| blob | 315d7c26f0b83231f4918661c63cf83e773928ed |
1 HEADER Generated by trjconv : Pure Methanol - Yummie! (and some water) t= 1.00000
2 REMARK THIS IS A SIMULATION BOX
3 CRYST1 46.935 23.474 23.500 90.00 90.00 90.00 P 1 1
4 MODEL 1
5 ATOM 1 Me1 MeO 1 11.540 13.880 7.100 1.00 0.00
6 ATOM 2 O2 MeO 1 11.950 14.700 6.090 1.00 0.00
7 ATOM 3 H3 MeO 1 11.780 15.620 6.440 1.00 0.00
8 ATOM 4 Me1 MeO 2 6.960 22.180 20.590 1.00 0.00
9 ATOM 5 O2 MeO 2 6.390 23.370 20.260 1.00 0.00
10 ATOM 6 H3 MeO 2 6.230 23.170 19.290 1.00 0.00
11 ATOM 7 Me1 MeO 3 46.100 1.460 5.400 1.00 0.00
12 ATOM 8 O2 MeO 3 46.750 0.720 6.340 1.00 0.00
13 ATOM 9 H3 MeO 3 46.150 0.320 7.030 1.00 0.00
14 ATOM 10 Me1 MeO 4 11.620 20.350 13.230 1.00 0.00
15 ATOM 11 O2 MeO 4 12.950 20.470 13.480 1.00 0.00
16 ATOM 12 H3 MeO 4 13.330 20.240 12.590 1.00 0.00
17 ATOM 13 Me1 MeO 5 7.900 1.410 15.030 1.00 0.00
18 ATOM 14 O2 MeO 5 7.080 1.680 13.970 1.00 0.00
19 ATOM 15 H3 MeO 5 7.020 0.900 13.350 1.00 0.00
20 ATOM 16 Me1 MeO 6 9.780 19.130 9.330 1.00 0.00
21 ATOM 17 O2 MeO 6 9.900 18.000 8.590 1.00 0.00
22 ATOM 18 H3 MeO 6 9.010 17.540 8.570 1.00 0.00
23 ATOM 19 Me1 MeO 7 11.380 21.900 4.530 1.00 0.00
24 ATOM 20 O2 MeO 7 10.430 21.240 3.810 1.00 0.00
25 ATOM 21 H3 MeO 7 10.660 21.120 2.850 1.00 0.00
26 ATOM 22 Me1 MeO 8 8.870 11.200 19.810 1.00 0.00
27 ATOM 23 O2 MeO 8 8.040 11.790 18.920 1.00 0.00
28 ATOM 24 H3 MeO 8 7.110 11.840 19.280 1.00 0.00
29 ATOM 25 Me1 MeO 9 2.950 18.830 0.850 1.00 0.00
30 ATOM 26 O2 MeO 9 3.110 17.680 0.150 1.00 0.00
31 ATOM 27 H3 MeO 9 2.840 17.700 -0.820 1.00 0.00
32 ATOM 28 Me1 MeO 10 12.320 -0.010 14.940 1.00 0.00
33 ATOM 29 O2 MeO 10 12.000 1.030 14.120 1.00 0.00
34 ATOM 30 H3 MeO 10 12.210 1.890 14.600 1.00 0.00
35 ATOM 31 Me1 MeO 11 15.090 16.760 3.280 1.00 0.00
36 ATOM 32 O2 MeO 11 14.030 16.090 2.750 1.00 0.00
37 ATOM 33 H3 MeO 11 14.160 15.140 3.020 1.00 0.00
38 ATOM 34 Me1 MeO 12 16.920 11.190 6.970 1.00 0.00
39 ATOM 35 O2 MeO 12 16.220 10.180 6.390 1.00 0.00
40 ATOM 36 H3 MeO 12 16.850 9.650 5.820 1.00 0.00
41 ATOM 37 Me1 MeO 13 11.540 13.500 12.660 1.00 0.00
42 ATOM 38 O2 MeO 13 10.590 12.650 12.200 1.00 0.00
43 ATOM 39 H3 MeO 13 10.630 11.770 12.670 1.00 0.00
44 ATOM 40 Me1 MeO 14 8.000 17.560 12.480 1.00 0.00
45 ATOM 41 O2 MeO 14 7.310 16.550 13.070 1.00 0.00
46 ATOM 42 H3 MeO 14 7.620 15.660 12.720 1.00 0.00
47 ATOM 43 Me1 MeO 15 17.720 14.630 18.610 1.00 0.00
48 ATOM 44 O2 MeO 15 17.360 14.660 17.300 1.00 0.00
49 ATOM 45 H3 MeO 15 17.880 15.460 16.990 1.00 0.00
50 ATOM 46 Me1 MeO 16 15.420 13.420 3.580 1.00 0.00
51 ATOM 47 O2 MeO 16 14.250 13.350 4.260 1.00 0.00
52 ATOM 48 H3 MeO 16 14.430 12.640 4.930 1.00 0.00
53 ATOM 49 Me1 MeO 17 15.940 13.380 10.250 1.00 0.00
54 ATOM 50 O2 MeO 17 15.180 14.390 9.760 1.00 0.00
55 ATOM 51 H3 MeO 17 15.030 14.230 8.780 1.00 0.00
56 ATOM 52 Me1 MeO 18 11.690 1.730 21.260 1.00 0.00
57 ATOM 53 O2 MeO 18 12.230 1.120 20.170 1.00 0.00
58 ATOM 54 H3 MeO 18 12.520 0.190 20.380 1.00 0.00
59 ATOM 55 Me1 MeO 19 20.940 21.900 16.690 1.00 0.00
60 ATOM 56 O2 MeO 19 21.480 20.770 16.180 1.00 0.00
61 ATOM 57 H3 MeO 19 20.980 20.360 15.420 1.00 0.00
62 ATOM 58 Me1 MeO 20 7.990 17.500 18.320 1.00 0.00
63 ATOM 59 O2 MeO 20 9.030 18.370 18.240 1.00 0.00
64 ATOM 60 H3 MeO 20 8.740 19.210 17.790 1.00 0.00
65 ATOM 61 Me1 MeO 21 20.960 4.980 1.420 1.00 0.00
66 ATOM 62 O2 MeO 21 21.180 4.140 2.460 1.00 0.00
67 ATOM 63 H3 MeO 21 20.980 3.190 2.240 1.00 0.00
68 ATOM 64 Me1 MeO 22 16.670 15.070 23.140 1.00 0.00
69 ATOM 65 O2 MeO 22 16.880 15.190 21.800 1.00 0.00
70 ATOM 66 H3 MeO 22 16.240 14.600 21.320 1.00 0.00
71 ATOM 67 Me1 MeO 23 21.830 23.080 10.680 1.00 0.00
72 ATOM 68 O2 MeO 23 21.470 21.960 9.990 1.00 0.00
73 ATOM 69 H3 MeO 23 20.840 21.390 10.530 1.00 0.00
74 ATOM 70 Me1 MeO 24 21.780 17.990 3.470 1.00 0.00
75 ATOM 71 O2 MeO 24 22.290 16.870 4.040 1.00 0.00
76 ATOM 72 H3 MeO 24 21.700 16.650 4.810 1.00 0.00
77 ATOM 73 Me1 MeO 25 1.840 16.660 18.680 1.00 0.00
78 ATOM 74 O2 MeO 25 2.110 17.050 17.410 1.00 0.00
79 ATOM 75 H3 MeO 25 3.050 16.700 17.340 1.00 0.00
80 ATOM 76 Me1 MeO 26 5.500 18.690 15.130 1.00 0.00
81 ATOM 77 O2 MeO 26 6.320 17.640 15.340 1.00 0.00
82 ATOM 78 H3 MeO 26 6.660 17.530 14.410 1.00 0.00
83 ATOM 79 Me1 MeO 27 18.080 17.340 9.060 1.00 0.00
84 ATOM 80 O2 MeO 27 18.880 17.070 10.130 1.00 0.00
85 ATOM 81 H3 MeO 27 19.840 17.020 9.860 1.00 0.00
86 ATOM 82 Me1 MeO 28 5.540 9.970 22.470 1.00 0.00
87 ATOM 83 O2 MeO 28 5.940 11.260 22.270 1.00 0.00
88 ATOM 84 H3 MeO 28 6.100 11.650 23.180 1.00 0.00
89 ATOM 85 Me1 MeO 29 12.060 23.270 1.260 1.00 0.00
90 ATOM 86 O2 MeO 29 13.140 22.560 0.820 1.00 0.00
91 ATOM 87 H3 MeO 29 13.700 23.120 0.220 1.00 0.00
92 ATOM 88 Me1 MeO 30 6.650 8.830 13.300 1.00 0.00
93 ATOM 89 O2 MeO 30 7.070 8.170 14.410 1.00 0.00
94 ATOM 90 H3 MeO 30 6.400 8.370 15.120 1.00 0.00
95 ATOM 91 Me1 MeO 31 24.720 6.960 10.300 1.00 0.00
96 ATOM 92 O2 MeO 31 23.810 6.610 11.250 1.00 0.00
97 ATOM 93 H3 MeO 31 23.050 6.240 10.740 1.00 0.00
98 ATOM 94 Me1 MeO 32 20.220 5.470 15.060 1.00 0.00
99 ATOM 95 O2 MeO 32 20.960 5.690 13.940 1.00 0.00
100 ATOM 96 H3 MeO 32 20.650 6.580 13.600 1.00 0.00
101 ATOM 97 Me1 MeO 33 8.710 0.720 2.540 1.00 0.00
102 ATOM 98 O2 MeO 33 8.580 0.160 1.310 1.00 0.00
103 ATOM 99 H3 MeO 33 8.970 -0.760 1.410 1.00 0.00
104 ATOM 100 Me1 MeO 34 44.650 14.170 13.940 1.00 0.00
105 ATOM 101 O2 MeO 34 43.810 14.320 15.000 1.00 0.00
106 ATOM 102 H3 MeO 34 43.210 13.520 15.060 1.00 0.00
107 ATOM 103 Me1 MeO 35 45.640 9.600 10.510 1.00 0.00
108 ATOM 104 O2 MeO 35 46.030 9.600 11.820 1.00 0.00
109 ATOM 105 H3 MeO 35 46.960 9.990 11.850 1.00 0.00
110 ATOM 106 Me1 MeO 36 21.850 10.540 6.140 1.00 0.00
111 ATOM 107 O2 MeO 36 20.970 11.120 5.280 1.00 0.00
112 ATOM 108 H3 MeO 36 21.000 10.590 4.440 1.00 0.00
113 ATOM 109 Me1 MeO 37 1.240 17.530 8.590 1.00 0.00
114 ATOM 110 O2 MeO 37 2.000 18.570 9.030 1.00 0.00
115 ATOM 111 H3 MeO 37 2.530 18.270 9.820 1.00 0.00
116 ATOM 112 Me1 MeO 38 15.050 15.030 14.800 1.00 0.00
117 ATOM 113 O2 MeO 38 13.850 15.660 14.920 1.00 0.00
118 ATOM 114 H3 MeO 38 13.630 15.970 15.840 1.00 0.00
119 ATOM 115 Me1 MeO 39 19.690 8.640 18.530 1.00 0.00
120 ATOM 116 O2 MeO 39 18.940 9.780 18.440 1.00 0.00
121 ATOM 117 H3 MeO 39 18.390 9.810 19.270 1.00 0.00
122 ATOM 118 Me1 MeO 40 3.680 14.460 22.160 1.00 0.00
123 ATOM 119 O2 MeO 40 3.800 13.210 21.650 1.00 0.00
124 ATOM 120 H3 MeO 40 4.760 13.060 21.380 1.00 0.00
125 ATOM 121 Me1 MeO 41 5.510 2.630 4.720 1.00 0.00
126 ATOM 122 O2 MeO 41 4.480 3.340 4.180 1.00 0.00
127 ATOM 123 H3 MeO 41 4.640 3.390 3.200 1.00 0.00
128 ATOM 124 Me1 MeO 42 4.570 -0.070 0.410 1.00 0.00
129 ATOM 125 O2 MeO 42 5.340 0.910 0.960 1.00 0.00
130 ATOM 126 H3 MeO 42 6.280 0.630 0.750 1.00 0.00
131 ATOM 127 Me1 MeO 43 14.260 5.100 2.990 1.00 0.00
132 ATOM 128 O2 MeO 43 14.690 4.130 3.840 1.00 0.00
133 ATOM 129 H3 MeO 43 13.920 3.870 4.420 1.00 0.00
134 ATOM 130 Me1 MeO 44 46.550 18.520 21.420 1.00 0.00
135 ATOM 131 O2 MeO 44 47.360 17.840 22.270 1.00 0.00
136 ATOM 132 H3 MeO 44 46.880 17.840 23.150 1.00 0.00
137 ATOM 133 Me1 MeO 45 20.070 19.970 5.940 1.00 0.00
138 ATOM 134 O2 MeO 45 20.670 18.970 6.630 1.00 0.00
139 ATOM 135 H3 MeO 45 21.010 19.320 7.500 1.00 0.00
140 ATOM 136 Me1 MeO 46 18.200 0.830 23.770 1.00 0.00
141 ATOM 137 O2 MeO 46 17.420 0.690 22.660 1.00 0.00
142 ATOM 138 H3 MeO 46 17.800 1.210 21.900 1.00 0.00
143 ATOM 139 Me1 MeO 47 24.680 21.810 13.760 1.00 0.00
144 ATOM 140 O2 MeO 47 25.900 22.320 13.450 1.00 0.00
145 ATOM 141 H3 MeO 47 25.940 22.270 12.450 1.00 0.00
146 ATOM 142 Me1 MeO 48 14.650 8.150 9.740 1.00 0.00
147 ATOM 143 O2 MeO 48 13.990 8.800 8.740 1.00 0.00
148 ATOM 144 H3 MeO 48 14.010 8.110 8.020 1.00 0.00
149 ATOM 145 Me1 MeO 49 5.170 9.850 4.710 1.00 0.00
150 ATOM 146 O2 MeO 49 5.030 10.850 3.800 1.00 0.00
151 ATOM 147 H3 MeO 49 4.080 11.160 3.690 1.00 0.00
152 ATOM 148 Me1 MeO 50 11.090 10.080 22.710 1.00 0.00
153 ATOM 149 O2 MeO 50 12.210 9.300 22.630 1.00 0.00
154 ATOM 150 H3 MeO 50 12.430 9.250 21.660 1.00 0.00
155 ATOM 151 Me1 MeO 51 5.260 12.580 15.240 1.00 0.00
156 ATOM 152 O2 MeO 51 5.500 13.890 14.990 1.00 0.00
157 ATOM 153 H3 MeO 51 6.240 14.070 15.630 1.00 0.00
158 ATOM 154 Me1 MeO 52 8.940 20.980 15.800 1.00 0.00
159 ATOM 155 O2 MeO 52 7.990 20.160 16.330 1.00 0.00
160 ATOM 156 H3 MeO 52 7.100 20.280 15.900 1.00 0.00
161 ATOM 157 Me1 MeO 53 2.800 20.420 17.310 1.00 0.00
162 ATOM 158 O2 MeO 53 3.650 20.980 18.210 1.00 0.00
163 ATOM 159 H3 MeO 53 3.150 21.480 18.920 1.00 0.00
164 ATOM 160 Me1 MeO 54 23.200 21.770 7.290 1.00 0.00
165 ATOM 161 O2 MeO 54 23.700 21.360 8.480 1.00 0.00
166 ATOM 162 H3 MeO 54 23.000 21.610 9.150 1.00 0.00
167 ATOM 163 Me1 MeO 55 20.220 12.680 9.790 1.00 0.00
168 ATOM 164 O2 MeO 55 20.410 11.520 9.110 1.00 0.00
169 ATOM 165 H3 MeO 55 21.130 11.750 8.460 1.00 0.00
170 ATOM 166 Me1 MeO 56 3.430 6.010 6.550 1.00 0.00
171 ATOM 167 O2 MeO 56 4.360 5.030 6.470 1.00 0.00
172 ATOM 168 H3 MeO 56 4.250 4.480 5.650 1.00 0.00
173 ATOM 169 Me1 MeO 57 19.670 15.490 6.620 1.00 0.00
174 ATOM 170 O2 MeO 57 20.590 16.230 5.940 1.00 0.00
175 ATOM 171 H3 MeO 57 20.790 17.090 6.420 1.00 0.00
176 ATOM 172 Me1 MeO 58 9.120 4.010 1.310 1.00 0.00
177 ATOM 173 O2 MeO 58 10.270 4.700 1.470 1.00 0.00
178 ATOM 174 H3 MeO 58 10.270 5.100 2.380 1.00 0.00
179 ATOM 175 Me1 MeO 59 2.920 9.500 8.540 1.00 0.00
180 ATOM 176 O2 MeO 59 2.760 9.390 9.890 1.00 0.00
181 ATOM 177 H3 MeO 59 2.750 8.390 9.990 1.00 0.00
182 ATOM 178 Me1 MeO 60 45.770 14.280 9.650 1.00 0.00
183 ATOM 179 O2 MeO 60 46.860 13.600 9.180 1.00 0.00
184 ATOM 180 H3 MeO 60 47.490 13.700 9.950 1.00 0.00
185 ATOM 181 Me1 MeO 61 8.570 13.880 16.310 1.00 0.00
186 ATOM 182 O2 MeO 61 7.460 13.630 17.070 1.00 0.00
187 ATOM 183 H3 MeO 61 7.780 12.910 17.680 1.00 0.00
188 ATOM 184 Me1 MeO 62 12.170 9.940 19.050 1.00 0.00
189 ATOM 185 O2 MeO 62 12.590 9.170 20.080 1.00 0.00
190 ATOM 186 H3 MeO 62 13.310 8.610 19.680 1.00 0.00
191 ATOM 187 Me1 MeO 63 25.120 15.000 3.090 1.00 0.00
192 ATOM 188 O2 MeO 63 24.830 16.300 3.370 1.00 0.00
193 ATOM 189 H3 MeO 63 23.880 16.360 3.680 1.00 0.00
194 ATOM 190 Me1 MeO 64 2.120 21.840 21.290 1.00 0.00
195 ATOM 191 O2 MeO 64 2.120 22.350 20.030 1.00 0.00
196 ATOM 192 H3 MeO 64 1.270 22.880 19.980 1.00 0.00
197 ATOM 193 Me1 MeO 65 46.950 6.230 4.770 1.00 0.00
198 ATOM 194 O2 MeO 65 46.230 6.470 5.890 1.00 0.00
199 ATOM 195 H3 MeO 65 46.390 7.390 6.250 1.00 0.00
200 ATOM 196 Me1 MeO 66 21.420 5.480 5.860 1.00 0.00
201 ATOM 197 O2 MeO 66 22.310 5.630 4.850 1.00 0.00
202 ATOM 198 H3 MeO 66 22.190 5.050 4.040 1.00 0.00
203 ATOM 199 Me1 MeO 67 0.080 20.230 12.840 1.00 0.00
204 ATOM 200 O2 MeO 67 0.440 20.530 14.120 1.00 0.00
205 ATOM 201 H3 MeO 67 0.300 19.800 14.800 1.00 0.00
206 ATOM 202 Me1 MeO 68 15.690 11.820 17.710 1.00 0.00
207 ATOM 203 O2 MeO 68 15.160 13.050 17.930 1.00 0.00
208 ATOM 204 H3 MeO 68 15.740 13.620 17.350 1.00 0.00
209 ATOM 205 Me1 MeO 69 5.790 18.190 21.340 1.00 0.00
210 ATOM 206 O2 MeO 69 6.610 18.040 22.420 1.00 0.00
211 ATOM 207 H3 MeO 69 7.280 17.350 22.150 1.00 0.00
212 ATOM 208 Me1 MeO 70 13.400 4.250 9.970 1.00 0.00
213 ATOM 209 O2 MeO 70 14.750 4.350 9.860 1.00 0.00
214 ATOM 210 H3 MeO 70 15.090 4.800 10.680 1.00 0.00
215 ATOM 211 Me1 MeO 71 22.680 0.420 0.630 1.00 0.00
216 ATOM 212 O2 MeO 71 22.330 1.730 0.650 1.00 0.00
217 ATOM 213 H3 MeO 71 23.110 2.290 0.940 1.00 0.00
218 ATOM 214 Me1 MeO 72 46.320 9.460 3.070 1.00 0.00
219 ATOM 215 O2 MeO 72 46.710 10.460 3.900 1.00 0.00
220 ATOM 216 H3 MeO 72 45.830 10.690 4.300 1.00 0.00
221 ATOM 217 Me1 MeO 73 12.970 17.780 6.810 1.00 0.00
222 ATOM 218 O2 MeO 73 11.730 17.230 6.840 1.00 0.00
223 ATOM 219 H3 MeO 73 11.080 17.790 7.360 1.00 0.00
224 ATOM 220 Me1 MeO 74 20.430 3.880 18.950 1.00 0.00
225 ATOM 221 O2 MeO 74 20.080 2.910 19.840 1.00 0.00
226 ATOM 222 H3 MeO 74 20.850 2.770 20.460 1.00 0.00
227 ATOM 223 Me1 MeO 75 2.020 1.900 -0.030 1.00 0.00
228 ATOM 224 O2 MeO 75 0.880 1.150 -0.030 1.00 0.00
229 ATOM 225 H3 MeO 75 1.110 0.390 0.580 1.00 0.00
230 ATOM 226 Me1 MeO 76 7.670 14.490 5.460 1.00 0.00
231 ATOM 227 O2 MeO 76 7.230 13.280 5.920 1.00 0.00
232 ATOM 228 H3 MeO 76 7.870 12.660 5.460 1.00 0.00
233 ATOM 229 Me1 MeO 77 12.870 16.670 10.930 1.00 0.00
234 ATOM 230 O2 MeO 77 14.190 16.800 10.620 1.00 0.00
235 ATOM 231 H3 MeO 77 14.440 15.870 10.370 1.00 0.00
236 ATOM 232 Me1 MeO 78 1.770 11.400 12.590 1.00 0.00
237 ATOM 233 O2 MeO 78 1.520 10.130 12.160 1.00 0.00
238 ATOM 234 H3 MeO 78 1.830 10.110 11.210 1.00 0.00
239 ATOM 235 Me1 MeO 79 4.720 22.630 3.580 1.00 0.00
240 ATOM 236 O2 MeO 79 3.360 22.530 3.570 1.00 0.00
241 ATOM 237 H3 MeO 79 2.960 23.170 4.220 1.00 0.00
242 ATOM 238 Me1 MeO 80 19.400 19.230 20.430 1.00 0.00
243 ATOM 239 O2 MeO 80 20.520 19.820 19.920 1.00 0.00
244 ATOM 240 H3 MeO 80 21.220 19.100 20.010 1.00 0.00
245 ATOM 241 Me1 MeO 81 4.650 12.250 7.570 1.00 0.00
246 ATOM 242 O2 MeO 81 5.830 12.670 8.100 1.00 0.00
247 ATOM 243 H3 MeO 81 6.530 12.850 7.410 1.00 0.00
248 ATOM 244 Me1 MeO 82 4.450 18.380 11.390 1.00 0.00
249 ATOM 245 O2 MeO 82 3.180 18.820 11.570 1.00 0.00
250 ATOM 246 H3 MeO 82 3.280 19.420 12.360 1.00 0.00
251 ATOM 247 Me1 MeO 83 6.390 5.400 9.430 1.00 0.00
252 ATOM 248 O2 MeO 83 5.980 4.470 8.530 1.00 0.00
253 ATOM 249 H3 MeO 83 5.300 4.860 7.920 1.00 0.00
254 ATOM 250 Me1 MeO 84 5.170 3.530 19.070 1.00 0.00
255 ATOM 251 O2 MeO 84 4.990 4.010 20.340 1.00 0.00
256 ATOM 252 H3 MeO 84 5.260 3.290 20.980 1.00 0.00
257 ATOM 253 Me1 MeO 85 9.000 0.500 6.480 1.00 0.00
258 ATOM 254 O2 MeO 85 7.840 1.090 6.090 1.00 0.00
259 ATOM 255 H3 MeO 85 7.300 1.470 6.830 1.00 0.00
260 ATOM 256 Me1 MeO 86 15.930 7.440 19.320 1.00 0.00
261 ATOM 257 O2 MeO 86 14.710 7.830 18.860 1.00 0.00
262 ATOM 258 H3 MeO 86 14.780 7.920 17.870 1.00 0.00
263 ATOM 259 Me1 MeO 87 5.330 1.450 9.830 1.00 0.00
264 ATOM 260 O2 MeO 87 4.790 2.700 9.920 1.00 0.00
265 ATOM 261 H3 MeO 87 5.200 3.290 9.240 1.00 0.00
266 ATOM 262 Me1 MeO 88 16.590 8.530 23.470 1.00 0.00
267 ATOM 263 O2 MeO 88 16.340 9.720 22.860 1.00 0.00
268 ATOM 264 H3 MeO 88 15.600 10.230 23.310 1.00 0.00
269 ATOM 265 Me1 MeO 89 23.910 13.590 21.470 1.00 0.00
270 ATOM 266 O2 MeO 89 24.280 13.170 20.230 1.00 0.00
271 ATOM 267 H3 MeO 89 24.200 12.170 20.120 1.00 0.00
272 ATOM 268 Me1 MeO 90 1.790 5.950 21.560 1.00 0.00
273 ATOM 269 O2 MeO 90 1.290 6.480 22.710 1.00 0.00
274 ATOM 270 H3 MeO 90 0.640 5.810 23.080 1.00 0.00
275 ATOM 271 Me1 MeO 91 23.060 12.410 17.080 1.00 0.00
276 ATOM 272 O2 MeO 91 22.460 12.480 15.870 1.00 0.00
277 ATOM 273 H3 MeO 91 21.590 12.010 16.000 1.00 0.00
278 ATOM 274 Me1 MeO 92 15.650 3.420 15.660 1.00 0.00
279 ATOM 275 O2 MeO 92 16.540 3.570 14.650 1.00 0.00
280 ATOM 276 H3 MeO 92 16.770 2.730 14.150 1.00 0.00
281 ATOM 277 Me1 MeO 93 12.870 11.810 9.730 1.00 0.00
282 ATOM 278 O2 MeO 93 12.190 10.720 9.290 1.00 0.00
283 ATOM 279 H3 MeO 93 12.770 9.970 8.980 1.00 0.00
284 ATOM 280 Me1 MeO 94 11.070 7.730 9.690 1.00 0.00
285 ATOM 281 O2 MeO 94 9.900 7.060 9.880 1.00 0.00
286 ATOM 282 H3 MeO 94 9.120 7.630 9.610 1.00 0.00
287 ATOM 283 Me1 MeO 95 14.910 16.760 17.980 1.00 0.00
288 ATOM 284 O2 MeO 95 13.660 16.460 17.550 1.00 0.00
289 ATOM 285 H3 MeO 95 12.970 16.740 18.220 1.00 0.00
290 ATOM 286 Me1 MeO 96 6.620 19.630 1.890 1.00 0.00
291 ATOM 287 O2 MeO 96 7.190 19.970 0.700 1.00 0.00
292 ATOM 288 H3 MeO 96 6.950 19.210 0.100 1.00 0.00
293 ATOM 289 Me1 MeO 97 11.170 7.760 2.810 1.00 0.00
294 ATOM 290 O2 MeO 97 9.890 7.290 2.870 1.00 0.00
295 ATOM 291 H3 MeO 97 9.380 7.860 2.220 1.00 0.00
296 ATOM 292 Me1 MeO 98 27.930 12.250 5.300 1.00 0.00
297 ATOM 293 O2 MeO 98 28.560 11.200 5.880 1.00 0.00
298 ATOM 294 H3 MeO 98 29.420 11.660 6.090 1.00 0.00
299 ATOM 295 Me1 MeO 99 21.420 15.840 17.660 1.00 0.00
300 ATOM 296 O2 MeO 99 20.770 16.720 18.470 1.00 0.00
301 ATOM 297 H3 MeO 99 21.540 17.200 18.880 1.00 0.00
302 ATOM 298 Me1 MeO 100 22.600 8.100 15.420 1.00 0.00
303 ATOM 299 O2 MeO 100 23.210 7.250 14.550 1.00 0.00
304 ATOM 300 H3 MeO 100 22.500 6.600 14.280 1.00 0.00
305 ATOM 301 Me1 MeO 101 10.030 3.140 18.370 1.00 0.00
306 ATOM 302 O2 MeO 101 11.390 3.080 18.360 1.00 0.00
307 ATOM 303 H3 MeO 101 11.670 2.330 18.950 1.00 0.00
308 ATOM 304 Me1 MeO 102 23.750 18.070 20.630 1.00 0.00
309 ATOM 305 O2 MeO 102 22.690 18.020 19.790 1.00 0.00
310 ATOM 306 H3 MeO 102 23.040 18.380 18.920 1.00 0.00
311 ATOM 307 Me1 MeO 103 7.160 13.170 11.770 1.00 0.00
312 ATOM 308 O2 MeO 103 8.110 14.120 12.000 1.00 0.00
313 ATOM 309 H3 MeO 103 8.970 13.620 12.140 1.00 0.00
314 ATOM 310 Me1 MeO 104 21.760 1.290 4.740 1.00 0.00
315 ATOM 311 O2 MeO 104 23.050 0.900 4.930 1.00 0.00
316 ATOM 312 H3 MeO 104 23.110 0.140 4.280 1.00 0.00
317 ATOM 313 Me1 MeO 105 13.670 19.990 2.890 1.00 0.00
318 ATOM 314 O2 MeO 105 14.330 21.160 2.700 1.00 0.00
319 ATOM 315 H3 MeO 105 13.810 21.580 1.960 1.00 0.00
320 ATOM 316 Me1 MeO 106 21.580 6.530 21.000 1.00 0.00
321 ATOM 317 O2 MeO 106 22.160 7.750 20.820 1.00 0.00
322 ATOM 318 H3 MeO 106 22.900 7.630 20.150 1.00 0.00
323 ATOM 319 Me1 MeO 107 1.960 10.540 21.980 1.00 0.00
324 ATOM 320 O2 MeO 107 1.420 11.720 21.560 1.00 0.00
325 ATOM 321 H3 MeO 107 2.180 12.360 21.480 1.00 0.00
326 ATOM 322 Me1 MeO 108 5.670 7.350 17.830 1.00 0.00
327 ATOM 323 O2 MeO 108 5.620 7.960 16.620 1.00 0.00
328 ATOM 324 H3 MeO 108 4.670 8.190 16.450 1.00 0.00
329 ATOM 325 Me1 MeO 109 10.620 20.070 0.510 1.00 0.00
330 ATOM 326 O2 MeO 109 9.690 20.710 1.280 1.00 0.00
331 ATOM 327 H3 MeO 109 8.800 20.390 0.960 1.00 0.00
332 ATOM 328 Me1 MeO 110 8.890 5.400 12.990 1.00 0.00
333 ATOM 329 O2 MeO 110 8.900 5.080 11.670 1.00 0.00
334 ATOM 330 H3 MeO 110 9.200 5.850 11.090 1.00 0.00
335 ATOM 331 Me1 MeO 111 20.490 18.600 13.320 1.00 0.00
336 ATOM 332 O2 MeO 111 20.100 19.470 14.290 1.00 0.00
337 ATOM 333 H3 MeO 111 19.100 19.560 14.300 1.00 0.00
338 ATOM 334 Me1 MeO 112 2.440 3.480 12.500 1.00 0.00
339 ATOM 335 O2 MeO 112 2.470 3.780 11.170 1.00 0.00
340 ATOM 336 H3 MeO 112 3.080 3.120 10.710 1.00 0.00
341 ATOM 337 Me1 MeO 113 7.090 7.910 1.420 1.00 0.00
342 ATOM 338 O2 MeO 113 8.300 8.120 0.830 1.00 0.00
343 ATOM 339 H3 MeO 113 8.190 7.690 -0.070 1.00 0.00
344 ATOM 340 Me1 MeO 114 18.420 20.980 10.680 1.00 0.00
345 ATOM 341 O2 MeO 114 19.440 21.260 11.530 1.00 0.00
346 ATOM 342 H3 MeO 114 19.120 21.690 12.370 1.00 0.00
347 ATOM 343 Me1 MeO 115 3.200 1.060 6.530 1.00 0.00
348 ATOM 344 O2 MeO 115 2.490 0.560 5.490 1.00 0.00
349 ATOM 345 H3 MeO 115 1.610 0.350 5.910 1.00 0.00
350 ATOM 346 Me1 MeO 116 4.150 22.120 13.810 1.00 0.00
351 ATOM 347 O2 MeO 116 3.460 20.980 13.510 1.00 0.00
352 ATOM 348 H3 MeO 116 2.490 21.150 13.650 1.00 0.00
353 ATOM 349 Me1 MeO 117 13.150 0.950 7.980 1.00 0.00
354 ATOM 350 O2 MeO 117 13.640 -0.040 7.190 1.00 0.00
355 ATOM 351 H3 MeO 117 14.250 0.430 6.540 1.00 0.00
356 ATOM 352 Me1 MeO 118 13.890 13.190 21.150 1.00 0.00
357 ATOM 353 O2 MeO 118 15.090 13.590 20.650 1.00 0.00
358 ATOM 354 H3 MeO 118 15.130 13.360 19.680 1.00 0.00
359 ATOM 355 Me1 MeO 119 20.330 20.900 23.650 1.00 0.00
360 ATOM 356 O2 MeO 119 21.210 20.060 23.040 1.00 0.00
361 ATOM 357 H3 MeO 119 20.920 19.110 23.070 1.00 0.00
362 ATOM 358 Me1 MeO 120 2.930 6.720 11.520 1.00 0.00
363 ATOM 359 O2 MeO 120 2.940 6.890 10.170 1.00 0.00
364 ATOM 360 H3 MeO 120 2.590 6.040 9.780 1.00 0.00
365 ATOM 361 Me1 MeO 121 4.700 11.120 19.000 1.00 0.00
366 ATOM 362 O2 MeO 121 5.670 11.850 19.610 1.00 0.00
367 ATOM 363 H3 MeO 121 5.560 11.580 20.560 1.00 0.00
368 ATOM 364 Me1 MeO 122 23.670 3.800 13.330 1.00 0.00
369 ATOM 365 O2 MeO 122 23.930 2.480 13.550 1.00 0.00
370 ATOM 366 H3 MeO 122 24.710 2.360 14.160 1.00 0.00
371 ATOM 367 Me1 MeO 123 45.100 10.460 21.610 1.00 0.00
372 ATOM 368 O2 MeO 123 45.630 11.710 21.580 1.00 0.00
373 ATOM 369 H3 MeO 123 46.610 11.690 21.370 1.00 0.00
374 ATOM 370 Me1 MeO 124 22.420 15.000 13.590 1.00 0.00
375 ATOM 371 O2 MeO 124 23.480 14.310 14.090 1.00 0.00
376 ATOM 372 H3 MeO 124 23.210 13.680 14.820 1.00 0.00
377 ATOM 373 Me1 MeO 125 17.360 5.400 12.150 1.00 0.00
378 ATOM 374 O2 MeO 125 16.200 4.690 12.110 1.00 0.00
379 ATOM 375 H3 MeO 125 16.090 4.580 13.100 1.00 0.00
380 ATOM 376 Me1 MeO 126 20.340 5.380 10.440 1.00 0.00
381 ATOM 377 O2 MeO 126 21.340 6.300 10.470 1.00 0.00
382 ATOM 378 H3 MeO 126 20.930 7.150 10.140 1.00 0.00
383 ATOM 379 Me1 MeO 127 20.120 14.540 21.620 1.00 0.00
384 ATOM 380 O2 MeO 127 19.500 15.710 21.920 1.00 0.00
385 ATOM 381 H3 MeO 127 18.590 15.750 21.510 1.00 0.00
386 ATOM 382 Me1 MeO 128 23.830 18.670 16.610 1.00 0.00
387 ATOM 383 O2 MeO 128 23.180 19.410 17.560 1.00 0.00
388 ATOM 384 H3 MeO 128 22.560 20.050 17.120 1.00 0.00
389 ATOM 385 Me1 MeO 129 18.750 22.270 3.440 1.00 0.00
390 ATOM 386 O2 MeO 129 18.490 23.520 3.900 1.00 0.00
391 ATOM 387 H3 MeO 129 18.020 23.450 4.780 1.00 0.00
392 ATOM 388 Me1 MeO 130 47.740 12.760 6.170 1.00 0.00
393 ATOM 389 O2 MeO 130 46.460 12.910 6.610 1.00 0.00
394 ATOM 390 H3 MeO 130 46.480 12.960 7.600 1.00 0.00
395 ATOM 391 Me1 MeO 131 0.700 4.210 8.040 1.00 0.00
396 ATOM 392 O2 MeO 131 0.920 5.550 7.970 1.00 0.00
397 ATOM 393 H3 MeO 131 0.270 5.920 7.310 1.00 0.00
398 ATOM 394 Me1 MeO 132 7.890 19.330 5.210 1.00 0.00
399 ATOM 395 O2 MeO 132 8.650 20.160 5.980 1.00 0.00
400 ATOM 396 H3 MeO 132 9.130 20.750 5.340 1.00 0.00
401 ATOM 397 Me1 MeO 133 4.650 18.750 6.890 1.00 0.00
402 ATOM 398 O2 MeO 133 5.270 17.550 6.730 1.00 0.00
403 ATOM 399 H3 MeO 133 4.850 17.070 5.960 1.00 0.00
404 ATOM 400 Me1 MeO 134 16.850 22.590 7.600 1.00 0.00
405 ATOM 401 O2 MeO 134 17.620 23.050 6.570 1.00 0.00
406 ATOM 402 H3 MeO 134 18.000 23.900 6.930 1.00 0.00
407 ATOM 403 Me1 MeO 135 13.930 6.090 6.450 1.00 0.00
408 ATOM 404 O2 MeO 135 14.610 7.260 6.560 1.00 0.00
409 ATOM 405 H3 MeO 135 14.870 7.520 5.630 1.00 0.00
410 ATOM 406 Me1 MeO 136 8.680 5.230 5.210 1.00 0.00
411 ATOM 407 O2 MeO 136 9.580 4.300 5.620 1.00 0.00
412 ATOM 408 H3 MeO 136 9.100 3.740 6.290 1.00 0.00
413 ATOM 409 Me1 MeO 137 5.090 4.340 0.340 1.00 0.00
414 ATOM 410 O2 MeO 137 5.020 3.570 1.460 1.00 0.00
415 ATOM 411 H3 MeO 137 5.030 2.650 1.070 1.00 0.00
416 ATOM 412 Me1 MeO 138 16.820 21.650 14.650 1.00 0.00
417 ATOM 413 O2 MeO 138 17.740 21.010 13.870 1.00 0.00
418 ATOM 414 H3 MeO 138 17.380 20.090 13.740 1.00 0.00
419 ATOM 415 Me1 MeO 139 2.420 8.740 15.770 1.00 0.00
420 ATOM 416 O2 MeO 139 3.480 9.360 15.190 1.00 0.00
421 ATOM 417 H3 MeO 139 3.230 9.740 14.300 1.00 0.00
422 ATOM 418 Me1 MeO 140 12.770 10.610 5.990 1.00 0.00
423 ATOM 419 O2 MeO 140 13.900 11.370 5.920 1.00 0.00
424 ATOM 420 H3 MeO 140 14.690 10.900 6.310 1.00 0.00
425 ATOM 421 Me1 MeO 141 23.600 15.790 6.850 1.00 0.00
426 ATOM 422 O2 MeO 141 22.560 15.740 7.730 1.00 0.00
427 ATOM 423 H3 MeO 141 22.890 15.190 8.490 1.00 0.00
428 ATOM 424 Me1 MeO 142 45.890 7.090 18.700 1.00 0.00
429 ATOM 425 O2 MeO 142 45.160 8.190 19.020 1.00 0.00
430 ATOM 426 H3 MeO 142 45.700 9.000 18.760 1.00 0.00
431 ATOM 427 Me1 MeO 143 22.270 18.310 10.260 1.00 0.00
432 ATOM 428 O2 MeO 143 21.500 17.570 9.410 1.00 0.00
433 ATOM 429 H3 MeO 143 22.170 17.020 8.890 1.00 0.00
434 ATOM 430 Me1 MeO 144 18.300 3.870 3.450 1.00 0.00
435 ATOM 431 O2 MeO 144 17.200 3.910 2.640 1.00 0.00
436 ATOM 432 H3 MeO 144 16.430 4.150 3.230 1.00 0.00
437 ATOM 433 Me1 MeO 145 9.170 12.060 9.140 1.00 0.00
438 ATOM 434 O2 MeO 145 9.640 10.840 8.770 1.00 0.00
439 ATOM 435 H3 MeO 145 10.620 10.860 8.970 1.00 0.00
440 ATOM 436 Me1 MeO 146 3.810 14.980 5.090 1.00 0.00
441 ATOM 437 O2 MeO 146 4.320 16.110 4.530 1.00 0.00
442 ATOM 438 H3 MeO 146 4.260 16.110 3.530 1.00 0.00
443 ATOM 439 Me1 MeO 147 12.020 2.640 4.920 1.00 0.00
444 ATOM 440 O2 MeO 147 12.130 3.990 5.020 1.00 0.00
445 ATOM 441 H3 MeO 147 11.190 4.230 5.270 1.00 0.00
446 ATOM 442 Me1 MeO 148 5.400 15.760 1.490 1.00 0.00
447 ATOM 443 O2 MeO 148 4.130 15.970 1.910 1.00 0.00
448 ATOM 444 H3 MeO 148 3.670 16.420 1.140 1.00 0.00
449 ATOM 445 Me1 MeO 149 13.920 20.950 16.900 1.00 0.00
450 ATOM 446 O2 MeO 149 14.220 21.010 18.230 1.00 0.00
451 ATOM 447 H3 MeO 149 15.140 21.390 18.370 1.00 0.00
452 ATOM 448 Me1 MeO 150 11.440 21.060 20.020 1.00 0.00
453 ATOM 449 O2 MeO 150 12.500 21.920 20.030 1.00 0.00
454 ATOM 450 H3 MeO 150 13.200 21.400 19.540 1.00 0.00
455 ATOM 451 Me1 MeO 151 7.680 6.350 20.990 1.00 0.00
456 ATOM 452 O2 MeO 151 8.360 7.080 21.920 1.00 0.00
457 ATOM 453 H3 MeO 151 9.270 6.700 22.040 1.00 0.00
458 ATOM 454 Me1 MeO 152 7.510 15.020 21.280 1.00 0.00
459 ATOM 455 O2 MeO 152 7.960 15.810 22.290 1.00 0.00
460 ATOM 456 H3 MeO 152 8.900 15.520 22.460 1.00 0.00
461 ATOM 457 Me1 MeO 153 11.060 17.260 15.120 1.00 0.00
462 ATOM 458 O2 MeO 153 11.490 16.630 13.990 1.00 0.00
463 ATOM 459 H3 MeO 153 12.440 16.350 13.880 1.00 0.00
464 ATOM 460 Me1 MeO 154 12.370 7.630 13.570 1.00 0.00
465 ATOM 461 O2 MeO 154 12.270 7.580 14.920 1.00 0.00
466 ATOM 462 H3 MeO 154 11.300 7.640 15.170 1.00 0.00
467 ATOM 463 Me1 MeO 155 5.580 4.780 13.470 1.00 0.00
468 ATOM 464 O2 MeO 155 5.500 3.890 14.490 1.00 0.00
469 ATOM 465 H3 MeO 155 6.320 3.350 14.300 1.00 0.00
470 ATOM 466 Me1 MeO 156 7.090 15.740 8.750 1.00 0.00
471 ATOM 467 O2 MeO 156 7.700 16.590 7.890 1.00 0.00
472 ATOM 468 H3 MeO 156 6.970 16.920 7.290 1.00 0.00
473 ATOM 469 Me1 MeO 157 13.420 19.910 9.800 1.00 0.00
474 ATOM 470 O2 MeO 157 13.960 19.450 10.950 1.00 0.00
475 ATOM 471 H3 MeO 157 14.180 18.480 10.820 1.00 0.00
476 ATOM 472 Me1 MeO 158 0.820 1.150 15.600 1.00 0.00
477 ATOM 473 O2 MeO 158 1.050 2.180 16.450 1.00 0.00
478 ATOM 474 H3 MeO 158 1.930 2.520 16.110 1.00 0.00
479 ATOM 475 Me1 MeO 159 18.030 22.230 18.640 1.00 0.00
480 ATOM 476 O2 MeO 159 16.840 21.630 18.870 1.00 0.00
481 ATOM 477 H3 MeO 159 16.540 22.020 19.740 1.00 0.00
482 ATOM 478 Me1 MeO 160 11.400 5.370 21.200 1.00 0.00
483 ATOM 479 O2 MeO 160 10.630 5.820 22.230 1.00 0.00
484 ATOM 480 H3 MeO 160 11.100 5.780 23.110 1.00 0.00
485 ATOM 481 Me1 MeO 161 13.550 17.720 -0.150 1.00 0.00
486 ATOM 482 O2 MeO 161 12.760 16.820 0.490 1.00 0.00
487 ATOM 483 H3 MeO 161 13.220 16.650 1.350 1.00 0.00
488 ATOM 484 Me1 MeO 162 9.560 3.170 8.850 1.00 0.00
489 ATOM 485 O2 MeO 162 8.440 2.970 8.100 1.00 0.00
490 ATOM 486 H3 MeO 162 7.760 3.500 8.600 1.00 0.00
491 ATOM 487 Me1 MeO 163 18.110 18.030 16.590 1.00 0.00
492 ATOM 488 O2 MeO 163 18.850 16.890 16.470 1.00 0.00
493 ATOM 489 H3 MeO 163 19.660 17.040 17.040 1.00 0.00
494 ATOM 490 Me1 MeO 164 6.660 9.170 9.220 1.00 0.00
495 ATOM 491 O2 MeO 164 7.950 8.760 9.160 1.00 0.00
496 ATOM 492 H3 MeO 164 8.420 9.620 8.950 1.00 0.00
497 ATOM 493 Me1 MeO 165 5.120 15.600 18.270 1.00 0.00
498 ATOM 494 O2 MeO 165 4.620 16.520 17.400 1.00 0.00
499 ATOM 495 H3 MeO 165 5.410 16.690 16.810 1.00 0.00
500 ATOM 496 Me1 MeO 166 10.790 11.140 15.130 1.00 0.00
501 ATOM 497 O2 MeO 166 10.100 10.560 14.110 1.00 0.00
502 ATOM 498 H3 MeO 166 9.890 9.620 14.360 1.00 0.00
503 ATOM 499 Me1 MeO 167 13.350 11.570 1.340 1.00 0.00
504 ATOM 500 O2 MeO 167 14.120 10.820 0.510 1.00 0.00
505 ATOM 501 H3 MeO 167 13.500 10.270 -0.060 1.00 0.00
506 ATOM 502 Me1 MeO 168 0.460 21.870 1.880 1.00 0.00
507 ATOM 503 O2 MeO 168 1.660 22.460 1.610 1.00 0.00
508 ATOM 504 H3 MeO 168 2.430 22.360 2.250 1.00 0.00
509 ATOM 505 Me1 MeO 169 1.680 12.800 2.260 1.00 0.00
510 ATOM 506 O2 MeO 169 2.050 11.710 2.970 1.00 0.00
511 ATOM 507 H3 MeO 169 1.230 11.270 3.340 1.00 0.00
512 ATOM 508 Me1 MeO 170 15.600 18.390 13.530 1.00 0.00
513 ATOM 509 O2 MeO 170 16.940 18.320 13.770 1.00 0.00
514 ATOM 510 H3 MeO 170 17.300 17.420 13.560 1.00 0.00
515 ATOM 511 Me1 MeO 171 22.750 10.210 12.080 1.00 0.00
516 ATOM 512 O2 MeO 171 22.110 9.030 11.860 1.00 0.00
517 ATOM 513 H3 MeO 171 22.800 8.310 11.970 1.00 0.00
518 ATOM 514 Me1 MeO 172 15.470 21.470 22.580 1.00 0.00
519 ATOM 515 O2 MeO 172 16.120 22.100 21.560 1.00 0.00
520 ATOM 516 H3 MeO 172 16.410 22.870 22.130 1.00 0.00
521 ATOM 517 Me1 MeO 173 15.310 24.350 3.860 1.00 0.00
522 ATOM 518 O2 MeO 173 14.610 23.430 4.580 1.00 0.00
523 ATOM 519 H3 MeO 173 14.700 22.540 4.130 1.00 0.00
524 ATOM 520 Me1 MeO 174 9.600 10.880 3.970 1.00 0.00
525 ATOM 521 O2 MeO 174 9.360 12.060 4.600 1.00 0.00
526 ATOM 522 H3 MeO 174 9.890 12.690 4.040 1.00 0.00
527 ATOM 523 Me1 MeO 175 14.470 8.590 3.260 1.00 0.00
528 ATOM 524 O2 MeO 175 15.290 8.130 4.250 1.00 0.00
529 ATOM 525 H3 MeO 175 16.250 8.350 4.060 1.00 0.00
530 ATOM 526 Me1 MeO 176 5.070 23.960 17.240 1.00 0.00
531 ATOM 527 O2 MeO 176 5.610 22.840 17.770 1.00 0.00
532 ATOM 528 H3 MeO 176 4.850 22.220 17.940 1.00 0.00
533 ATOM 529 Me1 MeO 177 15.800 8.630 15.330 1.00 0.00
534 ATOM 530 O2 MeO 177 14.670 8.590 16.090 1.00 0.00
535 ATOM 531 H3 MeO 177 13.930 8.540 15.410 1.00 0.00
536 ATOM 532 Me1 MeO 178 21.740 13.710 2.430 1.00 0.00
537 ATOM 533 O2 MeO 178 20.800 13.050 3.160 1.00 0.00
538 ATOM 534 H3 MeO 178 21.310 12.900 4.000 1.00 0.00
539 ATOM 535 Me1 MeO 179 17.310 4.650 7.050 1.00 0.00
540 ATOM 536 O2 MeO 179 17.430 3.810 8.120 1.00 0.00
541 ATOM 537 H3 MeO 179 16.700 4.110 8.730 1.00 0.00
542 ATOM 538 Me1 MeO 180 13.400 0.340 11.410 1.00 0.00
543 ATOM 539 O2 MeO 180 12.110 0.670 11.670 1.00 0.00
544 ATOM 540 H3 MeO 180 12.010 0.920 12.630 1.00 0.00
545 ATOM 541 Me1 MeO 181 15.390 15.370 6.730 1.00 0.00
546 ATOM 542 O2 MeO 181 14.520 14.460 7.240 1.00 0.00
547 ATOM 543 H3 MeO 181 13.870 14.130 6.550 1.00 0.00
548 ATOM 544 Me1 MeO 182 18.850 8.310 4.660 1.00 0.00
549 ATOM 545 O2 MeO 182 17.750 9.070 4.460 1.00 0.00
550 ATOM 546 H3 MeO 182 18.070 9.930 4.050 1.00 0.00
551 ATOM 547 Me1 MeO 183 18.300 11.570 1.850 1.00 0.00
552 ATOM 548 O2 MeO 183 18.570 11.290 3.150 1.00 0.00
553 ATOM 549 H3 MeO 183 19.390 11.850 3.270 1.00 0.00
554 ATOM 550 Me1 MeO 184 11.570 17.090 20.070 1.00 0.00
555 ATOM 551 O2 MeO 184 11.430 17.410 18.750 1.00 0.00
556 ATOM 552 H3 MeO 184 10.500 17.750 18.650 1.00 0.00
557 ATOM 553 Me1 MeO 185 17.270 4.210 -0.780 1.00 0.00
558 ATOM 554 O2 MeO 185 16.550 4.920 0.120 1.00 0.00
559 ATOM 555 H3 MeO 185 16.900 4.530 0.980 1.00 0.00
560 ATOM 556 Me1 MeO 186 17.690 11.770 20.980 1.00 0.00
561 ATOM 557 O2 MeO 186 18.020 10.450 21.000 1.00 0.00
562 ATOM 558 H3 MeO 186 17.560 10.100 21.820 1.00 0.00
563 ATOM 559 Me1 MeO 187 20.690 1.350 15.100 1.00 0.00
564 ATOM 560 O2 MeO 187 20.400 1.980 13.930 1.00 0.00
565 ATOM 561 H3 MeO 187 21.110 2.690 13.920 1.00 0.00
566 ATOM 562 Me1 MeO 188 23.720 21.220 3.360 1.00 0.00
567 ATOM 563 O2 MeO 188 23.880 22.570 3.300 1.00 0.00
568 ATOM 564 H3 MeO 188 24.840 22.820 3.250 1.00 0.00
569 ATOM 565 Me1 MeO 189 7.800 12.740 1.540 1.00 0.00
570 ATOM 566 O2 MeO 189 6.450 12.570 1.550 1.00 0.00
571 ATOM 567 H3 MeO 189 6.170 12.160 2.410 1.00 0.00
572 ATOM 568 Me1 MeO 190 3.140 13.990 10.300 1.00 0.00
573 ATOM 569 O2 MeO 190 2.210 14.230 11.260 1.00 0.00
574 ATOM 570 H3 MeO 190 2.500 14.730 12.080 1.00 0.00
575 ATOM 571 Me1 MeO 191 10.870 14.240 22.800 1.00 0.00
576 ATOM 572 O2 MeO 191 10.590 15.570 22.760 1.00 0.00
577 ATOM 573 H3 MeO 191 11.390 16.030 23.140 1.00 0.00
578 ATOM 574 Me1 MeO 192 12.170 4.490 15.750 1.00 0.00
579 ATOM 575 O2 MeO 192 12.110 3.150 15.950 1.00 0.00
580 ATOM 576 H3 MeO 192 11.810 2.990 16.890 1.00 0.00
581 ATOM 577 Me1 MeO 193 21.830 22.950 20.770 1.00 0.00
582 ATOM 578 O2 MeO 193 22.330 21.860 20.140 1.00 0.00
583 ATOM 579 H3 MeO 193 21.680 21.100 20.110 1.00 0.00
584 ATOM 580 Me1 MeO 194 19.110 8.380 8.750 1.00 0.00
585 ATOM 581 O2 MeO 194 20.370 8.550 9.240 1.00 0.00
586 ATOM 582 H3 MeO 194 20.620 9.490 9.030 1.00 0.00
587 ATOM 583 Me1 MeO 195 22.310 16.540 23.380 1.00 0.00
588 ATOM 584 O2 MeO 195 21.160 17.260 23.400 1.00 0.00
589 ATOM 585 H3 MeO 195 20.410 16.780 22.930 1.00 0.00
590 ATOM 586 Me1 MeO 196 10.380 22.650 9.610 1.00 0.00
591 ATOM 587 O2 MeO 196 10.000 22.820 10.900 1.00 0.00
592 ATOM 588 H3 MeO 196 10.710 23.390 11.310 1.00 0.00
593 ATOM 589 Me1 MeO 197 7.150 21.730 12.220 1.00 0.00
594 ATOM 590 O2 MeO 197 7.830 22.900 12.360 1.00 0.00
595 ATOM 591 H3 MeO 197 8.650 22.950 11.800 1.00 0.00
596 ATOM 592 Me1 MeO 198 16.790 2.120 19.090 1.00 0.00
597 ATOM 593 O2 MeO 198 17.730 1.810 20.020 1.00 0.00
598 ATOM 594 H3 MeO 198 18.650 2.040 19.710 1.00 0.00
599 ATOM 595 Me1 MeO 199 9.490 7.360 16.640 1.00 0.00
600 ATOM 596 O2 MeO 199 9.570 7.900 15.400 1.00 0.00
601 ATOM 597 H3 MeO 199 8.640 8.100 15.080 1.00 0.00
602 ATOM 598 Me1 MeO 200 47.150 11.870 18.420 1.00 0.00
603 ATOM 599 O2 MeO 200 46.320 10.850 18.070 1.00 0.00
604 ATOM 600 H3 MeO 200 45.560 11.270 17.570 1.00 0.00
605 ATOM 601 Me1 MeO 201 23.480 2.390 20.950 1.00 0.00
606 ATOM 602 O2 MeO 201 22.220 2.620 21.410 1.00 0.00
607 ATOM 603 H3 MeO 201 22.290 2.500 22.400 1.00 0.00
608 ATOM 604 Me1 MeO 202 17.470 1.440 12.170 1.00 0.00
609 ATOM 605 O2 MeO 202 17.780 1.570 13.490 1.00 0.00
610 ATOM 606 H3 MeO 202 18.770 1.530 13.590 1.00 0.00
611 ATOM 607 Me1 MeO 203 14.340 2.210 23.350 1.00 0.00
612 ATOM 608 O2 MeO 203 14.900 1.020 23.660 1.00 0.00
613 ATOM 609 H3 MeO 203 15.850 0.940 23.350 1.00 0.00
614 ATOM 610 Me1 MeO 204 2.590 15.420 14.470 1.00 0.00
615 ATOM 611 O2 MeO 204 3.440 15.000 13.500 1.00 0.00
616 ATOM 612 H3 MeO 204 4.340 14.820 13.880 1.00 0.00
617 ATOM 613 Me1 MeO 205 6.610 21.560 8.350 1.00 0.00
618 ATOM 614 O2 MeO 205 6.370 22.570 7.470 1.00 0.00
619 ATOM 615 H3 MeO 205 6.810 22.230 6.640 1.00 0.00
620 ATOM 616 Me1 MeO 206 47.240 17.040 4.600 1.00 0.00
621 ATOM 617 O2 MeO 206 45.970 17.250 4.170 1.00 0.00
622 ATOM 618 H3 MeO 206 45.780 16.640 3.400 1.00 0.00
623 ATOM 619 Me1 MeO 207 3.440 4.600 16.350 1.00 0.00
624 ATOM 620 O2 MeO 207 3.180 3.510 15.580 1.00 0.00
625 ATOM 621 H3 MeO 207 4.010 3.500 15.010 1.00 0.00
626 ATOM 622 Me1 MeO 208 20.060 1.580 8.450 1.00 0.00
627 ATOM 623 O2 MeO 208 19.050 1.620 7.540 1.00 0.00
628 ATOM 624 H3 MeO 208 18.600 2.500 7.380 1.00 0.00
629 ATOM 625 Me1 MeO 209 10.760 14.880 2.920 1.00 0.00
630 ATOM 626 O2 MeO 209 11.200 13.730 3.520 1.00 0.00
631 ATOM 627 H3 MeO 209 11.850 14.080 4.190 1.00 0.00
632 ATOM 628 Me1 MeO 210 7.640 2.610 21.770 1.00 0.00
633 ATOM 629 O2 MeO 210 6.400 2.060 21.670 1.00 0.00
634 ATOM 630 H3 MeO 210 6.430 1.220 21.130 1.00 0.00
635 ATOM 631 Me1 MeO 211 45.990 7.020 14.840 1.00 0.00
636 ATOM 632 O2 MeO 211 45.910 6.910 13.480 1.00 0.00
637 ATOM 633 H3 MeO 211 45.730 7.820 13.130 1.00 0.00
638 ATOM 634 Me1 MeO 212 0.320 21.360 7.650 1.00 0.00
639 ATOM 635 O2 MeO 212 0.760 20.920 8.860 1.00 0.00
640 ATOM 636 H3 MeO 212 1.170 20.030 8.660 1.00 0.00
641 ATOM 637 Me1 MeO 213 18.730 8.860 12.640 1.00 0.00
642 ATOM 638 O2 MeO 213 19.920 8.260 12.900 1.00 0.00
643 ATOM 639 H3 MeO 213 20.650 8.760 12.430 1.00 0.00
644 ATOM 640 Me1 MeO 214 1.010 24.160 11.010 1.00 0.00
645 ATOM 641 O2 MeO 214 0.020 23.230 10.950 1.00 0.00
646 ATOM 642 H3 MeO 214 0.190 22.790 10.070 1.00 0.00
647 ATOM 643 Me1 MeO 215 18.870 15.060 12.670 1.00 0.00
648 ATOM 644 O2 MeO 215 17.980 16.070 12.500 1.00 0.00
649 ATOM 645 H3 MeO 215 18.140 16.410 11.570 1.00 0.00
650 ATOM 646 Me1 MeO 216 18.760 11.740 15.450 1.00 0.00
651 ATOM 647 O2 MeO 216 19.940 11.590 16.110 1.00 0.00
652 ATOM 648 H3 MeO 216 19.630 11.240 17.000 1.00 0.00
653 ATOM 649 OW SOL 217 35.740 16.090 8.270 1.00 0.00
654 ATOM 650 HW1 SOL 217 36.240 15.630 9.010 1.00 0.00
655 ATOM 651 HW2 SOL 217 35.250 15.410 7.730 1.00 0.00
656 ATOM 652 OW SOL 218 34.390 18.990 20.960 1.00 0.00
657 ATOM 653 HW1 SOL 218 34.000 19.910 20.840 1.00 0.00
658 ATOM 654 HW2 SOL 218 33.830 18.320 20.470 1.00 0.00
659 ATOM 655 OW SOL 219 24.460 1.730 7.060 1.00 0.00
660 ATOM 656 HW1 SOL 219 25.030 0.940 7.270 1.00 0.00
661 ATOM 657 HW2 SOL 219 23.690 1.450 6.490 1.00 0.00
662 ATOM 658 OW SOL 220 36.330 22.170 14.030 1.00 0.00
663 ATOM 659 HW1 SOL 220 36.470 21.500 14.760 1.00 0.00
664 ATOM 660 HW2 SOL 220 35.360 22.200 13.790 1.00 0.00
665 ATOM 661 OW SOL 221 33.710 20.370 13.280 1.00 0.00
666 ATOM 662 HW1 SOL 221 33.700 20.050 12.340 1.00 0.00
667 ATOM 663 HW2 SOL 221 32.810 20.760 13.510 1.00 0.00
668 ATOM 664 OW SOL 222 31.070 19.150 10.030 1.00 0.00
669 ATOM 665 HW1 SOL 222 30.740 18.360 9.520 1.00 0.00
670 ATOM 666 HW2 SOL 222 31.370 19.860 9.390 1.00 0.00
671 ATOM 667 OW SOL 223 36.360 19.000 5.080 1.00 0.00
672 ATOM 668 HW1 SOL 223 36.090 18.880 6.040 1.00 0.00
673 ATOM 669 HW2 SOL 223 37.250 19.450 5.030 1.00 0.00
674 ATOM 670 OW SOL 224 32.340 10.900 19.600 1.00 0.00
675 ATOM 671 HW1 SOL 224 32.830 10.090 19.270 1.00 0.00
676 ATOM 672 HW2 SOL 224 32.200 10.830 20.590 1.00 0.00
677 ATOM 673 OW SOL 225 27.530 21.250 2.450 1.00 0.00
678 ATOM 674 HW1 SOL 225 27.370 22.210 2.680 1.00 0.00
679 ATOM 675 HW2 SOL 225 27.480 21.140 1.460 1.00 0.00
680 ATOM 676 OW SOL 226 35.780 1.650 16.540 1.00 0.00
681 ATOM 677 HW1 SOL 226 36.360 1.310 15.800 1.00 0.00
682 ATOM 678 HW2 SOL 226 36.350 2.010 17.280 1.00 0.00
683 ATOM 679 OW SOL 227 40.500 16.170 4.930 1.00 0.00
684 ATOM 680 HW1 SOL 227 41.380 16.470 5.310 1.00 0.00
685 ATOM 681 HW2 SOL 227 39.790 16.230 5.640 1.00 0.00
686 ATOM 682 OW SOL 228 42.960 12.260 7.510 1.00 0.00
687 ATOM 683 HW1 SOL 228 42.310 12.580 8.200 1.00 0.00
688 ATOM 684 HW2 SOL 228 43.270 13.030 6.960 1.00 0.00
689 ATOM 685 OW SOL 229 36.880 14.290 13.420 1.00 0.00
690 ATOM 686 HW1 SOL 229 37.660 14.390 12.790 1.00 0.00
691 ATOM 687 HW2 SOL 229 36.800 15.110 13.980 1.00 0.00
692 ATOM 688 OW SOL 230 32.820 16.500 13.700 1.00 0.00
693 ATOM 689 HW1 SOL 230 32.950 17.390 14.120 1.00 0.00
694 ATOM 690 HW2 SOL 230 32.150 16.580 12.950 1.00 0.00
695 ATOM 691 OW SOL 231 38.130 15.630 15.970 1.00 0.00
696 ATOM 692 HW1 SOL 231 38.310 14.850 16.560 1.00 0.00
697 ATOM 693 HW2 SOL 231 37.220 16.000 16.160 1.00 0.00
698 ATOM 694 OW SOL 232 37.070 12.300 1.840 1.00 0.00
699 ATOM 695 HW1 SOL 232 36.820 11.440 1.400 1.00 0.00
700 ATOM 696 HW2 SOL 232 37.970 12.590 1.520 1.00 0.00
701 ATOM 697 OW SOL 233 37.750 14.670 10.230 1.00 0.00
702 ATOM 698 HW1 SOL 233 36.850 14.230 10.300 1.00 0.00
703 ATOM 699 HW2 SOL 233 38.460 13.970 10.270 1.00 0.00
704 ATOM 700 OW SOL 234 37.230 4.790 20.890 1.00 0.00
705 ATOM 701 HW1 SOL 234 36.340 5.060 20.540 1.00 0.00
706 ATOM 702 HW2 SOL 234 37.540 5.450 21.580 1.00 0.00
707 ATOM 703 OW SOL 235 43.050 20.920 12.870 1.00 0.00
708 ATOM 704 HW1 SOL 235 43.690 21.690 12.820 1.00 0.00
709 ATOM 705 HW2 SOL 235 42.310 21.060 12.210 1.00 0.00
710 ATOM 706 OW SOL 236 28.310 18.810 20.660 1.00 0.00
711 ATOM 707 HW1 SOL 236 29.080 19.370 20.990 1.00 0.00
712 ATOM 708 HW2 SOL 236 28.160 18.050 21.290 1.00 0.00
713 ATOM 709 OW SOL 237 44.480 6.440 2.310 1.00 0.00
714 ATOM 710 HW1 SOL 237 44.730 6.550 3.270 1.00 0.00
715 ATOM 711 HW2 SOL 237 44.470 5.470 2.070 1.00 0.00
716 ATOM 712 OW SOL 238 37.640 16.830 0.800 1.00 0.00
717 ATOM 713 HW1 SOL 238 37.940 16.330 -0.010 1.00 0.00
718 ATOM 714 HW2 SOL 238 36.640 16.840 0.840 1.00 0.00
719 ATOM 715 OW SOL 239 44.920 2.820 9.950 1.00 0.00
720 ATOM 716 HW1 SOL 239 45.190 2.870 10.910 1.00 0.00
721 ATOM 717 HW2 SOL 239 44.760 3.740 9.590 1.00 0.00
722 ATOM 718 OW SOL 240 42.310 16.850 2.240 1.00 0.00
723 ATOM 719 HW1 SOL 240 42.260 17.330 3.110 1.00 0.00
724 ATOM 720 HW2 SOL 240 41.430 16.430 2.040 1.00 0.00
725 ATOM 721 OW SOL 241 25.750 15.860 14.830 1.00 0.00
726 ATOM 722 HW1 SOL 241 24.870 15.770 14.370 1.00 0.00
727 ATOM 723 HW2 SOL 241 26.460 16.030 14.160 1.00 0.00
728 ATOM 724 OW SOL 242 28.950 20.630 16.040 1.00 0.00
729 ATOM 725 HW1 SOL 242 28.960 20.090 16.880 1.00 0.00
730 ATOM 726 HW2 SOL 242 28.650 21.570 16.250 1.00 0.00
731 ATOM 727 OW SOL 243 41.460 14.710 9.200 1.00 0.00
732 ATOM 728 HW1 SOL 243 40.800 14.330 9.850 1.00 0.00
733 ATOM 729 HW2 SOL 243 42.310 14.940 9.680 1.00 0.00
734 ATOM 730 OW SOL 244 30.930 7.770 20.790 1.00 0.00
735 ATOM 731 HW1 SOL 244 30.750 8.080 21.730 1.00 0.00
736 ATOM 732 HW2 SOL 244 30.270 8.200 20.170 1.00 0.00
737 ATOM 733 OW SOL 245 40.350 20.060 2.410 1.00 0.00
738 ATOM 734 HW1 SOL 245 41.010 19.370 2.110 1.00 0.00
739 ATOM 735 HW2 SOL 245 40.570 20.940 1.980 1.00 0.00
740 ATOM 736 OW SOL 246 33.160 11.150 14.440 1.00 0.00
741 ATOM 737 HW1 SOL 246 33.190 12.140 14.280 1.00 0.00
742 ATOM 738 HW2 SOL 246 32.220 10.870 14.630 1.00 0.00
743 ATOM 739 OW SOL 247 46.490 8.890 6.930 1.00 0.00
744 ATOM 740 HW1 SOL 247 47.040 9.720 7.030 1.00 0.00
745 ATOM 741 HW2 SOL 247 45.540 9.100 7.170 1.00 0.00
746 ATOM 742 OW SOL 248 41.360 2.940 16.530 1.00 0.00
747 ATOM 743 HW1 SOL 248 41.290 2.520 15.630 1.00 0.00
748 ATOM 744 HW2 SOL 248 40.460 2.980 16.960 1.00 0.00
749 ATOM 745 OW SOL 249 36.940 21.820 20.580 1.00 0.00
750 ATOM 746 HW1 SOL 249 37.250 20.870 20.670 1.00 0.00
751 ATOM 747 HW2 SOL 249 35.940 21.840 20.530 1.00 0.00
752 ATOM 748 OW SOL 250 26.070 12.510 12.210 1.00 0.00
753 ATOM 749 HW1 SOL 250 25.650 11.750 11.720 1.00 0.00
754 ATOM 750 HW2 SOL 250 25.380 12.970 12.770 1.00 0.00
755 ATOM 751 OW SOL 251 24.320 11.760 8.370 1.00 0.00
756 ATOM 752 HW1 SOL 251 25.130 11.300 8.750 1.00 0.00
757 ATOM 753 HW2 SOL 251 24.370 11.760 7.370 1.00 0.00
758 ATOM 754 OW SOL 252 43.570 6.900 6.950 1.00 0.00
759 ATOM 755 HW1 SOL 252 44.430 6.410 6.790 1.00 0.00
760 ATOM 756 HW2 SOL 252 43.670 7.500 7.740 1.00 0.00
761 ATOM 757 OW SOL 253 28.400 20.040 13.380 1.00 0.00
762 ATOM 758 HW1 SOL 253 27.600 20.650 13.310 1.00 0.00
763 ATOM 759 HW2 SOL 253 28.850 20.190 14.260 1.00 0.00
764 ATOM 760 OW SOL 254 35.590 20.720 17.600 1.00 0.00
765 ATOM 761 HW1 SOL 254 36.510 21.110 17.610 1.00 0.00
766 ATOM 762 HW2 SOL 254 35.530 20.010 16.900 1.00 0.00
767 ATOM 763 OW SOL 255 38.800 11.090 19.350 1.00 0.00
768 ATOM 764 HW1 SOL 255 39.300 10.700 18.580 1.00 0.00
769 ATOM 765 HW2 SOL 255 38.250 10.380 19.780 1.00 0.00
770 ATOM 766 OW SOL 256 27.870 16.970 22.570 1.00 0.00
771 ATOM 767 HW1 SOL 256 28.260 16.060 22.440 1.00 0.00
772 ATOM 768 HW2 SOL 256 27.080 16.920 23.180 1.00 0.00
773 ATOM 769 OW SOL 257 28.050 4.860 4.660 1.00 0.00
774 ATOM 770 HW1 SOL 257 27.610 5.410 5.370 1.00 0.00
775 ATOM 771 HW2 SOL 257 28.240 3.950 5.000 1.00 0.00
776 ATOM 772 OW SOL 258 29.550 23.740 20.930 1.00 0.00
777 ATOM 773 HW1 SOL 258 29.440 22.910 21.470 1.00 0.00
778 ATOM 774 HW2 SOL 258 29.870 23.510 20.010 1.00 0.00
779 ATOM 775 OW SOL 259 38.280 5.660 5.500 1.00 0.00
780 ATOM 776 HW1 SOL 259 38.490 4.740 5.140 1.00 0.00
781 ATOM 777 HW2 SOL 259 39.080 6.250 5.390 1.00 0.00
782 ATOM 778 OW SOL 260 25.400 22.270 22.640 1.00 0.00
783 ATOM 779 HW1 SOL 260 25.600 21.860 21.750 1.00 0.00
784 ATOM 780 HW2 SOL 260 26.050 23.020 22.810 1.00 0.00
785 ATOM 781 OW SOL 261 43.560 18.420 5.110 1.00 0.00
786 ATOM 782 HW1 SOL 261 43.310 17.670 5.720 1.00 0.00
787 ATOM 783 HW2 SOL 261 44.550 18.490 5.050 1.00 0.00
788 ATOM 784 OW SOL 262 41.060 3.870 1.940 1.00 0.00
789 ATOM 785 HW1 SOL 262 40.500 4.070 1.130 1.00 0.00
790 ATOM 786 HW2 SOL 262 40.460 3.690 2.720 1.00 0.00
791 ATOM 787 OW SOL 263 44.360 -0.120 12.180 1.00 0.00
792 ATOM 788 HW1 SOL 263 45.260 -0.350 11.800 1.00 0.00
793 ATOM 789 HW2 SOL 263 44.420 0.740 12.680 1.00 0.00
794 ATOM 790 OW SOL 264 39.180 9.870 14.760 1.00 0.00
795 ATOM 791 HW1 SOL 264 39.120 9.470 13.840 1.00 0.00
796 ATOM 792 HW2 SOL 264 38.400 10.480 14.910 1.00 0.00
797 ATOM 793 OW SOL 265 29.450 8.860 4.370 1.00 0.00
798 ATOM 794 HW1 SOL 265 28.990 9.630 4.830 1.00 0.00
799 ATOM 795 HW2 SOL 265 28.800 8.400 3.760 1.00 0.00
800 ATOM 796 OW SOL 266 33.700 7.560 21.280 1.00 0.00
801 ATOM 797 HW1 SOL 266 34.140 7.860 20.440 1.00 0.00
802 ATOM 798 HW2 SOL 266 32.750 7.880 21.290 1.00 0.00
803 ATOM 799 OW SOL 267 27.630 10.300 13.040 1.00 0.00
804 ATOM 800 HW1 SOL 267 27.130 11.160 12.890 1.00 0.00
805 ATOM 801 HW2 SOL 267 26.980 9.550 13.110 1.00 0.00
806 ATOM 802 OW SOL 268 31.460 21.660 14.270 1.00 0.00
807 ATOM 803 HW1 SOL 268 30.660 22.140 14.630 1.00 0.00
808 ATOM 804 HW2 SOL 268 32.210 21.710 14.940 1.00 0.00
809 ATOM 805 OW SOL 269 27.390 18.980 18.020 1.00 0.00
810 ATOM 806 HW1 SOL 269 26.940 18.100 17.920 1.00 0.00
811 ATOM 807 HW2 SOL 269 27.700 19.100 18.970 1.00 0.00
812 ATOM 808 OW SOL 270 45.100 0.470 8.350 1.00 0.00
813 ATOM 809 HW1 SOL 270 45.110 1.240 8.990 1.00 0.00
814 ATOM 810 HW2 SOL 270 44.230 -0.020 8.420 1.00 0.00
815 ATOM 811 OW SOL 271 41.390 10.840 12.550 1.00 0.00
816 ATOM 812 HW1 SOL 271 41.690 10.330 13.360 1.00 0.00
817 ATOM 813 HW2 SOL 271 40.740 10.280 12.030 1.00 0.00
818 ATOM 814 OW SOL 272 29.740 4.210 2.550 1.00 0.00
819 ATOM 815 HW1 SOL 272 29.100 4.610 3.200 1.00 0.00
820 ATOM 816 HW2 SOL 272 30.660 4.210 2.930 1.00 0.00
821 ATOM 817 OW SOL 273 44.410 14.310 5.910 1.00 0.00
822 ATOM 818 HW1 SOL 273 44.500 14.710 5.000 1.00 0.00
823 ATOM 819 HW2 SOL 273 45.220 13.770 6.130 1.00 0.00
824 ATOM 820 OW SOL 274 34.060 5.950 23.590 1.00 0.00
825 ATOM 821 HW1 SOL 274 34.050 6.450 22.720 1.00 0.00
826 ATOM 822 HW2 SOL 274 33.270 5.340 23.630 1.00 0.00
827 ATOM 823 OW SOL 275 28.830 12.370 9.450 1.00 0.00
828 ATOM 824 HW1 SOL 275 29.320 12.020 10.250 1.00 0.00
829 ATOM 825 HW2 SOL 275 29.480 12.640 8.750 1.00 0.00
830 ATOM 826 OW SOL 276 22.700 15.040 10.380 1.00 0.00
831 ATOM 827 HW1 SOL 276 23.330 15.760 10.670 1.00 0.00
832 ATOM 828 HW2 SOL 276 22.320 14.580 11.190 1.00 0.00
833 ATOM 829 OW SOL 277 35.190 17.180 16.660 1.00 0.00
834 ATOM 830 HW1 SOL 277 34.270 16.840 16.440 1.00 0.00
835 ATOM 831 HW2 SOL 277 35.420 16.930 17.590 1.00 0.00
836 ATOM 832 OW SOL 278 33.720 8.520 18.440 1.00 0.00
837 ATOM 833 HW1 SOL 278 33.280 7.660 18.180 1.00 0.00
838 ATOM 834 HW2 SOL 278 34.030 9.000 17.620 1.00 0.00
839 ATOM 835 OW SOL 279 45.080 15.430 2.210 1.00 0.00
840 ATOM 836 HW1 SOL 279 45.190 14.490 1.900 1.00 0.00
841 ATOM 837 HW2 SOL 279 44.110 15.600 2.400 1.00 0.00
842 ATOM 838 OW SOL 280 25.390 21.730 20.000 1.00 0.00
843 ATOM 839 HW1 SOL 280 24.400 21.730 19.900 1.00 0.00
844 ATOM 840 HW2 SOL 280 25.820 21.460 19.140 1.00 0.00
845 ATOM 841 OW SOL 281 27.420 3.080 9.930 1.00 0.00
846 ATOM 842 HW1 SOL 281 26.940 3.520 9.160 1.00 0.00
847 ATOM 843 HW2 SOL 281 27.960 2.310 9.590 1.00 0.00
848 ATOM 844 OW SOL 282 42.220 4.780 7.830 1.00 0.00
849 ATOM 845 HW1 SOL 282 42.340 5.700 7.460 1.00 0.00
850 ATOM 846 HW2 SOL 282 42.770 4.690 8.670 1.00 0.00
851 ATOM 847 OW SOL 283 25.970 21.120 17.220 1.00 0.00
852 ATOM 848 HW1 SOL 283 26.590 20.350 17.360 1.00 0.00
853 ATOM 849 HW2 SOL 283 25.100 20.790 16.860 1.00 0.00
854 ATOM 850 OW SOL 284 38.670 13.560 17.860 1.00 0.00
855 ATOM 851 HW1 SOL 284 38.550 12.800 18.500 1.00 0.00
856 ATOM 852 HW2 SOL 284 39.630 13.830 17.840 1.00 0.00
857 ATOM 853 OW SOL 285 27.600 20.060 23.170 1.00 0.00
858 ATOM 854 HW1 SOL 285 27.420 19.100 23.390 1.00 0.00
859 ATOM 855 HW2 SOL 285 26.760 20.470 22.800 1.00 0.00
860 ATOM 856 OW SOL 286 36.570 3.080 9.010 1.00 0.00
861 ATOM 857 HW1 SOL 286 36.570 4.080 9.000 1.00 0.00
862 ATOM 858 HW2 SOL 286 36.580 2.740 8.070 1.00 0.00
863 ATOM 859 OW SOL 287 44.960 0.250 22.810 1.00 0.00
864 ATOM 860 HW1 SOL 287 44.640 0.900 22.130 1.00 0.00
865 ATOM 861 HW2 SOL 287 45.690 0.660 23.350 1.00 0.00
866 ATOM 862 OW SOL 288 21.650 9.560 2.610 1.00 0.00
867 ATOM 863 HW1 SOL 288 22.440 9.020 2.350 1.00 0.00
868 ATOM 864 HW2 SOL 288 20.960 9.530 1.880 1.00 0.00
869 ATOM 865 OW SOL 289 32.870 20.310 7.110 1.00 0.00
870 ATOM 866 HW1 SOL 289 33.760 19.890 6.890 1.00 0.00
871 ATOM 867 HW2 SOL 289 32.880 21.270 6.830 1.00 0.00
872 ATOM 868 OW SOL 290 46.280 3.760 18.060 1.00 0.00
873 ATOM 869 HW1 SOL 290 46.860 3.200 17.470 1.00 0.00
874 ATOM 870 HW2 SOL 290 45.320 3.620 17.810 1.00 0.00
875 ATOM 871 OW SOL 291 24.320 3.100 1.730 1.00 0.00
876 ATOM 872 HW1 SOL 291 25.230 3.300 1.380 1.00 0.00
877 ATOM 873 HW2 SOL 291 24.340 3.130 2.730 1.00 0.00
878 ATOM 874 OW SOL 292 30.760 13.830 5.040 1.00 0.00
879 ATOM 875 HW1 SOL 292 31.370 14.160 4.320 1.00 0.00
880 ATOM 876 HW2 SOL 292 29.950 14.410 5.090 1.00 0.00
881 ATOM 877 OW SOL 293 39.900 15.140 13.990 1.00 0.00
882 ATOM 878 HW1 SOL 293 40.490 15.870 13.650 1.00 0.00
883 ATOM 879 HW2 SOL 293 39.240 15.530 14.640 1.00 0.00
884 ATOM 880 OW SOL 294 26.810 10.610 8.770 1.00 0.00
885 ATOM 881 HW1 SOL 294 27.590 11.240 8.790 1.00 0.00
886 ATOM 882 HW2 SOL 294 27.080 9.740 9.170 1.00 0.00
887 ATOM 883 OW SOL 295 27.650 20.420 5.130 1.00 0.00
888 ATOM 884 HW1 SOL 295 26.660 20.410 5.260 1.00 0.00
889 ATOM 885 HW2 SOL 295 27.860 20.740 4.200 1.00 0.00
890 ATOM 886 OW SOL 296 41.320 18.730 22.880 1.00 0.00
891 ATOM 887 HW1 SOL 296 40.420 19.160 22.960 1.00 0.00
892 ATOM 888 HW2 SOL 296 41.370 18.210 22.030 1.00 0.00
893 ATOM 889 OW SOL 297 30.990 13.520 7.830 1.00 0.00
894 ATOM 890 HW1 SOL 297 31.170 13.580 6.840 1.00 0.00
895 ATOM 891 HW2 SOL 297 31.410 14.300 8.290 1.00 0.00
896 ATOM 892 OW SOL 298 30.420 18.270 12.650 1.00 0.00
897 ATOM 893 HW1 SOL 298 29.710 18.880 13.010 1.00 0.00
898 ATOM 894 HW2 SOL 298 30.730 18.610 11.760 1.00 0.00
899 ATOM 895 OW SOL 299 28.760 7.710 11.270 1.00 0.00
900 ATOM 896 HW1 SOL 299 28.010 8.290 10.950 1.00 0.00
901 ATOM 897 HW2 SOL 299 29.260 8.170 12.000 1.00 0.00
902 ATOM 898 OW SOL 300 27.240 5.140 18.610 1.00 0.00
903 ATOM 899 HW1 SOL 300 26.820 4.420 18.050 1.00 0.00
904 ATOM 900 HW2 SOL 300 26.950 5.040 19.560 1.00 0.00
905 ATOM 901 OW SOL 301 33.120 23.120 7.940 1.00 0.00
906 ATOM 902 HW1 SOL 301 33.470 23.920 8.420 1.00 0.00
907 ATOM 903 HW2 SOL 301 32.220 22.880 8.300 1.00 0.00
908 ATOM 904 OW SOL 302 34.380 5.260 20.030 1.00 0.00
909 ATOM 905 HW1 SOL 302 34.140 5.850 20.800 1.00 0.00
910 ATOM 906 HW2 SOL 302 33.730 5.410 19.280 1.00 0.00
911 ATOM 907 OW SOL 303 27.270 23.430 8.250 1.00 0.00
912 ATOM 908 HW1 SOL 303 27.120 22.590 8.760 1.00 0.00
913 ATOM 909 HW2 SOL 303 28.050 23.930 8.640 1.00 0.00
914 ATOM 910 OW SOL 304 38.580 4.190 0.370 1.00 0.00
915 ATOM 911 HW1 SOL 304 38.010 3.990 -0.440 1.00 0.00
916 ATOM 912 HW2 SOL 304 37.990 4.290 1.170 1.00 0.00
917 ATOM 913 OW SOL 305 44.630 12.560 1.580 1.00 0.00
918 ATOM 914 HW1 SOL 305 43.820 12.540 1.000 1.00 0.00
919 ATOM 915 HW2 SOL 305 45.210 11.780 1.380 1.00 0.00
920 ATOM 916 OW SOL 306 26.780 4.460 21.280 1.00 0.00
921 ATOM 917 HW1 SOL 306 26.510 4.680 22.220 1.00 0.00
922 ATOM 918 HW2 SOL 306 27.490 3.760 21.300 1.00 0.00
923 ATOM 919 OW SOL 307 43.920 11.350 17.260 1.00 0.00
924 ATOM 920 HW1 SOL 307 43.890 11.720 16.330 1.00 0.00
925 ATOM 921 HW2 SOL 307 43.010 11.410 17.670 1.00 0.00
926 ATOM 922 OW SOL 308 37.880 0.560 15.140 1.00 0.00
927 ATOM 923 HW1 SOL 308 38.650 0.770 14.540 1.00 0.00
928 ATOM 924 HW2 SOL 308 37.280 -0.100 14.700 1.00 0.00
929 ATOM 925 OW SOL 309 36.920 11.890 9.610 1.00 0.00
930 ATOM 926 HW1 SOL 309 37.720 11.350 9.360 1.00 0.00
931 ATOM 927 HW2 SOL 309 36.280 11.930 8.840 1.00 0.00
932 ATOM 928 OW SOL 310 36.340 7.420 12.000 1.00 0.00
933 ATOM 929 HW1 SOL 310 35.930 8.320 12.090 1.00 0.00
934 ATOM 930 HW2 SOL 310 36.990 7.270 12.750 1.00 0.00
935 ATOM 931 OW SOL 311 38.090 21.970 16.810 1.00 0.00
936 ATOM 932 HW1 SOL 311 38.780 21.760 16.120 1.00 0.00
937 ATOM 933 HW2 SOL 311 37.940 22.960 16.850 1.00 0.00
938 ATOM 934 OW SOL 312 30.050 20.850 21.890 1.00 0.00
939 ATOM 935 HW1 SOL 312 30.930 20.670 22.310 1.00 0.00
940 ATOM 936 HW2 SOL 312 29.320 20.540 22.500 1.00 0.00
941 ATOM 937 OW SOL 313 33.440 7.330 2.690 1.00 0.00
942 ATOM 938 HW1 SOL 313 33.660 6.670 1.980 1.00 0.00
943 ATOM 939 HW2 SOL 313 34.280 7.750 3.030 1.00 0.00
944 ATOM 940 OW SOL 314 43.980 9.720 7.600 1.00 0.00
945 ATOM 941 HW1 SOL 314 43.730 10.670 7.450 1.00 0.00
946 ATOM 942 HW2 SOL 314 43.230 9.130 7.300 1.00 0.00
947 ATOM 943 OW SOL 315 43.350 15.450 18.170 1.00 0.00
948 ATOM 944 HW1 SOL 315 43.850 15.150 18.980 1.00 0.00
949 ATOM 945 HW2 SOL 315 43.980 15.870 17.520 1.00 0.00
950 ATOM 946 OW SOL 316 42.510 8.560 18.400 1.00 0.00
951 ATOM 947 HW1 SOL 316 43.390 9.030 18.360 1.00 0.00
952 ATOM 948 HW2 SOL 316 42.660 7.570 18.490 1.00 0.00
953 ATOM 949 OW SOL 317 33.640 3.350 15.210 1.00 0.00
954 ATOM 950 HW1 SOL 317 33.950 3.680 14.320 1.00 0.00
955 ATOM 951 HW2 SOL 317 34.430 3.010 15.730 1.00 0.00
956 ATOM 952 OW SOL 318 0.230 18.500 15.640 1.00 0.00
957 ATOM 953 HW1 SOL 318 -0.620 18.020 15.880 1.00 0.00
958 ATOM 954 HW2 SOL 318 1.010 17.920 15.880 1.00 0.00
959 ATOM 955 OW SOL 319 33.370 13.870 13.930 1.00 0.00
960 ATOM 956 HW1 SOL 319 34.290 13.920 13.520 1.00 0.00
961 ATOM 957 HW2 SOL 319 32.960 14.780 13.930 1.00 0.00
962 ATOM 958 OW SOL 320 45.500 1.790 2.270 1.00 0.00
963 ATOM 959 HW1 SOL 320 45.020 0.930 2.430 1.00 0.00
964 ATOM 960 HW2 SOL 320 46.480 1.620 2.250 1.00 0.00
965 ATOM 961 OW SOL 321 39.970 15.540 2.380 1.00 0.00
966 ATOM 962 HW1 SOL 321 39.280 16.200 2.080 1.00 0.00
967 ATOM 963 HW2 SOL 321 40.060 15.570 3.370 1.00 0.00
968 ATOM 964 OW SOL 322 45.690 5.380 -0.020 1.00 0.00
969 ATOM 965 HW1 SOL 322 45.100 4.630 -0.320 1.00 0.00
970 ATOM 966 HW2 SOL 322 45.220 5.930 0.660 1.00 0.00
971 ATOM 967 OW SOL 323 29.230 8.430 18.510 1.00 0.00
972 ATOM 968 HW1 SOL 323 29.210 7.560 18.020 1.00 0.00
973 ATOM 969 HW2 SOL 323 29.600 9.140 17.920 1.00 0.00
974 ATOM 970 OW SOL 324 32.690 5.980 17.780 1.00 0.00
975 ATOM 971 HW1 SOL 324 31.710 6.140 17.830 1.00 0.00
976 ATOM 972 HW2 SOL 324 32.880 5.170 17.220 1.00 0.00
977 ATOM 973 OW SOL 325 38.300 19.500 0.080 1.00 0.00
978 ATOM 974 HW1 SOL 325 37.890 18.630 -0.190 1.00 0.00
979 ATOM 975 HW2 SOL 325 38.140 19.660 1.050 1.00 0.00
980 ATOM 976 OW SOL 326 31.040 2.490 14.740 1.00 0.00
981 ATOM 977 HW1 SOL 326 30.640 2.030 15.540 1.00 0.00
982 ATOM 978 HW2 SOL 326 32.000 2.710 14.930 1.00 0.00
983 ATOM 979 OW SOL 327 44.900 17.180 10.590 1.00 0.00
984 ATOM 980 HW1 SOL 327 45.060 17.970 10.000 1.00 0.00
985 ATOM 981 HW2 SOL 327 44.240 17.430 11.300 1.00 0.00
986 ATOM 982 OW SOL 328 27.290 2.810 14.030 1.00 0.00
987 ATOM 983 HW1 SOL 328 27.860 2.390 13.320 1.00 0.00
988 ATOM 984 HW2 SOL 328 27.150 3.780 13.810 1.00 0.00
989 ATOM 985 OW SOL 329 31.020 8.400 -0.080 1.00 0.00
990 ATOM 986 HW1 SOL 329 31.280 7.480 0.190 1.00 0.00
991 ATOM 987 HW2 SOL 329 31.150 9.030 0.690 1.00 0.00
992 ATOM 988 OW SOL 330 41.570 -0.140 11.130 1.00 0.00
993 ATOM 989 HW1 SOL 330 41.570 0.320 10.240 1.00 0.00
994 ATOM 990 HW2 SOL 330 42.440 0.020 11.590 1.00 0.00
995 ATOM 991 OW SOL 331 27.210 2.060 5.880 1.00 0.00
996 ATOM 992 HW1 SOL 331 26.270 2.350 6.070 1.00 0.00
997 ATOM 993 HW2 SOL 331 27.570 1.580 6.680 1.00 0.00
998 ATOM 994 OW SOL 332 29.540 0.730 9.660 1.00 0.00
999 ATOM 995 HW1 SOL 332 29.760 0.970 10.610 1.00 0.00
1000 ATOM 996 HW2 SOL 332 30.330 0.300 9.230 1.00 0.00
1001 ATOM 997 OW SOL 333 35.600 19.010 7.840 1.00 0.00
1002 ATOM 998 HW1 SOL 333 36.000 19.380 8.670 1.00 0.00
1003 ATOM 999 HW2 SOL 333 35.570 18.020 7.890 1.00 0.00
1004 ATOM 1000 OW SOL 334 35.700 16.650 21.890 1.00 0.00
1005 ATOM 1001 HW1 SOL 334 35.470 16.680 22.860 1.00 0.00
1006 ATOM 1002 HW2 SOL 334 35.490 17.520 21.460 1.00 0.00
1007 ATOM 1003 OW SOL 335 46.310 18.720 1.050 1.00 0.00
1008 ATOM 1004 HW1 SOL 335 45.460 19.020 0.630 1.00 0.00
1009 ATOM 1005 HW2 SOL 335 46.230 18.760 2.040 1.00 0.00
1010 ATOM 1006 OW SOL 336 29.620 2.180 12.370 1.00 0.00
1011 ATOM 1007 HW1 SOL 336 30.160 2.140 13.210 1.00 0.00
1012 ATOM 1008 HW2 SOL 336 29.810 3.040 11.900 1.00 0.00
1013 ATOM 1009 OW SOL 337 26.740 11.220 17.560 1.00 0.00
1014 ATOM 1010 HW1 SOL 337 27.610 10.880 17.190 1.00 0.00
1015 ATOM 1011 HW2 SOL 337 26.390 11.950 16.970 1.00 0.00
1016 ATOM 1012 OW SOL 338 46.230 5.210 11.210 1.00 0.00
1017 ATOM 1013 HW1 SOL 338 46.290 5.960 11.870 1.00 0.00
1018 ATOM 1014 HW2 SOL 338 47.130 4.770 11.130 1.00 0.00
1019 ATOM 1015 OW SOL 339 23.760 10.560 20.180 1.00 0.00
1020 ATOM 1016 HW1 SOL 339 24.580 10.050 19.930 1.00 0.00
1021 ATOM 1017 HW2 SOL 339 23.020 9.910 20.390 1.00 0.00
1022 ATOM 1018 OW SOL 340 43.890 18.430 13.760 1.00 0.00
1023 ATOM 1019 HW1 SOL 340 44.890 18.460 13.790 1.00 0.00
1024 ATOM 1020 HW2 SOL 340 43.530 19.350 13.580 1.00 0.00
1025 ATOM 1021 OW SOL 341 41.200 5.650 12.150 1.00 0.00
1026 ATOM 1022 HW1 SOL 341 40.510 5.010 11.800 1.00 0.00
1027 ATOM 1023 HW2 SOL 341 41.370 5.440 13.110 1.00 0.00
1028 ATOM 1024 OW SOL 342 43.640 5.820 9.990 1.00 0.00
1029 ATOM 1025 HW1 SOL 342 43.060 6.190 10.720 1.00 0.00
1030 ATOM 1026 HW2 SOL 342 44.590 5.810 10.300 1.00 0.00
1031 ATOM 1027 OW SOL 343 44.900 14.390 20.270 1.00 0.00
1032 ATOM 1028 HW1 SOL 343 44.610 13.440 20.330 1.00 0.00
1033 ATOM 1029 HW2 SOL 343 45.740 14.520 20.800 1.00 0.00
1034 ATOM 1030 OW SOL 344 44.930 16.930 15.990 1.00 0.00
1035 ATOM 1031 HW1 SOL 344 44.980 15.990 15.670 1.00 0.00
1036 ATOM 1032 HW2 SOL 344 44.150 17.390 15.570 1.00 0.00
1037 ATOM 1033 OW SOL 345 41.510 22.700 2.610 1.00 0.00
1038 ATOM 1034 HW1 SOL 345 41.970 22.690 1.720 1.00 0.00
1039 ATOM 1035 HW2 SOL 345 40.910 23.490 2.670 1.00 0.00
1040 ATOM 1036 OW SOL 346 26.410 13.830 8.810 1.00 0.00
1041 ATOM 1037 HW1 SOL 346 27.290 13.430 9.060 1.00 0.00
1042 ATOM 1038 HW2 SOL 346 25.710 13.120 8.770 1.00 0.00
1043 ATOM 1039 OW SOL 347 25.650 4.200 7.960 1.00 0.00
1044 ATOM 1040 HW1 SOL 347 25.140 4.980 7.610 1.00 0.00
1045 ATOM 1041 HW2 SOL 347 25.070 3.390 7.940 1.00 0.00
1046 ATOM 1042 OW SOL 348 32.220 17.680 5.670 1.00 0.00
1047 ATOM 1043 HW1 SOL 348 32.570 18.470 6.180 1.00 0.00
1048 ATOM 1044 HW2 SOL 348 31.280 17.860 5.380 1.00 0.00
1049 ATOM 1045 OW SOL 349 26.920 16.310 7.360 1.00 0.00
1050 ATOM 1046 HW1 SOL 349 26.530 16.950 8.020 1.00 0.00
1051 ATOM 1047 HW2 SOL 349 26.980 15.400 7.760 1.00 0.00
1052 ATOM 1048 OW SOL 350 42.580 22.580 7.710 1.00 0.00
1053 ATOM 1049 HW1 SOL 350 42.270 22.120 6.880 1.00 0.00
1054 ATOM 1050 HW2 SOL 350 42.310 23.550 7.670 1.00 0.00
1055 ATOM 1051 OW SOL 351 35.810 4.360 6.430 1.00 0.00
1056 ATOM 1052 HW1 SOL 351 35.060 4.990 6.220 1.00 0.00
1057 ATOM 1053 HW2 SOL 351 36.680 4.840 6.340 1.00 0.00
1058 ATOM 1054 OW SOL 352 36.120 5.670 9.910 1.00 0.00
1059 ATOM 1055 HW1 SOL 352 35.210 5.280 10.020 1.00 0.00
1060 ATOM 1056 HW2 SOL 352 36.330 6.270 10.680 1.00 0.00
1061 ATOM 1057 OW SOL 353 27.760 2.820 0.970 1.00 0.00
1062 ATOM 1058 HW1 SOL 353 28.150 2.790 0.050 1.00 0.00
1063 ATOM 1059 HW2 SOL 353 28.490 2.970 1.630 1.00 0.00
1064 ATOM 1060 OW SOL 354 39.550 23.110 12.850 1.00 0.00
1065 ATOM 1061 HW1 SOL 354 38.750 22.580 12.590 1.00 0.00
1066 ATOM 1062 HW2 SOL 354 40.200 23.140 12.090 1.00 0.00
1067 ATOM 1063 OW SOL 355 28.190 9.270 16.050 1.00 0.00
1068 ATOM 1064 HW1 SOL 355 27.240 8.970 16.080 1.00 0.00
1069 ATOM 1065 HW2 SOL 355 28.470 9.390 15.090 1.00 0.00
1070 ATOM 1066 OW SOL 356 34.910 13.420 7.070 1.00 0.00
1071 ATOM 1067 HW1 SOL 356 35.340 13.140 6.210 1.00 0.00
1072 ATOM 1068 HW2 SOL 356 34.090 12.880 7.220 1.00 0.00
1073 ATOM 1069 OW SOL 357 45.230 19.370 9.320 1.00 0.00
1074 ATOM 1070 HW1 SOL 357 44.470 19.980 9.510 1.00 0.00
1075 ATOM 1071 HW2 SOL 357 46.010 19.900 8.970 1.00 0.00
1076 ATOM 1072 OW SOL 358 24.150 7.450 19.150 1.00 0.00
1077 ATOM 1073 HW1 SOL 358 24.550 6.540 19.100 1.00 0.00
1078 ATOM 1074 HW2 SOL 358 24.880 8.140 19.220 1.00 0.00
1079 ATOM 1075 OW SOL 359 42.580 20.780 9.950 1.00 0.00
1080 ATOM 1076 HW1 SOL 359 42.810 21.380 9.180 1.00 0.00
1081 ATOM 1077 HW2 SOL 359 41.600 20.810 10.120 1.00 0.00
1082 ATOM 1078 OW SOL 360 39.080 2.910 4.080 1.00 0.00
1083 ATOM 1079 HW1 SOL 360 38.110 2.670 3.990 1.00 0.00
1084 ATOM 1080 HW2 SOL 360 39.430 2.540 4.940 1.00 0.00
1085 ATOM 1081 OW SOL 361 35.990 12.430 4.840 1.00 0.00
1086 ATOM 1082 HW1 SOL 361 35.190 12.000 4.420 1.00 0.00
1087 ATOM 1083 HW2 SOL 361 36.700 12.570 4.150 1.00 0.00
1088 ATOM 1084 OW SOL 362 28.030 16.130 4.920 1.00 0.00
1089 ATOM 1085 HW1 SOL 362 27.350 16.170 4.180 1.00 0.00
1090 ATOM 1086 HW2 SOL 362 27.560 16.130 5.800 1.00 0.00
1091 ATOM 1087 OW SOL 363 35.090 23.660 6.080 1.00 0.00
1092 ATOM 1088 HW1 SOL 363 35.920 23.110 6.130 1.00 0.00
1093 ATOM 1089 HW2 SOL 363 34.310 23.120 6.400 1.00 0.00
1094 ATOM 1090 OW SOL 364 29.360 18.330 5.770 1.00 0.00
1095 ATOM 1091 HW1 SOL 364 28.850 17.470 5.700 1.00 0.00
1096 ATOM 1092 HW2 SOL 364 28.790 19.090 5.470 1.00 0.00
1097 ATOM 1093 OW SOL 365 34.050 21.360 19.730 1.00 0.00
1098 ATOM 1094 HW1 SOL 365 33.650 22.210 19.400 1.00 0.00
1099 ATOM 1095 HW2 SOL 365 34.640 20.970 19.020 1.00 0.00
1100 ATOM 1096 OW SOL 366 33.330 23.060 15.990 1.00 0.00
1101 ATOM 1097 HW1 SOL 366 34.120 22.470 16.160 1.00 0.00
1102 ATOM 1098 HW2 SOL 366 33.450 23.930 16.450 1.00 0.00
1103 ATOM 1099 OW SOL 367 30.960 4.600 20.560 1.00 0.00
1104 ATOM 1100 HW1 SOL 367 30.660 4.330 19.650 1.00 0.00
1105 ATOM 1101 HW2 SOL 367 30.990 5.600 20.620 1.00 0.00
1106 ATOM 1102 OW SOL 368 33.930 12.830 19.170 1.00 0.00
1107 ATOM 1103 HW1 SOL 368 34.640 12.150 18.980 1.00 0.00
1108 ATOM 1104 HW2 SOL 368 33.040 12.370 19.230 1.00 0.00
1109 ATOM 1105 OW SOL 369 35.970 19.330 14.850 1.00 0.00
1110 ATOM 1106 HW1 SOL 369 35.880 18.480 15.370 1.00 0.00
1111 ATOM 1107 HW2 SOL 369 35.060 19.710 14.670 1.00 0.00
1112 ATOM 1108 OW SOL 370 38.130 7.270 13.990 1.00 0.00
1113 ATOM 1109 HW1 SOL 370 37.850 6.350 14.270 1.00 0.00
1114 ATOM 1110 HW2 SOL 370 38.770 7.640 14.650 1.00 0.00
1115 ATOM 1111 OW SOL 371 29.700 4.830 15.250 1.00 0.00
1116 ATOM 1112 HW1 SOL 371 29.240 5.090 14.400 1.00 0.00
1117 ATOM 1113 HW2 SOL 371 30.060 3.900 15.170 1.00 0.00
1118 ATOM 1114 OW SOL 372 30.500 17.150 8.090 1.00 0.00
1119 ATOM 1115 HW1 SOL 372 30.100 17.690 7.350 1.00 0.00
1120 ATOM 1116 HW2 SOL 372 31.190 16.530 7.730 1.00 0.00
1121 ATOM 1117 OW SOL 373 39.070 20.020 10.050 1.00 0.00
1122 ATOM 1118 HW1 SOL 373 38.550 19.250 9.690 1.00 0.00
1123 ATOM 1119 HW2 SOL 373 39.320 19.830 11.000 1.00 0.00
1124 ATOM 1120 OW SOL 374 26.700 3.210 17.020 1.00 0.00
1125 ATOM 1121 HW1 SOL 374 26.830 2.330 17.470 1.00 0.00
1126 ATOM 1122 HW2 SOL 374 27.240 3.230 16.170 1.00 0.00
1127 ATOM 1123 OW SOL 375 38.600 2.680 16.550 1.00 0.00
1128 ATOM 1124 HW1 SOL 375 38.070 2.890 17.370 1.00 0.00
1129 ATOM 1125 HW2 SOL 375 38.280 1.820 16.150 1.00 0.00
1130 ATOM 1126 OW SOL 376 31.170 5.680 23.600 1.00 0.00
1131 ATOM 1127 HW1 SOL 376 31.220 5.450 22.630 1.00 0.00
1132 ATOM 1128 HW2 SOL 376 30.360 5.250 24.010 1.00 0.00
1133 ATOM 1129 OW SOL 377 35.120 16.090 1.500 1.00 0.00
1134 ATOM 1130 HW1 SOL 377 34.870 16.120 2.460 1.00 0.00
1135 ATOM 1131 HW2 SOL 377 35.410 15.170 1.250 1.00 0.00
1136 ATOM 1132 OW SOL 378 33.900 1.420 10.380 1.00 0.00
1137 ATOM 1133 HW1 SOL 378 34.540 2.180 10.260 1.00 0.00
1138 ATOM 1134 HW2 SOL 378 34.050 0.990 11.270 1.00 0.00
1139 ATOM 1135 OW SOL 379 41.420 13.730 17.620 1.00 0.00
1140 ATOM 1136 HW1 SOL 379 42.010 13.210 17.000 1.00 0.00
1141 ATOM 1137 HW2 SOL 379 41.900 14.540 17.940 1.00 0.00
1142 ATOM 1138 OW SOL 380 28.140 5.320 12.350 1.00 0.00
1143 ATOM 1139 HW1 SOL 380 27.610 4.890 11.610 1.00 0.00
1144 ATOM 1140 HW2 SOL 380 28.490 6.210 12.040 1.00 0.00
1145 ATOM 1141 OW SOL 381 26.350 16.630 17.520 1.00 0.00
1146 ATOM 1142 HW1 SOL 381 26.100 16.380 16.580 1.00 0.00
1147 ATOM 1143 HW2 SOL 381 26.170 15.860 18.130 1.00 0.00
1148 ATOM 1144 OW SOL 382 37.470 12.130 15.140 1.00 0.00
1149 ATOM 1145 HW1 SOL 382 37.890 12.780 15.770 1.00 0.00
1150 ATOM 1146 HW2 SOL 382 37.070 12.630 14.370 1.00 0.00
1151 ATOM 1147 OW SOL 383 39.360 14.600 23.120 1.00 0.00
1152 ATOM 1148 HW1 SOL 383 40.030 14.130 22.540 1.00 0.00
1153 ATOM 1149 HW2 SOL 383 39.750 14.740 24.020 1.00 0.00
1154 ATOM 1150 OW SOL 384 26.130 0.300 3.060 1.00 0.00
1155 ATOM 1151 HW1 SOL 384 26.510 0.710 3.890 1.00 0.00
1156 ATOM 1152 HW2 SOL 384 25.990 1.000 2.370 1.00 0.00
1157 ATOM 1153 OW SOL 385 25.720 17.600 0.380 1.00 0.00
1158 ATOM 1154 HW1 SOL 385 25.210 18.450 0.220 1.00 0.00
1159 ATOM 1155 HW2 SOL 385 25.320 17.110 1.160 1.00 0.00
1160 ATOM 1156 OW SOL 386 39.540 19.800 12.750 1.00 0.00
1161 ATOM 1157 HW1 SOL 386 40.090 20.480 13.230 1.00 0.00
1162 ATOM 1158 HW2 SOL 386 38.600 19.830 13.100 1.00 0.00
1163 ATOM 1159 OW SOL 387 42.160 11.960 15.030 1.00 0.00
1164 ATOM 1160 HW1 SOL 387 41.320 11.750 15.540 1.00 0.00
1165 ATOM 1161 HW2 SOL 387 41.950 12.020 14.060 1.00 0.00
1166 ATOM 1162 OW SOL 388 43.540 22.070 0.780 1.00 0.00
1167 ATOM 1163 HW1 SOL 388 44.010 22.720 0.180 1.00 0.00
1168 ATOM 1164 HW2 SOL 388 43.950 21.170 0.670 1.00 0.00
1169 ATOM 1165 OW SOL 389 41.240 21.510 5.260 1.00 0.00
1170 ATOM 1166 HW1 SOL 389 41.080 20.540 5.100 1.00 0.00
1171 ATOM 1167 HW2 SOL 389 41.220 22.000 4.390 1.00 0.00
1172 ATOM 1168 OW SOL 390 32.860 14.500 3.230 1.00 0.00
1173 ATOM 1169 HW1 SOL 390 32.460 15.130 2.570 1.00 0.00
1174 ATOM 1170 HW2 SOL 390 33.650 14.930 3.660 1.00 0.00
1175 ATOM 1171 OW SOL 391 36.150 8.200 4.050 1.00 0.00
1176 ATOM 1172 HW1 SOL 391 36.510 9.120 4.130 1.00 0.00
1177 ATOM 1173 HW2 SOL 391 36.600 7.600 4.710 1.00 0.00
1178 ATOM 1174 OW SOL 392 27.090 23.130 15.810 1.00 0.00
1179 ATOM 1175 HW1 SOL 392 26.850 22.980 14.850 1.00 0.00
1180 ATOM 1176 HW2 SOL 392 26.540 22.540 16.390 1.00 0.00
1181 ATOM 1177 OW SOL 393 35.350 6.830 16.490 1.00 0.00
1182 ATOM 1178 HW1 SOL 393 34.770 6.870 17.300 1.00 0.00
1183 ATOM 1179 HW2 SOL 393 35.310 7.700 16.000 1.00 0.00
1184 ATOM 1180 OW SOL 394 43.070 11.720 4.170 1.00 0.00
1185 ATOM 1181 HW1 SOL 394 42.640 12.510 4.600 1.00 0.00
1186 ATOM 1182 HW2 SOL 394 43.170 11.890 3.190 1.00 0.00
1187 ATOM 1183 OW SOL 395 36.290 2.140 4.250 1.00 0.00
1188 ATOM 1184 HW1 SOL 395 36.130 1.160 4.410 1.00 0.00
1189 ATOM 1185 HW2 SOL 395 35.660 2.670 4.820 1.00 0.00
1190 ATOM 1186 OW SOL 396 39.430 3.940 13.270 1.00 0.00
1191 ATOM 1187 HW1 SOL 396 39.000 4.010 14.170 1.00 0.00
1192 ATOM 1188 HW2 SOL 396 38.750 3.660 12.590 1.00 0.00
1193 ATOM 1189 OW SOL 397 42.570 16.540 6.530 1.00 0.00
1194 ATOM 1190 HW1 SOL 397 43.200 15.780 6.380 1.00 0.00
1195 ATOM 1191 HW2 SOL 397 41.930 16.310 7.260 1.00 0.00
1196 ATOM 1192 OW SOL 398 40.010 6.850 2.340 1.00 0.00
1197 ATOM 1193 HW1 SOL 398 40.340 5.920 2.480 1.00 0.00
1198 ATOM 1194 HW2 SOL 398 40.770 7.450 2.130 1.00 0.00
1199 ATOM 1195 OW SOL 399 42.460 8.380 2.330 1.00 0.00
1200 ATOM 1196 HW1 SOL 399 43.170 7.680 2.210 1.00 0.00
1201 ATOM 1197 HW2 SOL 399 42.670 8.920 3.140 1.00 0.00
1202 ATOM 1198 OW SOL 400 34.630 15.290 19.360 1.00 0.00
1203 ATOM 1199 HW1 SOL 400 34.640 15.380 20.350 1.00 0.00
1204 ATOM 1200 HW2 SOL 400 34.410 14.350 19.110 1.00 0.00
1205 ATOM 1201 OW SOL 401 43.830 3.800 2.350 1.00 0.00
1206 ATOM 1202 HW1 SOL 401 44.230 2.890 2.380 1.00 0.00
1207 ATOM 1203 HW2 SOL 401 42.860 3.730 2.110 1.00 0.00
1208 ATOM 1204 OW SOL 402 40.690 13.190 21.130 1.00 0.00
1209 ATOM 1205 HW1 SOL 402 40.460 12.530 20.420 1.00 0.00
1210 ATOM 1206 HW2 SOL 402 40.680 14.110 20.740 1.00 0.00
1211 ATOM 1207 OW SOL 403 43.840 2.350 13.560 1.00 0.00
1212 ATOM 1208 HW1 SOL 403 42.860 2.180 13.460 1.00 0.00
1213 ATOM 1209 HW2 SOL 403 44.000 3.000 14.300 1.00 0.00
1214 ATOM 1210 OW SOL 404 44.540 19.530 3.010 1.00 0.00
1215 ATOM 1211 HW1 SOL 404 43.910 20.010 2.400 1.00 0.00
1216 ATOM 1212 HW2 SOL 404 44.020 19.020 3.690 1.00 0.00
1217 ATOM 1213 OW SOL 405 31.280 9.390 2.460 1.00 0.00
1218 ATOM 1214 HW1 SOL 405 30.490 9.140 3.020 1.00 0.00
1219 ATOM 1215 HW2 SOL 405 32.070 8.860 2.740 1.00 0.00
1220 ATOM 1216 OW SOL 406 25.180 15.830 11.780 1.00 0.00
1221 ATOM 1217 HW1 SOL 406 26.120 16.110 11.930 1.00 0.00
1222 ATOM 1218 HW2 SOL 406 25.170 15.010 11.200 1.00 0.00
1223 ATOM 1219 OW SOL 407 33.670 11.320 3.570 1.00 0.00
1224 ATOM 1220 HW1 SOL 407 33.040 10.590 3.280 1.00 0.00
1225 ATOM 1221 HW2 SOL 407 33.230 12.200 3.420 1.00 0.00
1226 ATOM 1222 OW SOL 408 36.650 5.250 14.590 1.00 0.00
1227 ATOM 1223 HW1 SOL 408 36.380 5.720 13.750 1.00 0.00
1228 ATOM 1224 HW2 SOL 408 36.200 5.670 15.370 1.00 0.00
1229 ATOM 1225 OW SOL 409 0.630 1.420 20.370 1.00 0.00
1230 ATOM 1226 HW1 SOL 409 0.540 2.030 19.590 1.00 0.00
1231 ATOM 1227 HW2 SOL 409 0.670 1.960 21.210 1.00 0.00
1232 ATOM 1228 OW SOL 410 39.910 8.350 12.350 1.00 0.00
1233 ATOM 1229 HW1 SOL 410 39.070 7.940 12.690 1.00 0.00
1234 ATOM 1230 HW2 SOL 410 40.560 7.620 12.110 1.00 0.00
1235 ATOM 1231 OW SOL 411 43.820 19.290 0.350 1.00 0.00
1236 ATOM 1232 HW1 SOL 411 43.010 19.010 -0.160 1.00 0.00
1237 ATOM 1233 HW2 SOL 411 44.000 18.630 1.080 1.00 0.00
1238 ATOM 1234 OW SOL 412 37.330 2.860 11.720 1.00 0.00
1239 ATOM 1235 HW1 SOL 412 37.180 3.210 10.790 1.00 0.00
1240 ATOM 1236 HW2 SOL 412 37.200 1.870 11.730 1.00 0.00
1241 ATOM 1237 OW SOL 413 30.050 21.740 7.810 1.00 0.00
1242 ATOM 1238 HW1 SOL 413 29.300 22.310 7.490 1.00 0.00
1243 ATOM 1239 HW2 SOL 413 30.350 21.140 7.070 1.00 0.00
1244 ATOM 1240 OW SOL 414 37.230 2.760 18.940 1.00 0.00
1245 ATOM 1241 HW1 SOL 414 37.130 3.630 19.430 1.00 0.00
1246 ATOM 1242 HW2 SOL 414 37.440 2.030 19.590 1.00 0.00
1247 ATOM 1243 OW SOL 415 35.220 9.620 16.010 1.00 0.00
1248 ATOM 1244 HW1 SOL 415 36.170 9.910 16.140 1.00 0.00
1249 ATOM 1245 HW2 SOL 415 34.750 10.270 15.410 1.00 0.00
1250 ATOM 1246 OW SOL 416 26.070 9.240 19.180 1.00 0.00
1251 ATOM 1247 HW1 SOL 416 27.010 8.980 19.360 1.00 0.00
1252 ATOM 1248 HW2 SOL 416 26.050 10.000 18.530 1.00 0.00
1253 ATOM 1249 OW SOL 417 45.130 3.680 20.630 1.00 0.00
1254 ATOM 1250 HW1 SOL 417 45.010 4.610 20.980 1.00 0.00
1255 ATOM 1251 HW2 SOL 417 45.400 3.720 19.670 1.00 0.00
1256 ATOM 1252 OW SOL 418 41.030 2.010 13.820 1.00 0.00
1257 ATOM 1253 HW1 SOL 418 40.850 1.140 13.340 1.00 0.00
1258 ATOM 1254 HW2 SOL 418 40.400 2.710 13.490 1.00 0.00
1259 ATOM 1255 OW SOL 419 37.580 1.030 20.960 1.00 0.00
1260 ATOM 1256 HW1 SOL 419 37.430 0.050 20.820 1.00 0.00
1261 ATOM 1257 HW2 SOL 419 38.220 1.170 21.710 1.00 0.00
1262 ATOM 1258 OW SOL 420 27.760 16.930 11.880 1.00 0.00
1263 ATOM 1259 HW1 SOL 420 28.150 16.650 11.000 1.00 0.00
1264 ATOM 1260 HW2 SOL 420 28.370 17.600 12.310 1.00 0.00
1265 ATOM 1261 OW SOL 421 28.390 19.710 10.810 1.00 0.00
1266 ATOM 1262 HW1 SOL 421 29.370 19.770 10.620 1.00 0.00
1267 ATOM 1263 HW2 SOL 421 28.240 19.810 11.800 1.00 0.00
1268 ATOM 1264 OW SOL 422 24.190 19.940 23.500 1.00 0.00
1269 ATOM 1265 HW1 SOL 422 24.540 20.850 23.270 1.00 0.00
1270 ATOM 1266 HW2 SOL 422 23.260 19.830 23.150 1.00 0.00
1271 ATOM 1267 OW SOL 423 29.770 5.390 17.810 1.00 0.00
1272 ATOM 1268 HW1 SOL 423 29.740 5.150 16.840 1.00 0.00
1273 ATOM 1269 HW2 SOL 423 28.850 5.300 18.190 1.00 0.00
1274 ATOM 1270 OW SOL 424 42.130 1.890 7.820 1.00 0.00
1275 ATOM 1271 HW1 SOL 424 41.580 2.690 7.590 1.00 0.00
1276 ATOM 1272 HW2 SOL 424 43.050 1.990 7.450 1.00 0.00
1277 ATOM 1273 OW SOL 425 34.370 16.740 4.050 1.00 0.00
1278 ATOM 1274 HW1 SOL 425 33.530 16.960 4.560 1.00 0.00
1279 ATOM 1275 HW2 SOL 425 35.100 17.370 4.310 1.00 0.00
1280 ATOM 1276 OW SOL 426 29.170 2.990 21.810 1.00 0.00
1281 ATOM 1277 HW1 SOL 426 29.330 2.120 21.350 1.00 0.00
1282 ATOM 1278 HW2 SOL 426 29.870 3.650 21.510 1.00 0.00
1283 ATOM 1279 OW SOL 427 26.210 8.240 14.340 1.00 0.00
1284 ATOM 1280 HW1 SOL 427 26.520 7.290 14.300 1.00 0.00
1285 ATOM 1281 HW2 SOL 427 25.260 8.270 14.630 1.00 0.00
1286 ATOM 1282 OW SOL 428 26.380 17.950 9.680 1.00 0.00
1287 ATOM 1283 HW1 SOL 428 27.140 18.580 9.870 1.00 0.00
1288 ATOM 1284 HW2 SOL 428 26.130 17.460 10.510 1.00 0.00
1289 ATOM 1285 OW SOL 429 40.300 13.850 11.520 1.00 0.00
1290 ATOM 1286 HW1 SOL 429 40.490 14.530 12.220 1.00 0.00
1291 ATOM 1287 HW2 SOL 429 40.460 12.930 11.900 1.00 0.00
1292 ATOM 1288 OW SOL 430 26.040 21.330 10.340 1.00 0.00
1293 ATOM 1289 HW1 SOL 430 26.920 20.860 10.370 1.00 0.00
1294 ATOM 1290 HW2 SOL 430 25.330 20.690 10.040 1.00 0.00
1295 ATOM 1291 OW SOL 431 41.760 17.160 13.070 1.00 0.00
1296 ATOM 1292 HW1 SOL 431 41.510 17.720 12.290 1.00 0.00
1297 ATOM 1293 HW2 SOL 431 42.640 17.470 13.440 1.00 0.00
1298 ATOM 1294 OW SOL 432 40.190 9.780 17.480 1.00 0.00
1299 ATOM 1295 HW1 SOL 432 41.020 9.270 17.710 1.00 0.00
1300 ATOM 1296 HW2 SOL 432 39.980 9.660 16.510 1.00 0.00
1301 TER
1302 ENDMDL