53.12 1oi6 s ALA 200 Cb 0.37 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 1oi6 s ALA 200 CO 0.06 -0.98 1.29 0.08 0.00 0.00 0.00 175.76 176.21 1oi6 s VAL 201 N -1.55 4.11 0.56 0.00 1.01 -1.26 -4.64 120.40 118.63 1oi6 s VAL 201 Ca 0.71 1.41 -0.19 0.00 0.00 0.00 0.00 61.98 63.91 1oi6 s VAL 201 Cb -0.31 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1oi6 s VAL 201 CO 0.35 -0.05 1.13 -2.16 0.00 0.00 0.00 175.10 174.37 1oi6 s PRO 202 N 2.81 3.28 0.00 2.72 0.04 -1.26 -5.12 135.00 137.47 1oi6 s PRO 202 Ca 0.58 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1oi6 s PRO 202 Cb -0.26 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1oi6 s PRO 202 CO 0.21 -0.91 0.00 0.28 0.04 0.00 0.00 177.00 176.62