#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f9h h PHE 3 N 0.00 -0.87 -3.38 1.61 3.57 -1.96 -3.45 116.94 112.46 3f9h h PHE 3 Ca 0.00 -0.02 -0.59 0.00 3.53 0.00 0.00 57.97 60.89 3f9h h PHE 3 Cb 0.00 0.29 -0.10 0.00 2.79 0.00 0.00 35.95 38.93 3f9h h PHE 3 CO 0.00 -0.53 -0.18 1.03 -2.23 0.00 0.00 178.31 176.39 3f9h s ARG 4 N -6.05 4.25 -1.11 1.11 0.52 -1.26 -4.99 118.95 111.43 3f9h s ARG 4 Ca -0.18 0.29 -0.22 0.00 -0.52 0.00 0.00 55.73 55.11 3f9h s ARG 4 Cb 0.03 -3.48 0.02 0.00 0.52 0.00 0.00 34.95 32.04 3f9h s ARG 4 CO 0.62 0.07 1.70 0.21 0.02 0.00 0.00 175.30 177.92 3f9h s LYS 5 N 0.93 3.36 0.13 3.54 2.20 -1.26 -4.96 119.74 123.68 3f9h s LYS 5 Ca 0.22 -1.24 0.02 0.00 -0.36 0.00 0.00 55.97 54.61 3f9h s LYS 5 Cb -0.15 -5.34 -0.04 0.00 -1.51 0.00 0.00 37.83 30.79 3f9h s LYS 5 CO 0.08 -2.69 0.25 0.00 -0.36 0.00 0.00 175.35 172.62 3f9h s MET 6 N 5.34 3.36 0.35 4.03 0.23 -1.26 -4.59 119.30 126.76 3f9h s MET 6 Ca 0.56 -0.59 0.07 0.00 -1.03 0.00 0.00 55.69 54.69 3f9h s MET 6 Cb -0.00 -2.94 -0.01 0.00 -1.53 0.00 0.00 34.83 30.35 3f9h s MET 6 CO 0.00 0.54 0.47 0.00 -2.03 0.00 0.00 175.02 174.01 3f9h s ALA 7 N -1.68 4.26 0.38 3.16 0.00 -1.26 -4.74 121.76 121.89 3f9h s ALA 7 Ca 0.34 -1.51 -0.26 0.00 0.00 0.00 0.00 51.96 50.53 3f9h s ALA 7 Cb -0.11 -1.63 -0.09 0.00 0.00 0.00 0.00 23.12 21.29 3f9h s ALA 7 CO 0.28 -0.07 1.18 -0.06 0.00 0.00 0.00 175.76 177.08 3f9h s PHE 8 N -2.22 3.10 0.16 0.00 0.08 -1.26 -4.97 117.98 112.87 3f9h s PHE 8 Ca 0.46 1.55 -0.33 0.00 0.12 0.00 0.00 56.93 58.73 3f9h s PHE 8 Cb -0.09 -3.42 -0.13 0.00 -0.57 0.00 0.00 43.02 38.81 3f9h s PHE 8 CO 0.31 -1.32 1.65 -2.30 -0.10 0.00 0.00 175.22 173.46 3f9h n PRO 9 N 0.23 2.35 -0.19 0.24 -0.02 -1.26 -4.88 135.00 131.46 3f9h n PRO 9 Ca 0.03 0.85 0.09 0.00 -2.02 0.00 0.00 63.50 62.46 3f9h n PRO 9 Cb 0.46 -2.65 0.26 0.00 -0.02 0.00 0.00 33.50 31.55 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 3.91 2.55 -0.23 2.55 3.41 -1.26 -4.55 113.62 120.00 3f9h n SER 10 Ca 0.17 -1.92 0.04 0.00 -0.26 0.00 0.00 58.87 56.90 3f9h n SER 10 Cb 0.31 -0.25 0.16 0.00 -0.26 0.00 0.00 64.21 64.16 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 4.87 0.92 2.00 5.00 0.00 -2.00 0.22 103.07 114.07 3f9h h GLY 11 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 3f9h h GLY 11 CO 0.00 -0.18 -0.31 0.50 0.00 0.00 0.00 176.54 176.54 3f9h h LYS 12 N 0.25 0.00 0.09 4.80 1.57 -1.97 -3.22 116.57 118.10 3f9h h LYS 12 Ca 0.38 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.85 3f9h h LYS 12 Cb 0.63 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 3f9h h LYS 12 CO -0.49 0.31 -1.68 0.28 -0.57 0.00 0.00 179.45 177.30 3f9h h VAL 13 N 0.00 0.96 -0.97 0.50 2.07 -1.15 -3.35 116.25 114.31 3f9h h VAL 13 Ca -0.00 -2.67 0.17 0.00 0.82 0.00 0.00 66.70 65.02 3f9h h VAL 13 Cb 0.64 2.63 -0.10 0.00 -1.52 0.00 0.00 31.29 32.94 3f9h h VAL 13 CO 0.04 0.77 0.57 -0.33 0.02 0.00 0.00 177.57 178.64 3f9h h GLU 14 N 0.05 0.74 0.00 1.57 5.08 -0.71 0.71 114.58 122.02 3f9h h GLU 14 Ca -0.29 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 3f9h h GLU 14 Cb 2.02 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 31.10 3f9h h GLU 14 CO 0.13 0.49 0.00 0.41 -1.00 0.00 0.00 179.01 179.03 3f9h n GLY 15 N -1.33 -0.80 0.48 -3.84 0.00 -1.25 -2.67 105.19 95.78 3f9h n GLY 15 Ca 0.21 -0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.45 4.35 0.30 0.00 -1.94 -1.09 0.03 119.30 119.50 3f9h s MET 17 Ca 0.15 0.64 0.03 0.00 -1.71 0.00 0.00 55.69 54.79 3f9h s MET 17 Cb 0.12 -3.47 -0.06 0.00 2.01 0.00 0.00 34.83 33.43 3f9h s MET 17 CO 0.26 0.05 0.08 0.14 -0.01 0.00 0.00 175.02 175.53 3f9h s VAL 18 N 0.94 0.91 0.04 -6.03 -7.23 -0.20 -4.73 120.40 104.10 3f9h s VAL 18 Ca 0.31 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.51 3f9h s VAL 18 Cb -0.16 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.01 3f9h s VAL 18 CO 0.13 0.00 -0.01 0.00 -0.31 0.00 0.00 175.10 174.91 3f9h s GLN 19 N -3.95 2.64 -0.16 4.82 -2.07 -1.16 0.11 119.66 119.88 3f9h s GLN 19 Ca 0.37 -0.73 0.00 0.00 -1.82 0.00 0.00 55.36 53.18 3f9h s GLN 19 Cb 0.08 -2.58 0.03 0.00 -1.09 0.00 0.00 33.01 29.45 3f9h s GLN 19 CO 0.15 0.58 -0.11 0.08 -1.32 0.00 0.00 175.29 174.67 3f9h s VAL 20 N -1.18 1.43 -0.18 3.63 1.01 -0.13 -2.92 120.40 122.06 3f9h s VAL 20 Ca 0.22 -0.68 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 3f9h s VAL 20 Cb -0.12 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 3f9h s VAL 20 CO 0.14 0.31 0.04 -0.89 0.00 0.00 0.00 175.10 174.70 3f9h s THR 21 N 1.52 4.63 -0.04 3.92 2.01 -0.49 -1.92 115.64 125.27 3f9h s THR 21 Ca 0.03 -0.09 -0.01 0.00 0.31 0.00 0.00 61.69 61.92 3f9h s THR 21 Cb -0.14 -3.08 0.03 0.00 0.01 0.00 0.00 72.50 69.32 3f9h s THR 21 CO -0.09 0.47 0.03 0.00 -0.69 0.00 0.00 174.62 174.34 3f9h n GLY 23 N 4.93 4.05 0.36 0.00 0.00 -1.26 -2.33 105.19 110.95 3f9h n GLY 23 Ca -0.11 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3f9h n GLY 23 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3f9h n THR 24 N 0.00 0.00 -3.75 2.61 5.66 -1.26 -4.94 114.28 112.60 3f9h n THR 24 Ca 0.00 -0.19 -0.35 0.00 -3.05 0.00 0.00 64.05 60.46 3f9h n THR 24 Cb 0.00 1.10 -0.05 0.00 -1.55 0.00 0.00 70.33 69.83 3f9h n THR 24 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3f9h s THR 25 N -2.60 5.31 -0.04 1.09 2.01 -0.98 -5.10 115.64 115.33 3f9h s THR 25 Ca 0.17 0.26 -0.00 0.00 0.31 0.00 0.00 61.69 62.42 3f9h s THR 25 Cb 0.18 -3.55 0.03 0.00 0.01 0.00 0.00 72.50 69.16 3f9h s THR 25 CO 0.63 0.44 0.01 -0.89 -0.69 0.00 0.00 174.62 174.12 3f9h s THR 26 N -1.22 0.15 0.25 -0.82 2.01 -1.26 -1.66 115.64 113.08 3f9h s THR 26 Ca 0.25 0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.45 3f9h s THR 26 Cb -0.13 -0.28 -0.02 0.00 0.01 0.00 0.00 72.50 72.08 3f9h s THR 26 CO 0.14 0.16 0.20 0.00 -0.69 0.00 0.00 174.62 174.43 3f9h n LEU 27 N 4.41 0.00 -4.84 4.42 -0.00 -0.81 -4.79 117.00 115.39 3f9h n LEU 27 Ca -0.21 -2.31 -0.35 0.00 -0.00 0.00 0.00 56.01 53.14 3f9h n LEU 27 Cb 0.50 1.20 -0.06 0.00 -0.00 0.00 0.00 43.42 45.06 3f9h n LEU 27 CO 0.19 -0.38 0.29 0.20 -0.00 0.00 0.00 177.39 177.68 3f9h s ASN 28 N -2.71 6.85 0.04 1.45 0.01 -0.96 -0.96 114.94 118.67 3f9h s ASN 28 Ca 0.28 1.15 0.02 0.00 -0.71 0.00 0.00 52.86 53.61 3f9h s ASN 28 Cb 0.01 -2.32 -0.02 0.00 0.41 0.00 0.00 41.25 39.33 3f9h s ASN 28 CO 0.20 0.05 -0.08 -0.83 -1.51 0.00 0.00 177.10 174.93 3f9h s GLY 29 N -1.81 0.49 -0.34 0.66 0.00 0.12 -4.25 107.32 102.19 3f9h s GLY 29 Ca 0.41 -0.75 -0.12 0.00 0.00 0.00 0.00 44.72 44.26 3f9h s GLY 29 CO 0.20 -0.80 0.23 -2.27 0.00 0.00 0.00 173.10 170.45 3f9h s LEU 30 N -1.55 4.45 -0.52 0.66 0.20 0.26 -1.03 118.68 121.15 3f9h s LEU 30 Ca -0.10 -0.44 -0.14 0.00 0.69 0.00 0.00 54.13 54.13 3f9h s LEU 30 Cb -0.10 -2.11 0.13 0.00 -0.43 0.00 0.00 46.19 43.67 3f9h s LEU 30 CO 0.00 -0.23 0.46 0.86 -0.29 0.00 0.00 176.35 177.16 3f9h s TRP 31 N 1.70 3.29 -0.10 5.38 -0.00 0.10 0.17 118.94 129.49 3f9h s TRP 31 Ca 0.06 -1.41 0.04 0.00 -0.00 0.00 0.00 56.10 54.78 3f9h s TRP 31 Cb -0.17 -3.71 0.00 0.00 -0.00 0.00 0.00 33.47 29.58 3f9h s TRP 31 CO 0.10 -1.01 -0.23 -0.51 -0.00 0.00 0.00 176.95 175.30 3f9h s LEU 32 N 1.55 2.06 0.00 5.86 1.43 -0.89 -4.68 118.68 124.01 3f9h s LEU 32 Ca 0.04 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 3f9h s LEU 32 Cb -0.29 -1.37 0.00 0.00 0.03 0.00 0.00 46.19 44.56 3f9h s LEU 32 CO 0.02 0.15 0.00 0.47 0.23 0.00 0.00 176.35 177.22 3f9h n ASP 33 N 3.54 0.00 -0.97 2.29 8.00 -1.26 -1.53 116.55 126.62 3f9h n ASP 33 Ca -0.19 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.43 3f9h n ASP 33 Cb 0.53 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.73 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 4.66 3.02 -4.96 -2.24 3.85 -1.26 0.31 116.55 119.93 3f9h n ASP 34 Ca 0.00 -1.99 -0.23 0.00 -0.71 0.00 0.00 54.79 51.86 3f9h n ASP 34 Cb 0.00 -0.01 -0.02 0.00 -1.35 0.00 0.00 41.12 39.73 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 -1.96 5.26 -0.05 2.12 2.01 -0.58 -0.78 115.64 121.67 3f9h s THR 35 Ca 0.28 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.47 3f9h s THR 35 Cb 0.20 -3.83 0.00 0.00 0.01 0.00 0.00 72.50 68.89 3f9h s THR 35 CO 0.30 -0.28 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.11 3f9h s VAL 36 N -1.94 1.26 -0.09 3.82 1.01 0.58 -2.09 120.40 122.96 3f9h s VAL 36 Ca 0.35 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.74 3f9h s VAL 36 Cb -0.10 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 3f9h s VAL 36 CO 0.29 0.37 -0.15 -0.31 0.00 0.00 0.00 175.10 175.31 3f9h s TYR 37 N 0.24 2.72 0.15 5.22 2.02 0.13 -1.68 117.35 126.14 3f9h s TYR 37 Ca -0.07 -0.50 -0.20 0.00 -0.37 0.00 0.00 57.07 55.93 3f9h s TYR 37 Cb -0.12 -1.74 0.05 0.00 -0.40 0.00 0.00 41.96 39.76 3f9h s TYR 37 CO 0.03 -0.08 0.52 0.00 -1.57 0.00 0.00 175.55 174.45 3f9h n PRO 39 N -0.32 2.38 0.11 0.00 -0.02 -1.26 -0.74 135.00 135.14 3f9h n PRO 39 Ca -0.16 0.87 0.08 0.00 -2.02 0.00 0.00 63.50 62.27 3f9h n PRO 39 Cb 0.64 -2.73 0.41 0.00 -0.02 0.00 0.00 33.50 31.80 3f9h n PRO 39 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 3f9h n ARG 40 N 6.22 0.10 0.00 -0.52 1.85 -0.92 -2.70 116.66 120.69 3f9h n ARG 40 Ca 0.21 0.59 0.15 0.00 -1.00 0.00 0.00 57.85 57.80 3f9h n ARG 40 Cb 0.32 -1.81 0.83 0.00 -1.05 0.00 0.00 32.46 30.75 3f9h n ARG 40 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 3f9h n HIS 41 N -2.02 0.00 -0.18 2.89 1.44 -1.26 -3.43 115.22 112.67 3f9h n HIS 41 Ca -0.01 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.78 3f9h n HIS 41 Cb 0.03 -0.17 0.38 0.00 0.12 0.00 0.00 29.99 30.35 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 0.02 0.99 0.00 0.61 3.04 -1.90 -1.29 116.25 117.72 3f9h h VAL 42 Ca 0.00 -0.24 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 3f9h h VAL 42 Cb 0.18 0.22 0.00 0.00 -2.01 0.00 0.00 31.29 29.68 3f9h h VAL 42 CO 0.00 0.13 0.00 0.16 -1.01 0.00 0.00 177.57 176.85 3f9h h ILE 43 N 0.70 0.00 -3.58 3.17 3.07 -1.84 -3.43 117.51 115.60 3f9h h ILE 43 Ca 0.32 -0.08 -0.50 0.00 1.55 0.00 0.00 64.86 66.15 3f9h h ILE 43 Cb 0.34 0.70 -0.00 0.00 -0.27 0.00 0.00 36.82 37.58 3f9h h ILE 43 CO -0.11 0.00 0.04 0.00 -1.05 0.00 0.00 178.15 177.04 3f9h n THR 45 N -1.02 0.00 -0.22 0.00 -2.24 -1.26 -4.86 114.28 104.68 3f9h n THR 45 Ca 0.02 -1.58 -0.04 0.00 -2.27 0.00 0.00 64.05 60.18 3f9h n THR 45 Cb 0.54 -0.88 0.14 0.00 -2.10 0.00 0.00 70.33 68.02 3f9h n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f9h h ALA 46 N -0.59 1.17 -0.08 6.98 0.00 -1.99 -2.84 119.26 121.92 3f9h h ALA 46 Ca -0.33 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.28 3f9h h ALA 46 Cb 1.22 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.74 3f9h h ALA 46 CO 0.35 0.60 -0.43 1.49 0.00 0.00 0.00 179.25 181.26 3f9h h GLU 47 N 1.00 0.43 -0.81 0.00 4.81 -2.04 -3.29 114.58 114.69 3f9h h GLU 47 Ca 0.23 -0.36 0.16 0.00 -0.13 0.00 0.00 59.36 59.27 3f9h h GLU 47 Cb 0.20 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.60 3f9h h GLU 47 CO -0.02 0.99 0.54 -0.44 -0.73 0.00 0.00 179.01 179.35 3f9h h ASP 48 N -0.02 0.41 0.27 1.04 3.32 -1.91 -1.94 116.42 117.59 3f9h h ASP 48 Ca -0.03 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3f9h h ASP 48 Cb 1.08 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.58 3f9h h ASP 48 CO 0.09 0.20 0.00 0.23 -1.72 0.00 0.00 179.24 178.04 3f9h n MET 49 N -4.49 0.13 -0.03 3.56 2.81 -1.08 -1.58 117.12 116.44 3f9h n MET 49 Ca 0.16 0.53 -0.11 0.00 -1.81 0.00 0.00 57.70 56.47 3f9h n MET 49 Cb 0.58 -1.85 0.03 0.00 -0.71 0.00 0.00 33.22 31.26 3f9h n MET 49 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3f9h h LEU 50 N 0.00 0.76 -5.38 4.03 3.38 -1.54 0.51 115.31 117.07 3f9h h LEU 50 Ca 0.00 -0.39 -0.34 0.00 0.09 0.00 0.00 57.88 57.23 3f9h h LEU 50 Cb 0.13 -0.22 -0.24 0.00 0.09 0.00 0.00 40.66 40.43 3f9h h LEU 50 CO 0.00 1.13 -0.73 -3.20 0.09 0.00 0.00 178.44 175.74 3f9h n ASN 51 N -3.99 -1.53 -4.78 -0.43 4.05 -1.06 -4.68 115.26 102.85 3f9h n ASN 51 Ca -0.03 -3.20 -0.37 0.00 0.45 0.00 0.00 54.58 51.43 3f9h n ASN 51 Cb 0.60 0.92 -0.03 0.00 1.23 0.00 0.00 39.78 42.49 3f9h n ASN 51 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3f9h s PRO 52 N -0.27 4.06 -0.47 1.20 0.04 -0.61 -5.03 135.00 133.91 3f9h s PRO 52 Ca 0.32 1.61 0.04 0.00 0.04 0.00 0.00 61.00 63.00 3f9h s PRO 52 Cb 0.24 -2.52 0.12 0.00 0.04 0.00 0.00 34.50 32.39 3f9h s PRO 52 CO -0.15 -0.26 0.22 1.21 0.04 0.00 0.00 177.00 178.06 3f9h s ASN 53 N -1.47 4.28 0.37 6.66 3.84 -1.26 -5.00 114.94 122.35 3f9h s ASN 53 Ca 0.59 -2.77 0.08 0.00 0.21 0.00 0.00 52.86 50.97 3f9h s ASN 53 Cb -0.24 -1.52 0.71 0.00 -0.55 0.00 0.00 41.25 39.64 3f9h s ASN 53 CO 0.30 -0.27 1.88 1.88 -2.79 0.00 0.00 177.10 178.11 3f9h h TYR 54 N 6.77 0.32 0.48 0.43 -1.99 -1.98 -0.34 116.97 120.66 3f9h h TYR 54 Ca -0.06 -0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.60 3f9h h TYR 54 Cb 0.92 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.57 3f9h h TYR 54 CO 0.50 0.43 -0.23 0.93 -0.00 0.00 0.00 178.16 179.79 3f9h h GLU 55 N 0.29 -0.62 -0.69 4.88 4.39 -1.99 -1.88 114.58 118.96 3f9h h GLU 55 Ca 0.06 0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 3f9h h GLU 55 Cb 0.41 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 3f9h h GLU 55 CO 0.02 -0.36 0.24 0.22 -1.16 0.00 0.00 179.01 177.97 3f9h h ASP 56 N -0.76 0.97 -0.29 1.42 3.58 -1.90 -2.41 116.42 117.03 3f9h h ASP 56 Ca -0.07 -0.16 -0.17 0.00 0.42 0.00 0.00 57.03 57.05 3f9h h ASP 56 Cb 0.55 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 3f9h h ASP 56 CO 0.11 0.89 -0.49 -0.07 -2.88 0.00 0.00 179.24 176.80 3f9h h LEU 57 N 1.01 0.95 -0.83 2.28 3.38 -1.08 -3.19 115.31 117.83 3f9h h LEU 57 Ca 0.23 -0.48 -0.12 0.00 0.09 0.00 0.00 57.88 57.59 3f9h h LEU 57 Cb 0.25 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3f9h h LEU 57 CO -0.01 1.27 -0.52 0.25 0.09 0.00 0.00 178.44 179.52 3f9h h LEU 58 N 0.68 0.19 -1.42 1.67 5.85 -1.24 -3.31 115.31 117.73 3f9h h LEU 58 Ca 0.03 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 3f9h h LEU 58 Cb 1.08 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 3f9h h LEU 58 CO 0.11 0.68 0.27 -0.29 -0.34 0.00 0.00 178.44 178.86 3f9h h ILE 59 N 0.14 1.15 -0.98 4.05 6.09 -1.42 -1.06 117.51 125.49 3f9h h ILE 59 Ca 0.00 -0.37 -0.60 0.00 -1.37 0.00 0.00 64.86 62.52 3f9h h ILE 59 Cb 0.96 0.50 -0.30 0.00 0.47 0.00 0.00 36.82 38.45 3f9h h ILE 59 CO 0.08 0.16 0.74 -2.11 -3.07 0.00 0.00 178.15 173.95 3f9h n ARG 60 N -4.42 2.50 -4.57 2.19 1.85 -1.25 -4.86 116.66 108.11 3f9h n ARG 60 Ca 0.04 -3.18 -0.33 0.00 -1.00 0.00 0.00 57.85 53.38 3f9h n ARG 60 Cb 0.10 -2.23 -0.16 0.00 -1.05 0.00 0.00 32.46 29.11 3f9h n ARG 60 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3f9h s LYS 61 N -3.59 3.12 0.73 2.89 -0.14 -0.40 -5.12 119.74 117.24 3f9h s LYS 61 Ca 0.61 -0.80 -0.02 0.00 -1.36 0.00 0.00 55.97 54.39 3f9h s LYS 61 Cb 0.49 -2.54 0.13 0.00 -1.68 0.00 0.00 37.83 34.23 3f9h s LYS 61 CO 0.04 -0.01 1.01 -1.54 -0.76 0.00 0.00 175.35 174.09 3f9h s SER 62 N 0.85 4.31 0.51 2.83 1.04 -1.26 -4.99 113.70 116.99 3f9h s SER 62 Ca -0.05 -0.24 0.21 0.00 0.48 0.00 0.00 55.95 56.34 3f9h s SER 62 Cb -0.15 -0.15 1.35 0.00 0.10 0.00 0.00 66.02 67.16 3f9h s SER 62 CO -0.02 -1.89 2.11 0.78 0.98 0.00 0.00 173.24 175.21 3f9h h ASN 63 N -0.60 0.00 0.69 7.02 2.35 -1.97 -2.81 115.58 120.25 3f9h h ASN 63 Ca -0.38 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.32 3f9h h ASN 63 Cb 1.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.63 3f9h h ASN 63 CO 0.42 0.08 -0.25 0.45 -1.65 0.00 0.00 177.43 176.48 3f9h h HIS 64 N 0.00 0.00 -0.02 1.19 3.86 -1.94 -3.21 115.15 115.03 3f9h h HIS 64 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3f9h h HIS 64 Cb 0.15 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.62 3f9h h HIS 64 CO 0.00 0.25 0.02 0.77 0.86 0.00 0.00 177.93 179.82 3f9h h SER 65 N 0.00 0.00 -3.09 2.45 0.02 -1.88 -3.41 113.55 107.64 3f9h h SER 65 Ca -0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.31 3f9h h SER 65 Cb 0.66 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.08 3f9h h SER 65 CO 0.03 0.00 -0.52 -0.36 -1.14 0.00 0.00 176.83 174.84 3f9h s PHE 66 N -4.74 3.39 -0.27 3.45 0.08 -1.21 -4.11 117.98 114.57 3f9h s PHE 66 Ca -0.05 0.30 0.03 0.00 0.12 0.00 0.00 56.93 57.33 3f9h s PHE 66 Cb 0.16 -2.03 0.07 0.00 -0.57 0.00 0.00 43.02 40.64 3f9h s PHE 66 CO 0.58 0.40 -0.07 -0.51 -0.10 0.00 0.00 175.22 175.52 3f9h s LEU 67 N -0.18 3.52 -0.26 -0.37 1.02 0.47 -4.79 118.68 118.08 3f9h s LEU 67 Ca 0.09 -1.51 -0.04 0.00 0.02 0.00 0.00 54.13 52.70 3f9h s LEU 67 Cb -0.12 -1.49 0.01 0.00 0.02 0.00 0.00 46.19 44.62 3f9h s LEU 67 CO 0.01 -0.24 -0.02 -0.69 0.02 0.00 0.00 176.35 175.43 3f9h s VAL 68 N 1.12 3.29 -0.02 -1.59 1.01 -1.26 -1.40 120.40 121.55 3f9h s VAL 68 Ca -0.04 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.17 3f9h s VAL 68 Cb -0.20 -2.64 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 3f9h s VAL 68 CO -0.06 0.21 -0.21 0.00 0.00 0.00 0.00 175.10 175.04 3f9h s GLN 69 N 1.41 1.80 -0.47 2.72 -2.07 -1.15 0.15 119.66 122.04 3f9h s GLN 69 Ca 0.02 -0.74 -0.11 0.00 -1.82 0.00 0.00 55.36 52.70 3f9h s GLN 69 Cb -0.16 -1.68 0.10 0.00 -1.09 0.00 0.00 33.01 30.18 3f9h s GLN 69 CO -0.02 0.41 0.35 0.00 -1.32 0.00 0.00 175.29 174.72 3f9h s ALA 70 N -0.38 3.43 0.00 2.60 0.00 -0.42 -2.97 121.76 124.01 3f9h s ALA 70 Ca 0.05 -2.37 0.00 0.00 0.00 0.00 0.00 51.96 49.64 3f9h s ALA 70 Cb -0.09 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.14 3f9h s ALA 70 CO 0.00 -1.83 0.00 0.41 0.00 0.00 0.00 175.76 174.34 3f9h n GLY 71 N 5.01 1.39 1.40 0.00 0.00 -1.26 -2.68 105.19 109.05 3f9h n GLY 71 Ca -0.10 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 3.02 0.14 -4.45 1.61 3.02 -1.26 -5.04 115.26 112.29 3f9h n ASN 72 Ca 0.00 0.07 -0.49 0.00 -0.03 0.00 0.00 54.58 54.13 3f9h n ASN 72 Cb 0.00 -0.01 -0.08 0.00 -0.61 0.00 0.00 39.78 39.09 3f9h n ASN 72 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3f9h n VAL 73 N -2.97 0.13 -2.92 2.41 0.31 -1.09 -4.89 118.33 109.31 3f9h n VAL 73 Ca 0.00 -0.28 -0.41 0.00 -0.01 0.00 0.00 64.34 63.64 3f9h n VAL 73 Cb 0.23 -1.60 -0.04 0.00 -0.91 0.00 0.00 33.84 31.52 3f9h n VAL 73 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 3f9h s GLN 74 N 6.70 4.40 0.29 5.55 0.74 -1.26 -1.31 119.66 134.77 3f9h s GLN 74 Ca 1.11 1.04 -0.22 0.00 0.05 0.00 0.00 55.36 57.34 3f9h s GLN 74 Cb -0.85 -3.50 -0.09 0.00 1.10 0.00 0.00 33.01 29.66 3f9h s GLN 74 CO 0.47 -0.12 0.84 -0.51 -0.55 0.00 0.00 175.29 175.43 3f9h s LEU 75 N 1.39 4.29 -0.22 3.68 1.43 0.39 -4.95 118.68 124.70 3f9h s LEU 75 Ca 0.40 1.61 -0.17 0.00 -1.03 0.00 0.00 54.13 54.95 3f9h s LEU 75 Cb -0.18 -3.88 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 3f9h s LEU 75 CO 0.18 -0.06 0.46 -0.60 0.23 0.00 0.00 176.35 176.56 3f9h s ARG 76 N -2.16 4.14 -0.39 1.70 3.52 -1.26 -4.16 118.95 120.34 3f9h s ARG 76 Ca 0.48 0.28 -0.20 0.00 -0.13 0.00 0.00 55.73 56.17 3f9h s ARG 76 Cb -0.17 -3.58 0.01 0.00 -1.56 0.00 0.00 34.95 29.66 3f9h s ARG 76 CO 0.21 -0.16 0.60 0.54 -0.81 0.00 0.00 175.30 175.69 3f9h s VAL 77 N 1.68 4.90 -0.21 7.11 0.11 -1.26 -1.31 120.40 131.42 3f9h s VAL 77 Ca 0.21 0.30 0.15 0.00 -2.93 0.00 0.00 61.98 59.71 3f9h s VAL 77 Cb -0.15 -4.11 0.58 0.00 -1.53 0.00 0.00 36.38 31.18 3f9h s VAL 77 CO 0.09 -0.42 1.50 2.30 -3.33 0.00 0.00 175.10 175.24 3f9h n ILE 78 N 5.66 2.43 0.00 7.04 -6.64 0.52 -4.72 119.36 123.65 3f9h n ILE 78 Ca -0.02 -1.89 0.00 0.00 -1.77 0.00 0.00 62.75 59.07 3f9h n ILE 78 Cb 0.48 -0.28 0.00 0.00 -1.44 0.00 0.00 39.64 38.41 3f9h n ILE 78 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3f9h n GLY 79 N -0.40 2.14 2.71 3.28 0.00 -1.16 -4.93 105.19 106.83 3f9h n GLY 79 Ca 0.25 -0.17 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.41 -0.18 0.47 1.61 -3.43 -1.26 -0.52 115.29 110.57 3f9h s HIS 80 Ca 0.00 -0.00 0.07 0.00 -0.80 0.00 0.00 55.06 54.33 3f9h s HIS 80 Cb 0.00 -0.47 0.01 0.00 -1.43 0.00 0.00 32.58 30.68 3f9h s HIS 80 CO 0.00 -0.65 0.41 -1.54 -2.00 0.00 0.00 174.74 170.96 3f9h s SER 81 N 2.28 4.89 -0.16 7.38 1.04 0.30 -4.99 113.70 124.45 3f9h s SER 81 Ca 0.07 -0.92 -0.01 0.00 0.48 0.00 0.00 55.95 55.56 3f9h s SER 81 Cb -0.16 -0.19 0.04 0.00 0.10 0.00 0.00 66.02 65.82 3f9h s SER 81 CO -0.16 -0.85 -0.02 -0.32 0.98 0.00 0.00 173.24 172.87 3f9h s MET 82 N -4.21 1.10 -0.35 4.02 1.75 -1.26 -1.54 119.30 118.82 3f9h s MET 82 Ca 0.45 -0.39 -0.10 0.00 -1.25 0.00 0.00 55.69 54.40 3f9h s MET 82 Cb -0.03 -1.85 0.02 0.00 2.84 0.00 0.00 34.83 35.81 3f9h s MET 82 CO 0.27 -0.46 0.17 -1.14 -0.65 0.00 0.00 175.02 173.21 3f9h s GLN 83 N 1.74 2.97 2.86 4.11 0.74 -1.01 -4.98 119.66 126.09 3f9h s GLN 83 Ca 0.01 -0.97 0.00 0.00 0.05 0.00 0.00 55.36 54.45 3f9h s GLN 83 Cb -0.15 -3.64 0.00 0.00 1.10 0.00 0.00 33.01 30.32 3f9h s GLN 83 CO -0.07 -0.60 0.00 0.09 -0.55 0.00 0.00 175.29 174.16 3f9h n ASN 84 N 4.97 0.00 -1.00 6.67 3.02 -1.26 -0.49 115.26 127.17 3f9h n ASN 84 Ca -0.13 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.48 3f9h n ASN 84 Cb 0.47 0.00 0.20 0.00 -0.61 0.00 0.00 39.78 39.84 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 -1.24 2.74 -0.20 0.00 1.43 0.35 -2.17 118.68 119.59 3f9h s LEU 86 Ca 0.29 -0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 52.47 3f9h s LEU 86 Cb 0.18 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 45.03 3f9h s LEU 86 CO 0.15 0.06 0.07 -0.76 0.23 0.00 0.00 176.35 176.10 3f9h s LEU 87 N -3.26 3.75 -0.46 1.79 1.43 0.08 -2.42 118.68 119.60 3f9h s LEU 87 Ca 0.27 0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 53.30 3f9h s LEU 87 Cb -0.07 -1.97 0.11 0.00 0.03 0.00 0.00 46.19 44.30 3f9h s LEU 87 CO 0.15 0.12 0.32 -0.13 0.23 0.00 0.00 176.35 177.03 3f9h s ARG 88 N 0.72 2.46 -0.34 1.70 0.52 -0.59 -2.83 118.95 120.60 3f9h s ARG 88 Ca 0.04 -1.72 -0.12 0.00 -0.52 0.00 0.00 55.73 53.41 3f9h s ARG 88 Cb -0.13 -3.87 -0.01 0.00 0.52 0.00 0.00 34.95 31.45 3f9h s ARG 88 CO 0.02 -1.14 0.22 -0.51 0.02 0.00 0.00 175.30 173.90 3f9h s LEU 89 N 1.35 4.45 -0.02 2.53 1.43 -0.68 -0.54 118.68 127.21 3f9h s LEU 89 Ca 0.05 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.36 3f9h s LEU 89 Cb -0.25 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 3f9h s LEU 89 CO -0.01 -0.24 1.10 -0.54 0.23 0.00 0.00 176.35 176.89 3f9h s LYS 90 N 1.69 4.44 0.35 1.70 1.02 0.32 -0.31 119.74 128.96 3f9h s LYS 90 Ca 0.05 1.57 0.08 0.00 0.02 0.00 0.00 55.97 57.69 3f9h s LYS 90 Cb -0.17 -3.48 -0.03 0.00 -0.52 0.00 0.00 37.83 33.62 3f9h s LYS 90 CO 0.09 -0.27 0.23 0.14 -0.92 0.00 0.00 175.35 174.62 3f9h s VAL 91 N 1.57 3.10 -2.00 3.17 -7.23 0.04 -0.35 120.40 118.70 3f9h s VAL 91 Ca 0.54 -1.54 0.02 0.00 -1.81 0.00 0.00 61.98 59.19 3f9h s VAL 91 Cb -0.24 -3.05 0.05 0.00 0.56 0.00 0.00 36.38 33.70 3f9h s VAL 91 CO 0.24 -0.14 0.90 -0.90 -0.31 0.00 0.00 175.10 174.89 3f9h n ASP 92 N -1.28 0.00 -3.77 4.85 5.75 -0.43 -4.77 116.55 116.91 3f9h n ASP 92 Ca -0.02 -1.61 -0.13 0.00 -0.01 0.00 0.00 54.79 53.03 3f9h n ASP 92 Cb 0.61 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.58 3f9h n ASP 92 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3f9h s THR 93 N -2.00 -0.01 0.03 2.12 2.01 -1.26 -5.05 115.64 111.48 3f9h s THR 93 Ca 0.03 0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 3f9h s THR 93 Cb 0.01 -0.39 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 3f9h s THR 93 CO 0.02 0.02 0.95 -0.44 -0.69 0.00 0.00 174.62 174.48 3f9h s SER 94 N 0.45 7.39 -0.20 3.53 0.01 -1.26 -4.26 113.70 119.36 3f9h s SER 94 Ca -0.03 1.67 -0.35 0.00 1.31 0.00 0.00 55.95 58.56 3f9h s SER 94 Cb -0.04 -2.57 -0.12 0.00 0.21 0.00 0.00 66.02 63.51 3f9h s SER 94 CO -0.02 -0.18 1.98 -3.20 0.41 0.00 0.00 173.24 172.23 3f9h n ASN 95 N 3.50 2.91 0.25 2.44 2.85 0.15 -4.83 115.26 122.53 3f9h n ASN 95 Ca 0.04 0.76 0.17 0.00 -0.11 0.00 0.00 54.58 55.44 3f9h n ASN 95 Cb 0.50 -1.32 0.71 0.00 1.24 0.00 0.00 39.78 40.91 3f9h n ASN 95 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3f9h h PRO 96 N 10.38 0.00 -0.60 1.20 0.11 -1.94 -2.70 132.00 138.45 3f9h h PRO 96 Ca -0.42 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.56 3f9h h PRO 96 Cb 1.29 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.32 3f9h h PRO 96 CO 0.97 0.00 0.15 1.63 -0.21 0.00 0.00 178.00 180.54 3f9h n LYS 97 N -2.88 3.74 -1.98 1.05 5.02 -1.26 -4.98 118.16 116.87 3f9h n LYS 97 Ca 0.00 -3.08 -0.42 0.00 -2.02 0.00 0.00 58.31 52.79 3f9h n LYS 97 Cb 0.25 -2.15 -0.03 0.00 -0.02 0.00 0.00 35.03 33.09 3f9h n LYS 97 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3f9h s THR 98 N -2.94 3.53 0.77 -0.18 2.01 -1.02 -4.80 115.64 113.01 3f9h s THR 98 Ca 0.52 0.64 -0.07 0.00 0.31 0.00 0.00 61.69 63.09 3f9h s THR 98 Cb 0.42 -3.43 0.11 0.00 0.01 0.00 0.00 72.50 69.61 3f9h s THR 98 CO 0.12 -0.08 1.08 -2.16 -0.69 0.00 0.00 174.62 172.90 3f9h s PRO 99 N 4.18 1.69 0.07 4.92 0.04 -1.26 -5.01 135.00 139.63 3f9h s PRO 99 Ca 0.75 -0.51 -0.31 0.00 0.04 0.00 0.00 61.00 60.98 3f9h s PRO 99 Cb -0.33 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 31.99 3f9h s PRO 99 CO 0.31 -1.57 1.66 0.21 0.04 0.00 0.00 177.00 177.65 3f9h s LYS 100 N -5.37 4.19 0.09 4.56 2.20 -1.26 -4.95 119.74 119.20 3f9h s LYS 100 Ca 0.65 2.35 -0.00 0.00 -0.36 0.00 0.00 55.97 58.60 3f9h s LYS 100 Cb -0.08 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.60 3f9h s LYS 100 CO 0.47 -0.74 -0.02 1.52 -0.36 0.00 0.00 175.35 176.21 3f9h s TYR 101 N 2.65 0.73 0.03 4.03 -0.85 -1.26 -0.05 117.35 122.62 3f9h s TYR 101 Ca 0.74 -1.06 -0.01 0.00 -0.52 0.00 0.00 57.07 56.22 3f9h s TYR 101 Cb -0.40 -0.46 -0.02 0.00 0.38 0.00 0.00 41.96 41.46 3f9h s TYR 101 CO 0.32 -0.34 -0.01 0.15 -1.52 0.00 0.00 175.55 174.16 3f9h s LYS 102 N -3.92 0.44 -0.16 -3.49 1.02 0.22 -4.86 119.74 108.99 3f9h s LYS 102 Ca 0.13 -0.80 -0.06 0.00 0.02 0.00 0.00 55.97 55.26 3f9h s LYS 102 Cb 0.07 0.16 -0.04 0.00 -0.52 0.00 0.00 37.83 37.50 3f9h s LYS 102 CO -0.05 -0.08 0.05 -0.06 -0.92 0.00 0.00 175.35 174.28 3f9h s PHE 103 N -2.31 3.25 0.09 3.18 2.99 -1.26 -0.82 117.98 123.09 3f9h s PHE 103 Ca -0.08 0.09 0.02 0.00 0.00 0.00 0.00 56.93 56.97 3f9h s PHE 103 Cb -0.04 -2.01 -0.04 0.00 0.00 0.00 0.00 43.02 40.93 3f9h s PHE 103 CO -0.04 0.24 -0.07 0.14 -0.00 0.00 0.00 175.22 175.48 3f9h s VAL 104 N 0.05 0.72 -0.24 -0.44 -7.23 -0.36 -4.96 120.40 107.94 3f9h s VAL 104 Ca 0.05 -1.83 0.01 0.00 -1.81 0.00 0.00 61.98 58.40 3f9h s VAL 104 Cb -0.12 -1.55 0.04 0.00 0.56 0.00 0.00 36.38 35.31 3f9h s VAL 104 CO 0.01 -0.79 -0.10 -0.60 -0.31 0.00 0.00 175.10 173.31 3f9h s ARG 105 N -3.50 2.63 0.20 4.82 3.52 -1.26 -4.30 118.95 121.06 3f9h s ARG 105 Ca 0.09 -1.10 -0.06 0.00 -0.13 0.00 0.00 55.73 54.53 3f9h s ARG 105 Cb 0.03 -2.88 -0.06 0.00 -1.56 0.00 0.00 34.95 30.48 3f9h s ARG 105 CO -0.03 -0.44 0.46 0.96 -0.81 0.00 0.00 175.30 175.44 3f9h s ILE 106 N 1.23 5.07 0.47 4.11 -5.25 -1.26 -5.08 121.20 120.49 3f9h s ILE 106 Ca -0.02 0.14 -0.22 0.00 -0.99 0.00 0.00 60.65 59.55 3f9h s ILE 106 Cb -0.17 -3.65 -0.07 0.00 2.95 0.00 0.00 42.46 41.51 3f9h s ILE 106 CO -0.06 -0.08 1.13 -1.10 -1.79 0.00 0.00 174.94 173.03 3f9h s GLN 107 N -2.94 3.76 0.11 0.37 1.11 -1.26 -4.98 119.66 115.83 3f9h s GLN 107 Ca 0.43 1.66 -0.31 0.00 0.01 0.00 0.00 55.36 57.15 3f9h s GLN 107 Cb -0.11 -2.33 -0.10 0.00 -1.01 0.00 0.00 33.01 29.46 3f9h s GLN 107 CO 0.25 -0.52 1.74 -2.14 0.01 0.00 0.00 175.29 174.63 3f9h s PRO 108 N -2.82 4.16 0.00 2.91 0.02 -1.26 -2.18 135.00 135.84 3f9h s PRO 108 Ca 0.65 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.15 3f9h s PRO 108 Cb -0.25 -3.55 0.00 0.00 0.02 0.00 0.00 34.50 30.72 3f9h s PRO 108 CO 0.31 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 3f9h n GLY 109 N 4.11 0.69 3.94 0.52 0.00 0.12 -4.84 105.19 109.73 3f9h n GLY 109 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.59 3.33 0.17 1.61 -0.21 -0.92 -4.79 119.66 118.25 3f9h s GLN 110 Ca 0.00 -0.32 0.07 0.00 0.02 0.00 0.00 55.36 55.13 3f9h s GLN 110 Cb 0.00 -2.58 -0.04 0.00 1.00 0.00 0.00 33.01 31.39 3f9h s GLN 110 CO 0.00 -0.07 0.00 0.95 -2.12 0.00 0.00 175.29 174.06 3f9h s THR 111 N -2.47 3.75 0.08 -0.19 -4.23 -1.26 -1.03 115.64 110.29 3f9h s THR 111 Ca 0.44 -1.39 -0.26 0.00 -1.18 0.00 0.00 61.69 59.30 3f9h s THR 111 Cb -0.10 -2.88 0.08 0.00 1.34 0.00 0.00 72.50 70.94 3f9h s THR 111 CO 0.38 -0.10 0.72 0.72 -0.54 0.00 0.00 174.62 175.81 3f9h s PHE 112 N -1.71 -0.47 -0.00 3.99 -0.12 -0.56 -4.92 117.98 114.19 3f9h s PHE 112 Ca 0.27 0.35 -0.17 0.00 -0.05 0.00 0.00 56.93 57.33 3f9h s PHE 112 Cb -0.09 0.54 -0.06 0.00 -0.63 0.00 0.00 43.02 42.78 3f9h s PHE 112 CO 0.19 -0.71 0.47 -1.12 -0.05 0.00 0.00 175.22 174.00 3f9h s SER 113 N -2.50 6.86 -0.11 1.98 0.01 0.08 -2.05 113.70 117.97 3f9h s SER 113 Ca 0.02 1.02 -0.01 0.00 1.31 0.00 0.00 55.95 58.29 3f9h s SER 113 Cb -0.01 -2.29 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 3f9h s SER 113 CO -0.10 0.25 -0.08 -0.69 0.41 0.00 0.00 173.24 173.03 3f9h s VAL 114 N -0.75 3.52 -0.61 3.43 1.01 -0.48 -0.55 120.40 125.96 3f9h s VAL 114 Ca 0.26 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.62 3f9h s VAL 114 Cb -0.17 -2.48 0.16 0.00 0.00 0.00 0.00 36.38 33.89 3f9h s VAL 114 CO 0.14 0.55 0.50 -0.22 0.00 0.00 0.00 175.10 176.07 3f9h s LEU 115 N -0.12 5.98 0.23 3.92 2.96 -0.60 -2.65 118.68 128.40 3f9h s LEU 115 Ca 0.01 -2.28 -0.30 0.00 -0.22 0.00 0.00 54.13 51.34 3f9h s LEU 115 Cb -0.13 -2.07 -0.09 0.00 0.50 0.00 0.00 46.19 44.40 3f9h s LEU 115 CO 0.03 -0.63 1.30 0.00 -1.32 0.00 0.00 176.35 175.73 3f9h s ALA 116 N 0.81 3.51 0.01 5.97 0.00 -0.71 -3.78 121.76 127.57 3f9h s ALA 116 Ca 0.11 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.20 3f9h s ALA 116 Cb -0.21 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.43 3f9h s ALA 116 CO -0.03 -0.53 -0.02 0.00 0.00 0.00 0.00 175.76 175.18 3f9h s TYR 118 N -0.38 3.42 -1.15 0.00 5.04 0.08 -4.19 117.35 120.17 3f9h s TYR 118 Ca -0.03 -2.06 -0.17 0.00 -2.44 0.00 0.00 57.07 52.36 3f9h s TYR 118 Cb -0.03 -2.70 -0.01 0.00 0.35 0.00 0.00 41.96 39.57 3f9h s TYR 118 CO -0.00 -0.88 0.78 0.09 -1.34 0.00 0.00 175.55 174.20 3f9h n ASN 119 N 4.64 -4.91 0.00 4.32 3.02 -1.26 -2.77 115.26 118.30 3f9h n ASN 119 Ca -0.08 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.50 3f9h n ASN 119 Cb 0.43 -3.57 0.00 0.00 -0.61 0.00 0.00 39.78 36.03 3f9h n ASN 119 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f9h n GLY 120 N -1.65 2.03 3.65 7.41 0.00 -1.26 -4.63 105.19 110.73 3f9h n GLY 120 Ca -0.11 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 6.73 0.02 1.61 0.15 -1.11 -4.49 113.70 116.61 3f9h s SER 121 Ca 0.00 1.81 -0.30 0.00 0.70 0.00 0.00 55.95 58.16 3f9h s SER 121 Cb 0.00 -2.54 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 3f9h s SER 121 CO 0.00 -0.93 1.75 -2.84 1.20 0.00 0.00 173.24 172.42 3f9h s PRO 122 N 3.95 4.17 0.00 5.44 0.02 -1.26 -0.75 135.00 146.58 3f9h s PRO 122 Ca 0.64 2.38 0.00 0.00 0.02 0.00 0.00 61.00 64.04 3f9h s PRO 122 Cb -0.26 -3.88 0.00 0.00 0.02 0.00 0.00 34.50 30.38 3f9h s PRO 122 CO 0.23 -0.84 0.00 0.45 -0.33 0.00 0.00 177.00 176.51 3f9h n SER 123 N 6.64 0.00 -3.79 2.53 2.88 0.99 -4.91 113.62 117.95 3f9h n SER 123 Ca 0.18 0.11 -0.23 0.00 -1.33 0.00 0.00 58.87 57.60 3f9h n SER 123 Cb 0.41 -0.24 -0.08 0.00 -0.75 0.00 0.00 64.21 63.55 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 -1.73 2.46 -0.02 0.46 0.00 -1.17 -5.02 107.32 102.31 3f9h s GLY 124 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 44.72 43.13 3f9h s GLY 124 CO 0.00 -1.66 0.01 0.54 0.00 0.00 0.00 173.10 171.99 3f9h s VAL 125 N -3.34 0.01 0.09 1.40 0.11 -1.26 -1.73 120.40 115.67 3f9h s VAL 125 Ca 0.31 0.13 -0.04 0.00 -2.93 0.00 0.00 61.98 59.45 3f9h s VAL 125 Cb 0.03 -0.10 -0.03 0.00 -1.53 0.00 0.00 36.38 34.75 3f9h s VAL 125 CO 0.20 0.08 0.07 -0.72 -3.33 0.00 0.00 175.10 171.39 3f9h s TYR 126 N 0.74 0.50 -0.13 1.54 -0.85 -1.08 -4.94 117.35 113.12 3f9h s TYR 126 Ca -0.06 -0.97 -0.06 0.00 -0.52 0.00 0.00 57.07 55.46 3f9h s TYR 126 Cb -0.09 -0.30 -0.04 0.00 0.38 0.00 0.00 41.96 41.91 3f9h s TYR 126 CO -0.02 -0.48 0.10 -1.14 -1.52 0.00 0.00 175.55 172.49 3f9h s GLN 127 N -3.94 3.51 0.18 -3.49 2.00 -1.26 -1.39 119.66 115.27 3f9h s GLN 127 Ca 0.11 -0.23 -0.10 0.00 -2.00 0.00 0.00 55.36 53.14 3f9h s GLN 127 Cb 0.07 -3.14 -0.00 0.00 0.80 0.00 0.00 33.01 30.73 3f9h s GLN 127 CO -0.07 0.64 0.33 0.00 -0.50 0.00 0.00 175.29 175.69 3f9h s ALA 129 N -3.96 2.52 -0.26 0.00 0.00 -1.26 -1.50 121.76 117.30 3f9h s ALA 129 Ca 0.17 -1.12 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 3f9h s ALA 129 Cb 0.02 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 3f9h s ALA 129 CO 0.01 0.56 1.92 1.41 0.00 0.00 0.00 175.76 179.66 3f9h s MET 130 N -1.07 3.36 0.61 0.00 0.00 -0.19 -4.84 119.30 117.16 3f9h s MET 130 Ca 0.13 1.70 -0.19 0.00 0.00 0.00 0.00 55.69 57.33 3f9h s MET 130 Cb -0.10 -4.23 -0.03 0.00 0.00 0.00 0.00 34.83 30.46 3f9h s MET 130 CO 0.03 -1.83 1.26 0.54 0.00 0.00 0.00 175.02 175.02 3f9h n ARG 131 N 8.41 1.25 0.25 4.11 5.12 -0.73 0.15 116.66 135.21 3f9h n ARG 131 Ca 0.25 0.48 0.18 0.00 -1.93 0.00 0.00 57.85 56.82 3f9h n ARG 131 Cb 0.46 -2.49 0.89 0.00 -1.16 0.00 0.00 32.46 30.16 3f9h n ARG 131 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3f9h h PRO 132 N 0.79 0.00 -0.70 5.56 0.11 -1.88 0.22 132.00 136.10 3f9h h PRO 132 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3f9h h PRO 132 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3f9h h PRO 132 CO 0.54 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.60 3f9h n ASN 133 N -3.52 3.53 -3.40 -2.05 2.04 -1.26 -4.93 115.26 105.68 3f9h n ASN 133 Ca 0.00 -2.45 -0.19 0.00 -0.44 0.00 0.00 54.58 51.51 3f9h n ASN 133 Cb 0.31 -0.55 0.08 0.00 -2.53 0.00 0.00 39.78 37.09 3f9h n ASN 133 CO 0.00 0.00 0.00 1.41 -0.44 0.00 0.00 177.26 178.23 3f9h n HIS 134 N 0.45 -2.36 -4.37 -2.53 8.25 0.77 -4.55 115.22 110.88 3f9h n HIS 134 Ca 0.16 0.93 -0.19 0.00 -0.26 0.00 0.00 57.72 58.37 3f9h n HIS 134 Cb 0.73 -4.95 -0.10 0.00 1.12 0.00 0.00 29.99 26.78 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 -3.33 0.77 -0.05 1.59 -4.23 -1.24 -4.63 115.64 104.51 3f9h s THR 135 Ca 0.21 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 3f9h s THR 135 Cb -0.09 -2.67 0.02 0.00 1.34 0.00 0.00 72.50 71.10 3f9h s THR 135 CO 0.70 0.00 -0.03 -0.63 -0.54 0.00 0.00 174.62 174.13 3f9h s ILE 136 N -3.56 0.46 0.67 2.99 1.09 -0.39 -1.78 121.20 120.68 3f9h s ILE 136 Ca 0.37 -0.03 -0.13 0.00 -1.10 0.00 0.00 60.65 59.75 3f9h s ILE 136 Cb 0.08 -0.53 0.00 0.00 -1.06 0.00 0.00 42.46 40.95 3f9h s ILE 136 CO 0.15 0.23 1.08 -0.54 -0.10 0.00 0.00 174.94 175.75 3f9h s LYS 137 N 1.27 2.90 0.00 2.79 1.02 -1.26 0.50 119.74 126.96 3f9h s LYS 137 Ca -0.06 1.17 0.00 0.00 0.02 0.00 0.00 55.97 57.11 3f9h s LYS 137 Cb -0.14 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 3f9h s LYS 137 CO -0.02 -1.14 0.00 0.41 -0.92 0.00 0.00 175.35 173.68 3f9h n GLY 138 N -1.19 -2.22 0.00 -3.33 0.00 -1.22 -4.84 105.19 92.40 3f9h n GLY 138 Ca 0.09 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 2.06 0.03 -0.04 1.61 3.41 -1.26 -4.68 113.62 114.75 3f9h n SER 139 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 3f9h n SER 139 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 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 -0.73 -0.02 0.00 7.33 0.00 -1.95 -3.37 119.26 120.51 3f9h h ALA 140 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3f9h h ALA 140 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3f9h h ALA 140 CO 0.00 -0.11 -0.34 1.25 0.00 0.00 0.00 179.25 180.05 3f9h h LEU 141 N -0.83 0.00 -1.83 0.00 5.85 -1.99 -3.32 115.31 113.19 3f9h h LEU 141 Ca -0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3f9h h LEU 141 Cb 0.75 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.78 3f9h h LEU 141 CO 0.00 0.01 0.00 0.59 -0.34 0.00 0.00 178.44 178.70 3f9h n ASN 142 N -2.80 0.28 0.00 1.25 5.03 -1.26 -3.80 115.26 113.97 3f9h n ASN 142 Ca 0.03 -0.21 0.00 0.00 0.87 0.00 0.00 54.58 55.27 3f9h n ASN 142 Cb 0.52 -0.05 0.00 0.00 -1.02 0.00 0.00 39.78 39.22 3f9h n ASN 142 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3f9h n GLY 143 N 0.86 0.06 3.77 7.41 0.00 -1.26 -4.73 105.19 111.31 3f9h n GLY 143 Ca 0.00 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 3f9h n GLY 143 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3f9h s SER 144 N 0.00 6.71 0.45 1.61 0.15 -1.25 -4.84 113.70 116.53 3f9h s SER 144 Ca 0.00 2.67 -0.23 0.00 0.70 0.00 0.00 55.95 59.09 3f9h s SER 144 Cb 0.00 -2.65 -0.11 0.00 -1.71 0.00 0.00 66.02 61.56 3f9h s SER 144 CO 0.00 -0.57 0.81 0.00 1.20 0.00 0.00 173.24 174.68 3f9h n GLY 146 N 1.44 2.57 3.68 0.00 0.00 -0.85 -2.26 105.19 109.77 3f9h n GLY 146 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 2.23 -4.58 1.61 7.64 -0.86 -4.49 113.62 115.17 3f9h n SER 147 Ca 0.00 1.09 -0.33 0.00 1.01 0.00 0.00 58.87 60.64 3f9h n SER 147 Cb 0.00 -1.47 -0.11 0.00 -1.01 0.00 0.00 64.21 61.63 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 -1.22 3.61 -0.06 0.44 -7.23 -1.25 -1.54 120.40 113.15 3f9h s VAL 148 Ca 0.62 -0.71 -0.01 0.00 -1.81 0.00 0.00 61.98 60.06 3f9h s VAL 148 Cb -0.52 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 33.85 3f9h s VAL 148 CO 0.57 0.45 0.02 -0.83 -0.31 0.00 0.00 175.10 175.00 3f9h s GLY 149 N -1.24 1.90 0.18 2.32 0.00 0.16 -1.55 107.32 109.08 3f9h s GLY 149 Ca 0.16 -0.83 -0.20 0.00 0.00 0.00 0.00 44.72 43.85 3f9h s GLY 149 CO 0.06 -0.62 0.55 -0.11 0.00 0.00 0.00 173.10 172.98 3f9h s PHE 150 N -0.97 -0.30 0.26 1.90 -0.12 0.29 -1.17 117.98 117.87 3f9h s PHE 150 Ca 0.16 -0.00 0.06 0.00 -0.05 0.00 0.00 56.93 57.09 3f9h s PHE 150 Cb -0.11 0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 42.69 3f9h s PHE 150 CO 0.05 -0.89 -0.05 -0.80 -0.05 0.00 0.00 175.22 173.48 3f9h s ASN 151 N -2.82 2.46 -0.12 1.98 0.01 0.54 -0.74 114.94 116.26 3f9h s ASN 151 Ca 0.05 -1.18 -0.01 0.00 -0.71 0.00 0.00 52.86 51.02 3f9h s ASN 151 Cb -0.01 -0.11 0.03 0.00 0.41 0.00 0.00 41.25 41.56 3f9h s ASN 151 CO -0.07 -0.37 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.45 3f9h s ILE 152 N -3.13 0.99 -0.37 0.60 1.01 -1.26 -0.51 121.20 118.53 3f9h s ILE 152 Ca 0.28 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.66 3f9h s ILE 152 Cb 0.04 -1.05 0.11 0.00 0.01 0.00 0.00 42.46 41.57 3f9h s ILE 152 CO 0.10 0.32 0.09 -1.81 0.00 0.00 0.00 174.94 173.65 3f9h s ASP 153 N 1.72 4.75 1.70 3.58 1.01 -0.28 -5.01 116.67 124.14 3f9h s ASP 153 Ca 0.04 -2.27 0.00 0.00 0.71 0.00 0.00 52.55 51.03 3f9h s ASP 153 Cb -0.13 -1.65 0.00 0.00 1.01 0.00 0.00 42.92 42.15 3f9h s ASP 153 CO -0.08 -0.37 0.00 -1.22 0.21 0.00 0.00 175.17 173.71 3f9h n TYR 154 N 4.11 0.00 0.22 4.23 4.02 -1.26 -1.53 117.16 126.96 3f9h n TYR 154 Ca 0.04 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.01 3f9h n TYR 154 Cb 0.41 0.00 0.48 0.00 -0.02 0.00 0.00 39.34 40.21 3f9h n TYR 154 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 176.86 176.23 3f9h h ASP 155 N 0.00 0.00 -2.96 7.72 2.03 -1.96 -3.45 116.42 117.80 3f9h h ASP 155 Ca 0.00 0.00 -0.62 0.00 -0.73 0.00 0.00 57.03 55.68 3f9h h ASP 155 Cb 0.00 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 38.43 3f9h h ASP 155 CO 0.00 0.26 -0.32 0.00 -1.03 0.00 0.00 179.24 178.15 3f9h s VAL 157 N -0.71 5.00 -0.57 0.00 1.01 0.92 -1.12 120.40 124.93 3f9h s VAL 157 Ca 0.19 -0.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.82 3f9h s VAL 157 Cb -0.14 -3.49 0.11 0.00 0.00 0.00 0.00 36.38 32.85 3f9h s VAL 157 CO 0.08 0.12 0.64 -0.44 0.00 0.00 0.00 175.10 175.50 3f9h s SER 158 N 1.69 6.19 0.32 3.32 0.01 0.34 -0.61 113.70 124.96 3f9h s SER 158 Ca 0.06 -1.51 -0.27 0.00 1.31 0.00 0.00 55.95 55.53 3f9h s SER 158 Cb -0.17 -2.27 -0.09 0.00 0.21 0.00 0.00 66.02 63.70 3f9h s SER 158 CO 0.09 -1.03 1.03 -0.36 0.41 0.00 0.00 173.24 173.38 3f9h s PHE 159 N 2.37 3.57 0.00 2.43 0.08 -0.00 -0.34 117.98 126.09 3f9h s PHE 159 Ca 0.09 1.73 0.00 0.00 0.12 0.00 0.00 56.93 58.87 3f9h s PHE 159 Cb -0.26 -3.13 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 3f9h s PHE 159 CO 0.06 -0.30 0.00 0.00 -0.10 0.00 0.00 175.22 174.88 3f9h s TYR 161 N 0.00 -0.38 -0.04 0.00 5.04 -1.09 -4.26 117.35 116.63 3f9h s TYR 161 Ca 0.00 0.87 0.01 0.00 -2.44 0.00 0.00 57.07 55.51 3f9h s TYR 161 Cb 0.00 0.14 0.02 0.00 0.35 0.00 0.00 41.96 42.47 3f9h s TYR 161 CO 0.00 -0.25 -0.02 1.41 -1.34 0.00 0.00 175.55 175.35 3f9h s MET 162 N -0.13 0.58 0.28 4.97 -2.45 -0.50 0.38 119.30 122.43 3f9h s MET 162 Ca -0.03 -0.02 -0.29 0.00 -1.25 0.00 0.00 55.69 54.09 3f9h s MET 162 Cb -0.03 -0.67 -0.10 0.00 1.25 0.00 0.00 34.83 35.28 3f9h s MET 162 CO 0.01 -0.10 1.33 -1.58 1.05 0.00 0.00 175.02 175.73 3f9h s HIS 163 N 0.95 3.11 0.00 4.11 2.46 -0.59 -2.00 115.29 123.33 3f9h s HIS 163 Ca -0.11 1.29 0.00 0.00 0.47 0.00 0.00 55.06 56.72 3f9h s HIS 163 Cb -0.14 -3.68 0.00 0.00 -0.13 0.00 0.00 32.58 28.63 3f9h s HIS 163 CO -0.01 -2.00 0.00 0.72 -2.47 0.00 0.00 174.74 170.98 3f9h n HIS 164 N 1.57 0.00 -4.50 3.88 8.25 -0.64 -2.00 115.22 121.77 3f9h n HIS 164 Ca 0.03 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.28 3f9h n HIS 164 Cb 0.42 0.21 -0.15 0.00 1.12 0.00 0.00 29.99 31.58 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 -1.91 0.93 -0.25 -0.41 -1.94 -0.80 -4.91 119.30 110.00 3f9h s MET 165 Ca 0.00 -0.42 -0.12 0.00 -1.71 0.00 0.00 55.69 53.44 3f9h s MET 165 Cb 0.00 -0.90 -0.05 0.00 2.01 0.00 0.00 34.83 35.90 3f9h s MET 165 CO 0.00 0.25 0.23 -2.00 -0.01 0.00 0.00 175.02 173.49 3f9h s GLU 166 N -0.29 4.04 0.48 2.03 2.12 -1.26 -1.57 118.70 124.26 3f9h s GLU 166 Ca 0.04 -0.17 -0.06 0.00 0.36 0.00 0.00 54.97 55.14 3f9h s GLU 166 Cb -0.04 -3.59 -0.04 0.00 0.26 0.00 0.00 34.13 30.72 3f9h s GLU 166 CO -0.00 -0.07 0.80 -0.51 -0.54 0.00 0.00 175.26 174.94 3f9h s LEU 167 N 1.43 3.62 0.13 2.70 2.01 0.38 -5.01 118.68 123.94 3f9h s LEU 167 Ca 0.10 0.99 -0.32 0.00 0.01 0.00 0.00 54.13 54.91 3f9h s LEU 167 Cb -0.15 -3.95 -0.11 0.00 0.01 0.00 0.00 46.19 42.00 3f9h s LEU 167 CO 0.08 -0.58 1.54 1.55 1.01 0.00 0.00 176.35 179.94 3f9h h PRO 168 N 0.30 -0.36 -0.66 1.29 0.13 -1.92 -2.02 132.00 128.76 3f9h h PRO 168 Ca -0.47 0.02 0.19 0.00 -0.87 0.00 0.00 66.00 64.88 3f9h h PRO 168 Cb 1.20 0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 3f9h h PRO 168 CO 0.62 -0.24 0.85 1.79 -0.23 0.00 0.00 178.00 180.79 3f9h h THR 169 N -0.37 0.13 0.00 1.56 1.35 -1.98 -3.43 112.91 110.18 3f9h h THR 169 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 3f9h h THR 169 Cb 0.58 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 3f9h h THR 169 CO -0.61 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.27 3f9h n GLY 170 N -1.58 0.89 3.93 5.82 0.00 -0.76 -5.09 105.19 108.40 3f9h n GLY 170 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 3f9h n GLY 170 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3f9h s VAL 171 N -2.00 2.68 -0.00 1.61 -7.23 -1.25 -3.37 120.40 110.83 3f9h s VAL 171 Ca 0.00 -0.22 0.06 0.00 -1.81 0.00 0.00 61.98 60.01 3f9h s VAL 171 Cb 0.00 -3.12 -0.02 0.00 0.56 0.00 0.00 36.38 33.80 3f9h s VAL 171 CO 0.00 -0.13 -0.20 -1.00 -0.31 0.00 0.00 175.10 173.46 3f9h s HIS 172 N -3.14 1.76 0.07 2.82 0.09 0.18 -0.47 115.29 116.61 3f9h s HIS 172 Ca 0.58 -0.34 0.07 0.00 -0.00 0.00 0.00 55.06 55.37 3f9h s HIS 172 Cb -0.11 -1.12 -0.04 0.00 -0.00 0.00 0.00 32.58 31.32 3f9h s HIS 172 CO 0.44 -0.01 -0.15 0.00 -0.00 0.00 0.00 174.74 175.03 3f9h s ALA 173 N -0.53 2.76 0.10 -1.40 0.00 -0.61 -1.26 121.76 120.83 3f9h s ALA 173 Ca 0.07 -1.23 -0.00 0.00 0.00 0.00 0.00 51.96 50.80 3f9h s ALA 173 Cb -0.08 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.24 3f9h s ALA 173 CO -0.00 0.60 0.13 0.41 0.00 0.00 0.00 175.76 176.90 3f9h n GLY 174 N 1.11 3.01 3.60 0.00 0.00 -1.26 -1.63 105.19 110.02 3f9h n GLY 174 Ca -0.15 -1.49 -0.27 0.00 0.00 0.00 0.00 46.02 44.10 3f9h n GLY 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3f9h s THR 175 N -2.51 1.83 0.74 2.61 -4.23 -0.84 -1.69 115.64 111.55 3f9h s THR 175 Ca 0.09 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.48 3f9h s THR 175 Cb -0.00 -2.93 0.03 0.00 1.34 0.00 0.00 72.50 70.94 3f9h s THR 175 CO 0.06 0.00 1.08 1.51 -0.54 0.00 0.00 174.62 176.74 3f9h s ASP 176 N -3.68 5.07 0.00 3.99 1.47 -0.98 -1.41 116.67 121.13 3f9h s ASP 176 Ca 0.34 1.32 0.00 0.00 1.18 0.00 0.00 52.55 55.39 3f9h s ASP 176 Cb 0.09 -2.13 0.00 0.00 -0.34 0.00 0.00 42.92 40.55 3f9h s ASP 176 CO 0.17 -1.60 0.36 0.18 0.68 0.00 0.00 175.17 174.95 3f9h n LEU 177 N -3.20 0.89 -0.06 2.11 7.99 -1.26 -0.50 117.00 122.97 3f9h n LEU 177 Ca 0.07 -0.44 -0.06 0.00 -0.01 0.00 0.00 56.01 55.56 3f9h n LEU 177 Cb 0.56 -0.27 -0.10 0.00 -0.11 0.00 0.00 43.42 43.49 3f9h n LEU 177 CO 0.57 0.18 -0.92 1.21 -1.51 0.00 0.00 177.39 176.92 3f9h n GLU 178 N 0.39 1.86 0.00 3.23 2.13 -1.26 -5.03 120.64 121.96 3f9h n GLU 178 Ca 0.00 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.81 3f9h n GLU 178 Cb 0.18 -1.33 0.00 0.00 0.27 0.00 0.00 31.44 30.56 3f9h n GLU 178 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3f9h n GLY 179 N 2.19 1.06 3.56 8.31 0.00 0.35 -4.50 105.19 116.16 3f9h n GLY 179 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 3f9h n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f9h s LYS 180 N -0.16 3.71 0.67 1.61 1.02 -1.26 -1.96 119.74 123.38 3f9h s LYS 180 Ca 0.00 -0.28 -0.17 0.00 0.02 0.00 0.00 55.97 55.54 3f9h s LYS 180 Cb 0.00 -3.76 -0.04 0.00 -0.52 0.00 0.00 37.83 33.51 3f9h s LYS 180 CO 0.00 -0.44 0.69 1.19 -0.92 0.00 0.00 175.35 175.87 3f9h n PHE 181 N 5.37 -0.22 -3.27 3.18 3.01 -1.26 -2.31 117.46 121.95 3f9h n PHE 181 Ca -0.09 0.39 -0.39 0.00 1.01 0.00 0.00 57.45 58.37 3f9h n PHE 181 Cb 0.50 -1.99 -0.06 0.00 -0.01 0.00 0.00 39.48 37.92 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 -1.79 3.78 0.05 1.38 2.02 -0.68 -4.84 117.35 117.27 3f9h s TYR 182 Ca 0.70 1.25 0.00 0.00 -0.37 0.00 0.00 57.07 58.65 3f9h s TYR 182 Cb -0.38 -2.51 0.00 0.00 -0.40 0.00 0.00 41.96 38.67 3f9h s TYR 182 CO 0.54 0.55 0.00 0.41 -1.57 0.00 0.00 175.55 175.48 3f9h n GLY 183 N 1.85 -1.86 1.58 0.71 0.00 -1.26 -4.22 105.19 101.99 3f9h n GLY 183 Ca -0.10 -1.32 -0.08 0.00 0.00 0.00 0.00 46.02 44.52 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 -1.30 1.41 -3.77 1.61 -0.04 -1.26 -4.93 135.00 126.72 3f9h n PRO 184 Ca 0.00 -0.85 -0.32 0.00 -0.04 0.00 0.00 63.50 62.29 3f9h n PRO 184 Cb 0.10 -1.33 -0.05 0.00 -0.04 0.00 0.00 33.50 32.18 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 -0.97 3.51 0.02 0.54 0.08 -1.26 -4.96 117.98 114.94 3f9h s PHE 185 Ca 0.17 0.46 0.03 0.00 0.12 0.00 0.00 56.93 57.71 3f9h s PHE 185 Cb 0.13 -1.92 -0.02 0.00 -0.57 0.00 0.00 43.02 40.64 3f9h s PHE 185 CO 0.01 0.52 -0.11 0.14 -0.10 0.00 0.00 175.22 175.69 3f9h s VAL 186 N -1.53 0.82 -1.55 -0.44 -7.23 -1.26 -4.80 120.40 104.41 3f9h s VAL 186 Ca 0.36 -0.74 -0.09 0.00 -1.81 0.00 0.00 61.98 59.69 3f9h s VAL 186 Cb -0.13 -0.74 -0.03 0.00 0.56 0.00 0.00 36.38 36.04 3f9h s VAL 186 CO 0.24 0.01 2.77 -0.90 -0.31 0.00 0.00 175.10 176.91 3f9h n ASP 187 N 2.23 8.17 -3.88 4.85 5.75 -1.26 -4.81 116.55 127.61 3f9h n ASP 187 Ca -0.17 -2.72 -0.12 0.00 -0.01 0.00 0.00 54.79 51.78 3f9h n ASP 187 Cb 0.56 -1.53 -0.14 0.00 -1.03 0.00 0.00 41.12 38.98 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 1.56 0.02 -0.64 0.11 1.70 -1.26 -4.93 118.95 115.50 3f9h s ARG 188 Ca 0.64 -0.03 -0.26 0.00 -0.47 0.00 0.00 55.73 55.61 3f9h s ARG 188 Cb 0.18 0.01 -0.04 0.00 -0.57 0.00 0.00 34.95 34.52 3f9h s ARG 188 CO -0.07 -0.00 2.01 -1.14 -1.08 0.00 0.00 175.30 175.02 3f9h s GLN 189 N -0.09 2.46 0.38 3.89 2.00 0.18 -4.86 119.66 123.62 3f9h s GLN 189 Ca -0.01 0.62 -0.12 0.00 -2.00 0.00 0.00 55.36 53.85 3f9h s GLN 189 Cb -0.01 -4.55 0.05 0.00 0.80 0.00 0.00 33.01 29.30 3f9h s GLN 189 CO -0.00 -3.03 0.72 -0.08 -0.50 0.00 0.00 175.29 172.40 3f9h s THR 190 N 10.14 0.00 0.28 -0.34 -1.32 -1.26 -4.52 115.64 118.62 3f9h s THR 190 Ca 0.75 -1.14 -0.29 0.00 -1.21 0.00 0.00 61.69 59.79 3f9h s THR 190 Cb -0.13 -2.88 -0.10 0.00 -1.51 0.00 0.00 72.50 67.89 3f9h s THR 190 CO 0.18 0.00 1.09 0.00 -2.21 0.00 0.00 174.62 173.68 3f9h s ALA 191 N -2.37 3.40 -0.24 11.08 0.00 -1.26 -4.94 121.76 127.43 3f9h s ALA 191 Ca 0.19 0.89 -0.02 0.00 0.00 0.00 0.00 51.96 53.02 3f9h s ALA 191 Cb -0.04 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 19.83 3f9h s ALA 191 CO 0.14 -0.15 0.05 -0.65 0.00 0.00 0.00 175.76 175.15 3f9h s GLN 192 N -1.46 0.70 -0.33 0.00 -1.52 -1.26 -5.10 119.66 110.69 3f9h s GLN 192 Ca 0.45 -0.65 -0.28 0.00 -1.95 0.00 0.00 55.36 52.93 3f9h s GLN 192 Cb -0.32 -2.04 -0.02 0.00 -0.22 0.00 0.00 33.01 30.41 3f9h s GLN 192 CO 0.41 -0.76 1.86 0.00 -0.25 0.00 0.00 175.29 176.55 3f9h s ALA 193 N 1.78 2.80 0.10 6.09 0.00 -1.26 -4.98 121.76 126.28 3f9h s ALA 193 Ca 0.02 0.28 -0.07 0.00 0.00 0.00 0.00 51.96 52.20 3f9h s ALA 193 Cb -0.17 -4.04 -0.06 0.00 0.00 0.00 0.00 23.12 18.85 3f9h s ALA 193 CO -0.15 -2.74 0.37 0.00 0.00 0.00 0.00 175.76 173.25 3f9h s ALA 194 N 7.25 3.77 0.71 0.00 0.00 -1.26 -4.91 121.76 127.33 3f9h s ALA 194 Ca 0.82 -0.49 -0.12 0.00 0.00 0.00 0.00 51.96 52.17 3f9h s ALA 194 Cb -0.23 -2.18 0.03 0.00 0.00 0.00 0.00 23.12 20.74 3f9h s ALA 194 CO 0.33 0.62 1.09 0.20 0.00 0.00 0.00 175.76 178.00 3f9h s GLY 195 N -2.05 1.84 0.21 0.00 0.00 -1.26 -4.97 107.32 101.09 3f9h s GLY 195 Ca 0.36 0.32 -0.32 0.00 0.00 0.00 0.00 44.72 45.08 3f9h s GLY 195 CO 0.21 0.66 1.55 -0.37 0.00 0.00 0.00 173.10 175.15 3f9h n THR 196 N -3.03 0.44 -2.87 0.90 5.66 -1.26 -4.74 114.28 109.38 3f9h n THR 196 Ca 0.09 -0.11 -0.43 0.00 -3.05 0.00 0.00 64.05 60.55 3f9h n THR 196 Cb 0.53 -1.66 -0.02 0.00 -1.55 0.00 0.00 70.33 67.63 3f9h n THR 196 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3f9h s ASP 197 N 0.70 6.67 0.80 1.09 3.68 -1.26 -4.40 116.67 123.95 3f9h s ASP 197 Ca 0.73 -2.10 -0.12 0.00 2.13 0.00 0.00 52.55 53.19 3f9h s ASP 197 Cb -0.61 -2.43 0.07 0.00 -1.45 0.00 0.00 42.92 38.50 3f9h s ASP 197 CO 0.42 -1.09 1.11 0.42 0.13 0.00 0.00 175.17 176.16 3f9h s THR 198 N 2.91 2.93 -0.07 1.71 -4.23 -1.26 -5.02 115.64 112.61 3f9h s THR 198 Ca 0.36 0.30 -0.22 0.00 -1.18 0.00 0.00 61.69 60.96 3f9h s THR 198 Cb -0.04 -3.10 -0.04 0.00 1.34 0.00 0.00 72.50 70.66 3f9h s THR 198 CO -0.08 -0.40 0.64 -0.89 -0.54 0.00 0.00 174.62 173.35 3f9h s THR 199 N -3.23 5.05 -0.78 3.99 2.01 -0.49 -4.66 115.64 117.54 3f9h s THR 199 Ca 0.61 1.31 -0.26 0.00 0.31 0.00 0.00 61.69 63.67 3f9h s THR 199 Cb -0.14 -3.98 -0.01 0.00 0.01 0.00 0.00 72.50 68.38 3f9h s THR 199 CO 0.53 0.29 1.73 -0.63 -0.69 0.00 0.00 174.62 175.86 3f9h s ILE 200 N 0.60 3.52 0.15 1.82 1.01 -1.26 -2.16 121.20 124.88 3f9h s ILE 200 Ca 0.34 -0.06 -0.21 0.00 0.00 0.00 0.00 60.65 60.72 3f9h s ILE 200 Cb -0.17 -4.28 0.03 0.00 0.01 0.00 0.00 42.46 38.05 3f9h s ILE 200 CO 0.16 -1.23 1.65 0.74 0.00 0.00 0.00 174.94 176.27 3f9h h THR 201 N 6.84 0.53 -0.82 2.92 2.02 -1.94 -1.90 112.91 120.55 3f9h h THR 201 Ca -0.09 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.25 3f9h h THR 201 Cb 1.07 0.53 -0.10 0.00 -1.74 0.00 0.00 68.15 67.91 3f9h h THR 201 CO 1.26 0.00 0.37 0.25 0.37 0.00 0.00 175.52 177.76 3f9h h LEU 202 N -0.15 0.37 -0.29 2.58 5.85 -1.90 -1.59 115.31 120.19 3f9h h LEU 202 Ca 0.14 0.11 -0.20 0.00 0.84 0.00 0.00 57.88 58.77 3f9h h LEU 202 Cb 0.36 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3f9h h LEU 202 CO -0.34 0.12 -0.72 0.78 -0.34 0.00 0.00 178.44 177.93 3f9h h ASN 203 N 0.49 0.77 -0.58 1.25 2.35 -1.62 -2.05 115.58 116.19 3f9h h ASN 203 Ca 0.47 -0.49 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 3f9h h ASN 203 Cb 0.74 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.85 3f9h h ASN 203 CO -0.42 1.26 0.34 0.58 -1.65 0.00 0.00 177.43 177.54 3f9h h VAL 204 N 0.46 1.18 -0.22 2.81 2.07 -0.70 -0.46 116.25 121.38 3f9h h VAL 204 Ca -0.03 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 3f9h h VAL 204 Cb 1.32 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3f9h h VAL 204 CO 0.14 0.19 0.08 -0.07 0.02 0.00 0.00 177.57 177.93 3f9h h LEU 205 N 0.78 0.31 -0.68 2.57 3.38 -1.24 -0.58 115.31 119.85 3f9h h LEU 205 Ca 0.21 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.09 3f9h h LEU 205 Cb 0.00 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.60 3f9h h LEU 205 CO -0.04 0.41 0.32 0.00 0.09 0.00 0.00 178.44 179.22 3f9h h ALA 206 N 0.92 0.92 0.00 1.53 0.00 -1.22 -1.09 119.26 120.31 3f9h h ALA 206 Ca 0.07 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3f9h h ALA 206 Cb 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3f9h h ALA 206 CO -0.00 -0.07 -0.24 2.35 0.00 0.00 0.00 179.25 181.28 3f9h h TRP 207 N 0.56 0.00 0.00 0.00 7.01 -0.69 -0.85 115.95 121.99 3f9h h TRP 207 Ca 0.33 0.00 -0.20 0.00 2.11 0.00 0.00 58.89 61.14 3f9h h TRP 207 Cb 0.35 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.40 3f9h h TRP 207 CO -0.12 0.24 -0.88 -0.07 -2.79 0.00 0.00 178.44 174.82 3f9h h LEU 208 N 0.00 0.24 -0.59 0.65 3.38 -0.20 -2.51 115.31 116.29 3f9h h LEU 208 Ca -0.00 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.66 3f9h h LEU 208 Cb 0.48 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3f9h h LEU 208 CO 0.03 1.00 -0.06 1.88 0.09 0.00 0.00 178.44 181.38 3f9h h TYR 209 N 0.10 1.16 -0.98 1.13 0.05 -0.77 -2.39 116.97 115.27 3f9h h TYR 209 Ca -0.04 -0.22 0.09 0.00 0.05 0.00 0.00 58.73 58.60 3f9h h TYR 209 Cb 1.51 -0.29 -0.08 0.00 1.01 0.00 0.00 36.73 38.88 3f9h h TYR 209 CO 0.03 1.05 0.62 0.00 -1.05 0.00 0.00 178.16 178.81 3f9h h ALA 210 N 0.97 1.42 -0.18 3.88 0.00 -1.08 -1.63 119.26 122.62 3f9h h ALA 210 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3f9h h ALA 210 Cb 0.63 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3f9h h ALA 210 CO 0.04 0.31 0.03 0.00 0.00 0.00 0.00 179.25 179.64 3f9h h ALA 211 N 1.49 0.24 0.07 0.00 0.00 -1.19 -2.33 119.26 117.53 3f9h h ALA 211 Ca 0.45 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.23 3f9h h ALA 211 Cb 0.32 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3f9h h ALA 211 CO -0.22 -0.10 -0.29 0.28 0.00 0.00 0.00 179.25 178.92 3f9h h VAL 212 N 0.10 0.37 -0.91 0.00 2.07 -1.02 -0.10 116.25 116.75 3f9h h VAL 212 Ca 0.06 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.79 3f9h h VAL 212 Cb 0.30 0.37 -0.12 0.00 -1.52 0.00 0.00 31.29 30.31 3f9h h VAL 212 CO 0.00 0.00 0.44 0.40 0.02 0.00 0.00 177.57 178.43 3f9h h ILE 213 N -0.47 0.53 -0.08 4.57 2.04 -1.27 0.17 117.51 123.00 3f9h h ILE 213 Ca 0.04 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.74 3f9h h ILE 213 Cb 0.53 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 3f9h h ILE 213 CO -0.20 0.09 0.00 0.59 0.00 0.00 0.00 178.15 178.62 3f9h n ASN 214 N -4.98 0.65 -0.07 1.72 3.02 -0.74 -4.87 115.26 109.99 3f9h n ASN 214 Ca 0.22 -2.02 -0.01 0.00 -0.03 0.00 0.00 54.58 52.74 3f9h n ASN 214 Cb 0.63 -0.15 -0.00 0.00 -0.61 0.00 0.00 39.78 39.65 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 0.51 0.44 3.14 7.41 0.00 0.58 -5.01 105.19 112.26 3f9h n GLY 215 Ca 0.03 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 3f9h n GLY 215 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f9h s ASP 216 N -2.99 5.44 -0.29 1.61 3.68 -0.13 -4.95 116.67 119.04 3f9h s ASP 216 Ca 0.00 -2.44 0.20 0.00 2.13 0.00 0.00 52.55 52.44 3f9h s ASP 216 Cb 0.00 -1.90 0.48 0.00 -1.45 0.00 0.00 42.92 40.05 3f9h s ASP 216 CO 0.00 -0.49 1.03 -2.11 0.13 0.00 0.00 175.17 173.73 3f9h n ARG 217 N 4.09 1.50 0.00 4.34 1.85 -1.26 -3.37 116.66 123.80 3f9h n ARG 217 Ca 0.03 -3.41 0.13 0.00 -1.00 0.00 0.00 57.85 53.60 3f9h n ARG 217 Cb 0.40 -1.45 0.48 0.00 -1.05 0.00 0.00 32.46 30.84 3f9h n ARG 217 CO 0.00 0.00 0.00 -2.67 -0.01 0.00 0.00 177.63 174.95 3f9h n TRP 218 N -0.33 0.02 0.93 2.89 4.27 -1.26 -3.76 117.44 120.20 3f9h n TRP 218 Ca 0.09 0.01 0.12 0.00 -3.89 0.00 0.00 57.50 53.83 3f9h n TRP 218 Cb 0.81 -0.42 0.11 0.00 -1.36 0.00 0.00 31.31 30.45 3f9h n TRP 218 CO 0.00 0.00 0.00 1.97 -2.29 0.00 0.00 177.69 177.37 3f9h n PHE 219 N -1.52 0.04 -2.48 -2.67 1.16 -1.26 -4.93 117.46 105.80 3f9h n PHE 219 Ca 0.06 -0.02 -0.34 0.00 -1.87 0.00 0.00 57.45 55.28 3f9h n PHE 219 Cb 0.34 -0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.18 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 -1.93 3.84 0.00 5.98 1.43 -1.25 -4.75 118.68 122.00 3f9h s LEU 220 Ca 0.29 1.99 0.06 0.00 -1.03 0.00 0.00 54.13 55.44 3f9h s LEU 220 Cb 0.20 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.85 3f9h s LEU 220 CO 0.30 -0.87 0.23 -0.46 0.23 0.00 0.00 176.35 175.78 3f9h n ASN 221 N -1.00 -0.57 -1.05 2.29 0.23 -1.26 -5.03 115.26 108.86 3f9h n ASN 221 Ca 0.10 -2.79 0.12 0.00 -0.53 0.00 0.00 54.58 51.48 3f9h n ASN 221 Cb 0.52 1.36 0.16 0.00 -2.08 0.00 0.00 39.78 39.74 3f9h n ASN 221 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3f9h n ARG 222 N -0.52 2.39 -1.86 -3.83 3.00 -1.26 -4.99 116.66 109.59 3f9h n ARG 222 Ca 0.06 -2.11 -0.32 0.00 -0.01 0.00 0.00 57.85 55.47 3f9h n ARG 222 Cb 0.49 -1.48 0.02 0.00 0.00 0.00 0.00 32.46 31.49 3f9h n ARG 222 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 3f9h s PHE 223 N -1.69 3.18 0.26 -1.55 0.08 -1.26 -5.08 117.98 111.92 3f9h s PHE 223 Ca 0.33 1.44 0.05 0.00 0.12 0.00 0.00 56.93 58.87 3f9h s PHE 223 Cb 0.21 -2.89 -0.06 0.00 -0.57 0.00 0.00 43.02 39.71 3f9h s PHE 223 CO 0.30 -1.02 -0.02 -0.08 -0.10 0.00 0.00 175.22 174.30 3f9h s THR 224 N -2.82 1.33 0.22 0.64 -1.32 -1.26 -4.81 115.64 107.63 3f9h s THR 224 Ca 0.60 -2.07 -0.17 0.00 -1.21 0.00 0.00 61.69 58.84 3f9h s THR 224 Cb -0.14 -2.44 0.02 0.00 -1.51 0.00 0.00 72.50 68.43 3f9h s THR 224 CO 0.46 -0.28 0.54 0.28 -2.21 0.00 0.00 174.62 173.41 3f9h s THR 225 N -3.22 0.02 0.30 5.08 -1.32 -1.26 -4.88 115.64 110.36 3f9h s THR 225 Ca 0.30 -0.96 0.07 0.00 -1.21 0.00 0.00 61.69 59.89 3f9h s THR 225 Cb 0.05 -1.78 -0.03 0.00 -1.51 0.00 0.00 72.50 69.23 3f9h s THR 225 CO 0.11 -0.08 0.30 0.42 -2.21 0.00 0.00 174.62 173.16 3f9h s THR 226 N -3.91 4.01 0.40 5.08 -4.23 -1.26 -4.85 115.64 110.87 3f9h s THR 226 Ca 0.12 -1.30 0.07 0.00 -1.18 0.00 0.00 61.69 59.41 3f9h s THR 226 Cb -0.02 -3.33 0.23 0.00 1.34 0.00 0.00 72.50 70.72 3f9h s THR 226 CO 0.01 -0.23 2.01 0.25 -0.54 0.00 0.00 174.62 176.12 3f9h h LEU 227 N 1.26 0.42 -0.13 4.79 6.46 -1.98 -1.06 115.31 125.07 3f9h h LEU 227 Ca -0.47 -0.03 -0.08 0.00 -0.12 0.00 0.00 57.88 57.18 3f9h h LEU 227 Cb 1.25 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 41.07 3f9h h LEU 227 CO 0.58 0.37 -0.23 -1.13 -0.62 0.00 0.00 178.44 177.42 3f9h h ASN 228 N 0.48 0.43 0.24 1.25 -1.24 -1.95 -2.91 115.58 111.87 3f9h h ASN 228 Ca 0.12 -0.54 -0.08 0.00 0.71 0.00 0.00 56.30 56.51 3f9h h ASN 228 Cb 0.06 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 38.98 3f9h h ASN 228 CO -0.02 0.89 -0.33 0.44 -1.29 0.00 0.00 177.43 177.12 3f9h h ASP 229 N -0.02 0.14 -0.06 1.15 3.32 -1.91 -3.20 116.42 115.84 3f9h h ASP 229 Ca 0.01 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 3f9h h ASP 229 Cb 0.81 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.32 3f9h h ASP 229 CO 0.05 0.47 -0.01 0.15 -1.72 0.00 0.00 179.24 178.19 3f9h h PHE 230 N 0.13 0.13 0.00 4.55 3.57 -1.20 -3.27 116.94 120.86 3f9h h PHE 230 Ca 0.02 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 3f9h h PHE 230 Cb 0.65 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.35 3f9h h PHE 230 CO 0.01 0.43 -0.07 -0.91 -2.23 0.00 0.00 178.31 175.53 3f9h h ASN 231 N -0.20 0.00 1.12 0.41 2.35 -1.50 0.02 115.58 117.77 3f9h h ASN 231 Ca 0.02 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3f9h h ASN 231 Cb 0.38 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 3f9h h ASN 231 CO 0.00 0.07 -0.21 -0.07 -1.65 0.00 0.00 177.43 175.58 3f9h h LEU 232 N 0.00 0.00 0.17 1.61 3.38 -1.60 0.35 115.31 119.21 3f9h h LEU 232 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 3f9h h LEU 232 Cb 0.16 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.92 3f9h h LEU 232 CO 0.01 0.21 -1.68 0.58 0.09 0.00 0.00 178.44 177.65 3f9h h VAL 233 N 0.00 1.01 -0.13 1.22 2.07 -1.33 -3.34 116.25 115.75 3f9h h VAL 233 Ca -0.00 -2.61 -0.02 0.00 0.82 0.00 0.00 66.70 64.89 3f9h h VAL 233 Cb 0.82 2.77 -0.00 0.00 -1.52 0.00 0.00 31.29 33.36 3f9h h VAL 233 CO 0.03 0.84 0.01 0.00 0.02 0.00 0.00 177.57 178.47 3f9h h ALA 234 N 0.24 0.17 -0.80 1.67 0.00 -0.69 -2.63 119.26 117.23 3f9h h ALA 234 Ca -0.31 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.52 3f9h h ALA 234 Cb 2.08 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.77 3f9h h ALA 234 CO 0.18 -0.15 0.52 0.52 0.00 0.00 0.00 179.25 180.31 3f9h h MET 235 N -0.02 0.74 -0.25 0.00 2.07 -0.34 0.22 114.93 117.36 3f9h h MET 235 Ca 0.04 -0.04 -0.14 0.00 -2.07 0.00 0.00 59.70 57.49 3f9h h MET 235 Cb 0.32 -0.17 -0.01 0.00 -1.87 0.00 0.00 31.60 29.88 3f9h h MET 235 CO 0.00 0.49 -0.41 -0.22 1.07 0.00 0.00 176.91 177.84 3f9h h LYS 236 N 0.77 0.61 -0.65 1.72 3.64 -1.62 -2.95 116.57 118.09 3f9h h LYS 236 Ca 0.36 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3f9h h LYS 236 Cb 0.39 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3f9h h LYS 236 CO -0.14 0.91 0.00 0.66 -2.27 0.00 0.00 179.45 178.61 3f9h n TYR 237 N -4.03 1.60 -1.15 1.91 4.02 -0.92 -4.92 117.16 113.67 3f9h n TYR 237 Ca -0.02 -0.58 -0.05 0.00 -0.01 0.00 0.00 57.90 57.24 3f9h n TYR 237 Cb 0.53 -0.37 -0.02 0.00 -0.02 0.00 0.00 39.34 39.45 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 0.66 -3.94 -4.72 7.72 5.15 -0.81 -4.91 115.26 114.41 3f9h n ASN 238 Ca 0.23 0.13 -0.41 0.00 -0.60 0.00 0.00 54.58 53.93 3f9h n ASN 238 Cb 0.96 -1.90 -0.04 0.00 -0.53 0.00 0.00 39.78 38.27 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 -2.08 3.67 0.49 1.20 1.51 0.71 -1.40 117.35 121.45 3f9h s TYR 239 Ca 0.00 1.51 -0.22 0.00 -1.01 0.00 0.00 57.07 57.35 3f9h s TYR 239 Cb 0.00 -2.94 -0.06 0.00 -0.11 0.00 0.00 41.96 38.84 3f9h s TYR 239 CO 0.00 0.11 1.19 -1.83 -1.11 0.00 0.00 175.55 173.91 3f9h s GLU 240 N 0.59 3.55 0.34 -0.62 -1.05 -0.92 -3.42 118.70 117.17 3f9h s GLU 240 Ca 0.44 1.82 -0.29 0.00 -0.15 0.00 0.00 54.97 56.79 3f9h s GLU 240 Cb -0.20 -2.29 -0.12 0.00 -0.44 0.00 0.00 34.13 31.08 3f9h s GLU 240 CO 0.24 -0.74 1.48 -2.30 0.95 0.00 0.00 175.26 174.89 3f9h n PRO 241 N -0.77 2.55 -2.78 -4.83 -0.02 -1.26 -4.49 135.00 123.40 3f9h n PRO 241 Ca 0.09 0.90 -0.40 0.00 -2.02 0.00 0.00 63.50 62.06 3f9h n PRO 241 Cb 0.48 -2.61 -0.05 0.00 -0.02 0.00 0.00 33.50 31.30 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 -1.24 4.56 0.37 2.45 2.96 -1.26 -4.98 118.68 121.54 3f9h s LEU 242 Ca 0.58 1.81 0.08 0.00 -0.22 0.00 0.00 54.13 56.38 3f9h s LEU 242 Cb -0.51 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.59 3f9h s LEU 242 CO 0.58 0.04 0.16 0.42 -1.32 0.00 0.00 176.35 176.23 3f9h s THR 243 N -0.51 2.70 0.19 3.68 -4.23 -1.26 -5.00 115.64 111.22 3f9h s THR 243 Ca 0.43 -1.70 -0.11 0.00 -1.18 0.00 0.00 61.69 59.14 3f9h s THR 243 Cb -0.24 -2.97 0.12 0.00 1.34 0.00 0.00 72.50 70.76 3f9h s THR 243 CO 0.30 -0.11 1.80 -0.61 -0.54 0.00 0.00 174.62 175.46 3f9h h GLN 244 N 1.50 0.98 -0.69 3.99 5.75 -1.99 -2.45 115.11 122.19 3f9h h GLN 244 Ca -0.43 -0.12 0.14 0.00 -0.15 0.00 0.00 58.65 58.09 3f9h h GLN 244 Cb 1.25 -0.19 -0.10 0.00 1.07 0.00 0.00 27.48 29.51 3f9h h GLN 244 CO 0.66 0.75 0.14 -0.44 -2.65 0.00 0.00 178.83 177.28 3f9h h ASP 245 N 0.96 -0.04 -0.62 -0.69 3.32 -2.00 -0.52 116.42 116.83 3f9h h ASP 245 Ca 0.24 0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.46 3f9h h ASP 245 Cb 0.06 0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.77 3f9h h ASP 245 CO -0.04 -0.04 0.38 0.45 -1.72 0.00 0.00 179.24 178.28 3f9h h HIS 246 N 0.24 0.72 -0.21 4.55 3.86 -1.86 -2.40 115.15 120.05 3f9h h HIS 246 Ca 0.38 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.58 3f9h h HIS 246 Cb 0.62 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 3f9h h HIS 246 CO -0.28 0.41 0.01 0.28 0.86 0.00 0.00 177.93 179.21 3f9h h VAL 247 N 0.75 1.13 -0.24 2.45 2.07 -0.72 -2.56 116.25 119.12 3f9h h VAL 247 Ca 0.25 -0.48 -0.16 0.00 0.82 0.00 0.00 66.70 67.13 3f9h h VAL 247 Cb 0.02 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 3f9h h VAL 247 CO -0.10 0.16 -0.51 0.44 0.02 0.00 0.00 177.57 177.58 3f9h h ASP 248 N 0.30 0.76 0.02 0.57 3.32 -0.78 -3.18 116.42 117.41 3f9h h ASP 248 Ca 0.07 -0.39 -0.06 0.00 0.02 0.00 0.00 57.03 56.67 3f9h h ASP 248 Cb 0.18 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3f9h h ASP 248 CO 0.00 1.13 -0.18 0.40 -1.72 0.00 0.00 179.24 178.88 3f9h h ILE 249 N 0.54 1.21 -0.00 0.35 2.04 -1.06 -2.52 117.51 118.07 3f9h h ILE 249 Ca 0.02 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.91 3f9h h ILE 249 Cb 1.08 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 3f9h h ILE 249 CO 0.10 0.30 -0.11 0.18 0.00 0.00 0.00 178.15 178.63 3f9h n LEU 250 N -4.21 0.40 -0.18 1.44 4.77 -1.14 -4.32 117.00 113.77 3f9h n LEU 250 Ca -0.00 0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 55.93 3f9h n LEU 250 Cb 0.32 -0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 3f9h n LEU 250 CO 0.39 0.08 0.55 1.23 -1.33 0.00 0.00 177.39 178.31 3f9h h GLY 251 N 4.97 -0.64 0.17 -0.72 0.00 -1.43 0.17 103.07 105.59 3f9h h GLY 251 Ca 0.00 0.61 0.05 0.00 0.00 0.00 0.00 47.33 47.99 3f9h h GLY 251 CO 0.00 -0.15 -0.31 -2.55 0.00 0.00 0.00 176.54 173.54 3f9h h PRO 252 N -0.29 -0.36 -0.67 4.80 0.11 -1.81 -1.24 132.00 132.54 3f9h h PRO 252 Ca 0.14 0.02 0.13 0.00 0.11 0.00 0.00 66.00 66.40 3f9h h PRO 252 Cb 0.57 0.08 -0.09 0.00 0.11 0.00 0.00 31.00 31.67 3f9h h PRO 252 CO -0.65 -0.24 0.19 -0.07 -0.21 0.00 0.00 178.00 177.03 3f9h h LEU 253 N -0.38 0.10 -0.65 2.35 3.38 -1.73 -1.99 115.31 116.40 3f9h h LEU 253 Ca 0.10 0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.24 3f9h h LEU 253 Cb 0.53 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 3f9h h LEU 253 CO -0.35 0.04 0.35 -1.28 0.09 0.00 0.00 178.44 177.29 3f9h h SER 254 N 0.32 0.52 0.00 -0.43 0.87 0.05 0.12 113.55 115.01 3f9h h SER 254 Ca 0.36 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.95 3f9h h SER 254 Cb 0.55 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 3f9h h SER 254 CO -0.42 0.34 0.00 0.00 -0.53 0.00 0.00 176.83 176.22 3f9h n ALA 255 N -2.35 -0.41 -0.18 6.23 0.00 -0.54 -1.45 120.51 121.81 3f9h n ALA 255 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.47 3f9h n ALA 255 Cb 0.17 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.58 3f9h n ALA 255 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3f9h n GLN 256 N -1.84 -0.19 0.14 0.00 7.27 -0.80 -0.12 117.38 121.86 3f9h n GLN 256 Ca 0.00 0.65 -0.00 0.00 0.07 0.00 0.00 57.00 57.72 3f9h n GLN 256 Cb 0.00 -0.96 0.24 0.00 2.41 0.00 0.00 30.24 31.93 3f9h n GLN 256 CO 0.00 0.00 0.00 1.79 0.07 0.00 0.00 177.06 178.92 3f9h h THR 257 N 0.00 1.36 0.00 1.69 1.35 -1.03 -3.47 112.91 112.81 3f9h h THR 257 Ca 0.07 -1.74 0.00 0.00 -0.55 0.00 0.00 66.41 64.19 3f9h h THR 257 Cb 0.18 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 3f9h h THR 257 CO -0.40 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 175.98 3f9h n GLY 258 N -0.06 0.75 3.30 5.82 0.00 0.83 -5.03 105.19 110.82 3f9h n GLY 258 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.50 2.95 0.44 -0.61 1.01 -1.01 -5.00 121.20 116.47 3f9h s ILE 259 Ca 0.00 -0.67 -0.24 0.00 0.00 0.00 0.00 60.65 59.74 3f9h s ILE 259 Cb 0.00 -2.27 -0.08 0.00 0.01 0.00 0.00 42.46 40.12 3f9h s ILE 259 CO 0.00 0.50 1.22 0.00 0.00 0.00 0.00 174.94 176.65 3f9h s ALA 260 N 0.85 3.07 0.18 9.38 0.00 -1.26 -4.48 121.76 129.50 3f9h s ALA 260 Ca -0.04 1.05 -0.16 0.00 0.00 0.00 0.00 51.96 52.82 3f9h s ALA 260 Cb -0.15 -3.43 0.14 0.00 0.00 0.00 0.00 23.12 19.68 3f9h s ALA 260 CO 0.00 -0.73 1.67 0.28 0.00 0.00 0.00 175.76 176.98 3f9h h VAL 261 N 2.09 0.59 0.00 0.00 2.07 -1.93 -2.09 116.25 116.99 3f9h h VAL 261 Ca -0.49 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.96 3f9h h VAL 261 Cb 1.25 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 3f9h h VAL 261 CO 0.61 0.01 -0.26 -0.07 0.02 0.00 0.00 177.57 177.87 3f9h h LEU 262 N 0.04 0.00 -0.27 2.57 3.38 -1.92 -2.03 115.31 117.08 3f9h h LEU 262 Ca 0.22 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.99 3f9h h LEU 262 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3f9h h LEU 262 CO -0.42 0.26 -0.67 0.44 0.09 0.00 0.00 178.44 178.14 3f9h h ASP 263 N 0.00 0.88 0.21 -0.43 3.32 -1.73 -2.80 116.42 115.87 3f9h h ASP 263 Ca -0.00 -0.53 -0.02 0.00 0.02 0.00 0.00 57.03 56.50 3f9h h ASP 263 Cb 0.53 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 3f9h h ASP 263 CO 0.03 1.31 -0.10 -0.03 -1.72 0.00 0.00 179.24 178.74 3f9h h MET 264 N 0.55 0.00 -0.27 3.56 4.05 -0.87 0.11 114.93 122.06 3f9h h MET 264 Ca -0.02 0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.24 3f9h h MET 264 Cb 1.28 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.07 3f9h h MET 264 CO 0.14 0.10 -0.45 0.00 0.23 0.00 0.00 176.91 176.93 3f9h h ALA 266 N 0.67 1.12 -0.13 0.00 0.00 -1.04 0.74 119.26 120.62 3f9h h ALA 266 Ca 0.02 -0.17 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 3f9h h ALA 266 Cb 1.06 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 3f9h h ALA 266 CO 0.10 0.23 -0.69 0.00 0.00 0.00 0.00 179.25 178.89 3f9h h ALA 267 N 1.81 0.53 -0.03 0.00 0.00 -0.62 -3.17 119.26 117.79 3f9h h ALA 267 Ca -0.00 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.28 3f9h h ALA 267 Cb 0.58 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3f9h h ALA 267 CO 0.02 0.72 -0.18 1.25 0.00 0.00 0.00 179.25 181.07 3f9h h LEU 268 N 0.40 0.21 -0.94 0.00 6.46 -0.31 -3.25 115.31 117.88 3f9h h LEU 268 Ca -0.03 -0.67 0.26 0.00 -0.12 0.00 0.00 57.88 57.32 3f9h h LEU 268 Cb 1.28 -0.06 -0.17 0.00 -0.73 0.00 0.00 40.66 40.98 3f9h h LEU 268 CO 0.13 0.85 0.07 0.50 -0.62 0.00 0.00 178.44 179.37 3f9h h LYS 269 N -0.41 0.05 -0.56 1.25 3.64 0.40 0.17 116.57 121.11 3f9h h LYS 269 Ca -0.01 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.27 3f9h h LYS 269 Cb 0.84 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.63 3f9h h LYS 269 CO 0.04 0.03 -0.02 0.93 -2.27 0.00 0.00 179.45 178.16 3f9h h GLU 270 N 0.05 0.98 -0.08 1.90 3.07 -1.62 -2.62 114.58 116.26 3f9h h GLU 270 Ca 0.58 -0.31 -0.13 0.00 -0.50 0.00 0.00 59.36 59.00 3f9h h GLU 270 Cb 1.18 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.98 3f9h h GLU 270 CO -0.84 0.98 -0.51 -0.07 -1.40 0.00 0.00 179.01 177.16 3f9h h LEU 271 N 0.90 0.23 -0.55 1.33 3.38 -0.75 -0.95 115.31 118.90 3f9h h LEU 271 Ca 0.16 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 3f9h h LEU 271 Cb 0.55 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3f9h h LEU 271 CO 0.03 0.70 -0.68 -0.07 0.09 0.00 0.00 178.44 178.51 3f9h h LEU 272 N 0.17 0.26 0.13 1.67 3.38 -1.16 -2.52 115.31 117.24 3f9h h LEU 272 Ca 0.00 -0.16 -0.27 0.00 0.09 0.00 0.00 57.88 57.54 3f9h h LEU 272 Cb 0.96 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3f9h h LEU 272 CO 0.08 0.86 -1.36 1.56 0.09 0.00 0.00 178.44 179.67 3f9h h GLN 273 N 0.15 0.28 -0.02 1.13 4.20 -1.36 -3.39 115.11 116.09 3f9h h GLN 273 Ca -0.02 -0.47 0.00 0.00 0.06 0.00 0.00 58.65 58.22 3f9h h GLN 273 Cb 1.22 0.18 0.00 0.00 0.30 0.00 0.00 27.48 29.18 3f9h h GLN 273 CO 0.10 1.23 -0.31 0.09 -0.67 0.00 0.00 178.83 179.27 3f9h n ASN 274 N -3.92 2.16 -0.09 1.46 3.02 -0.37 -5.09 115.26 112.43 3f9h n ASN 274 Ca -0.23 -1.58 0.00 0.00 -0.03 0.00 0.00 54.58 52.74 3f9h n ASN 274 Cb 0.91 0.34 0.00 0.00 -0.61 0.00 0.00 39.78 40.42 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 1.30 -1.44 0.57 7.41 0.00 -0.95 -4.51 105.19 107.57 3f9h n GLY 275 Ca 0.10 -1.28 0.06 0.00 0.00 0.00 0.00 46.02 44.90 3f9h n GLY 275 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3f9h n MET 276 N -0.19 1.52 -1.24 1.61 2.81 -1.26 -4.57 117.12 115.79 3f9h n MET 276 Ca 0.00 -1.56 -0.08 0.00 -1.81 0.00 0.00 57.70 54.24 3f9h n MET 276 Cb 0.00 -1.26 -0.04 0.00 -0.71 0.00 0.00 33.22 31.22 3f9h n MET 276 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3f9h n ASN 277 N 0.66 -5.56 0.00 7.83 4.13 -1.26 -1.45 115.26 119.60 3f9h n ASN 277 Ca 0.09 0.21 0.00 0.00 1.68 0.00 0.00 54.58 56.56 3f9h n ASN 277 Cb 0.36 -3.81 0.00 0.00 -1.54 0.00 0.00 39.78 34.79 3f9h n ASN 277 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3f9h n GLY 278 N 0.11 0.40 4.00 7.41 0.00 -1.26 -5.06 105.19 110.79 3f9h n GLY 278 Ca -0.08 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.64 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 -1.94 1.54 -0.08 1.61 0.52 -0.53 -5.09 118.95 114.98 3f9h s ARG 279 Ca 0.00 -1.25 0.02 0.00 -0.52 0.00 0.00 55.73 53.98 3f9h s ARG 279 Cb 0.00 -2.33 0.01 0.00 0.52 0.00 0.00 34.95 33.15 3f9h s ARG 279 CO 0.00 -1.55 -0.15 0.95 0.02 0.00 0.00 175.30 174.57 3f9h s THR 280 N -3.17 1.34 -0.31 0.02 -4.23 -1.26 -4.57 115.64 103.46 3f9h s THR 280 Ca 0.68 -0.59 -0.16 0.00 -1.18 0.00 0.00 61.69 60.44 3f9h s THR 280 Cb -0.04 -1.21 -0.02 0.00 1.34 0.00 0.00 72.50 72.56 3f9h s THR 280 CO 0.45 0.40 0.40 -0.63 -0.54 0.00 0.00 174.62 174.70 3f9h s ILE 281 N 0.66 5.14 -1.32 2.99 1.01 -0.84 -4.49 121.20 124.35 3f9h s ILE 281 Ca -0.14 0.35 -0.05 0.00 0.00 0.00 0.00 60.65 60.81 3f9h s ILE 281 Cb -0.16 -3.79 -0.00 0.00 0.01 0.00 0.00 42.46 38.52 3f9h s ILE 281 CO 0.04 0.00 0.57 0.18 0.00 0.00 0.00 174.94 175.73 3f9h n LEU 282 N 5.43 -2.56 0.00 2.97 4.77 -1.26 -1.76 117.00 124.59 3f9h n LEU 282 Ca -0.08 -0.97 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 3f9h n LEU 282 Cb 0.50 -2.35 0.00 0.00 -2.33 0.00 0.00 43.42 39.23 3f9h n LEU 282 CO 0.40 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 3f9h n GLY 283 N -1.83 0.20 3.81 -0.72 0.00 -1.26 -4.88 105.19 100.51 3f9h n GLY 283 Ca -0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.16 5.93 0.14 1.61 0.15 -0.72 -5.00 113.70 113.64 3f9h s SER 284 Ca 0.00 0.31 0.19 0.00 0.70 0.00 0.00 55.95 57.15 3f9h s SER 284 Cb 0.00 -1.81 -0.06 0.00 -1.71 0.00 0.00 66.02 62.43 3f9h s SER 284 CO 0.00 0.36 0.96 0.71 1.20 0.00 0.00 173.24 176.47 3f9h h THR 285 N 3.77 0.32 -4.11 6.45 1.35 -1.85 -2.25 112.91 116.61 3f9h h THR 285 Ca -0.52 -1.62 -0.69 0.00 -0.55 0.00 0.00 66.41 63.03 3f9h h THR 285 Cb 1.21 1.86 -0.24 0.00 -1.73 0.00 0.00 68.15 69.25 3f9h h THR 285 CO 0.59 0.18 -0.85 -0.51 -0.25 0.00 0.00 175.52 174.68 3f9h s ILE 286 N -3.09 2.39 0.21 6.82 1.10 -1.26 -4.92 121.20 122.44 3f9h s ILE 286 Ca -0.01 -1.40 -0.31 0.00 -0.51 0.00 0.00 60.65 58.42 3f9h s ILE 286 Cb 0.09 -1.99 -0.10 0.00 0.15 0.00 0.00 42.46 40.61 3f9h s ILE 286 CO 0.80 0.30 1.48 -0.76 -2.11 0.00 0.00 174.94 174.64 3f9h s LEU 287 N -1.49 4.38 0.00 8.50 1.43 -1.26 -4.99 118.68 125.25 3f9h s LEU 287 Ca 0.13 2.62 -0.06 0.00 -1.03 0.00 0.00 54.13 55.79 3f9h s LEU 287 Cb -0.10 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.46 3f9h s LEU 287 CO 0.04 -0.74 0.25 -1.61 0.23 0.00 0.00 176.35 174.52 3f9h s GLU 288 N 0.32 3.55 -0.02 1.70 0.41 -1.26 -5.03 118.70 118.37 3f9h s GLU 288 Ca 0.64 -0.12 0.25 0.00 -0.41 0.00 0.00 54.97 55.32 3f9h s GLU 288 Cb -0.42 -3.08 0.43 0.00 -1.78 0.00 0.00 34.13 29.28 3f9h s GLU 288 CO 0.38 0.65 1.17 -0.40 -0.49 0.00 0.00 175.26 176.57 3f9h n ASP 289 N 1.08 1.07 -1.23 -0.19 3.85 -1.26 -3.85 116.55 116.02 3f9h n ASP 289 Ca -0.11 -2.17 -0.06 0.00 -0.71 0.00 0.00 54.79 51.73 3f9h n ASP 289 Cb 0.53 -0.32 0.17 0.00 -1.35 0.00 0.00 41.12 40.15 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 0.35 2.04 -3.90 0.11 1.02 -1.26 -4.73 120.64 114.27 3f9h n GLU 290 Ca 0.07 -3.34 -0.29 0.00 -0.02 0.00 0.00 57.16 53.58 3f9h n GLU 290 Cb 1.11 -1.86 -0.16 0.00 -0.02 0.00 0.00 31.44 30.50 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 -3.33 1.81 0.66 -0.32 0.40 -1.26 -4.79 117.98 111.15 3f9h s PHE 291 Ca 0.45 -1.17 -0.11 0.00 -0.60 0.00 0.00 56.93 55.50 3f9h s PHE 291 Cb 0.41 -1.36 -0.01 0.00 0.51 0.00 0.00 43.02 42.56 3f9h s PHE 291 CO -0.01 -0.64 1.05 0.95 0.70 0.00 0.00 175.22 177.27 3f9h s THR 292 N 1.60 4.25 0.31 0.64 -4.23 -1.26 -4.46 115.64 112.49 3f9h s THR 292 Ca 0.00 0.73 0.07 0.00 -1.18 0.00 0.00 61.69 61.31 3f9h s THR 292 Cb -0.16 -3.65 0.30 0.00 1.34 0.00 0.00 72.50 70.34 3f9h s THR 292 CO -0.08 -0.96 1.78 -0.65 -0.54 0.00 0.00 174.62 174.18 3f9h h PRO 293 N -0.52 0.73 -0.68 3.99 0.11 -1.91 -0.96 132.00 132.76 3f9h h PRO 293 Ca -0.44 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 3f9h h PRO 293 Cb 1.21 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 3f9h h PRO 293 CO 0.61 0.48 0.25 0.35 -0.21 0.00 0.00 178.00 179.48 3f9h h PHE 294 N 0.75 1.03 -0.20 0.65 3.57 -1.94 -2.89 116.94 117.90 3f9h h PHE 294 Ca 0.57 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.99 3f9h h PHE 294 Cb 0.92 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 3f9h h PHE 294 CO -0.00 0.80 0.09 -0.44 -2.23 0.00 0.00 178.31 176.53 3f9h h ASP 295 N 0.99 0.27 -0.23 0.41 5.19 -1.57 -2.20 116.42 119.28 3f9h h ASP 295 Ca 0.23 -0.14 0.04 0.00 -0.62 0.00 0.00 57.03 56.54 3f9h h ASP 295 Cb 0.22 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 39.63 3f9h h ASP 295 CO -0.02 0.33 0.00 0.58 -3.12 0.00 0.00 179.24 177.02 3f9h h VAL 296 N 0.19 0.84 -0.44 -1.35 2.07 -1.21 -2.37 116.25 113.98 3f9h h VAL 296 Ca 0.07 -0.03 -0.07 0.00 0.82 0.00 0.00 66.70 67.49 3f9h h VAL 296 Cb 0.14 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3f9h h VAL 296 CO -0.01 0.01 -0.01 0.58 0.02 0.00 0.00 177.57 178.17 3f9h h VAL 297 N 0.08 1.23 -0.87 2.57 2.07 -1.52 -2.87 116.25 116.93 3f9h h VAL 297 Ca 0.11 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.68 3f9h h VAL 297 Cb 0.14 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 3f9h h VAL 297 CO -0.18 0.34 0.58 -0.09 0.02 0.00 0.00 177.57 178.24 3f9h h ARG 298 N 0.68 1.14 -1.01 1.57 2.43 -0.90 -3.05 114.38 115.24 3f9h h ARG 298 Ca 0.13 -0.07 -0.49 0.00 -0.81 0.00 0.00 59.98 58.74 3f9h h ARG 298 Cb 0.43 -0.26 -0.28 0.00 -0.42 0.00 0.00 29.97 29.44 3f9h h ARG 298 CO 0.02 0.76 0.63 1.04 -1.51 0.00 0.00 179.97 180.90 3f9h n GLN 299 N -4.41 2.19 0.00 0.20 6.02 -0.96 -5.11 117.38 115.32 3f9h n GLN 299 Ca 0.10 -2.80 0.00 0.00 -0.01 0.00 0.00 57.00 54.29 3f9h n GLN 299 Cb 0.03 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.19 3f9h n GLN 299 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05