#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f9h n GLY 2 N 0.00 -1.12 2.65 0.46 0.00 -0.58 -4.51 105.19 102.09 3f9h n GLY 2 Ca 0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 3f9h n GLY 2 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3f9h s PHE 3 N -2.66 0.01 -0.05 1.61 5.36 -1.26 -5.01 117.98 115.97 3f9h s PHE 3 Ca 0.20 -0.31 -0.24 0.00 -0.96 0.00 0.00 56.93 55.62 3f9h s PHE 3 Cb 0.16 -0.63 -0.04 0.00 -0.34 0.00 0.00 43.02 42.17 3f9h s PHE 3 CO 0.37 -0.69 0.72 1.03 -1.46 0.00 0.00 175.22 175.20 3f9h s ARG 4 N 2.21 4.45 -0.82 10.12 3.00 -1.26 -4.99 118.95 131.65 3f9h s ARG 4 Ca 0.06 0.92 -0.25 0.00 0.00 0.00 0.00 55.73 56.46 3f9h s ARG 4 Cb -0.16 -3.44 0.01 0.00 0.00 0.00 0.00 34.95 31.37 3f9h s ARG 4 CO -0.21 0.08 1.55 0.21 0.00 0.00 0.00 175.30 176.93 3f9h s LYS 5 N 0.73 3.09 -0.22 3.54 2.20 -1.26 -4.97 119.74 122.85 3f9h s LYS 5 Ca 0.38 -0.34 -0.12 0.00 -0.36 0.00 0.00 55.97 55.53 3f9h s LYS 5 Cb -0.18 -4.71 -0.05 0.00 -1.51 0.00 0.00 37.83 31.38 3f9h s LYS 5 CO 0.19 -2.48 0.24 -1.64 -0.36 0.00 0.00 175.35 171.30 3f9h s MET 6 N 5.98 4.12 0.75 4.03 -1.94 -1.26 -4.67 119.30 126.31 3f9h s MET 6 Ca 0.50 -0.11 -0.11 0.00 -1.71 0.00 0.00 55.69 54.27 3f9h s MET 6 Cb -0.06 -3.53 0.04 0.00 2.01 0.00 0.00 34.83 33.29 3f9h s MET 6 CO 0.06 0.05 1.08 0.00 -0.01 0.00 0.00 175.02 176.20 3f9h s ALA 7 N 1.07 2.40 0.46 3.03 0.00 -1.26 -4.83 121.76 122.63 3f9h s ALA 7 Ca 0.11 0.05 -0.20 0.00 0.00 0.00 0.00 51.96 51.92 3f9h s ALA 7 Cb -0.14 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.70 3f9h s ALA 7 CO 0.05 -1.55 0.98 -0.06 0.00 0.00 0.00 175.76 175.18 3f9h s PHE 8 N -3.03 3.22 -0.10 0.00 0.08 -1.26 -4.97 117.98 111.92 3f9h s PHE 8 Ca 0.60 1.58 -0.31 0.00 0.12 0.00 0.00 56.93 58.92 3f9h s PHE 8 Cb -0.15 -2.91 -0.09 0.00 -0.57 0.00 0.00 43.02 39.30 3f9h s PHE 8 CO 0.55 -0.38 2.02 -2.30 -0.10 0.00 0.00 175.22 175.02 3f9h n PRO 9 N -0.88 2.28 -0.01 0.24 -0.02 -1.26 -4.86 135.00 130.49 3f9h n PRO 9 Ca 0.08 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3f9h n PRO 9 Cb 0.54 -2.90 0.01 0.00 -0.02 0.00 0.00 33.50 31.12 3f9h n PRO 9 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3f9h n SER 10 N 8.43 0.19 0.13 2.55 3.41 -1.26 -4.35 113.62 122.73 3f9h n SER 10 Ca 0.25 -2.00 -0.13 0.00 -0.26 0.00 0.00 58.87 56.72 3f9h n SER 10 Cb 0.36 -0.06 -0.07 0.00 -0.26 0.00 0.00 64.21 64.19 3f9h n SER 10 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3f9h h GLY 11 N 5.87 -0.28 2.00 5.00 0.00 -2.00 0.12 103.07 113.78 3f9h h GLY 11 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.45 3f9h h GLY 11 CO 0.00 -0.11 0.00 0.28 0.00 0.00 0.00 176.54 176.71 3f9h n LYS 12 N -5.22 0.13 -0.08 4.80 5.02 -1.26 -2.24 118.16 119.31 3f9h n LYS 12 Ca -0.08 0.52 -0.08 0.00 -2.02 0.00 0.00 58.31 56.64 3f9h n LYS 12 Cb 0.15 -1.84 -0.12 0.00 -0.02 0.00 0.00 35.03 33.20 3f9h n LYS 12 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3f9h n VAL 13 N -2.11 1.07 -0.31 -0.18 0.31 -1.02 -4.52 118.33 111.57 3f9h n VAL 13 Ca 0.00 -0.63 0.08 0.00 -0.01 0.00 0.00 64.34 63.79 3f9h n VAL 13 Cb 0.11 -0.67 0.24 0.00 -0.91 0.00 0.00 33.84 32.61 3f9h n VAL 13 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3f9h h GLU 14 N 0.00 0.66 0.00 5.55 5.08 -0.51 0.87 114.58 126.22 3f9h h GLU 14 Ca -0.42 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 3f9h h GLU 14 Cb 1.92 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.02 3f9h h GLU 14 CO 0.01 0.43 0.00 0.41 -1.00 0.00 0.00 179.01 178.86 3f9h n GLY 15 N -1.33 -0.68 0.72 -3.84 0.00 -1.22 -2.96 105.19 95.88 3f9h n GLY 15 Ca 0.18 -0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.15 3f9h n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f9h s MET 17 N -1.11 3.97 0.26 0.00 -1.94 -1.16 -0.45 119.30 118.87 3f9h s MET 17 Ca 0.24 0.12 0.02 0.00 -1.71 0.00 0.00 55.69 54.36 3f9h s MET 17 Cb 0.14 -3.31 -0.04 0.00 2.01 0.00 0.00 34.83 33.63 3f9h s MET 17 CO 0.20 0.49 0.18 0.14 -0.01 0.00 0.00 175.02 176.01 3f9h s VAL 18 N -0.30 0.11 -0.04 -6.03 -7.23 -0.70 -4.65 120.40 101.56 3f9h s VAL 18 Ca 0.18 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.37 3f9h s VAL 18 Cb -0.14 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 3f9h s VAL 18 CO 0.06 0.00 -0.08 0.00 -0.31 0.00 0.00 175.10 174.77 3f9h s GLN 19 N -3.88 2.64 -0.21 4.82 -2.07 -0.71 -1.09 119.66 119.17 3f9h s GLN 19 Ca 0.39 -0.63 0.01 0.00 -1.82 0.00 0.00 55.36 53.31 3f9h s GLN 19 Cb 0.05 -2.53 0.04 0.00 -1.09 0.00 0.00 33.01 29.48 3f9h s GLN 19 CO 0.18 0.64 -0.12 0.08 -1.32 0.00 0.00 175.29 174.75 3f9h s VAL 20 N -0.87 1.80 -0.15 3.63 1.01 0.10 -1.96 120.40 123.97 3f9h s VAL 20 Ca 0.14 -1.12 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 3f9h s VAL 20 Cb -0.11 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 3f9h s VAL 20 CO 0.03 0.18 -0.09 -0.89 0.00 0.00 0.00 175.10 174.33 3f9h s THR 21 N 1.32 3.29 -0.24 3.92 2.01 0.15 -1.98 115.64 124.11 3f9h s THR 21 Ca -0.02 -0.56 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 3f9h s THR 21 Cb -0.16 -2.42 0.08 0.00 0.01 0.00 0.00 72.50 70.00 3f9h s THR 21 CO -0.08 0.50 0.06 0.00 -0.69 0.00 0.00 174.62 174.41 3f9h n GLY 23 N 5.00 1.67 0.02 0.00 0.00 -1.26 -2.66 105.19 107.96 3f9h n GLY 23 Ca -0.06 -0.11 0.01 0.00 0.00 0.00 0.00 46.02 45.86 3f9h n GLY 23 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3f9h n THR 24 N 0.00 0.28 -2.24 2.61 -2.24 -1.26 -5.01 114.28 106.42 3f9h n THR 24 Ca 0.00 -0.30 -0.41 0.00 -2.27 0.00 0.00 64.05 61.07 3f9h n THR 24 Cb 0.00 -0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.01 3f9h n THR 24 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3f9h s THR 25 N -2.47 3.26 -0.05 4.28 2.01 -1.09 -5.04 115.64 116.55 3f9h s THR 25 Ca -0.04 1.03 -0.02 0.00 0.31 0.00 0.00 61.69 62.98 3f9h s THR 25 Cb 0.05 -3.66 0.04 0.00 0.01 0.00 0.00 72.50 68.93 3f9h s THR 25 CO 0.39 0.15 0.09 -0.89 -0.69 0.00 0.00 174.62 173.68 3f9h s THR 26 N 0.14 -0.07 0.30 -0.82 2.01 -1.26 -1.42 115.64 114.53 3f9h s THR 26 Ca 0.57 0.22 -0.08 0.00 0.31 0.00 0.00 61.69 62.70 3f9h s THR 26 Cb -0.36 -0.17 0.00 0.00 0.01 0.00 0.00 72.50 71.98 3f9h s THR 26 CO 0.38 0.09 0.50 -1.48 -0.69 0.00 0.00 174.62 173.42 3f9h s LEU 27 N 1.24 0.61 0.57 4.42 0.05 -0.84 -4.92 118.68 119.81 3f9h s LEU 27 Ca -0.08 -1.21 -0.17 0.00 0.05 0.00 0.00 54.13 52.72 3f9h s LEU 27 Cb -0.12 1.73 -0.05 0.00 -2.05 0.00 0.00 46.19 45.70 3f9h s LEU 27 CO -0.05 -1.27 1.06 0.20 -0.55 0.00 0.00 176.35 175.74 3f9h s ASN 28 N -3.12 5.88 0.05 1.48 0.01 -0.43 0.03 114.94 118.84 3f9h s ASN 28 Ca 0.26 1.86 0.01 0.00 -0.71 0.00 0.00 52.86 54.28 3f9h s ASN 28 Cb -0.01 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 39.08 3f9h s ASN 28 CO 0.14 -1.10 -0.06 -0.83 -1.51 0.00 0.00 177.10 173.75 3f9h s GLY 29 N -2.55 0.48 -0.40 0.66 0.00 -0.25 -4.22 107.32 101.05 3f9h s GLY 29 Ca 0.65 -0.86 -0.12 0.00 0.00 0.00 0.00 44.72 44.39 3f9h s GLY 29 CO 0.33 -0.93 0.25 -2.27 0.00 0.00 0.00 173.10 170.48 3f9h s LEU 30 N -1.90 4.94 -0.46 0.66 0.20 0.17 -1.72 118.68 120.57 3f9h s LEU 30 Ca -0.06 -1.09 -0.20 0.00 0.69 0.00 0.00 54.13 53.47 3f9h s LEU 30 Cb -0.06 -2.06 0.03 0.00 -0.43 0.00 0.00 46.19 43.68 3f9h s LEU 30 CO -0.02 -0.44 0.64 0.86 -0.29 0.00 0.00 176.35 177.10 3f9h s TRP 31 N 1.57 3.05 -0.13 5.38 -0.00 0.40 -0.43 118.94 128.78 3f9h s TRP 31 Ca 0.03 -0.21 -0.00 0.00 -0.00 0.00 0.00 56.10 55.92 3f9h s TRP 31 Cb -0.20 -3.40 0.03 0.00 -0.00 0.00 0.00 33.47 29.90 3f9h s TRP 31 CO 0.07 -0.93 -0.09 -0.51 -0.00 0.00 0.00 176.95 175.49 3f9h s LEU 32 N 2.78 1.34 0.00 5.86 1.43 -0.39 -4.69 118.68 125.01 3f9h s LEU 32 Ca 0.20 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 3f9h s LEU 32 Cb -0.16 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.14 3f9h s LEU 32 CO 0.17 -0.11 0.00 0.47 0.23 0.00 0.00 176.35 177.11 3f9h n ASP 33 N 4.90 0.00 -1.34 2.29 8.00 -1.26 -2.10 116.55 127.03 3f9h n ASP 33 Ca -0.13 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.28 3f9h n ASP 33 Cb 0.50 0.00 0.16 0.00 -0.02 0.00 0.00 41.12 41.76 3f9h n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3f9h n ASP 34 N 9.46 3.16 -3.88 -2.24 3.85 -1.26 -0.12 116.55 125.52 3f9h n ASP 34 Ca 0.00 -3.80 -0.15 0.00 -0.71 0.00 0.00 54.79 50.13 3f9h n ASP 34 Cb 0.00 -0.60 -0.15 0.00 -1.35 0.00 0.00 41.12 39.02 3f9h n ASP 34 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3f9h s THR 35 N -3.59 0.20 -0.26 2.12 2.01 -0.89 -0.87 115.64 114.35 3f9h s THR 35 Ca 0.47 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 62.37 3f9h s THR 35 Cb 0.41 -0.22 -0.00 0.00 0.01 0.00 0.00 72.50 72.70 3f9h s THR 35 CO -0.01 0.09 0.03 -0.69 -0.69 0.00 0.00 174.62 173.36 3f9h s VAL 36 N 0.33 3.81 -0.20 3.82 1.01 0.12 -1.26 120.40 128.03 3f9h s VAL 36 Ca -0.03 -0.53 -0.17 0.00 0.00 0.00 0.00 61.98 61.25 3f9h s VAL 36 Cb -0.06 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 3f9h s VAL 36 CO -0.01 0.25 0.45 -0.31 0.00 0.00 0.00 175.10 175.48 3f9h s TYR 37 N 1.51 3.37 0.07 5.22 2.02 0.42 -1.88 117.35 128.09 3f9h s TYR 37 Ca 0.04 0.68 -0.12 0.00 -0.37 0.00 0.00 57.07 57.30 3f9h s TYR 37 Cb -0.16 -2.59 0.01 0.00 -0.40 0.00 0.00 41.96 38.83 3f9h s TYR 37 CO 0.01 -0.06 0.28 0.00 -1.57 0.00 0.00 175.55 174.21 3f9h n PRO 39 N 0.22 2.21 0.22 0.00 -0.02 -1.26 0.11 135.00 136.49 3f9h n PRO 39 Ca -0.17 0.78 0.10 0.00 -2.02 0.00 0.00 63.50 62.20 3f9h n PRO 39 Cb 0.61 -2.47 0.40 0.00 -0.02 0.00 0.00 33.50 32.03 3f9h n PRO 39 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 3f9h h ARG 40 N 2.46 0.00 0.00 -0.52 0.11 -1.20 -3.13 114.38 112.10 3f9h h ARG 40 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.60 3f9h h ARG 40 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 3f9h h ARG 40 CO 0.62 0.20 0.00 -2.39 0.10 0.00 0.00 179.97 178.49 3f9h n HIS 41 N -3.28 0.00 -0.07 4.08 1.44 -1.26 -2.87 115.22 113.25 3f9h n HIS 41 Ca 0.01 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.65 3f9h n HIS 41 Cb 0.46 0.00 0.11 0.00 0.12 0.00 0.00 29.99 30.69 3f9h n HIS 41 CO 0.00 0.00 0.00 -0.24 -2.81 0.00 0.00 176.34 173.29 3f9h h VAL 42 N 0.00 1.27 0.00 0.61 3.04 -1.94 -2.95 116.25 116.27 3f9h h VAL 42 Ca 0.00 -1.29 0.00 0.00 -1.01 0.00 0.00 66.70 64.40 3f9h h VAL 42 Cb 0.00 1.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 3f9h h VAL 42 CO 0.00 0.43 0.00 0.16 -1.01 0.00 0.00 177.57 177.15 3f9h h ILE 43 N 0.64 0.00 -3.88 3.17 3.07 -1.82 -3.44 117.51 115.26 3f9h h ILE 43 Ca 0.10 -0.30 -0.47 0.00 1.55 0.00 0.00 64.86 65.74 3f9h h ILE 43 Cb 0.69 1.09 -0.02 0.00 -0.27 0.00 0.00 36.82 38.31 3f9h h ILE 43 CO 0.05 0.00 0.30 0.00 -1.05 0.00 0.00 178.15 177.45 3f9h s THR 45 N -1.77 2.29 0.39 0.00 -4.23 -1.26 -4.83 115.64 106.22 3f9h s THR 45 Ca 0.52 -0.51 0.11 0.00 -1.18 0.00 0.00 61.69 60.64 3f9h s THR 45 Cb -0.15 -2.78 0.33 0.00 1.34 0.00 0.00 72.50 71.24 3f9h s THR 45 CO 0.20 0.00 1.91 0.00 -0.54 0.00 0.00 174.62 176.19 3f9h h ALA 46 N -0.47 1.93 -0.01 3.99 0.00 -1.98 -1.58 119.26 121.14 3f9h h ALA 46 Ca -0.40 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.27 3f9h h ALA 46 Cb 1.28 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.98 3f9h h ALA 46 CO 0.47 -0.13 -0.98 1.49 0.00 0.00 0.00 179.25 180.10 3f9h h GLU 47 N 0.58 0.60 0.00 0.00 4.81 -2.04 -3.32 114.58 115.22 3f9h h GLU 47 Ca 0.39 -0.63 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3f9h h GLU 47 Cb 0.68 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.23 3f9h h GLU 47 CO -0.15 1.23 0.00 -0.44 -0.73 0.00 0.00 179.01 178.93 3f9h h ASP 48 N 0.35 0.00 1.06 1.04 3.45 -1.66 -3.11 116.42 117.55 3f9h h ASP 48 Ca -0.10 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.36 3f9h h ASP 48 Cb 1.62 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.39 3f9h h ASP 48 CO 0.18 0.00 0.00 0.24 -1.57 0.00 0.00 179.24 178.09 3f9h h MET 49 N 0.00 0.00 -0.39 3.56 2.86 -1.56 -2.92 114.93 116.48 3f9h h MET 49 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3f9h h MET 49 Cb 0.45 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 3f9h h MET 49 CO 0.00 0.00 0.24 -0.07 1.06 0.00 0.00 176.91 178.14 3f9h h LEU 50 N 0.00 0.46 -6.22 1.22 3.38 -1.76 -2.08 115.31 110.31 3f9h h LEU 50 Ca 0.00 -0.04 -0.25 0.00 0.09 0.00 0.00 57.88 57.68 3f9h h LEU 50 Cb 0.53 -0.12 -0.26 0.00 0.09 0.00 0.00 40.66 40.90 3f9h h LEU 50 CO 0.00 0.37 -0.59 0.21 0.09 0.00 0.00 178.44 178.52 3f9h s ASN 51 N -5.61 0.13 -0.26 -0.43 2.47 -1.23 -4.74 114.94 105.29 3f9h s ASN 51 Ca -0.13 -1.24 -0.17 0.00 0.42 0.00 0.00 52.86 51.74 3f9h s ASN 51 Cb 0.10 1.10 -0.03 0.00 -1.45 0.00 0.00 41.25 40.98 3f9h s ASN 51 CO 0.73 -0.23 0.49 -2.16 -3.72 0.00 0.00 177.10 172.20 3f9h s PRO 52 N 1.63 4.07 -0.73 0.43 0.04 -1.10 -5.00 135.00 134.34 3f9h s PRO 52 Ca 0.16 0.28 -0.16 0.00 0.04 0.00 0.00 61.00 61.32 3f9h s PRO 52 Cb -0.11 -3.64 0.16 0.00 0.04 0.00 0.00 34.50 30.94 3f9h s PRO 52 CO -0.06 -0.31 0.75 1.21 0.04 0.00 0.00 177.00 178.63 3f9h s ASN 53 N 1.51 6.48 0.08 6.66 3.84 -1.26 -4.96 114.94 127.29 3f9h s ASN 53 Ca 0.20 -2.08 -0.21 0.00 0.21 0.00 0.00 52.86 50.97 3f9h s ASN 53 Cb -0.16 -2.26 -0.12 0.00 -0.55 0.00 0.00 41.25 38.16 3f9h s ASN 53 CO 0.09 -0.85 1.60 1.88 -2.79 0.00 0.00 177.10 177.03 3f9h h TYR 54 N 8.53 0.21 -0.61 0.43 -1.99 -1.98 -1.06 116.97 120.49 3f9h h TYR 54 Ca -0.07 -0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.68 3f9h h TYR 54 Cb 1.06 -0.06 -0.03 0.00 2.00 0.00 0.00 36.73 39.70 3f9h h TYR 54 CO 0.94 0.31 0.41 1.05 -0.00 0.00 0.00 178.16 180.87 3f9h h GLU 55 N 0.04 0.68 -0.26 4.88 9.09 -1.98 0.75 114.58 127.78 3f9h h GLU 55 Ca 0.04 -0.04 -0.09 0.00 0.05 0.00 0.00 59.36 59.32 3f9h h GLU 55 Cb 0.20 -0.15 -0.01 0.00 -1.65 0.00 0.00 28.75 27.13 3f9h h GLU 55 CO -0.00 0.45 -0.22 0.22 0.05 0.00 0.00 179.01 179.50 3f9h h ASP 56 N 0.70 0.48 0.25 3.06 -0.00 -1.82 -3.12 116.42 115.97 3f9h h ASP 56 Ca 0.25 -0.15 -0.34 0.00 -0.00 0.00 0.00 57.03 56.79 3f9h h ASP 56 Cb 0.12 -0.13 -0.03 0.00 -0.00 0.00 0.00 39.33 39.29 3f9h h ASP 56 CO -0.07 0.71 -1.90 0.18 -0.00 0.00 0.00 179.24 178.16 3f9h n LEU 57 N -4.14 1.99 0.08 2.28 4.77 -0.46 -4.30 117.00 117.23 3f9h n LEU 57 Ca -0.00 0.28 -0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3f9h n LEU 57 Cb 0.39 -0.65 0.30 0.00 -2.33 0.00 0.00 43.42 41.13 3f9h n LEU 57 CO 0.42 0.69 0.79 0.25 -1.33 0.00 0.00 177.39 178.21 3f9h h LEU 58 N 0.05 0.30 -1.81 2.23 5.85 0.40 -2.39 115.31 119.93 3f9h h LEU 58 Ca -0.38 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.23 3f9h h LEU 58 Cb 2.03 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.97 3f9h h LEU 58 CO 0.08 0.53 -0.15 -0.29 -0.34 0.00 0.00 178.44 178.27 3f9h h ILE 59 N 0.28 0.78 0.00 4.05 6.09 -1.73 -1.81 117.51 125.17 3f9h h ILE 59 Ca 0.05 -0.59 0.00 0.00 -1.37 0.00 0.00 64.86 62.95 3f9h h ILE 59 Cb 0.55 1.35 0.00 0.00 0.47 0.00 0.00 36.82 39.19 3f9h h ILE 59 CO 0.04 0.15 0.00 0.54 -3.07 0.00 0.00 178.15 175.81 3f9h n ARG 60 N -3.88 0.76 -4.09 2.19 1.74 -0.90 -4.82 116.66 107.66 3f9h n ARG 60 Ca -0.02 0.01 -0.23 0.00 -0.77 0.00 0.00 57.85 56.84 3f9h n ARG 60 Cb 0.25 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.12 3f9h n ARG 60 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3f9h s LYS 61 N -2.05 2.39 0.32 5.56 -0.14 -0.68 -5.11 119.74 120.03 3f9h s LYS 61 Ca 0.37 -1.53 0.05 0.00 -1.36 0.00 0.00 55.97 53.50 3f9h s LYS 61 Cb 0.17 -2.19 -0.03 0.00 -1.68 0.00 0.00 37.83 34.10 3f9h s LYS 61 CO 0.30 0.12 0.20 -1.54 -0.76 0.00 0.00 175.35 173.68 3f9h s SER 62 N -3.85 1.69 0.21 2.83 1.04 -1.26 -5.01 113.70 109.35 3f9h s SER 62 Ca 0.38 -1.65 -0.12 0.00 0.48 0.00 0.00 55.95 55.04 3f9h s SER 62 Cb -0.03 0.48 0.28 0.00 0.10 0.00 0.00 66.02 66.85 3f9h s SER 62 CO 0.23 -0.97 1.65 0.78 0.98 0.00 0.00 173.24 175.91 3f9h h ASN 63 N 2.14 -0.39 0.46 7.02 2.35 -1.95 -0.36 115.58 124.85 3f9h h ASN 63 Ca -0.30 0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 3f9h h ASN 63 Cb 1.25 0.32 0.00 0.00 0.05 0.00 0.00 38.32 39.93 3f9h h ASN 63 CO 0.46 -0.15 0.00 0.00 -1.65 0.00 0.00 177.43 176.08 3f9h n HIS 64 N -5.34 0.00 1.30 1.19 1.44 -1.26 -2.66 115.22 109.88 3f9h n HIS 64 Ca 0.09 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.81 3f9h n HIS 64 Cb 0.35 -0.48 0.09 0.00 0.12 0.00 0.00 29.99 30.08 3f9h n HIS 64 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 3f9h n SER 65 N -1.48 0.00 -3.83 4.39 7.64 -0.14 -4.70 113.62 115.49 3f9h n SER 65 Ca 0.04 -1.20 -0.26 0.00 1.01 0.00 0.00 58.87 58.46 3f9h n SER 65 Cb 0.16 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.19 3f9h n SER 65 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3f9h s PHE 66 N -2.00 1.15 -0.55 1.43 0.08 -1.09 -4.44 117.98 112.57 3f9h s PHE 66 Ca 0.05 -0.58 -0.17 0.00 0.12 0.00 0.00 56.93 56.34 3f9h s PHE 66 Cb 0.02 -1.06 0.10 0.00 -0.57 0.00 0.00 43.02 41.52 3f9h s PHE 66 CO 0.04 -0.47 0.58 -1.17 -0.10 0.00 0.00 175.22 174.10 3f9h s LEU 67 N 1.82 5.65 -0.13 -0.37 0.20 0.10 -4.81 118.68 121.14 3f9h s LEU 67 Ca 0.04 -1.48 -0.04 0.00 0.69 0.00 0.00 54.13 53.35 3f9h s LEU 67 Cb -0.13 -2.27 -0.03 0.00 -0.43 0.00 0.00 46.19 43.32 3f9h s LEU 67 CO -0.07 -0.93 0.01 0.68 -0.29 0.00 0.00 176.35 175.75 3f9h s VAL 68 N 2.15 4.31 -0.14 1.68 -7.23 -1.26 0.30 120.40 120.21 3f9h s VAL 68 Ca 0.08 -0.23 -0.06 0.00 -1.81 0.00 0.00 61.98 59.97 3f9h s VAL 68 Cb -0.26 -2.86 0.07 0.00 0.56 0.00 0.00 36.38 33.89 3f9h s VAL 68 CO 0.06 0.55 0.30 -1.58 -0.31 0.00 0.00 175.10 174.12 3f9h s GLN 69 N -0.29 0.21 -0.54 4.82 0.74 -0.83 -1.86 119.66 121.92 3f9h s GLN 69 Ca 0.06 0.79 -0.16 0.00 0.05 0.00 0.00 55.36 56.11 3f9h s GLN 69 Cb -0.12 0.04 0.13 0.00 1.10 0.00 0.00 33.01 34.15 3f9h s GLN 69 CO 0.02 -0.26 0.49 0.00 -0.55 0.00 0.00 175.29 175.00 3f9h s ALA 70 N 2.27 3.64 0.00 1.58 0.00 0.42 -1.74 121.76 127.93 3f9h s ALA 70 Ca -0.01 -2.54 0.00 0.00 0.00 0.00 0.00 51.96 49.41 3f9h s ALA 70 Cb -0.12 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.76 3f9h s ALA 70 CO -0.10 -2.01 0.00 0.41 0.00 0.00 0.00 175.76 174.06 3f9h n GLY 71 N 5.23 1.84 0.08 0.00 0.00 -1.26 -1.52 105.19 109.55 3f9h n GLY 71 Ca -0.14 0.27 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 3f9h n GLY 71 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3f9h n ASN 72 N 11.24 0.35 -4.71 1.61 3.02 -1.26 -4.93 115.26 120.58 3f9h n ASN 72 Ca 0.00 0.16 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 3f9h n ASN 72 Cb 0.00 0.78 -0.03 0.00 -0.61 0.00 0.00 39.78 39.92 3f9h n ASN 72 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3f9h s VAL 73 N -2.78 3.20 -0.09 2.41 1.01 -0.58 -5.02 120.40 118.54 3f9h s VAL 73 Ca -0.07 0.83 -0.12 0.00 0.00 0.00 0.00 61.98 62.63 3f9h s VAL 73 Cb 0.08 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 3f9h s VAL 73 CO 0.84 0.05 0.27 -1.10 0.00 0.00 0.00 175.10 175.16 3f9h s GLN 74 N 1.32 3.84 -0.17 2.72 -1.52 -1.26 -0.43 119.66 124.15 3f9h s GLN 74 Ca 0.66 0.11 -0.04 0.00 -1.95 0.00 0.00 55.36 54.14 3f9h s GLN 74 Cb -0.38 -3.27 -0.03 0.00 -0.22 0.00 0.00 33.01 29.12 3f9h s GLN 74 CO 0.30 0.59 -0.02 -0.51 -0.25 0.00 0.00 175.29 175.41 3f9h s LEU 75 N -0.61 3.30 -0.35 2.90 1.02 -0.78 -4.95 118.68 119.22 3f9h s LEU 75 Ca 0.18 -0.14 -0.28 0.00 0.02 0.00 0.00 54.13 53.91 3f9h s LEU 75 Cb -0.14 -1.81 0.02 0.00 0.02 0.00 0.00 46.19 44.28 3f9h s LEU 75 CO 0.07 0.13 1.03 -0.60 0.02 0.00 0.00 176.35 177.00 3f9h s ARG 76 N 0.60 3.96 -0.16 1.70 6.06 -1.26 -4.42 118.95 125.43 3f9h s ARG 76 Ca -0.01 0.85 -0.22 0.00 -2.50 0.00 0.00 55.73 53.85 3f9h s ARG 76 Cb -0.14 -3.77 -0.03 0.00 0.06 0.00 0.00 34.95 31.07 3f9h s ARG 76 CO 0.02 -0.95 0.65 0.54 -2.50 0.00 0.00 175.30 173.06 3f9h s VAL 77 N 3.65 5.03 -0.17 7.11 0.11 -1.26 -0.10 120.40 134.77 3f9h s VAL 77 Ca 0.43 1.26 0.15 0.00 -2.93 0.00 0.00 61.98 60.90 3f9h s VAL 77 Cb -0.12 -3.97 0.36 0.00 -1.53 0.00 0.00 36.38 31.12 3f9h s VAL 77 CO 0.18 0.15 1.19 2.30 -3.33 0.00 0.00 175.10 175.59 3f9h n ILE 78 N 4.41 2.05 0.00 7.04 -5.35 0.26 -4.66 119.36 123.12 3f9h n ILE 78 Ca -0.01 -2.72 0.00 0.00 -0.27 0.00 0.00 62.75 59.75 3f9h n ILE 78 Cb 0.50 -0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 3f9h n ILE 78 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3f9h n GLY 79 N -1.27 2.59 3.22 3.28 0.00 -1.06 -4.90 105.19 107.04 3f9h n GLY 79 Ca 0.18 -0.50 -0.12 0.00 0.00 0.00 0.00 46.02 45.58 3f9h n GLY 79 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3f9h s HIS 80 N -2.00 -0.48 0.12 1.61 -3.43 -1.26 0.58 115.29 110.43 3f9h s HIS 80 Ca 0.00 1.08 0.02 0.00 -0.80 0.00 0.00 55.06 55.35 3f9h s HIS 80 Cb 0.00 0.18 -0.04 0.00 -1.43 0.00 0.00 32.58 31.28 3f9h s HIS 80 CO 0.00 -0.27 -0.06 -1.54 -2.00 0.00 0.00 174.74 170.88 3f9h s SER 81 N 0.92 1.21 -0.15 7.38 1.04 0.05 -5.01 113.70 119.14 3f9h s SER 81 Ca -0.06 -1.04 -0.01 0.00 0.48 0.00 0.00 55.95 55.32 3f9h s SER 81 Cb -0.07 0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.13 3f9h s SER 81 CO -0.07 -0.47 -0.10 -0.32 0.98 0.00 0.00 173.24 173.26 3f9h s MET 82 N -3.84 3.45 -0.27 4.02 1.75 -1.26 -0.76 119.30 122.38 3f9h s MET 82 Ca 0.14 -0.64 0.02 0.00 -1.25 0.00 0.00 55.69 53.96 3f9h s MET 82 Cb 0.05 -2.74 0.08 0.00 2.84 0.00 0.00 34.83 35.06 3f9h s MET 82 CO -0.03 0.17 -0.01 -1.14 -0.65 0.00 0.00 175.02 173.36 3f9h s GLN 83 N 0.48 1.53 2.96 4.11 0.74 -1.10 -4.99 119.66 123.39 3f9h s GLN 83 Ca -0.07 -1.26 0.00 0.00 0.05 0.00 0.00 55.36 54.07 3f9h s GLN 83 Cb -0.15 -2.69 0.00 0.00 1.10 0.00 0.00 33.01 31.27 3f9h s GLN 83 CO 0.04 -0.74 0.00 0.09 -0.55 0.00 0.00 175.29 174.13 3f9h n ASN 84 N 4.57 0.00 -0.71 6.67 3.02 -1.26 -0.83 115.26 126.72 3f9h n ASN 84 Ca -0.07 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.55 3f9h n ASN 84 Cb 0.43 0.00 0.13 0.00 -0.61 0.00 0.00 39.78 39.73 3f9h n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3f9h s LEU 86 N -1.09 4.23 -0.20 0.00 1.43 -0.01 -0.77 118.68 122.28 3f9h s LEU 86 Ca 0.24 0.42 -0.06 0.00 -1.03 0.00 0.00 54.13 53.70 3f9h s LEU 86 Cb 0.14 -3.18 -0.03 0.00 0.03 0.00 0.00 46.19 43.14 3f9h s LEU 86 CO 0.19 -0.03 0.03 -0.22 0.23 0.00 0.00 176.35 176.55 3f9h s LEU 87 N -3.25 3.49 -0.36 1.79 1.98 0.30 -2.70 118.68 119.93 3f9h s LEU 87 Ca 0.39 -0.09 -0.11 0.00 -2.89 0.00 0.00 54.13 51.43 3f9h s LEU 87 Cb -0.11 -1.89 0.02 0.00 0.66 0.00 0.00 46.19 44.87 3f9h s LEU 87 CO 0.29 0.10 0.20 -0.13 -1.89 0.00 0.00 176.35 174.91 3f9h s ARG 88 N 0.79 2.95 -0.24 1.98 0.52 0.06 -2.35 118.95 122.65 3f9h s ARG 88 Ca 0.02 -0.99 -0.07 0.00 -0.52 0.00 0.00 55.73 54.17 3f9h s ARG 88 Cb -0.14 -3.70 -0.02 0.00 0.52 0.00 0.00 34.95 31.61 3f9h s ARG 88 CO 0.02 -0.64 0.05 -0.51 0.02 0.00 0.00 175.30 174.25 3f9h s LEU 89 N 1.57 3.35 -0.15 2.53 1.43 -0.79 -0.77 118.68 125.85 3f9h s LEU 89 Ca 0.03 -0.25 -0.24 0.00 -1.03 0.00 0.00 54.13 52.64 3f9h s LEU 89 Cb -0.19 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 3f9h s LEU 89 CO 0.07 -0.03 0.77 -0.75 0.23 0.00 0.00 176.35 176.63 3f9h s LYS 90 N 1.59 4.32 0.28 1.70 2.47 0.20 0.13 119.74 130.42 3f9h s LYS 90 Ca 0.06 0.93 0.10 0.00 -1.56 0.00 0.00 55.97 55.49 3f9h s LYS 90 Cb -0.15 -3.55 -0.04 0.00 -1.46 0.00 0.00 37.83 32.63 3f9h s LYS 90 CO 0.02 -0.22 -0.01 0.14 0.16 0.00 0.00 175.35 175.44 3f9h s VAL 91 N 1.79 3.32 -0.23 4.02 -7.23 -0.05 0.92 120.40 122.95 3f9h s VAL 91 Ca 0.37 -1.93 0.26 0.00 -1.81 0.00 0.00 61.98 58.87 3f9h s VAL 91 Cb -0.17 -2.82 0.34 0.00 0.56 0.00 0.00 36.38 34.29 3f9h s VAL 91 CO 0.14 -0.36 1.73 -2.24 -0.31 0.00 0.00 175.10 174.06 3f9h h ASP 92 N 1.88 0.00 -4.15 4.85 2.03 -0.82 -3.45 116.42 116.76 3f9h h ASP 92 Ca -0.44 0.00 -0.69 0.00 -0.73 0.00 0.00 57.03 55.17 3f9h h ASP 92 Cb 1.25 0.00 -0.26 0.00 -0.83 0.00 0.00 39.33 39.49 3f9h h ASP 92 CO 0.61 0.03 -0.81 -0.89 -1.03 0.00 0.00 179.24 177.15 3f9h s THR 93 N -3.37 2.74 0.10 1.15 2.01 -1.26 -5.06 115.64 111.95 3f9h s THR 93 Ca 0.05 -0.84 -0.15 0.00 0.31 0.00 0.00 61.69 61.06 3f9h s THR 93 Cb 0.07 -2.05 -0.07 0.00 0.01 0.00 0.00 72.50 70.47 3f9h s THR 93 CO 0.63 0.58 0.52 -0.55 -0.69 0.00 0.00 174.62 175.11 3f9h s SER 94 N -0.62 6.86 -0.43 3.53 0.15 -1.26 -4.51 113.70 117.42 3f9h s SER 94 Ca 0.09 1.07 -0.29 0.00 0.70 0.00 0.00 55.95 57.53 3f9h s SER 94 Cb -0.11 -2.29 0.01 0.00 -1.71 0.00 0.00 66.02 61.93 3f9h s SER 94 CO 0.00 0.18 1.38 0.21 1.20 0.00 0.00 173.24 176.22 3f9h s ASN 95 N -1.48 6.36 0.18 5.45 3.84 0.83 -4.89 114.94 125.22 3f9h s ASN 95 Ca 0.33 0.76 0.23 0.00 0.21 0.00 0.00 52.86 54.40 3f9h s ASN 95 Cb -0.16 -2.54 0.90 0.00 -0.55 0.00 0.00 41.25 38.90 3f9h s ASN 95 CO 0.18 -1.42 1.71 -0.81 -2.79 0.00 0.00 177.10 173.97 3f9h n PRO 96 N 8.07 0.16 -0.20 0.43 -0.04 -1.26 -2.58 135.00 139.59 3f9h n PRO 96 Ca 0.16 0.30 0.10 0.00 -0.04 0.00 0.00 63.50 64.02 3f9h n PRO 96 Cb 0.48 -1.76 0.27 0.00 -0.04 0.00 0.00 33.50 32.45 3f9h n PRO 96 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3f9h n LYS 97 N -2.05 2.20 -1.65 0.54 5.02 -1.26 -4.96 118.16 116.00 3f9h n LYS 97 Ca 0.04 -1.84 -0.43 0.00 -2.02 0.00 0.00 58.31 54.06 3f9h n LYS 97 Cb 0.28 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 33.82 3f9h n LYS 97 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3f9h n THR 98 N 1.02 0.69 -1.89 -0.18 -1.04 -1.06 -4.86 114.28 106.95 3f9h n THR 98 Ca 0.18 -0.19 -0.29 0.00 -2.04 0.00 0.00 64.05 61.71 3f9h n THR 98 Cb 0.47 -2.33 0.08 0.00 -1.82 0.00 0.00 70.33 66.74 3f9h n THR 98 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3f9h s PRO 99 N 4.78 2.08 -0.21 -2.82 0.04 -1.26 -4.97 135.00 132.63 3f9h s PRO 99 Ca 0.91 0.17 -0.29 0.00 0.04 0.00 0.00 61.00 61.83 3f9h s PRO 99 Cb -0.44 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 3f9h s PRO 99 CO 0.42 -1.53 1.88 0.21 0.04 0.00 0.00 177.00 178.01 3f9h s LYS 100 N -5.54 3.54 0.33 4.56 2.20 -1.26 -4.93 119.74 118.65 3f9h s LYS 100 Ca 0.61 1.84 0.07 0.00 -0.36 0.00 0.00 55.97 58.13 3f9h s LYS 100 Cb -0.11 -4.19 -0.07 0.00 -1.51 0.00 0.00 37.83 31.96 3f9h s LYS 100 CO 0.50 -1.61 -0.04 1.52 -0.36 0.00 0.00 175.35 175.35 3f9h s TYR 101 N 6.38 2.21 0.00 4.03 -0.85 -1.26 -1.02 117.35 126.84 3f9h s TYR 101 Ca 0.84 -0.67 -0.14 0.00 -0.52 0.00 0.00 57.07 56.58 3f9h s TYR 101 Cb -0.29 -1.35 0.02 0.00 0.38 0.00 0.00 41.96 40.72 3f9h s TYR 101 CO 0.34 0.37 0.30 0.15 -1.52 0.00 0.00 175.55 175.19 3f9h s LYS 102 N -3.71 0.70 -0.18 -3.49 1.02 -0.50 -4.92 119.74 108.66 3f9h s LYS 102 Ca 0.32 -0.29 -0.06 0.00 0.02 0.00 0.00 55.97 55.96 3f9h s LYS 102 Cb 0.05 0.30 -0.03 0.00 -0.52 0.00 0.00 37.83 37.63 3f9h s LYS 102 CO 0.15 -0.20 0.02 -0.06 -0.92 0.00 0.00 175.35 174.34 3f9h s PHE 103 N -1.68 3.14 0.11 3.18 2.99 -1.26 -1.81 117.98 122.65 3f9h s PHE 103 Ca -0.11 -0.14 0.04 0.00 0.00 0.00 0.00 56.93 56.71 3f9h s PHE 103 Cb -0.04 -2.04 -0.04 0.00 0.00 0.00 0.00 43.02 40.90 3f9h s PHE 103 CO 0.02 0.02 -0.10 0.14 -0.00 0.00 0.00 175.22 175.30 3f9h s VAL 104 N 0.50 0.96 -0.35 -0.44 -7.23 -0.86 -4.98 120.40 108.00 3f9h s VAL 104 Ca 0.00 -1.78 -0.01 0.00 -1.81 0.00 0.00 61.98 58.38 3f9h s VAL 104 Cb -0.13 -1.52 0.08 0.00 0.56 0.00 0.00 36.38 35.36 3f9h s VAL 104 CO 0.02 -0.65 0.08 -0.60 -0.31 0.00 0.00 175.10 173.64 3f9h s ARG 105 N -3.17 2.13 0.77 4.82 3.52 -1.26 -4.25 118.95 121.52 3f9h s ARG 105 Ca 0.09 -1.56 -0.11 0.00 -0.13 0.00 0.00 55.73 54.02 3f9h s ARG 105 Cb -0.00 -3.33 0.06 0.00 -1.56 0.00 0.00 34.95 30.11 3f9h s ARG 105 CO -0.01 -0.84 1.09 0.96 -0.81 0.00 0.00 175.30 175.69 3f9h s ILE 106 N 1.16 3.37 0.19 4.11 -4.36 -1.26 -5.05 121.20 119.35 3f9h s ILE 106 Ca 0.02 0.44 -0.10 0.00 -0.26 0.00 0.00 60.65 60.75 3f9h s ILE 106 Cb -0.21 -2.98 -0.07 0.00 1.25 0.00 0.00 42.46 40.45 3f9h s ILE 106 CO -0.03 -0.58 0.52 -1.10 0.24 0.00 0.00 174.94 173.98 3f9h s GLN 107 N -4.94 3.81 0.11 0.37 -1.52 -1.26 -5.02 119.66 111.21 3f9h s GLN 107 Ca 0.61 0.26 -0.34 0.00 -1.95 0.00 0.00 55.36 53.94 3f9h s GLN 107 Cb -0.17 -2.75 -0.14 0.00 -0.22 0.00 0.00 33.01 29.73 3f9h s GLN 107 CO 0.56 0.38 1.58 -0.35 -0.25 0.00 0.00 175.29 177.21 3f9h n PRO 108 N 0.15 1.97 0.00 2.91 -0.04 -1.26 -1.20 135.00 137.53 3f9h n PRO 108 Ca -0.02 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.16 3f9h n PRO 108 Cb 0.52 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 3f9h n PRO 108 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3f9h n GLY 109 N 3.39 1.75 3.87 0.55 0.00 0.24 -4.91 105.19 110.09 3f9h n GLY 109 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 3f9h n GLY 109 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3f9h s GLN 110 N -0.81 3.81 0.25 1.61 -0.21 -0.34 -4.79 119.66 119.18 3f9h s GLN 110 Ca 0.00 0.47 0.09 0.00 0.02 0.00 0.00 55.36 55.94 3f9h s GLN 110 Cb 0.00 -2.42 -0.04 0.00 1.00 0.00 0.00 33.01 31.55 3f9h s GLN 110 CO 0.00 0.03 0.01 0.95 -2.12 0.00 0.00 175.29 174.16 3f9h s THR 111 N -2.26 3.58 0.22 -0.19 -4.23 -1.26 -0.76 115.64 110.74 3f9h s THR 111 Ca 0.51 -1.78 -0.22 0.00 -1.18 0.00 0.00 61.69 59.02 3f9h s THR 111 Cb -0.10 -2.89 0.05 0.00 1.34 0.00 0.00 72.50 70.89 3f9h s THR 111 CO 0.28 -0.33 0.88 0.72 -0.54 0.00 0.00 174.62 175.64 3f9h s PHE 112 N -2.20 -0.09 -0.07 3.99 -0.12 0.05 -4.90 117.98 114.64 3f9h s PHE 112 Ca 0.31 -0.32 -0.04 0.00 -0.05 0.00 0.00 56.93 56.82 3f9h s PHE 112 Cb -0.07 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 42.98 3f9h s PHE 112 CO 0.20 -1.06 0.11 -1.12 -0.05 0.00 0.00 175.22 173.30 3f9h s SER 113 N -3.01 6.04 -0.16 1.98 0.01 -0.23 -0.93 113.70 117.40 3f9h s SER 113 Ca 0.14 0.33 0.01 0.00 1.31 0.00 0.00 55.95 57.73 3f9h s SER 113 Cb -0.03 -1.87 0.01 0.00 0.21 0.00 0.00 66.02 64.34 3f9h s SER 113 CO 0.05 0.35 -0.17 -0.69 0.41 0.00 0.00 173.24 173.19 3f9h s VAL 114 N -1.09 2.39 -0.87 3.43 1.01 0.35 -0.41 120.40 125.22 3f9h s VAL 114 Ca 0.18 -0.85 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 3f9h s VAL 114 Cb -0.12 -2.00 0.17 0.00 0.00 0.00 0.00 36.38 34.42 3f9h s VAL 114 CO 0.08 0.52 0.95 -0.22 0.00 0.00 0.00 175.10 176.44 3f9h s LEU 115 N 1.02 5.78 0.06 3.92 2.96 -0.92 -1.83 118.68 129.66 3f9h s LEU 115 Ca -0.02 -2.28 -0.30 0.00 -0.22 0.00 0.00 54.13 51.31 3f9h s LEU 115 Cb -0.15 -2.32 -0.09 0.00 0.50 0.00 0.00 46.19 44.14 3f9h s LEU 115 CO -0.05 -0.86 1.83 0.00 -1.32 0.00 0.00 176.35 175.95 3f9h s ALA 116 N 1.64 3.67 -0.11 5.97 0.00 -0.12 -4.02 121.76 128.78 3f9h s ALA 116 Ca 0.25 1.31 0.03 0.00 0.00 0.00 0.00 51.96 53.56 3f9h s ALA 116 Cb -0.08 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.26 3f9h s ALA 116 CO -0.08 -1.35 -0.22 0.00 0.00 0.00 0.00 175.76 174.10 3f9h s TYR 118 N 0.55 3.19 -1.31 0.00 5.04 0.35 -4.56 117.35 120.60 3f9h s TYR 118 Ca -0.14 -0.89 -0.11 0.00 -2.44 0.00 0.00 57.07 53.49 3f9h s TYR 118 Cb -0.17 -3.35 0.00 0.00 0.35 0.00 0.00 41.96 38.79 3f9h s TYR 118 CO 0.05 -0.89 0.53 0.09 -1.34 0.00 0.00 175.55 173.98 3f9h n ASN 119 N 5.46 -2.16 0.00 4.32 5.03 -1.26 -1.59 115.26 125.06 3f9h n ASN 119 Ca -0.11 -1.07 0.00 0.00 0.87 0.00 0.00 54.58 54.27 3f9h n ASN 119 Cb 0.44 -2.86 0.00 0.00 -1.02 0.00 0.00 39.78 36.34 3f9h n ASN 119 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3f9h n GLY 120 N -1.96 2.51 3.71 7.41 0.00 -1.26 -4.72 105.19 110.88 3f9h n GLY 120 Ca -0.22 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 3f9h n GLY 120 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3f9h s SER 121 N 0.33 6.94 0.48 1.61 0.15 -0.62 -4.11 113.70 118.47 3f9h s SER 121 Ca 0.00 1.13 -0.23 0.00 0.70 0.00 0.00 55.95 57.55 3f9h s SER 121 Cb 0.00 -2.40 -0.07 0.00 -1.71 0.00 0.00 66.02 61.84 3f9h s SER 121 CO 0.00 -0.14 1.25 -2.84 1.20 0.00 0.00 173.24 172.71 3f9h s PRO 122 N 0.97 3.60 0.00 5.44 0.02 -1.26 0.13 135.00 143.90 3f9h s PRO 122 Ca 0.36 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.37 3f9h s PRO 122 Cb -0.17 -2.43 0.00 0.00 0.02 0.00 0.00 34.50 31.92 3f9h s PRO 122 CO 0.16 -0.74 0.00 0.45 -0.33 0.00 0.00 177.00 176.54 3f9h n SER 123 N -0.54 3.46 -3.59 2.53 2.88 -0.34 -4.74 113.62 113.29 3f9h n SER 123 Ca 0.08 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.57 3f9h n SER 123 Cb 0.46 0.10 -0.02 0.00 -0.75 0.00 0.00 64.21 64.00 3f9h n SER 123 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3f9h s GLY 124 N -3.52 -0.32 -0.06 0.46 0.00 -1.11 -5.04 107.32 97.73 3f9h s GLY 124 Ca 0.00 1.45 0.06 0.00 0.00 0.00 0.00 44.72 46.22 3f9h s GLY 124 CO 0.00 0.47 -0.24 0.54 0.00 0.00 0.00 173.10 173.88 3f9h s VAL 125 N -2.50 1.95 0.17 1.40 0.11 -1.26 -0.95 120.40 119.32 3f9h s VAL 125 Ca 0.09 -1.00 0.02 0.00 -2.93 0.00 0.00 61.98 58.16 3f9h s VAL 125 Cb -0.01 -1.65 -0.05 0.00 -1.53 0.00 0.00 36.38 33.14 3f9h s VAL 125 CO -0.05 0.54 0.01 -0.72 -3.33 0.00 0.00 175.10 171.55 3f9h s TYR 126 N -0.07 1.19 -0.07 1.54 -0.85 -0.76 -4.93 117.35 113.41 3f9h s TYR 126 Ca -0.05 -1.04 0.00 0.00 -0.52 0.00 0.00 57.07 55.46 3f9h s TYR 126 Cb -0.14 -0.68 -0.03 0.00 0.38 0.00 0.00 41.96 41.49 3f9h s TYR 126 CO 0.04 -0.24 -0.05 -1.14 -1.52 0.00 0.00 175.55 172.64 3f9h s GLN 127 N -3.93 2.79 0.36 -3.49 2.00 -1.26 -0.50 119.66 115.64 3f9h s GLN 127 Ca 0.24 -0.52 -0.07 0.00 -2.00 0.00 0.00 55.36 53.01 3f9h s GLN 127 Cb 0.06 -2.64 0.02 0.00 0.80 0.00 0.00 33.01 31.26 3f9h s GLN 127 CO 0.04 0.67 0.59 0.00 -0.50 0.00 0.00 175.29 176.09 3f9h s ALA 129 N -2.76 1.57 -0.52 0.00 0.00 -1.26 -0.77 121.76 118.02 3f9h s ALA 129 Ca 0.25 -1.02 -0.27 0.00 0.00 0.00 0.00 51.96 50.92 3f9h s ALA 129 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 3f9h s ALA 129 CO 0.18 0.33 1.68 1.41 0.00 0.00 0.00 175.76 179.36 3f9h s MET 130 N -1.32 3.06 0.75 0.00 1.75 0.06 -4.78 119.30 118.82 3f9h s MET 130 Ca 0.05 0.78 -0.15 0.00 -1.25 0.00 0.00 55.69 55.12 3f9h s MET 130 Cb -0.09 -4.24 0.05 0.00 2.84 0.00 0.00 34.83 33.39 3f9h s MET 130 CO 0.02 -2.21 1.22 1.03 -0.65 0.00 0.00 175.02 174.42 3f9h s ARG 131 N 6.12 1.96 0.50 4.11 1.81 -0.98 0.80 118.95 133.27 3f9h s ARG 131 Ca 0.65 1.79 0.25 0.00 -1.72 0.00 0.00 55.73 56.70 3f9h s ARG 131 Cb -0.14 -1.81 1.33 0.00 -0.45 0.00 0.00 34.95 33.87 3f9h s ARG 131 CO 0.26 -1.98 1.93 -1.00 -0.68 0.00 0.00 175.30 173.83 3f9h h PRO 132 N -0.47 0.12 -0.59 3.54 0.13 -1.90 0.77 132.00 133.61 3f9h h PRO 132 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3f9h h PRO 132 Cb 1.30 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3f9h h PRO 132 CO 0.49 0.08 0.00 0.27 -0.23 0.00 0.00 178.00 178.61 3f9h n ASN 133 N -4.38 1.46 -1.42 1.44 6.94 -1.26 -4.89 115.26 113.15 3f9h n ASN 133 Ca 0.15 -2.11 -0.14 0.00 -0.02 0.00 0.00 54.58 52.46 3f9h n ASN 133 Cb 0.73 -0.35 -0.03 0.00 -2.36 0.00 0.00 39.78 37.78 3f9h n ASN 133 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 3f9h n HIS 134 N 0.05 -0.43 -4.52 -2.53 8.25 0.26 -4.58 115.22 111.72 3f9h n HIS 134 Ca 0.05 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.26 3f9h n HIS 134 Cb 0.31 -2.83 -0.10 0.00 1.12 0.00 0.00 29.99 28.48 3f9h n HIS 134 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3f9h s THR 135 N -2.64 2.17 -0.10 1.59 -4.23 -1.25 -4.66 115.64 106.52 3f9h s THR 135 Ca 0.00 -2.21 0.04 0.00 -1.18 0.00 0.00 61.69 58.34 3f9h s THR 135 Cb 0.00 -2.59 -0.00 0.00 1.34 0.00 0.00 72.50 71.25 3f9h s THR 135 CO 0.00 -0.23 -0.23 -0.63 -0.54 0.00 0.00 174.62 172.98 3f9h s ILE 136 N -2.66 2.15 0.46 2.99 -1.09 -0.30 -2.32 121.20 120.42 3f9h s ILE 136 Ca 0.32 -0.99 -0.22 0.00 -2.23 0.00 0.00 60.65 57.52 3f9h s ILE 136 Cb 0.02 -1.82 -0.08 0.00 -1.58 0.00 0.00 42.46 39.00 3f9h s ILE 136 CO 0.16 0.56 1.12 -0.54 -1.23 0.00 0.00 174.94 175.01 3f9h s LYS 137 N 0.29 3.80 0.00 2.79 1.02 -1.26 0.44 119.74 126.82 3f9h s LYS 137 Ca -0.17 1.66 0.00 0.00 0.02 0.00 0.00 55.97 57.48 3f9h s LYS 137 Cb -0.17 -2.36 0.00 0.00 -0.52 0.00 0.00 37.83 34.78 3f9h s LYS 137 CO 0.08 -0.49 0.00 0.41 -0.92 0.00 0.00 175.35 174.44 3f9h n GLY 138 N 0.32 0.44 0.00 -3.33 0.00 -0.17 -4.82 105.19 97.63 3f9h n GLY 138 Ca 0.07 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3f9h n GLY 138 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3f9h n SER 139 N -0.00 0.00 -0.21 1.61 3.41 -1.26 -4.50 113.62 112.67 3f9h n SER 139 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.60 3f9h n SER 139 Cb 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.05 3f9h n SER 139 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f9h h ALA 140 N 1.20 0.84 0.00 7.33 0.00 -1.98 -3.31 119.26 123.34 3f9h h ALA 140 Ca 0.00 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3f9h h ALA 140 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3f9h h ALA 140 CO 0.00 -0.04 -1.63 -0.11 0.00 0.00 0.00 179.25 177.47 3f9h n LEU 141 N -4.86 0.00 -0.35 0.00 7.94 -1.26 -4.71 117.00 113.77 3f9h n LEU 141 Ca 0.08 0.00 0.29 0.00 -1.11 0.00 0.00 56.01 55.27 3f9h n LEU 141 Cb 0.20 0.13 0.54 0.00 0.53 0.00 0.00 43.42 44.82 3f9h n LEU 141 CO 0.27 0.13 1.12 0.78 -1.11 0.00 0.00 177.39 178.58 3f9h h ASN 142 N 0.00 0.41 -2.97 1.96 -0.26 -1.95 -3.17 115.58 109.60 3f9h h ASN 142 Ca -0.14 0.20 -0.57 0.00 -0.56 0.00 0.00 56.30 55.23 3f9h h ASN 142 Cb 1.07 0.18 -0.40 0.00 -1.06 0.00 0.00 38.32 38.11 3f9h h ASN 142 CO 0.01 -0.24 -0.78 -0.83 -1.06 0.00 0.00 177.43 174.52 3f9h s GLY 143 N -4.29 0.97 -0.33 2.83 0.00 -1.26 -4.56 107.32 100.68 3f9h s GLY 143 Ca -0.09 -1.73 -0.14 0.00 0.00 0.00 0.00 44.72 42.76 3f9h s GLY 143 CO 0.79 1.85 0.30 -0.45 0.00 0.00 0.00 173.10 175.59 3f9h s SER 144 N 1.38 6.13 -0.27 1.64 0.15 -1.20 -4.96 113.70 116.57 3f9h s SER 144 Ca 0.13 -0.22 -0.27 0.00 0.70 0.00 0.00 55.95 56.29 3f9h s SER 144 Cb -0.20 -2.17 -0.11 0.00 -1.71 0.00 0.00 66.02 61.83 3f9h s SER 144 CO -0.17 -0.26 0.90 0.00 1.20 0.00 0.00 173.24 174.91 3f9h n GLY 146 N 2.20 2.56 3.72 0.00 0.00 -0.98 -1.31 105.19 111.38 3f9h n GLY 146 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3f9h n GLY 146 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3f9h n SER 147 N 0.00 3.81 -4.69 1.61 7.64 0.14 -4.53 113.62 117.60 3f9h n SER 147 Ca 0.00 1.10 -0.27 0.00 1.01 0.00 0.00 58.87 60.71 3f9h n SER 147 Cb 0.00 -1.56 -0.07 0.00 -1.01 0.00 0.00 64.21 61.56 3f9h n SER 147 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3f9h s VAL 148 N 0.65 3.92 -0.04 0.44 -7.23 -1.26 -1.67 120.40 115.22 3f9h s VAL 148 Ca 0.71 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.61 3f9h s VAL 148 Cb -0.52 -2.96 -0.03 0.00 0.56 0.00 0.00 36.38 33.43 3f9h s VAL 148 CO 0.40 -0.06 -0.00 -0.83 -0.31 0.00 0.00 175.10 174.29 3f9h s GLY 149 N -2.85 1.85 0.07 2.32 0.00 -0.58 -2.17 107.32 105.96 3f9h s GLY 149 Ca 0.28 -0.89 -0.21 0.00 0.00 0.00 0.00 44.72 43.90 3f9h s GLY 149 CO 0.19 -0.71 0.51 -0.11 0.00 0.00 0.00 173.10 172.98 3f9h s PHE 150 N -0.98 -0.40 0.06 1.90 -0.12 0.45 -0.93 117.98 117.97 3f9h s PHE 150 Ca 0.16 0.36 0.10 0.00 -0.05 0.00 0.00 56.93 57.50 3f9h s PHE 150 Cb -0.11 0.34 -0.03 0.00 -0.63 0.00 0.00 43.02 42.59 3f9h s PHE 150 CO 0.06 -0.67 -0.26 -0.80 -0.05 0.00 0.00 175.22 173.50 3f9h s ASN 151 N -2.17 3.22 -0.27 1.98 0.01 -1.03 -1.06 114.94 115.62 3f9h s ASN 151 Ca -0.03 -0.62 0.01 0.00 -0.71 0.00 0.00 52.86 51.50 3f9h s ASN 151 Cb -0.00 -0.28 0.05 0.00 0.41 0.00 0.00 41.25 41.43 3f9h s ASN 151 CO -0.04 0.24 -0.07 -0.63 -1.51 0.00 0.00 177.10 175.08 3f9h s ILE 152 N -0.87 2.46 -0.47 0.60 1.01 -1.26 0.01 121.20 122.69 3f9h s ILE 152 Ca 0.12 -1.51 -0.14 0.00 0.00 0.00 0.00 60.65 59.12 3f9h s ILE 152 Cb -0.10 -2.42 0.08 0.00 0.01 0.00 0.00 42.46 40.03 3f9h s ILE 152 CO 0.03 -0.03 0.38 -0.62 0.00 0.00 0.00 174.94 174.70 3f9h s ASP 153 N 1.16 6.04 0.00 3.58 2.15 -0.30 -4.90 116.67 124.41 3f9h s ASP 153 Ca -0.07 -1.42 0.00 0.00 0.43 0.00 0.00 52.55 51.48 3f9h s ASP 153 Cb -0.20 -2.15 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 3f9h s ASP 153 CO -0.04 -0.65 0.00 -1.22 -0.17 0.00 0.00 175.17 173.09 3f9h n TYR 154 N 5.15 0.00 -1.02 -5.34 4.01 -1.26 -1.13 117.16 117.57 3f9h n TYR 154 Ca -0.12 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.66 3f9h n TYR 154 Cb 0.43 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.51 3f9h n TYR 154 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3f9h n ASP 155 N 2.64 1.35 -4.22 7.72 5.75 -1.26 -5.02 116.55 123.51 3f9h n ASP 155 Ca 0.00 -2.25 -0.36 0.00 -0.01 0.00 0.00 54.79 52.17 3f9h n ASP 155 Cb 0.00 -0.21 -0.13 0.00 -1.03 0.00 0.00 41.12 39.75 3f9h n ASP 155 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3f9h s VAL 157 N 1.33 4.86 -0.57 0.00 1.01 -0.19 -1.16 120.40 125.67 3f9h s VAL 157 Ca -0.03 1.60 -0.05 0.00 0.00 0.00 0.00 61.98 63.50 3f9h s VAL 157 Cb -0.19 -4.13 0.15 0.00 0.00 0.00 0.00 36.38 32.21 3f9h s VAL 157 CO -0.00 -0.02 0.41 -0.44 0.00 0.00 0.00 175.10 175.04 3f9h s SER 158 N 1.25 5.46 0.13 3.32 0.01 0.10 -1.41 113.70 122.56 3f9h s SER 158 Ca 0.36 -2.51 -0.31 0.00 1.31 0.00 0.00 55.95 54.80 3f9h s SER 158 Cb -0.16 -1.91 -0.09 0.00 0.21 0.00 0.00 66.02 64.08 3f9h s SER 158 CO 0.10 -0.48 1.48 -0.36 0.41 0.00 0.00 173.24 174.39 3f9h s PHE 159 N 0.44 3.09 0.00 2.43 0.08 -0.75 -2.45 117.98 120.82 3f9h s PHE 159 Ca 0.13 0.76 0.00 0.00 0.12 0.00 0.00 56.93 57.95 3f9h s PHE 159 Cb -0.21 -3.80 0.00 0.00 -0.57 0.00 0.00 43.02 38.44 3f9h s PHE 159 CO -0.04 -2.93 0.00 0.00 -0.10 0.00 0.00 175.22 172.15 3f9h s TYR 161 N -0.86 0.33 -0.16 0.00 5.04 -1.03 -4.30 117.35 116.37 3f9h s TYR 161 Ca 0.00 -0.71 -0.07 0.00 -2.44 0.00 0.00 57.07 53.85 3f9h s TYR 161 Cb 0.00 -0.24 0.07 0.00 0.35 0.00 0.00 41.96 42.13 3f9h s TYR 161 CO 0.00 -0.31 0.35 1.41 -1.34 0.00 0.00 175.55 175.66 3f9h s MET 162 N -2.70 0.29 0.18 4.97 -2.45 0.12 -1.53 119.30 118.18 3f9h s MET 162 Ca -0.04 0.82 -0.31 0.00 -1.25 0.00 0.00 55.69 54.90 3f9h s MET 162 Cb -0.01 0.07 -0.10 0.00 1.25 0.00 0.00 34.83 36.04 3f9h s MET 162 CO -0.05 -0.22 1.55 -1.58 1.05 0.00 0.00 175.02 175.77 3f9h s HIS 163 N 1.98 3.05 0.08 4.11 2.46 -0.67 -1.43 115.29 124.87 3f9h s HIS 163 Ca -0.05 0.70 0.00 0.00 0.47 0.00 0.00 55.06 56.18 3f9h s HIS 163 Cb -0.11 -3.91 0.00 0.00 -0.13 0.00 0.00 32.58 28.43 3f9h s HIS 163 CO -0.11 -3.30 0.00 0.72 -2.47 0.00 0.00 174.74 169.58 3f9h n HIS 164 N 3.65 -0.33 -4.52 3.88 8.25 -0.98 -2.33 115.22 122.84 3f9h n HIS 164 Ca 0.12 0.06 -0.28 0.00 -0.26 0.00 0.00 57.72 57.37 3f9h n HIS 164 Cb 0.39 0.13 -0.13 0.00 1.12 0.00 0.00 29.99 31.49 3f9h n HIS 164 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3f9h s MET 165 N -2.00 1.43 -0.28 -0.41 -1.94 0.61 -4.81 119.30 111.90 3f9h s MET 165 Ca 0.00 -1.19 -0.07 0.00 -1.71 0.00 0.00 55.69 52.71 3f9h s MET 165 Cb 0.00 -1.75 -0.01 0.00 2.01 0.00 0.00 34.83 35.08 3f9h s MET 165 CO 0.00 0.43 0.09 -2.00 -0.01 0.00 0.00 175.02 173.52 3f9h s GLU 166 N -1.71 3.35 0.81 2.03 2.12 -1.26 -0.82 118.70 123.23 3f9h s GLU 166 Ca 0.11 -0.68 -0.11 0.00 0.36 0.00 0.00 54.97 54.64 3f9h s GLU 166 Cb -0.10 -3.38 0.08 0.00 0.26 0.00 0.00 34.13 30.99 3f9h s GLU 166 CO 0.04 -0.34 1.09 -0.51 -0.54 0.00 0.00 175.26 175.00 3f9h s LEU 167 N 1.56 2.62 0.13 2.70 2.01 0.36 -4.94 118.68 123.12 3f9h s LEU 167 Ca 0.05 1.46 -0.08 0.00 0.01 0.00 0.00 54.13 55.57 3f9h s LEU 167 Cb -0.16 -4.07 0.15 0.00 0.01 0.00 0.00 46.19 42.12 3f9h s LEU 167 CO 0.03 -2.11 0.80 -2.65 1.01 0.00 0.00 176.35 173.44 3f9h n PRO 168 N -3.54 -0.10 -3.16 1.29 -0.01 -1.26 -3.32 135.00 124.89 3f9h n PRO 168 Ca 0.07 0.80 -0.29 0.00 -0.01 0.00 0.00 63.50 64.08 3f9h n PRO 168 Cb 0.55 -1.19 -0.05 0.00 -0.01 0.00 0.00 33.50 32.80 3f9h n PRO 168 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 175.50 175.74 3f9h n THR 169 N -4.78 3.02 -2.85 3.45 -2.24 -1.26 -4.86 114.28 104.75 3f9h n THR 169 Ca 0.06 -5.46 -0.19 0.00 -2.27 0.00 0.00 64.05 56.20 3f9h n THR 169 Cb 0.22 -1.79 0.00 0.00 -2.10 0.00 0.00 70.33 66.67 3f9h n THR 169 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f9h n GLY 170 N 0.38 -0.50 3.60 3.38 0.00 -1.21 -4.94 105.19 105.90 3f9h n GLY 170 Ca 0.31 0.06 -0.34 0.00 0.00 0.00 0.00 46.02 46.04 3f9h n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f9h s VAL 171 N -2.89 4.17 -0.13 1.61 1.01 -1.25 -1.00 120.40 121.93 3f9h s VAL 171 Ca 0.19 -0.28 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 3f9h s VAL 171 Cb -0.10 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 3f9h s VAL 171 CO 0.24 0.55 -0.07 -1.00 0.00 0.00 0.00 175.10 174.82 3f9h s HIS 172 N -0.30 2.95 -0.06 5.22 3.76 0.17 0.14 115.29 127.17 3f9h s HIS 172 Ca 0.06 -0.30 0.04 0.00 -0.15 0.00 0.00 55.06 54.71 3f9h s HIS 172 Cb -0.12 -1.87 -0.02 0.00 1.11 0.00 0.00 32.58 31.68 3f9h s HIS 172 CO 0.02 0.02 -0.18 0.00 -0.85 0.00 0.00 174.74 173.75 3f9h s ALA 173 N 0.06 2.47 0.00 -1.40 0.00 0.00 -1.15 121.76 121.74 3f9h s ALA 173 Ca -0.02 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 50.95 3f9h s ALA 173 Cb -0.14 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.09 3f9h s ALA 173 CO 0.03 0.45 0.00 0.41 0.00 0.00 0.00 175.76 176.66 3f9h n GLY 174 N 2.74 3.81 3.24 0.00 0.00 -1.26 -0.28 105.19 113.43 3f9h n GLY 174 Ca -0.17 -1.32 -0.14 0.00 0.00 0.00 0.00 46.02 44.39 3f9h n GLY 174 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3f9h s THR 175 N -2.06 0.92 0.56 2.61 -1.32 -0.51 -1.34 115.64 114.49 3f9h s THR 175 Ca 0.00 -2.01 -0.09 0.00 -1.21 0.00 0.00 61.69 58.38 3f9h s THR 175 Cb 0.00 -1.96 0.13 0.00 -1.51 0.00 0.00 72.50 69.16 3f9h s THR 175 CO 0.00 -0.64 0.71 -0.90 -2.21 0.00 0.00 174.62 171.58 3f9h n ASP 176 N -0.21 -0.20 -1.16 8.08 5.68 -0.43 -0.70 116.55 127.61 3f9h n ASP 176 Ca -0.09 -1.20 -0.01 0.00 -0.50 0.00 0.00 54.79 52.99 3f9h n ASP 176 Cb 0.62 -0.56 0.12 0.00 -1.14 0.00 0.00 41.12 40.16 3f9h n ASP 176 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3f9h n LEU 177 N 0.00 3.28 -0.05 -2.12 7.99 -1.26 -2.62 117.00 122.23 3f9h n LEU 177 Ca 0.09 -1.68 0.01 0.00 -0.01 0.00 0.00 56.01 54.42 3f9h n LEU 177 Cb 0.32 -0.59 0.00 0.00 -0.11 0.00 0.00 43.42 43.04 3f9h n LEU 177 CO 0.23 0.49 0.18 -0.62 -1.51 0.00 0.00 177.39 176.16 3f9h n GLU 178 N 0.12 1.71 -0.36 3.23 1.02 -1.26 -5.00 120.64 120.10 3f9h n GLU 178 Ca 0.14 -0.40 0.00 0.00 -0.02 0.00 0.00 57.16 56.88 3f9h n GLU 178 Cb 0.71 -0.88 0.00 0.00 -0.02 0.00 0.00 31.44 31.25 3f9h n GLU 178 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3f9h n GLY 179 N 0.42 1.06 3.67 0.62 0.00 -1.08 -4.32 105.19 105.57 3f9h n GLY 179 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3f9h n GLY 179 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3f9h s LYS 180 N -0.45 4.31 1.12 1.61 2.47 -1.26 -2.26 119.74 125.28 3f9h s LYS 180 Ca 0.00 1.48 -0.12 0.00 -1.56 0.00 0.00 55.97 55.77 3f9h s LYS 180 Cb 0.00 -3.62 0.25 0.00 -1.46 0.00 0.00 37.83 33.00 3f9h s LYS 180 CO 0.00 -0.53 1.00 1.19 0.16 0.00 0.00 175.35 177.17 3f9h n PHE 181 N 5.84 -0.83 -3.68 4.03 3.01 -1.26 -1.32 117.46 123.25 3f9h n PHE 181 Ca 0.11 -0.03 -0.38 0.00 1.01 0.00 0.00 57.45 58.17 3f9h n PHE 181 Cb 0.47 -1.76 -0.12 0.00 -0.01 0.00 0.00 39.48 38.06 3f9h n PHE 181 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 3f9h s TYR 182 N -2.45 3.17 0.00 1.38 2.02 -0.45 -4.71 117.35 116.32 3f9h s TYR 182 Ca 0.68 -0.64 0.00 0.00 -0.37 0.00 0.00 57.07 56.73 3f9h s TYR 182 Cb -0.24 -2.33 0.00 0.00 -0.40 0.00 0.00 41.96 38.98 3f9h s TYR 182 CO 0.64 -0.48 0.00 0.41 -1.57 0.00 0.00 175.55 174.55 3f9h n GLY 183 N 4.96 -0.42 2.65 0.71 0.00 -1.26 -4.37 105.19 107.46 3f9h n GLY 183 Ca -0.14 -1.08 -0.37 0.00 0.00 0.00 0.00 46.02 44.43 3f9h n GLY 183 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3f9h n PRO 184 N 0.00 3.84 -4.25 1.61 -0.04 -1.26 -4.96 135.00 129.94 3f9h n PRO 184 Ca 0.00 -3.57 -0.23 0.00 -0.04 0.00 0.00 63.50 59.66 3f9h n PRO 184 Cb 0.00 -2.38 -0.07 0.00 -0.04 0.00 0.00 33.50 31.01 3f9h n PRO 184 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3f9h s PHE 185 N -2.98 2.69 0.05 0.54 0.08 -1.26 -5.03 117.98 112.07 3f9h s PHE 185 Ca 0.50 -0.27 0.01 0.00 0.12 0.00 0.00 56.93 57.30 3f9h s PHE 185 Cb 0.30 -1.31 -0.03 0.00 -0.57 0.00 0.00 43.02 41.41 3f9h s PHE 185 CO -0.22 0.55 -0.06 0.14 -0.10 0.00 0.00 175.22 175.53 3f9h s VAL 186 N -2.36 0.45 -1.24 -0.44 -7.23 -1.26 -4.88 120.40 103.44 3f9h s VAL 186 Ca 0.33 -1.34 -0.10 0.00 -1.81 0.00 0.00 61.98 59.06 3f9h s VAL 186 Cb -0.05 -0.91 0.18 0.00 0.56 0.00 0.00 36.38 36.16 3f9h s VAL 186 CO 0.21 -0.60 1.71 -0.90 -0.31 0.00 0.00 175.10 175.20 3f9h n ASP 187 N 0.96 5.23 -3.64 4.85 5.75 -1.26 -4.89 116.55 123.56 3f9h n ASP 187 Ca -0.19 -3.09 -0.08 0.00 -0.01 0.00 0.00 54.79 51.42 3f9h n ASP 187 Cb 0.57 -1.49 -0.07 0.00 -1.03 0.00 0.00 41.12 39.10 3f9h n ASP 187 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3f9h s ARG 188 N 0.47 0.64 -1.14 0.11 1.70 -1.26 -4.93 118.95 114.55 3f9h s ARG 188 Ca 0.40 0.98 -0.23 0.00 -0.47 0.00 0.00 55.73 56.41 3f9h s ARG 188 Cb 0.05 0.20 -0.06 0.00 -0.57 0.00 0.00 34.95 34.58 3f9h s ARG 188 CO 0.01 -0.11 1.90 -1.14 -1.08 0.00 0.00 175.30 174.87 3f9h s GLN 189 N 1.11 2.71 0.00 3.89 2.00 -0.78 -4.84 119.66 123.75 3f9h s GLN 189 Ca -0.06 -1.08 0.00 0.00 -2.00 0.00 0.00 55.36 52.22 3f9h s GLN 189 Cb -0.05 -5.25 0.00 0.00 0.80 0.00 0.00 33.01 28.52 3f9h s GLN 189 CO -0.12 -3.61 0.00 0.25 -0.50 0.00 0.00 175.29 171.31 3f9h n THR 190 N 7.63 0.00 -2.44 -0.34 -2.24 -1.26 -4.60 114.28 111.02 3f9h n THR 190 Ca 0.44 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.80 3f9h n THR 190 Cb 0.47 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.67 3f9h n THR 190 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f9h s ALA 191 N -2.00 2.89 -0.10 6.98 0.00 -1.26 -5.00 121.76 123.27 3f9h s ALA 191 Ca 0.00 -0.64 0.04 0.00 0.00 0.00 0.00 51.96 51.36 3f9h s ALA 191 Cb 0.00 -4.06 0.00 0.00 0.00 0.00 0.00 23.12 19.06 3f9h s ALA 191 CO 0.00 -2.78 -0.22 -0.65 0.00 0.00 0.00 175.76 172.11 3f9h s GLN 192 N 5.28 2.83 -0.01 0.00 -0.21 -1.26 -5.13 119.66 121.16 3f9h s GLN 192 Ca 0.51 -0.80 0.02 0.00 0.02 0.00 0.00 55.36 55.11 3f9h s GLN 192 Cb -0.10 -2.16 -0.03 0.00 1.00 0.00 0.00 33.01 31.71 3f9h s GLN 192 CO 0.26 0.15 -0.05 0.00 -2.12 0.00 0.00 175.29 173.53 3f9h s ALA 193 N 0.42 3.09 0.37 6.09 0.00 -1.26 -4.57 121.76 125.91 3f9h s ALA 193 Ca -0.18 -0.97 -0.19 0.00 0.00 0.00 0.00 51.96 50.61 3f9h s ALA 193 Cb -0.18 -1.21 -0.10 0.00 0.00 0.00 0.00 23.12 21.63 3f9h s ALA 193 CO 0.08 0.62 0.87 0.00 0.00 0.00 0.00 175.76 177.32 3f9h s ALA 194 N -0.99 3.17 1.07 0.00 0.00 -1.26 -5.08 121.76 118.67 3f9h s ALA 194 Ca 0.17 0.28 -0.17 0.00 0.00 0.00 0.00 51.96 52.24 3f9h s ALA 194 Cb -0.11 -3.01 0.23 0.00 0.00 0.00 0.00 23.12 20.23 3f9h s ALA 194 CO 0.07 0.21 1.19 0.41 0.00 0.00 0.00 175.76 177.64 3f9h n GLY 195 N -0.35 -1.87 3.56 0.00 0.00 -1.26 -4.94 105.19 100.34 3f9h n GLY 195 Ca 0.05 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 44.04 3f9h n GLY 195 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f9h s THR 196 N -3.48 3.29 -0.01 2.61 2.01 -1.26 -4.92 115.64 113.87 3f9h s THR 196 Ca 0.70 0.21 -0.30 0.00 0.31 0.00 0.00 61.69 62.61 3f9h s THR 196 Cb -0.03 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 3f9h s THR 196 CO 0.50 -0.58 1.03 -0.62 -0.69 0.00 0.00 174.62 174.26 3f9h s ASP 197 N 8.62 7.29 0.41 3.53 3.68 -1.26 -4.67 116.67 134.26 3f9h s ASP 197 Ca 0.78 1.71 0.07 0.00 2.13 0.00 0.00 52.55 57.23 3f9h s ASP 197 Cb -0.16 -2.57 -0.06 0.00 -1.45 0.00 0.00 42.92 38.67 3f9h s ASP 197 CO 0.25 -0.33 0.10 0.42 0.13 0.00 0.00 175.17 175.73 3f9h s THR 198 N 1.21 2.19 -0.17 1.71 -4.23 -1.26 -5.04 115.64 110.04 3f9h s THR 198 Ca 0.53 -1.84 -0.22 0.00 -1.18 0.00 0.00 61.69 58.97 3f9h s THR 198 Cb -0.22 -2.99 -0.02 0.00 1.34 0.00 0.00 72.50 70.61 3f9h s THR 198 CO 0.27 -0.01 0.69 -0.89 -0.54 0.00 0.00 174.62 174.13 3f9h s THR 199 N -2.64 4.99 -0.67 3.99 2.01 -1.04 -4.66 115.64 117.61 3f9h s THR 199 Ca 0.38 1.33 -0.26 0.00 0.31 0.00 0.00 61.69 63.45 3f9h s THR 199 Cb 0.06 -4.01 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 3f9h s THR 199 CO 0.20 0.11 1.78 -0.63 -0.69 0.00 0.00 174.62 175.39 3f9h s ILE 200 N 1.84 3.43 0.17 1.82 1.01 -1.26 -1.78 121.20 126.42 3f9h s ILE 200 Ca 0.32 0.14 -0.14 0.00 0.00 0.00 0.00 60.65 60.97 3f9h s ILE 200 Cb -0.16 -4.11 0.06 0.00 0.01 0.00 0.00 42.46 38.25 3f9h s ILE 200 CO 0.12 -1.07 1.77 0.74 0.00 0.00 0.00 174.94 176.50 3f9h h THR 201 N 6.81 0.93 -0.49 2.92 2.02 -1.93 -2.38 112.91 120.79 3f9h h THR 201 Ca -0.21 -0.14 0.10 0.00 0.77 0.00 0.00 66.41 66.93 3f9h h THR 201 Cb 1.12 0.49 -0.08 0.00 -1.74 0.00 0.00 68.15 67.94 3f9h h THR 201 CO 1.23 0.07 -0.03 0.25 0.37 0.00 0.00 175.52 177.42 3f9h h LEU 202 N 0.41 -0.27 -0.74 2.58 5.85 -1.89 -0.40 115.31 120.85 3f9h h LEU 202 Ca 0.20 0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.95 3f9h h LEU 202 Cb 0.14 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3f9h h LEU 202 CO -0.16 -0.09 -0.04 0.78 -0.34 0.00 0.00 178.44 178.58 3f9h h ASN 203 N 0.09 0.90 -0.35 1.25 2.35 -1.71 -2.27 115.58 115.84 3f9h h ASN 203 Ca 0.25 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 3f9h h ASN 203 Cb 0.37 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 3f9h h ASN 203 CO -0.43 0.99 0.18 0.58 -1.65 0.00 0.00 177.43 177.09 3f9h h VAL 204 N 0.84 1.15 -0.26 2.81 2.07 -0.84 -1.62 116.25 120.40 3f9h h VAL 204 Ca 0.15 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.30 3f9h h VAL 204 Cb 0.56 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 3f9h h VAL 204 CO 0.03 0.15 0.09 -0.07 0.02 0.00 0.00 177.57 177.80 3f9h h LEU 205 N 0.43 0.10 -0.98 2.57 3.38 -0.99 -0.94 115.31 118.87 3f9h h LEU 205 Ca 0.12 0.03 0.17 0.00 0.09 0.00 0.00 57.88 58.28 3f9h h LEU 205 Cb 0.08 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.74 3f9h h LEU 205 CO -0.02 0.09 0.59 0.00 0.09 0.00 0.00 178.44 179.19 3f9h h ALA 206 N 1.16 1.58 -0.08 1.53 0.00 -1.23 -0.89 119.26 121.34 3f9h h ALA 206 Ca 0.11 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3f9h h ALA 206 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3f9h h ALA 206 CO -0.12 0.01 -0.38 2.35 0.00 0.00 0.00 179.25 181.11 3f9h h TRP 207 N 0.80 0.18 -0.06 0.00 7.01 -0.23 0.22 115.95 123.86 3f9h h TRP 207 Ca 0.54 -0.04 -0.17 0.00 2.11 0.00 0.00 58.89 61.34 3f9h h TRP 207 Cb 0.77 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.78 3f9h h TRP 207 CO -0.02 0.52 -0.68 -0.07 -2.79 0.00 0.00 178.44 175.40 3f9h h LEU 208 N 0.13 0.33 -0.22 0.65 3.38 0.05 0.14 115.31 119.78 3f9h h LEU 208 Ca 0.01 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 3f9h h LEU 208 Cb 0.74 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 3f9h h LEU 208 CO 0.06 0.91 -0.20 1.88 0.09 0.00 0.00 178.44 181.18 3f9h h TYR 209 N 0.20 0.62 -0.74 1.13 0.05 -0.89 -1.24 116.97 116.10 3f9h h TYR 209 Ca -0.02 -0.18 0.12 0.00 0.05 0.00 0.00 58.73 58.70 3f9h h TYR 209 Cb 1.23 -0.13 -0.08 0.00 1.01 0.00 0.00 36.73 38.75 3f9h h TYR 209 CO 0.03 0.85 0.33 0.00 -1.05 0.00 0.00 178.16 178.32 3f9h h ALA 210 N 0.67 1.04 0.11 3.88 0.00 -0.48 -1.21 119.26 123.27 3f9h h ALA 210 Ca 0.04 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3f9h h ALA 210 Cb 0.74 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 3f9h h ALA 210 CO 0.05 -0.14 -0.30 0.00 0.00 0.00 0.00 179.25 178.87 3f9h h ALA 211 N 1.50 -0.50 -0.36 0.00 0.00 -0.55 -2.82 119.26 116.52 3f9h h ALA 211 Ca 0.39 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.33 3f9h h ALA 211 Cb 0.52 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 3f9h h ALA 211 CO -0.34 -0.84 -0.05 0.28 0.00 0.00 0.00 179.25 178.30 3f9h h VAL 212 N -0.51 0.68 -0.31 0.00 2.07 -0.27 -1.22 116.25 116.68 3f9h h VAL 212 Ca 0.03 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.60 3f9h h VAL 212 Cb 0.54 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3f9h h VAL 212 CO -0.18 0.01 0.21 0.40 0.02 0.00 0.00 177.57 178.03 3f9h h ILE 213 N 0.04 0.91 -0.30 4.57 2.04 -1.19 0.12 117.51 123.71 3f9h h ILE 213 Ca 0.18 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 3f9h h ILE 213 Cb 0.26 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3f9h h ILE 213 CO -0.34 0.02 0.01 0.59 0.00 0.00 0.00 178.15 178.44 3f9h n ASN 214 N -4.47 3.39 0.00 1.72 3.02 -0.49 -4.91 115.26 113.52 3f9h n ASN 214 Ca 0.04 -2.48 0.00 0.00 -0.03 0.00 0.00 54.58 52.11 3f9h n ASN 214 Cb 0.29 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 3f9h n ASN 214 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f9h n GLY 215 N 0.29 2.97 3.65 7.41 0.00 0.03 -5.02 105.19 114.52 3f9h n GLY 215 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3f9h n GLY 215 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3f9h s ASP 216 N 0.09 6.42 0.00 1.61 1.11 -1.06 -4.83 116.67 120.01 3f9h s ASP 216 Ca 0.00 2.28 0.00 0.00 0.18 0.00 0.00 52.55 55.01 3f9h s ASP 216 Cb 0.00 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.46 3f9h s ASP 216 CO 0.00 -1.13 0.01 0.54 1.18 0.00 0.00 175.17 175.77 3f9h n ARG 217 N 7.54 0.21 0.24 8.23 1.74 -1.26 -3.17 116.66 130.18 3f9h n ARG 217 Ca 0.20 -0.01 0.17 0.00 -0.77 0.00 0.00 57.85 57.44 3f9h n ARG 217 Cb 0.43 -0.17 0.86 0.00 -1.02 0.00 0.00 32.46 32.55 3f9h n ARG 217 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 3f9h h TRP 218 N 0.00 0.00 0.00 -1.55 5.08 -1.96 -1.90 115.95 115.62 3f9h h TRP 218 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3f9h h TRP 218 Cb 0.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.30 3f9h h TRP 218 CO 0.00 0.00 -0.22 1.97 -1.28 0.00 0.00 178.44 178.91 3f9h n PHE 219 N -3.79 0.47 -2.48 0.12 1.16 -1.26 -4.91 117.46 106.78 3f9h n PHE 219 Ca 0.00 0.14 -0.38 0.00 -1.87 0.00 0.00 57.45 55.34 3f9h n PHE 219 Cb 0.25 -0.66 -0.04 0.00 -1.61 0.00 0.00 39.48 37.42 3f9h n PHE 219 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3f9h s LEU 220 N -3.84 4.28 0.00 5.98 1.43 -0.72 -4.71 118.68 121.10 3f9h s LEU 220 Ca 0.10 2.17 0.03 0.00 -1.03 0.00 0.00 54.13 55.41 3f9h s LEU 220 Cb 0.15 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.38 3f9h s LEU 220 CO 0.62 -0.42 0.12 -0.46 0.23 0.00 0.00 176.35 176.45 3f9h n ASN 221 N 0.36 0.65 0.00 2.29 0.23 -1.26 -5.07 115.26 112.46 3f9h n ASN 221 Ca 0.03 -2.38 0.00 0.00 -0.53 0.00 0.00 54.58 51.70 3f9h n ASN 221 Cb 0.47 0.78 -0.11 0.00 -2.08 0.00 0.00 39.78 38.84 3f9h n ASN 221 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 3f9h n ARG 222 N -0.53 0.64 -1.71 -3.83 1.85 -1.26 -4.97 116.66 106.85 3f9h n ARG 222 Ca -0.01 0.10 -0.40 0.00 -1.00 0.00 0.00 57.85 56.55 3f9h n ARG 222 Cb 0.39 -1.70 0.03 0.00 -1.05 0.00 0.00 32.46 30.12 3f9h n ARG 222 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3f9h n PHE 223 N -2.75 2.09 -4.19 2.89 3.01 -1.26 -5.03 117.46 112.22 3f9h n PHE 223 Ca -0.13 0.46 -0.25 0.00 1.01 0.00 0.00 57.45 58.54 3f9h n PHE 223 Cb 0.85 -2.35 -0.17 0.00 -0.01 0.00 0.00 39.48 37.80 3f9h n PHE 223 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 3f9h s THR 224 N -1.27 0.99 0.28 4.37 -1.32 -1.26 -4.76 115.64 112.67 3f9h s THR 224 Ca 0.67 -0.33 0.06 0.00 -1.21 0.00 0.00 61.69 60.88 3f9h s THR 224 Cb -0.46 -0.97 -0.03 0.00 -1.51 0.00 0.00 72.50 69.53 3f9h s THR 224 CO 0.53 0.34 0.31 0.28 -2.21 0.00 0.00 174.62 173.88 3f9h s THR 225 N 1.22 4.44 0.45 5.08 -1.32 -1.25 -5.05 115.64 119.21 3f9h s THR 225 Ca -0.04 -1.20 -0.03 0.00 -1.21 0.00 0.00 61.69 59.21 3f9h s THR 225 Cb -0.14 -3.50 -0.02 0.00 -1.51 0.00 0.00 72.50 67.33 3f9h s THR 225 CO -0.03 -0.27 0.72 0.42 -2.21 0.00 0.00 174.62 173.25 3f9h s THR 226 N -2.13 4.67 0.21 5.08 -4.23 -1.26 -4.82 115.64 113.16 3f9h s THR 226 Ca 0.37 -0.11 -0.09 0.00 -1.18 0.00 0.00 61.69 60.69 3f9h s THR 226 Cb -0.08 -3.76 0.16 0.00 1.34 0.00 0.00 72.50 70.17 3f9h s THR 226 CO 0.28 -0.65 1.83 0.25 -0.54 0.00 0.00 174.62 175.78 3f9h h LEU 227 N 0.34 1.00 -0.59 4.79 5.85 -1.98 -2.52 115.31 122.20 3f9h h LEU 227 Ca -0.47 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.04 3f9h h LEU 227 Cb 1.22 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 3f9h h LEU 227 CO 0.61 0.82 -0.03 0.78 -0.34 0.00 0.00 178.44 180.28 3f9h h ASN 228 N 1.11 1.04 -0.89 1.25 2.35 -1.95 -2.64 115.58 115.86 3f9h h ASN 228 Ca 0.28 -0.32 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 3f9h h ASN 228 Cb 0.05 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.09 3f9h h ASN 228 CO -0.04 1.11 0.48 0.44 -1.65 0.00 0.00 177.43 177.77 3f9h h ASP 229 N 0.95 1.11 0.11 5.81 3.32 -1.93 -3.09 116.42 122.70 3f9h h ASP 229 Ca 0.16 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3f9h h ASP 229 Cb 0.59 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3f9h h ASP 229 CO 0.04 0.89 -0.05 0.15 -1.72 0.00 0.00 179.24 178.55 3f9h h PHE 230 N 1.24 -0.14 -0.67 4.55 3.57 -1.26 -3.09 116.94 121.15 3f9h h PHE 230 Ca 0.31 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.97 3f9h h PHE 230 Cb 0.03 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 3f9h h PHE 230 CO 0.01 0.15 0.46 -0.91 -2.23 0.00 0.00 178.31 175.80 3f9h h ASN 231 N -0.42 0.18 0.64 0.41 2.35 -1.47 0.45 115.58 117.72 3f9h h ASN 231 Ca -0.02 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3f9h h ASN 231 Cb 0.35 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 3f9h h ASN 231 CO 0.02 0.09 -0.36 -0.07 -1.65 0.00 0.00 177.43 175.47 3f9h h LEU 232 N 0.19 -0.89 -0.75 1.61 3.38 -1.46 -0.77 115.31 116.63 3f9h h LEU 232 Ca 0.33 0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 3f9h h LEU 232 Cb 1.01 0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 3f9h h LEU 232 CO -0.06 -0.58 -0.07 0.58 0.09 0.00 0.00 178.44 178.40 3f9h h VAL 233 N -0.93 1.26 0.06 1.22 2.07 -1.22 -2.53 116.25 116.17 3f9h h VAL 233 Ca -0.08 -1.16 0.02 0.00 0.82 0.00 0.00 66.70 66.30 3f9h h VAL 233 Cb 0.74 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 3f9h h VAL 233 CO 0.11 0.41 -0.24 0.00 0.02 0.00 0.00 177.57 177.86 3f9h h ALA 234 N 1.12 -0.36 0.00 1.67 0.00 -0.08 -2.30 119.26 119.30 3f9h h ALA 234 Ca 0.14 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3f9h h ALA 234 Cb 0.58 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3f9h h ALA 234 CO 0.04 -0.75 -0.10 0.52 0.00 0.00 0.00 179.25 178.95 3f9h h MET 235 N -0.40 0.00 -0.66 0.00 2.86 -1.06 0.98 114.93 116.64 3f9h h MET 235 Ca 0.05 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.61 3f9h h MET 235 Cb 0.46 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 3f9h h MET 235 CO -0.17 0.10 0.13 -0.22 1.06 0.00 0.00 176.91 177.81 3f9h h LYS 236 N 0.00 1.07 -0.57 1.72 3.64 -0.98 -3.16 116.57 118.29 3f9h h LYS 236 Ca -0.00 -0.27 -0.10 0.00 -1.27 0.00 0.00 60.65 59.01 3f9h h LYS 236 Cb 0.19 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.82 3f9h h LYS 236 CO 0.01 0.97 0.11 0.66 -2.27 0.00 0.00 179.45 178.93 3f9h n TYR 237 N -4.22 1.99 -3.16 1.91 4.02 -0.96 -4.95 117.16 111.78 3f9h n TYR 237 Ca 0.05 -0.99 -0.14 0.00 -0.01 0.00 0.00 57.90 56.80 3f9h n TYR 237 Cb 0.27 -0.55 0.07 0.00 -0.02 0.00 0.00 39.34 39.12 3f9h n TYR 237 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3f9h n ASN 238 N 0.01 -3.46 -4.37 7.72 5.15 -1.08 -4.97 115.26 114.25 3f9h n ASN 238 Ca 0.32 -0.57 -0.31 0.00 -0.60 0.00 0.00 54.58 53.43 3f9h n ASN 238 Cb 1.22 -4.54 -0.15 0.00 -0.53 0.00 0.00 39.78 35.78 3f9h n ASN 238 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 3f9h s TYR 239 N -3.32 2.42 0.21 1.20 1.51 0.30 -2.50 117.35 117.18 3f9h s TYR 239 Ca 0.14 -0.36 -0.30 0.00 -1.01 0.00 0.00 57.07 55.54 3f9h s TYR 239 Cb -0.02 -1.47 -0.10 0.00 -0.11 0.00 0.00 41.96 40.26 3f9h s TYR 239 CO 0.64 0.10 1.42 -2.00 -1.11 0.00 0.00 175.55 174.60 3f9h s GLU 240 N -0.99 4.29 0.37 -0.62 2.12 -0.73 -3.86 118.70 119.27 3f9h s GLU 240 Ca 0.12 2.23 -0.26 0.00 0.36 0.00 0.00 54.97 57.42 3f9h s GLU 240 Cb -0.10 -3.15 -0.12 0.00 0.26 0.00 0.00 34.13 31.02 3f9h s GLU 240 CO 0.01 -0.41 0.98 -2.30 -0.54 0.00 0.00 175.26 173.00 3f9h n PRO 241 N 2.76 1.31 -3.21 4.30 -0.02 -1.26 -4.43 135.00 134.45 3f9h n PRO 241 Ca 0.08 0.47 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 3f9h n PRO 241 Cb 0.41 -1.93 -0.07 0.00 -0.02 0.00 0.00 33.50 31.89 3f9h n PRO 241 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3f9h s LEU 242 N 0.04 4.19 0.38 2.45 2.96 -1.26 -4.94 118.68 122.49 3f9h s LEU 242 Ca 0.61 0.27 -0.03 0.00 -0.22 0.00 0.00 54.13 54.76 3f9h s LEU 242 Cb -0.62 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.36 3f9h s LEU 242 CO 0.58 -0.42 0.63 0.42 -1.32 0.00 0.00 176.35 176.25 3f9h s THR 243 N 2.43 5.01 0.44 3.68 -4.23 -1.26 -4.96 115.64 116.76 3f9h s THR 243 Ca 0.21 -0.11 0.10 0.00 -1.18 0.00 0.00 61.69 60.71 3f9h s THR 243 Cb -0.15 -3.83 0.25 0.00 1.34 0.00 0.00 72.50 70.11 3f9h s THR 243 CO 0.12 -0.60 2.07 -0.61 -0.54 0.00 0.00 174.62 175.05 3f9h h GLN 244 N 0.79 0.36 -0.33 3.99 5.75 -2.01 -1.17 115.11 122.50 3f9h h GLN 244 Ca -0.48 -0.03 0.03 0.00 -0.15 0.00 0.00 58.65 58.02 3f9h h GLN 244 Cb 1.21 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.66 3f9h h GLN 244 CO 0.62 0.26 0.22 0.22 -2.65 0.00 0.00 178.83 177.51 3f9h h ASP 245 N 0.37 0.28 -0.27 -0.69 1.82 -2.02 -2.77 116.42 113.14 3f9h h ASP 245 Ca 0.10 -0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.59 3f9h h ASP 245 Cb 0.00 -0.07 -0.00 0.00 0.68 0.00 0.00 39.33 39.95 3f9h h ASP 245 CO -0.02 0.20 -0.39 0.45 -1.61 0.00 0.00 179.24 177.87 3f9h h HIS 246 N 0.33 0.92 0.00 0.28 3.86 -1.59 -3.29 115.15 115.66 3f9h h HIS 246 Ca 0.13 -0.30 -0.06 0.00 -1.16 0.00 0.00 60.37 58.98 3f9h h HIS 246 Cb 0.13 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 3f9h h HIS 246 CO -0.00 1.08 -0.29 -0.39 0.86 0.00 0.00 177.93 179.19 3f9h h VAL 247 N 0.49 1.14 -0.83 2.45 -1.51 -1.40 -1.44 116.25 115.16 3f9h h VAL 247 Ca 0.03 -1.02 -0.01 0.00 -1.23 0.00 0.00 66.70 64.47 3f9h h VAL 247 Cb 0.98 1.56 -0.04 0.00 -2.13 0.00 0.00 31.29 31.66 3f9h h VAL 247 CO 0.09 0.28 0.48 0.44 -1.23 0.00 0.00 177.57 177.63 3f9h h ASP 248 N 0.00 1.00 0.17 4.19 3.32 -1.61 -2.84 116.42 120.65 3f9h h ASP 248 Ca -0.00 -0.07 -0.11 0.00 0.02 0.00 0.00 57.03 56.86 3f9h h ASP 248 Cb 0.54 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3f9h h ASP 248 CO 0.04 0.79 -0.41 0.40 -1.72 0.00 0.00 179.24 178.33 3f9h h ILE 249 N 1.14 1.31 0.00 0.35 2.04 -1.35 -2.70 117.51 118.31 3f9h h ILE 249 Ca 0.29 -1.55 0.00 0.00 1.00 0.00 0.00 64.86 64.60 3f9h h ILE 249 Cb -0.02 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3f9h h ILE 249 CO -0.05 0.47 0.00 0.18 0.00 0.00 0.00 178.15 178.75 3f9h n LEU 250 N -4.02 0.14 -0.39 1.44 4.77 -1.07 -4.27 117.00 113.60 3f9h n LEU 250 Ca -0.02 0.52 -0.10 0.00 -0.03 0.00 0.00 56.01 56.38 3f9h n LEU 250 Cb 0.49 -0.48 -0.08 0.00 -2.33 0.00 0.00 43.42 41.02 3f9h n LEU 250 CO 0.43 -0.08 0.50 1.23 -1.33 0.00 0.00 177.39 178.13 3f9h h GLY 251 N 4.48 -0.73 0.14 -0.72 0.00 -1.25 0.30 103.07 105.29 3f9h h GLY 251 Ca 0.00 0.76 0.11 0.00 0.00 0.00 0.00 47.33 48.20 3f9h h GLY 251 CO 0.00 0.00 0.06 -2.55 0.00 0.00 0.00 176.54 174.06 3f9h h PRO 252 N -0.03 0.18 -0.26 4.80 0.11 -1.81 0.39 132.00 135.38 3f9h h PRO 252 Ca 0.18 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.17 3f9h h PRO 252 Cb 0.45 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 3f9h h PRO 252 CO -0.92 0.12 -0.29 -0.07 -0.21 0.00 0.00 178.00 176.63 3f9h h LEU 253 N 0.18 0.54 -0.09 2.35 3.38 -1.59 -0.88 115.31 119.20 3f9h h LEU 253 Ca 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3f9h h LEU 253 Cb 0.45 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3f9h h LEU 253 CO -0.43 0.81 0.03 -1.28 0.09 0.00 0.00 178.44 177.66 3f9h h SER 254 N 0.46 0.12 0.50 -0.43 0.87 0.41 -2.89 113.55 112.59 3f9h h SER 254 Ca 0.06 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 3f9h h SER 254 Cb 0.74 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 3f9h h SER 254 CO 0.06 0.27 -0.36 0.00 -0.53 0.00 0.00 176.83 176.27 3f9h h ALA 255 N 0.86 -0.86 -0.93 6.23 0.00 -0.16 0.20 119.26 124.60 3f9h h ALA 255 Ca 0.03 -0.16 0.36 0.00 0.00 0.00 0.00 54.91 55.14 3f9h h ALA 255 Cb 0.19 0.47 -0.17 0.00 0.00 0.00 0.00 17.79 18.28 3f9h h ALA 255 CO -0.00 -1.01 0.38 0.94 0.00 0.00 0.00 179.25 179.57 3f9h n GLN 256 N -5.48 -0.06 -0.00 0.00 -0.06 -0.34 -1.95 117.38 109.48 3f9h n GLN 256 Ca -0.11 1.32 0.06 0.00 -2.00 0.00 0.00 57.00 56.27 3f9h n GLN 256 Cb 0.38 -2.29 -0.09 0.00 -4.06 0.00 0.00 30.24 24.18 3f9h n GLN 256 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 3f9h n THR 257 N -5.18 0.00 -1.96 1.69 -2.24 -1.09 -4.99 114.28 100.50 3f9h n THR 257 Ca 0.32 -0.24 -0.13 0.00 -2.27 0.00 0.00 64.05 61.73 3f9h n THR 257 Cb 1.08 0.67 -0.02 0.00 -2.10 0.00 0.00 70.33 69.97 3f9h n THR 257 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f9h n GLY 258 N 1.48 0.33 3.10 3.38 0.00 0.66 -5.00 105.19 109.14 3f9h n GLY 258 Ca 0.00 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 3f9h n GLY 258 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f9h s ILE 259 N -2.58 2.55 0.58 -0.61 1.01 -1.01 -5.04 121.20 116.10 3f9h s ILE 259 Ca 0.00 -1.71 -0.20 0.00 0.00 0.00 0.00 60.65 58.74 3f9h s ILE 259 Cb 0.00 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.84 3f9h s ILE 259 CO 0.00 -0.21 1.11 0.00 0.00 0.00 0.00 174.94 175.84 3f9h n ALA 260 N 4.48 0.66 -0.02 9.38 0.00 -1.26 -4.54 120.51 129.20 3f9h n ALA 260 Ca -0.10 0.06 -0.10 0.00 0.00 0.00 0.00 53.44 53.30 3f9h n ALA 260 Cb 0.42 -2.20 -0.04 0.00 0.00 0.00 0.00 19.45 17.64 3f9h n ALA 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3f9h h VAL 261 N 0.82 0.26 -0.25 0.00 2.07 -1.94 -2.14 116.25 115.07 3f9h h VAL 261 Ca -0.49 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.04 3f9h h VAL 261 Cb 1.34 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3f9h h VAL 261 CO 0.53 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 178.22 3f9h h LEU 262 N -0.37 0.27 -0.54 2.57 3.38 -1.91 0.13 115.31 118.85 3f9h h LEU 262 Ca 0.11 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 3f9h h LEU 262 Cb 0.55 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3f9h h LEU 262 CO -0.40 0.20 -0.39 0.44 0.09 0.00 0.00 178.44 178.39 3f9h h ASP 263 N 0.32 0.81 0.52 -0.43 5.19 -1.72 -0.11 116.42 121.00 3f9h h ASP 263 Ca 0.09 -0.36 -0.07 0.00 -0.62 0.00 0.00 57.03 56.07 3f9h h ASP 263 Cb -0.01 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.26 3f9h h ASP 263 CO -0.02 1.10 -0.35 -0.03 -3.12 0.00 0.00 179.24 176.82 3f9h h MET 264 N 0.62 0.00 0.00 3.56 4.05 -0.55 -2.69 114.93 119.92 3f9h h MET 264 Ca 0.05 0.00 -0.13 0.00 -0.28 0.00 0.00 59.70 59.34 3f9h h MET 264 Cb 0.93 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 3f9h h MET 264 CO 0.09 0.35 -0.63 0.00 0.23 0.00 0.00 176.91 176.95 3f9h h ALA 266 N 1.37 0.98 0.15 0.00 0.00 -0.83 -2.24 119.26 118.70 3f9h h ALA 266 Ca -0.01 -0.04 -0.24 0.00 0.00 0.00 0.00 54.91 54.62 3f9h h ALA 266 Cb 1.20 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.01 3f9h h ALA 266 CO 0.08 0.05 -1.05 0.00 0.00 0.00 0.00 179.25 178.34 3f9h h ALA 267 N 1.96 -0.08 -0.72 0.00 0.00 -1.14 -3.18 119.26 116.10 3f9h h ALA 267 Ca -0.00 -0.74 -0.06 0.00 0.00 0.00 0.00 54.91 54.11 3f9h h ALA 267 Cb 0.84 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3f9h h ALA 267 CO 0.01 0.51 0.22 1.25 0.00 0.00 0.00 179.25 181.24 3f9h h LEU 268 N -0.08 1.06 -0.13 0.00 6.46 -1.31 -2.13 115.31 119.17 3f9h h LEU 268 Ca -0.17 -0.21 0.04 0.00 -0.12 0.00 0.00 57.88 57.42 3f9h h LEU 268 Cb 1.80 -0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 41.40 3f9h h LEU 268 CO 0.20 0.99 -0.18 0.50 -0.62 0.00 0.00 178.44 179.34 3f9h h LYS 269 N 1.07 -0.21 -0.38 1.25 3.64 -1.50 0.91 116.57 121.35 3f9h h LYS 269 Ca 0.23 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.59 3f9h h LYS 269 Cb 0.32 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 3f9h h LYS 269 CO -0.01 -0.14 0.06 0.93 -2.27 0.00 0.00 179.45 178.03 3f9h h GLU 270 N -0.22 0.57 -0.09 1.90 4.39 -1.51 -0.60 114.58 119.02 3f9h h GLU 270 Ca 0.10 -0.11 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 3f9h h GLU 270 Cb 0.36 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3f9h h GLU 270 CO -0.26 0.55 -0.31 -0.07 -1.16 0.00 0.00 179.01 177.76 3f9h h LEU 271 N 0.56 0.17 -0.01 1.33 3.38 -0.66 0.16 115.31 120.24 3f9h h LEU 271 Ca 0.13 -0.06 -0.24 0.00 0.09 0.00 0.00 57.88 57.80 3f9h h LEU 271 Cb 0.26 -0.05 0.02 0.00 0.09 0.00 0.00 40.66 40.98 3f9h h LEU 271 CO 0.00 0.48 -0.93 -0.07 0.09 0.00 0.00 178.44 178.01 3f9h h LEU 272 N 0.16 0.84 0.30 1.67 3.38 -0.23 -1.03 115.31 120.38 3f9h h LEU 272 Ca 0.02 -0.74 -0.01 0.00 0.09 0.00 0.00 57.88 57.24 3f9h h LEU 272 Cb 0.63 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3f9h h LEU 272 CO 0.05 1.46 -0.14 1.56 0.09 0.00 0.00 178.44 181.45 3f9h h GLN 273 N 0.30 -0.39 0.00 1.13 7.50 -0.95 -3.39 115.11 119.30 3f9h h GLN 273 Ca -0.11 0.03 -0.38 0.00 0.50 0.00 0.00 58.65 58.68 3f9h h GLN 273 Cb 1.59 0.09 -0.07 0.00 0.05 0.00 0.00 27.48 29.14 3f9h h GLN 273 CO 0.18 -0.09 -2.43 0.09 -1.50 0.00 0.00 178.83 175.08 3f9h n ASN 274 N -5.15 1.55 0.00 1.46 3.02 0.54 -5.09 115.26 111.59 3f9h n ASN 274 Ca -0.10 -0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 3f9h n ASN 274 Cb 0.25 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 3f9h n ASN 274 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f9h n GLY 275 N 2.16 -2.83 0.33 7.41 0.00 -0.39 -4.53 105.19 107.34 3f9h n GLY 275 Ca -0.42 -1.75 -0.06 0.00 0.00 0.00 0.00 46.02 43.79 3f9h n GLY 275 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3f9h h MET 276 N 0.00 1.11 -5.97 1.61 2.86 -1.89 -3.45 114.93 109.20 3f9h h MET 276 Ca 0.00 -0.23 -0.21 0.00 -2.06 0.00 0.00 59.70 57.20 3f9h h MET 276 Cb 0.00 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.50 3f9h h MET 276 CO 0.00 0.94 -0.53 -1.71 1.06 0.00 0.00 176.91 176.67 3f9h n ASN 277 N -4.26 -6.54 0.00 1.22 4.05 -1.26 -3.03 115.26 105.45 3f9h n ASN 277 Ca 0.06 -0.38 0.00 0.00 0.45 0.00 0.00 54.58 54.71 3f9h n ASN 277 Cb 0.22 -3.70 0.00 0.00 1.23 0.00 0.00 39.78 37.53 3f9h n ASN 277 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3f9h n GLY 278 N -1.52 2.99 3.97 8.20 0.00 -1.26 -5.00 105.19 112.56 3f9h n GLY 278 Ca -0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 3f9h n GLY 278 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f9h s ARG 279 N -0.20 1.09 0.01 1.61 0.52 -1.17 -5.12 118.95 115.68 3f9h s ARG 279 Ca 0.00 -0.92 -0.00 0.00 -0.52 0.00 0.00 55.73 54.29 3f9h s ARG 279 Cb 0.00 -2.12 -0.01 0.00 0.52 0.00 0.00 34.95 33.34 3f9h s ARG 279 CO 0.00 -1.96 -0.01 0.95 0.02 0.00 0.00 175.30 174.30 3f9h s THR 280 N -3.49 0.06 -0.24 0.02 -4.23 -1.26 -4.80 115.64 101.69 3f9h s THR 280 Ca 0.71 -0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 60.71 3f9h s THR 280 Cb -0.04 -0.15 0.01 0.00 1.34 0.00 0.00 72.50 73.66 3f9h s THR 280 CO 0.49 -0.27 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.62 3f9h s ILE 281 N -0.78 3.10 -1.49 2.99 1.01 -0.77 -4.74 121.20 120.52 3f9h s ILE 281 Ca -0.09 -0.83 -0.09 0.00 0.00 0.00 0.00 60.65 59.64 3f9h s ILE 281 Cb -0.05 -2.52 0.07 0.00 0.01 0.00 0.00 42.46 39.97 3f9h s ILE 281 CO -0.00 0.27 0.79 0.18 0.00 0.00 0.00 174.94 176.18 3f9h n LEU 282 N 4.73 -2.47 0.00 2.97 4.32 -1.26 -1.45 117.00 123.84 3f9h n LEU 282 Ca -0.17 -0.87 0.00 0.00 -0.02 0.00 0.00 56.01 54.95 3f9h n LEU 282 Cb 0.48 -2.44 0.00 0.00 -1.62 0.00 0.00 43.42 39.84 3f9h n LEU 282 CO 0.28 0.42 0.00 0.61 -1.22 0.00 0.00 177.39 177.48 3f9h n GLY 283 N -1.67 2.80 3.86 -0.72 0.00 -1.26 -1.53 105.19 106.67 3f9h n GLY 283 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 3f9h n GLY 283 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3f9h s SER 284 N -0.44 6.55 0.00 1.61 0.15 -0.53 -4.90 113.70 116.15 3f9h s SER 284 Ca 0.00 1.38 0.11 0.00 0.70 0.00 0.00 55.95 58.14 3f9h s SER 284 Cb 0.00 -2.43 0.13 0.00 -1.71 0.00 0.00 66.02 62.01 3f9h s SER 284 CO 0.00 -0.53 0.93 0.35 1.20 0.00 0.00 173.24 175.19 3f9h n THR 285 N -1.55 0.18 -4.33 6.45 -2.24 -1.26 -1.85 114.28 109.67 3f9h n THR 285 Ca 0.05 -0.59 -0.18 0.00 -2.27 0.00 0.00 64.05 61.06 3f9h n THR 285 Cb 0.54 1.11 -0.10 0.00 -2.10 0.00 0.00 70.33 69.78 3f9h n THR 285 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 3f9h s ILE 286 N -0.96 1.48 -0.48 2.28 -5.25 -1.26 -4.87 121.20 112.13 3f9h s ILE 286 Ca 0.15 -2.14 -0.21 0.00 -0.99 0.00 0.00 60.65 57.46 3f9h s ILE 286 Cb 0.10 -2.10 0.04 0.00 2.95 0.00 0.00 42.46 43.45 3f9h s ILE 286 CO 0.15 -0.55 0.72 -0.76 -1.79 0.00 0.00 174.94 172.70 3f9h s LEU 287 N -3.30 4.52 0.16 0.37 1.43 -1.26 -4.96 118.68 115.65 3f9h s LEU 287 Ca 0.23 -0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 52.55 3f9h s LEU 287 Cb 0.02 -2.70 -0.07 0.00 0.03 0.00 0.00 46.19 43.46 3f9h s LEU 287 CO 0.06 -0.93 1.14 -0.70 0.23 0.00 0.00 176.35 176.16 3f9h s GLU 288 N 3.07 4.54 -0.08 1.70 2.56 -1.26 -4.95 118.70 124.28 3f9h s GLU 288 Ca 0.23 1.77 0.11 0.00 0.00 0.00 0.00 54.97 57.08 3f9h s GLU 288 Cb -0.15 -3.28 0.17 0.00 2.00 0.00 0.00 34.13 32.88 3f9h s GLU 288 CO 0.18 -0.02 1.06 -0.40 -0.56 0.00 0.00 175.26 175.52 3f9h n ASP 289 N 2.62 1.77 -1.35 -1.70 3.85 -1.26 -3.89 116.55 116.60 3f9h n ASP 289 Ca 0.04 -2.59 -0.07 0.00 -0.71 0.00 0.00 54.79 51.46 3f9h n ASP 289 Cb 0.46 -0.29 0.21 0.00 -1.35 0.00 0.00 41.12 40.14 3f9h n ASP 289 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3f9h n GLU 290 N -0.95 2.06 -3.96 0.11 1.02 -1.26 -4.62 120.64 113.05 3f9h n GLU 290 Ca 0.09 -3.13 -0.31 0.00 -0.02 0.00 0.00 57.16 53.80 3f9h n GLU 290 Cb 0.57 -1.89 -0.15 0.00 -0.02 0.00 0.00 31.44 29.94 3f9h n GLU 290 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3f9h s PHE 291 N -3.21 3.09 0.56 -0.32 0.40 -1.26 -4.84 117.98 112.39 3f9h s PHE 291 Ca 0.47 -2.47 -0.19 0.00 -0.60 0.00 0.00 56.93 54.14 3f9h s PHE 291 Cb 0.41 -2.35 -0.05 0.00 0.51 0.00 0.00 43.02 41.54 3f9h s PHE 291 CO 0.03 -0.90 1.11 0.95 0.70 0.00 0.00 175.22 177.11 3f9h s THR 292 N 1.14 3.27 0.47 0.64 -4.23 -1.26 -4.43 115.64 111.24 3f9h s THR 292 Ca 0.05 0.75 0.30 0.00 -1.18 0.00 0.00 61.69 61.62 3f9h s THR 292 Cb -0.19 -3.28 0.50 0.00 1.34 0.00 0.00 72.50 70.87 3f9h s THR 292 CO -0.11 -0.21 1.74 -0.65 -0.54 0.00 0.00 174.62 174.85 3f9h h PRO 293 N 1.05 0.15 -0.42 3.99 0.11 -1.89 0.20 132.00 135.19 3f9h h PRO 293 Ca -0.49 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 3f9h h PRO 293 Cb 1.25 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 3f9h h PRO 293 CO 0.57 0.10 0.15 0.35 -0.21 0.00 0.00 178.00 178.95 3f9h h PHE 294 N 0.15 0.66 -0.58 0.65 3.57 -1.95 -2.75 116.94 116.68 3f9h h PHE 294 Ca 0.66 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 62.09 3f9h h PHE 294 Cb 2.20 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 40.72 3f9h h PHE 294 CO -0.00 0.59 0.31 -0.44 -2.23 0.00 0.00 178.31 176.54 3f9h h ASP 295 N 0.53 0.74 0.92 0.41 3.32 -0.96 -1.71 116.42 119.68 3f9h h ASP 295 Ca 0.14 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 3f9h h ASP 295 Cb 0.22 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.59 3f9h h ASP 295 CO -0.01 0.63 -0.44 0.58 -1.72 0.00 0.00 179.24 178.28 3f9h h VAL 296 N 0.79 0.07 -0.69 -1.35 2.07 -1.42 -0.65 116.25 115.07 3f9h h VAL 296 Ca 0.20 -0.04 0.13 0.00 0.82 0.00 0.00 66.70 67.81 3f9h h VAL 296 Cb 0.06 0.07 -0.09 0.00 -1.52 0.00 0.00 31.29 29.81 3f9h h VAL 296 CO -0.03 0.00 0.21 0.58 0.02 0.00 0.00 177.57 178.35 3f9h h VAL 297 N -1.27 0.62 -0.94 2.57 2.07 -1.50 0.16 116.25 117.96 3f9h h VAL 297 Ca -0.13 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.29 3f9h h VAL 297 Cb 0.95 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 3f9h h VAL 297 CO 0.21 0.06 0.62 -0.09 0.02 0.00 0.00 177.57 178.39 3f9h h ARG 298 N 0.33 1.23 -0.00 1.57 2.43 -1.17 -3.11 114.38 115.66 3f9h h ARG 298 Ca 0.38 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 3f9h h ARG 298 Cb 0.58 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3f9h h ARG 298 CO -0.43 0.81 -0.67 1.04 -1.51 0.00 0.00 179.97 179.22 3f9h n GLN 299 N -4.39 0.25 0.00 0.20 6.02 -0.26 -5.09 117.38 114.10 3f9h n GLN 299 Ca 0.11 -0.18 0.13 0.00 -0.01 0.00 0.00 57.00 57.05 3f9h n GLN 299 Cb 0.02 -1.50 0.34 0.00 1.02 0.00 0.00 30.24 30.12 3f9h n GLN 299 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05