2 jlee = 1 nbank = 200 nstep = 34569 339.60528
3 # 1 total E -2.01101E+02 rmsd from N 0.000 %NC 0.00 0
4 93.628 48.462 112.620 -83.685
5 92.071 83.734 133.119 143.598
6 92.111 69.963 165.759 16.093
7 92.006 42.943 92.815 -74.667
8 91.254 50.200 125.131 -60.957
9 92.168 50.625 148.475 -29.858
10 91.698 52.655 163.518-169.279
11 92.795 76.804 103.590 -98.960
12 93.673 -66.543 136.829 -19.035
13 118.963-159.478 0.000 0.000
14 95.002 59.243 0.000 0.000
15 94.393 113.622 99.874-105.191
16 91.922 -31.801 114.034-142.254
17 88.388 -56.849 115.357 -75.891
18 93.397 19.198 0.000 0.000
19 124.742 -89.372 101.573 -56.272
20 116.850-106.877 132.276-144.126
21 118.162-137.604 111.447-111.900
22 93.132 57.993 101.475-105.622
23 93.331 0.000 115.812 -76.605
24 # 2 total E -2.06457E+02 rmsd from N 0.000 %NC 0.00 0
25 93.633 49.929 111.264 -81.964
26 92.067 75.804 144.023-137.346
27 92.498 52.432 131.982 110.055
28 92.402 43.545 143.564 -86.157
29 91.416 43.394 132.237 -59.936
30 92.238 56.599 152.899 -5.333
31 91.435 43.699 150.676-131.510
32 92.980 70.898 94.745-102.839
33 93.756 -94.806 139.786 -16.621
34 94.573 154.831 0.000 0.000
35 133.455 -50.145 0.000 0.000
36 91.970 65.300 99.173 -95.393
37 92.552 31.074 104.644 -74.281
38 95.811-115.151 112.125 -81.320
39 95.528 154.698 0.000 0.000
40 129.958-104.618 103.676 -54.546
41 117.219-107.138 125.899-134.774
42 118.041-127.395 108.543-108.425
43 117.696-115.813 125.672-134.066
44 121.612 0.000 121.479 -79.841
45 # 3 total E -1.99562E+02 rmsd from N 0.000 %NC 0.00 0
46 93.639 49.445 109.508 -80.290
47 92.301 94.302 154.972-143.583
48 92.260 101.676 124.949 -42.789
49 92.947 4.875 91.440 -89.522
50 93.815 -94.752 138.494-130.278
51 93.902 148.076 140.603 24.773
52 93.003 72.568 134.543-100.278
53 130.312-126.305 122.091 -91.009
54 123.666 -79.597 107.551 -70.647
55 94.947 61.553 0.000 0.000
56 95.651 43.135 0.000 0.000
57 92.450 48.630 104.325-107.806
58 91.872 53.595 105.719 -80.065
59 92.814 58.912 110.222-120.077
60 94.811 68.578 0.000 0.000
61 120.741 -90.325 93.771 -59.478
62 117.233-107.276 126.198-134.830
63 118.195-138.376 110.855-111.325
64 93.103 57.968 104.602-110.683
65 93.333 0.000 115.845 -76.544
66 # 4 total E -2.00294E+02 rmsd from N 0.000 %NC 0.00 0
67 93.636 47.935 112.597 -83.764
68 92.478 155.401 142.833-173.463
69 93.591 95.045 124.629 -43.543
70 92.240 -0.397 81.588 -80.902
71 91.484 -88.035 141.653-111.086
72 103.415 171.315 84.917-123.472
73 91.995 82.620 157.276 174.075
74 92.743 65.387 118.575-137.863
75 93.799 106.233 139.007 3.208
76 130.671 -14.903 0.000 0.000
77 125.788 -68.564 0.000 0.000
78 112.570 -52.088 111.071-115.247
79 89.604 75.209 112.315 -74.209
80 90.822 2.986 110.303 -76.529
81 102.509 -72.833 0.000 0.000
82 128.510 -47.148 153.581 28.670
83 121.294-150.816 109.554-109.538
84 119.595-107.955 108.618-106.832
85 117.701-115.836 120.510-126.576
86 121.610 0.000 121.475 -79.880
87 # 5 total E -2.08978E+02 rmsd from N 0.000 %NC 0.00 0
88 93.639 49.798 109.346 -80.134
89 92.499 159.685 161.329 162.004
90 92.744 81.296 164.463 20.443
91 92.667 41.079 100.400 -81.587
92 91.558 59.358 114.426 -79.776
93 92.848 53.822 146.211 -28.284
94 92.678 114.616 156.756-154.162
95 90.806 -29.715 136.789-146.788
96 90.750 -55.433 111.043 -56.306
97 94.249 10.792 0.000 0.000
98 110.211 -61.075 0.000 0.000
99 87.469 -29.354 101.870-104.918
100 92.987 116.673 108.305 -75.766
101 95.954 39.297 131.110 -50.427
102 95.928 76.358 0.000 0.000
103 120.943 -88.382 124.351 -41.688
104 117.319-106.189 124.248-131.113
105 117.492-139.370 114.640-116.533
106 93.229 57.871 129.800-154.682
107 93.333 0.000 115.853 -76.511
108 # 6 total E -2.03063E+02 rmsd from N 0.000 %NC 0.00 0
109 93.622 40.830 113.415 -86.579
110 92.340 154.101 136.451-155.361
111 93.712 96.012 124.698 -42.298
112 92.296 -0.616 84.620 -84.754
113 91.639 -88.749 141.639-128.895
114 99.166 170.043 84.812-121.512
115 92.365 64.092 154.133-179.598
116 92.997 89.313 106.620-115.204
117 94.046 -80.441 135.342 -23.514
118 94.340 145.684 0.000 0.000
119 136.520 -63.555 0.000 0.000
120 92.387 59.578 104.579-113.541
121 92.837 47.691 113.998 -73.277
122 93.691 50.173 105.033 -82.937
123 95.050 67.611 0.000 0.000
124 123.161 -78.373 138.018-165.618
125 118.042-108.168 115.213-120.097
126 117.889-137.693 117.327-120.985
127 93.136 57.769 102.181-103.219
128 93.334 0.000 115.863 -76.686
129 # 7 total E -2.06326E+02 rmsd from N 0.000 %NC 0.00 0
130 93.639 49.480 109.206 -80.057
131 92.503 161.124 163.398 163.551
132 92.519 79.957 165.531 19.880
133 92.299 43.229 101.286 -81.199
134 91.332 51.314 124.645 -73.502
135 92.332 48.696 151.031 -27.994
136 91.606 61.003 161.620 178.888
137 92.232 69.184 110.270-106.475
138 93.288 141.265 138.991 -5.929
139 130.240 -58.756 0.000 0.000
140 123.711 -57.937 0.000 0.000
141 92.078 54.569 131.737-158.144
142 93.175 26.060 110.496 -75.517
143 96.096 -95.150 122.244-116.174
144 123.575-174.976 0.000 0.000
145 131.653 -89.523 95.577 -62.132
146 116.820-107.120 127.395-139.752
147 118.176-137.973 109.445-109.175
148 93.117 58.015 103.272-113.107
149 93.334 0.000 115.829 -76.570
150 # 8 total E -2.08074E+02 rmsd from N 0.000 %NC 0.00 0
151 93.640 49.358 109.144 -80.038
152 92.508 161.719 164.507 164.863
153 92.417 79.059 166.129 18.660
154 92.289 41.872 100.241 -78.259
155 91.377 50.777 141.782-122.900
156 92.211 45.115 141.689 -32.438
157 92.075 56.064 165.133-167.499
158 93.186 108.052 124.249 102.036
159 128.409 -27.829 110.166 -68.993
160 130.479 -24.839 0.000 0.000
161 128.382 -59.831 0.000 0.000
162 100.951 -28.030 129.297-150.223
163 91.416 97.235 112.992 -74.396
164 91.231 -17.689 113.157 -74.827
165 100.875 -64.500 0.000 0.000
166 124.942 -50.864 143.051 174.867
167 118.174-114.954 129.973-141.063
168 118.918-141.085 120.078-122.718
169 92.935 57.369 106.168-111.293
170 93.336 0.000 115.588 -76.868
171 # 9 total E -2.06029E+02 rmsd from N 0.000 %NC 0.00 0
172 93.641 49.362 109.151 -80.032
173 92.505 161.670 164.475 164.912
174 92.443 79.060 166.060 18.708
175 92.226 43.581 100.772 -79.604
176 91.299 50.092 123.909 -70.081
177 92.315 47.095 150.980 -29.268
178 91.593 58.514 161.399 176.710
179 92.095 71.663 108.825-101.704
180 93.120 113.313 151.650 -24.542
181 126.652 -54.812 0.000 0.000
182 124.107 -80.699 0.000 0.000
183 92.007 42.689 131.410-157.584
184 93.605 42.262 109.535 -74.503
185 94.897 -79.963 112.651 -86.856
186 125.991 -11.121 0.000 0.000
187 129.757 -77.680 119.861 -49.480
188 118.734-106.202 133.547-144.378
189 117.401-139.007 116.780-119.373
190 93.240 58.121 127.935-152.467
191 93.332 0.000 115.627 -76.653
192 # 10 total E -2.05364E+02 rmsd from N 0.000 %NC 0.00 0
193 93.639 49.309 109.148 -80.035
194 92.504 161.665 164.366 163.267
195 92.361 78.804 166.464 18.129
196 92.164 43.315 100.163 -77.809
197 91.278 48.540 137.317-115.594
198 91.991 43.070 141.758 -37.928
199 91.385 52.995 162.402 176.336
200 91.172 69.767 88.193 -61.266
201 92.260 43.920 134.104 5.653
202 94.428 49.193 0.000 0.000
203 94.916 41.808 0.000 0.000
204 92.182 46.303 95.166 -98.434
205 91.889 49.429 110.365 -84.096
206 92.979 47.949 108.761-120.268
207 95.001 67.468 0.000 0.000
208 122.541 -78.101 137.709-166.562
209 118.024-109.664 115.842-120.941
210 117.987-118.068 113.498-115.490
211 117.765-115.827 122.121-127.775
212 121.615 0.000 121.478 -79.862
213 # 11 total E -2.06632E+02 rmsd from N 0.000 %NC 0.00 0
214 93.640 49.277 109.266 -80.098
215 92.496 160.951 162.234 162.981
216 92.634 79.107 165.127 17.873
217 92.504 42.757 100.399 -81.139
218 91.590 51.217 135.672-125.986
219 92.453 52.700 135.970 22.089
220 91.663 75.949 165.124 175.865
221 92.423 1.432 86.338 -92.514
222 116.741-146.819 145.648 -13.281
223 131.277 -59.975 0.000 0.000
224 129.240 -56.251 0.000 0.000
225 109.427 -33.945 123.649-135.747
226 91.127 93.411 113.241 -74.434
227 91.524 -17.958 102.382 -78.347
228 107.070 -47.188 0.000 0.000
229 132.098 -58.727 98.843-110.934
230 118.901-108.504 118.105-125.453
231 118.096-140.219 117.913-120.669
232 93.017 57.670 107.360-112.701
233 93.333 0.000 115.594 -76.780
234 # 12 total E -2.05754E+02 rmsd from N 0.000 %NC 0.00 0
235 93.657 122.742 109.054 -81.247
236 119.302-116.936 145.783 -30.943
237 92.457 56.014 130.527 111.452
238 92.104 45.773 143.715 -89.204
239 91.432 42.099 131.437 -55.525
240 92.344 56.701 152.417 -3.454
241 91.457 42.604 148.396-135.970
242 93.030 74.335 93.693-101.613
243 93.823 -90.967 135.829 -17.598
244 94.537 157.137 0.000 0.000
245 134.122 -58.254 0.000 0.000
246 92.186 56.613 132.648-159.038
247 93.148 26.661 105.934 -72.675
248 96.484 -93.553 116.645 -83.912
249 123.181-174.662 0.000 0.000
250 131.171 -82.590 113.276 -63.380
251 117.227-106.289 118.165-124.811
252 117.707-137.473 113.574-115.374
253 93.271 58.091 126.264-149.269
254 93.332 0.000 115.852 -76.496
255 # 13 total E -2.03340E+02 rmsd from N 0.000 %NC 0.00 0
256 93.658 122.900 108.975 -81.129
257 118.853-118.994 149.077 -31.497
258 92.540 56.353 135.840 107.788
259 92.165 45.151 138.213 -84.342
260 91.401 44.263 131.054 -53.329
261 92.331 51.751 154.576 -14.300
262 91.483 64.065 149.310-141.436
263 92.075 67.795 110.839-113.924
264 93.513 118.962 144.529 18.437
265 128.437 -76.050 0.000 0.000
266 124.909 -50.551 0.000 0.000
267 91.771 56.928 100.242 -98.633
268 92.721 18.737 108.843 -74.561
269 108.481 -85.991 131.755-110.208
270 126.906 -14.917 0.000 0.000
271 134.070 -84.789 95.383 95.406
272 118.645-107.566 125.056-134.259
273 117.883-137.412 113.780-115.406
274 93.142 57.260 102.466-107.668
275 93.334 0.000 116.101 -76.777
276 # 14 total E -2.04872E+02 rmsd from N 0.000 %NC 0.00 0
277 93.638 49.207 109.184 -80.045
278 92.505 161.424 163.927 164.459
279 92.487 79.316 165.786 19.094
280 92.267 43.535 100.818 -80.244
281 91.339 50.647 124.936 -70.912
282 92.353 48.968 151.116 -26.848
283 91.673 58.140 161.534 175.924
284 92.039 76.403 107.909-103.994
285 93.418 124.719 129.934 26.820
286 94.303 53.936 0.000 0.000
287 123.710 -71.678 0.000 0.000
288 116.423 -84.323 122.026-129.584
289 93.130 66.033 113.174 -74.371
290 94.513 43.558 113.956 -76.876
291 95.767 82.922 0.000 0.000
292 128.271 -85.026 123.596 135.194
293 117.957-107.675 116.543-125.556
294 117.948-137.978 116.379-119.181
295 93.124 57.987 102.162-104.196
296 93.334 0.000 115.867 -76.648
297 # 15 total E -1.98891E+02 rmsd from N 0.000 %NC 0.00 0
298 93.639 48.249 108.840 -80.064
299 92.550 165.004 176.423-163.180
300 92.062 76.817 169.730 14.070
301 92.176 44.604 102.409 -66.612
302 91.339 47.810 123.653 -58.267
303 92.325 47.792 149.265 -36.052
304 91.649 61.626 159.190-177.024
305 92.266 95.577 110.547 -96.903
306 93.231 6.289 143.325 -19.005
307 120.421-166.540 0.000 0.000
308 136.190 -71.926 0.000 0.000
309 117.558 -74.410 121.036-127.988
310 93.052 75.142 112.887 -74.479
311 114.289 -82.155 117.913 -79.481
312 122.198-168.084 0.000 0.000
313 128.971 -79.273 98.048 -67.718
314 116.228-107.411 93.185 -82.756
315 117.704-140.178 115.037-117.733
316 93.210 57.543 125.864-149.906
317 93.335 0.000 115.894 -76.578
318 # 16 total E -1.99702E+02 rmsd from N 0.000 %NC 0.00 0
319 93.643 98.666 110.736 -77.924
320 92.440 118.306 138.378 -14.999
321 93.960 51.820 102.996 -76.414
322 121.170-133.504 171.687-176.972
323 91.312 57.542 123.064-108.478
324 92.242 59.694 137.087 -42.323
325 91.762 52.084 126.306 -78.888
326 92.474 97.732 96.034 -82.466
327 93.411 33.058 138.036 0.475
328 95.751 66.317 0.000 0.000
329 131.856 -66.591 0.000 0.000
330 92.894 69.641 100.811-104.350
331 93.459 1.733 137.629-104.318
332 120.036-165.199 109.943-129.774
333 94.959 82.313 0.000 0.000
334 130.213 -92.039 96.195 -59.860
335 117.365-106.943 125.669-133.551
336 118.070-137.568 110.542-111.379
337 93.132 56.570 102.878-111.320
338 93.337 0.000 116.304 -76.931
339 # 17 total E -1.99567E+02 rmsd from N 0.000 %NC 0.00 0
340 93.639 49.097 109.178 -80.039
341 92.503 161.365 164.039 164.532
342 92.478 79.374 165.867 18.919
343 92.249 43.655 100.815 -80.083
344 91.319 50.310 124.001 -71.272
345 92.299 48.281 150.887 -28.183
346 91.568 56.789 161.338 175.398
347 91.801 71.752 107.263-102.142
348 93.059 66.345 139.357 -12.309
349 94.915 65.062 0.000 0.000
350 129.061 -64.968 0.000 0.000
351 117.769-131.965 129.844-138.957
352 125.139-122.386 128.430 -26.133
353 93.756 57.236 114.695 -74.908
354 95.198 76.366 0.000 0.000
355 124.909 -81.959 87.181 -64.949
356 116.560-106.089 125.283-134.169
357 118.148-139.469 110.505-110.930
358 93.080 57.668 105.252-112.513
359 93.333 0.000 115.857 -76.576
360 # 18 total E -2.05086E+02 rmsd from N 0.000 %NC 0.00 0
361 93.637 47.962 109.578 -81.032
362 92.625 170.646 148.206 -8.805
363 92.851 75.586 150.305 97.292
364 92.420 43.364 138.664 -82.555
365 91.429 45.923 128.864 -44.803
366 92.382 54.114 154.069 -7.051
367 91.317 54.193 150.352-140.288
368 92.001 64.904 103.000-108.422
369 93.282 157.417 132.489 -1.119
370 94.234 123.933 0.000 0.000
371 133.009 -61.213 0.000 0.000
372 111.502 -37.263 125.106-137.011
373 91.526 90.952 113.238 -74.435
374 91.947 -17.726 103.830 -77.971
375 111.473 -30.521 0.000 0.000
376 133.251 -78.855 101.067 -61.040
377 117.782-112.897 123.341-129.366
378 118.000-116.523 115.802-117.601
379 117.598-115.817 126.764-134.774
380 121.612 0.000 121.484 -79.832
381 # 19 total E -1.99816E+02 rmsd from N 0.000 %NC 0.00 0
382 93.637 48.092 109.584 -81.054
383 92.629 170.989 147.926 -8.460
384 92.812 75.101 150.677 96.841
385 92.472 43.188 139.953 -83.487
386 91.493 45.340 129.603 -43.979
387 92.345 55.717 153.440 -9.166
388 91.501 44.239 150.919-135.002
389 92.925 72.975 95.697-102.516
390 93.853 -92.479 135.957 -19.078
391 94.664 157.842 0.000 0.000
392 136.313 -54.896 0.000 0.000
393 92.790 60.128 99.397 -97.449
394 93.446 63.623 109.815 -76.256
395 93.870 129.136 110.037-115.719
396 135.432 -90.079 0.000 0.000
397 127.743 -91.379 95.466 -60.119
398 117.031-107.339 125.676-134.358
399 118.174-137.530 110.495-110.864
400 93.128 58.033 102.976-111.184
401 93.333 0.000 115.850 -76.569
402 # 20 total E -2.03163E+02 rmsd from N 0.000 %NC 0.00 0
403 93.640 49.289 109.128 -80.028
404 92.504 161.648 164.817 164.080
405 92.358 78.555 166.573 17.362
406 92.211 43.252 100.215 -77.702
407 91.294 49.011 140.414-120.599
408 92.023 43.054 141.158 -42.045
409 91.461 55.112 162.085 178.939
410 91.368 77.205 88.489 -59.930
411 92.420 51.260 134.413 4.625
412 94.314 52.768 0.000 0.000
413 94.502 67.768 0.000 0.000
414 114.019 -34.405 115.904-123.426
415 91.981 79.860 111.895 -75.082
416 91.878 -7.677 121.542-121.767
417 113.560 -39.440 0.000 0.000
418 134.673 -80.339 66.167 -74.261
419 117.447-110.210 116.224-121.054
420 117.477-136.377 135.171-147.684
421 93.166 58.110 101.313 -99.757
422 93.334 0.000 115.865 -76.614
423 # 21 total E -2.02176E+02 rmsd from N 0.000 %NC 0.00 0
424 93.637 48.027 109.553 -81.021
425 92.614 170.119 148.682 -9.028
426 92.854 75.927 151.865 97.029
427 92.428 44.412 137.778 -81.543
428 91.432 44.857 128.122 -44.661
429 92.374 50.550 153.100 -14.426
430 91.510 50.386 149.641-138.666
431 92.608 68.649 101.749-100.956
432 93.614 -79.778 137.806 -20.438
433 121.213 -66.350 0.000 0.000
434 131.107 -52.633 0.000 0.000
435 92.460 64.699 103.381-112.079
436 93.188 52.603 107.900 -75.174
437 93.868 44.920 109.713 -79.417
438 95.270 67.767 0.000 0.000
439 124.323 -76.767 135.872-169.194
440 118.000-108.192 114.908-119.286
441 117.912-137.743 117.405-121.146
442 93.131 57.812 102.105-103.378
443 93.333 0.000 115.867 -76.654
444 # 22 total E -2.04347E+02 rmsd from N 0.000 %NC 0.00 0
445 93.639 49.760 109.230 -80.070
446 92.503 161.263 162.873 162.672
447 92.540 79.860 165.298 20.604
448 92.308 42.999 101.803 -82.531
449 91.327 51.383 125.117 -74.847
450 92.306 49.609 152.423 -21.182
451 91.600 58.856 162.125 175.975
452 92.228 68.531 108.344-106.867
453 93.440 154.379 130.829 9.175
454 94.177 124.736 0.000 0.000
455 133.763 -61.511 0.000 0.000
456 116.456 -48.101 112.367-115.557
457 91.142 83.101 113.074 -74.439
458 91.694 -9.256 107.798 -75.278
459 111.937 -35.603 0.000 0.000
460 132.876 -73.230 109.781-127.546
461 120.893-162.734 120.018-127.431
462 93.145 113.950 105.974 -98.708
463 93.168 29.098 99.413-105.365
464 93.345 0.000 115.745 -76.640
465 # 23 total E -2.01269E+02 rmsd from N 0.000 %NC 0.00 0
466 93.639 49.396 109.169 -80.045
467 92.509 161.720 163.978 162.457
468 92.419 79.209 166.147 18.663
469 92.236 43.579 100.491 -78.466
470 91.340 49.642 136.228-117.849
471 92.192 45.640 141.986 -37.621
472 91.702 61.017 161.920 178.075
473 91.942 87.208 95.313 -71.252
474 92.978 131.575 129.199 20.737
475 94.152 66.970 0.000 0.000
476 124.615 -81.186 0.000 0.000
477 117.853 -91.145 121.518-128.167
478 93.513 86.590 113.473 -74.583
479 94.311 1.813 113.798 -76.836
480 129.446-135.221 0.000 0.000
481 125.507-101.265 106.261 -51.292
482 116.669-105.984 120.582-128.165
483 117.213-141.597 112.419-113.754
484 93.248 57.492 130.509-157.683
485 93.331 0.000 115.927 -76.440
486 # 24 total E -2.01549E+02 rmsd from N 0.000 %NC 0.00 0
487 93.639 47.045 108.117 -79.524
488 92.740 158.335 144.341-109.481
489 132.011 -95.958 105.640 -99.382
490 93.787 43.749 166.216-175.892
491 91.565 43.874 133.243 -74.072
492 92.429 54.022 154.417 -14.721
493 91.308 57.337 137.103-118.563
494 92.239 65.510 106.139-109.388
495 93.698 136.524 134.617 -3.383
496 130.189 -69.849 0.000 0.000
497 128.176 -47.534 0.000 0.000
498 106.994 -28.877 128.693-145.444
499 91.538 98.406 113.239 -74.445
500 91.665 -20.946 105.247 -76.843
501 107.040 -45.767 0.000 0.000
502 128.855 -64.729 101.828 -62.129
503 118.456-112.723 126.545-133.203
504 117.763-128.623 114.467-116.956
505 117.349-115.797 132.905-145.396
506 121.602 0.000 121.489 -79.780
507 # 25 total E -2.03720E+02 rmsd from N 0.000 %NC 0.00 0
508 93.639 49.396 109.167 -80.061
509 92.556 164.536 164.325 143.558
510 92.363 82.825 165.494 24.900
511 92.376 42.550 108.722 -82.759
512 91.365 55.288 127.292 -83.979
513 92.600 52.947 150.887 -32.615
514 91.513 79.359 158.233-172.138
515 92.229 112.411 122.143-126.088
516 93.456 -50.049 101.650 -71.244
517 94.947 83.178 0.000 0.000
518 132.061 -74.875 0.000 0.000
519 126.544 106.227 119.243-120.020
520 93.557 71.715 109.034 -80.794
521 94.054 56.362 125.532-145.780
522 95.187 67.391 0.000 0.000
523 121.927 -87.863 91.346 -61.038
524 116.874-107.081 126.370-135.289
525 117.990-140.722 110.812-111.328
526 93.224 46.270 100.276-106.858
527 93.374 0.000 119.782 -79.893
528 # 26 total E -2.01331E+02 rmsd from N 0.000 %NC 0.00 0
529 93.631 49.536 111.643 -82.293
530 92.491 89.459 138.176 142.079
531 94.218 109.636 164.977 6.396
532 123.391-106.183 118.828 -96.060
533 91.857 63.620 131.060-138.502
534 92.653 93.268 110.342-104.859
535 91.784 55.134 123.508 -82.209
536 93.574 160.795 90.798 109.198
537 116.165 -62.144 145.739 -19.634
538 125.898 -18.170 0.000 0.000
539 125.318 -68.682 0.000 0.000
540 113.702 -54.016 127.088-139.935
541 89.563 73.344 112.656 -74.331
542 90.518 3.981 110.988 -76.287
543 104.735 -69.492 0.000 0.000
544 125.900 -50.950 107.312-121.304
545 122.974 135.158 114.752-119.528
546 92.846 119.631 105.640 -65.985
547 92.674 43.224 101.494-114.747
548 93.287 0.000 105.040 -77.747
549 # 27 total E -2.10700E+02 rmsd from N 0.000 %NC 0.00 0
550 93.639 49.349 109.189 -80.048
551 92.505 161.410 163.609 161.432
552 92.407 79.305 166.365 17.945
553 92.237 43.528 100.099 -78.030
554 91.333 49.041 131.865-106.695
555 92.146 44.654 142.188 -39.295
556 91.566 58.746 162.171 177.359
557 91.603 84.213 96.415 -70.610
558 93.162 38.282 138.027 -6.639
559 95.206 72.370 0.000 0.000
560 131.575 -58.822 0.000 0.000
561 92.844 67.100 101.839-109.654
562 93.177 41.204 105.824 -74.408
563 93.856 53.706 109.640 -83.826
564 94.781 65.974 0.000 0.000
565 122.440 -76.876 139.180-168.005
566 117.995-107.979 115.455-120.569
567 117.915-137.701 117.263-120.848
568 93.133 57.828 101.934-103.363
569 93.334 0.000 115.858 -76.659
570 # 28 total E -2.02960E+02 rmsd from N 0.000 %NC 0.00 0
571 93.659 122.847 109.009 -81.185
572 119.300-117.472 147.491 -31.158
573 92.482 56.449 132.900 109.410
574 92.070 45.117 140.512 -86.362
575 91.365 43.291 130.532 -55.120
576 92.338 53.911 154.130 -4.557
577 91.286 54.825 149.279-140.247
578 92.009 64.442 103.263-108.339
579 93.283 159.833 132.167 2.593
580 94.066 121.719 0.000 0.000
581 132.899 -60.853 0.000 0.000
582 112.947 -40.076 114.319-120.061
583 91.366 89.035 113.127 -74.462
584 91.821 -16.659 103.725 -74.960
585 111.045 -32.165 0.000 0.000
586 133.562 -73.712 112.844 -65.537
587 119.887-161.794 120.224-126.565
588 93.159 113.795 104.655 -98.071
589 93.182 28.319 99.216-104.752
590 93.348 0.000 116.211 -76.739
591 # 29 total E -2.05817E+02 rmsd from N 0.000 %NC 0.00 0
592 93.660 122.786 108.909 -81.139
593 118.795-121.127 151.987 -30.818
594 92.714 58.451 139.402 104.988
595 92.391 45.839 134.951 -79.840
596 91.538 46.871 122.126 -55.054
597 93.312 51.677 152.331 -17.852
598 92.917 112.858 147.267-143.330
599 91.015 -29.759 135.459-150.610
600 90.830 -55.917 105.392 -59.350
601 93.888 11.316 0.000 0.000
602 110.624 -62.675 0.000 0.000
603 87.877 -28.858 100.137-101.542
604 92.923 116.666 112.764 -76.645
605 95.934 40.719 127.988-147.704
606 95.698 73.910 0.000 0.000
607 120.302 -78.283 126.101 142.234
608 117.848-107.800 117.682-125.215
609 117.986-137.941 116.278-119.078
610 93.124 57.830 102.205-104.567
611 93.335 0.000 115.844 -76.665
612 # 30 total E -2.02340E+02 rmsd from N 0.000 %NC 0.00 0
613 93.637 47.962 109.555 -81.025
614 92.601 169.836 148.167 -11.071
615 92.765 73.118 152.277 96.443
616 92.305 44.684 135.066 -77.904
617 91.464 42.883 126.047 -36.152
618 92.442 48.112 153.360 -25.337
619 91.639 45.928 153.700-141.876
620 92.872 80.661 99.367 -90.737
621 93.661 -90.517 143.618 -10.592
622 94.592 136.114 0.000 0.000
623 129.864 -37.491 0.000 0.000
624 92.934 84.640 103.112-107.267
625 127.820 -71.883 118.858 -83.481
626 129.619 -64.737 121.982 -81.693
627 95.520 168.647 0.000 0.000
628 129.731 -79.548 77.138 -68.328
629 116.901-103.618 125.058-133.914
630 118.382-141.014 108.642-108.310
631 93.007 57.354 105.666-125.101
632 93.333 0.000 115.553 -76.652
633 # 31 total E -1.99921E+02 rmsd from N 0.000 %NC 0.00 0
634 93.639 49.685 109.403 -80.169
635 92.500 159.742 160.965 161.436
636 92.775 81.682 164.797 18.201
637 92.722 43.053 100.091 -81.140
638 91.798 54.882 128.159-104.337
639 93.089 67.199 142.716 -35.581
640 92.466 76.822 160.531 161.169
641 120.021-105.788 116.573-104.603
642 121.434 -81.818 109.501 -68.471
643 94.925 57.669 0.000 0.000
644 95.908 41.149 0.000 0.000
645 92.802 47.512 105.084-101.586
646 92.044 48.371 106.715 -84.079
647 92.965 58.409 108.292 -83.855
648 94.912 69.078 0.000 0.000
649 121.036 -90.546 92.890 -60.747
650 117.358-108.207 125.582-134.256
651 118.011-127.883 108.764-108.573
652 117.690-115.775 126.867-135.395
653 121.609 0.000 121.446 -79.844
654 # 32 total E -2.01281E+02 rmsd from N 0.000 %NC 0.00 0
655 93.639 49.386 109.213 -80.061
656 92.504 161.236 163.147 161.655
657 92.455 79.805 165.901 19.290
658 92.253 43.276 100.630 -79.345
659 91.330 49.936 133.201-112.977
660 92.135 45.263 142.417 -33.369
661 91.664 60.197 162.345 179.221
662 91.913 77.982 92.862 -70.717
663 93.010 130.051 135.252 23.139
664 94.620 130.524 0.000 0.000
665 129.636 -30.086 0.000 0.000
666 116.418 -71.434 116.589-125.359
667 93.559 71.265 112.791 -74.477
668 119.353 -98.519 120.990 -80.844
669 94.985 159.221 0.000 0.000
670 129.168-101.155 102.792 -56.272
671 117.282-107.431 116.692-119.363
672 117.809-137.006 131.692-142.242
673 93.128 58.707 103.689-110.635
674 93.332 0.000 115.506 -76.603
675 # 33 total E -2.06284E+02 rmsd from N 0.000 %NC 0.00 0
676 93.637 48.071 109.620 -81.079
677 92.636 170.831 147.089 -8.108
678 92.844 75.938 149.121 98.520
679 92.466 44.120 141.761 -85.308
680 91.499 44.557 129.905 -45.845
681 92.403 56.880 152.459 -6.413
682 91.498 42.866 149.663-135.508
683 93.034 74.667 94.068-102.304
684 93.796 -90.287 135.756 -18.118
685 94.539 157.410 0.000 0.000
686 134.220 -58.279 0.000 0.000
687 92.185 56.548 132.008-158.134
688 93.146 26.711 105.910 -73.196
689 96.444 -93.570 116.575 -83.878
690 123.046-174.850 0.000 0.000
691 131.306 -82.578 113.820 -63.526
692 117.195-106.124 117.982-124.628
693 117.665-137.536 113.613-115.470
694 93.276 58.170 126.238-149.346
695 93.333 0.000 115.853 -76.496
696 # 34 total E -2.08420E+02 rmsd from N 0.000 %NC 0.00 0
697 93.659 122.787 109.011 -81.190
698 119.274-117.434 147.360 -31.198
699 92.481 56.499 132.723 109.508
700 92.068 45.181 140.743 -86.551
701 91.367 43.235 130.508 -54.938
702 92.338 54.064 154.137 -4.214
703 91.285 54.259 149.141-140.001
704 91.992 64.646 102.803-108.062
705 93.254 157.031 132.313 0.776
706 94.154 123.885 0.000 0.000
707 132.572 -60.961 0.000 0.000
708 111.771 -38.313 123.040-133.673
709 91.485 90.647 113.217 -74.445
710 91.933 -17.777 103.702 -76.765
711 111.449 -30.288 0.000 0.000
712 133.879 -77.494 107.080 -61.958
713 118.120-109.955 119.208-123.415
714 117.832-137.041 118.788-122.286
715 93.208 58.409 128.422-151.182
716 93.332 0.000 115.722 -76.542
717 # 35 total E -2.02360E+02 rmsd from N 0.000 %NC 0.00 0
718 93.641 49.381 109.177 -80.044
719 92.506 161.385 163.878 164.019
720 92.478 79.849 165.851 19.383
721 92.282 43.075 101.392 -80.881
722 91.314 50.850 123.522 -72.901
723 92.240 47.803 151.290 -27.355
724 91.538 58.486 161.764 177.903
725 92.135 64.820 108.771-103.601
726 93.453 66.055 139.118 -3.008
727 127.108 10.138 0.000 0.000
728 131.429 -26.260 0.000 0.000
729 92.334 71.309 103.127-111.406
730 92.094 53.929 109.501 -75.648
731 93.137 45.306 121.873-124.237
732 94.209 57.619 0.000 0.000
733 112.329 -58.359 131.665-149.655
734 117.775-105.194 115.200-120.150
735 118.281-135.869 117.224-120.785
736 93.129 58.096 96.414 -99.094
737 93.334 0.000 115.499 -77.019
738 # 36 total E -2.03713E+02 rmsd from N 0.000 %NC 0.00 0
739 93.642 39.468 147.137 -35.857
740 92.286 108.506 145.400 172.350
741 94.826 47.649 140.645 101.400
742 118.930-127.811 133.287 -61.882
743 91.285 69.207 122.840-101.661
744 92.633 61.356 151.524 -23.275
745 91.528 57.383 137.963 -99.085
746 92.458 68.729 103.412-121.424
747 93.712 139.756 136.373 -7.180
748 130.087 -66.790 0.000 0.000
749 128.359 -46.504 0.000 0.000
750 107.180 -28.900 127.490-143.263
751 91.510 98.481 113.231 -74.463
752 91.639 -21.083 105.060 -76.831
753 107.199 -45.857 0.000 0.000
754 128.760 -63.442 104.877 -61.886
755 118.507-110.564 125.098-130.698
756 117.630-138.100 117.058-120.366
757 93.189 58.272 128.184-152.163
758 93.331 0.000 115.497 -76.732
759 # 37 total E -2.02996E+02 rmsd from N 0.000 %NC 0.00 0
760 93.624 40.801 112.425 -85.656
761 92.421 155.216 139.556-165.060
762 93.751 95.734 124.856 -42.854
763 92.237 -0.314 84.607 -83.877
764 91.540 -88.378 141.103-122.092
765 100.834 170.889 84.773-122.276
766 92.292 64.585 155.370-177.868
767 93.169 81.013 107.627-118.606
768 94.278 -89.440 135.981 -24.860
769 94.146 153.687 0.000 0.000
770 135.274 -54.145 0.000 0.000
771 91.739 64.271 103.182-108.267
772 92.360 32.660 109.168 -75.197
773 95.289-115.305 110.484 -82.121
774 95.538 152.683 0.000 0.000
775 130.356-104.149 103.681 -54.147
776 116.898-106.279 126.145-135.008
777 118.124-139.157 110.539-111.025
778 93.086 57.833 106.161-115.196
779 93.335 0.000 115.823 -76.581
780 # 38 total E -2.05557E+02 rmsd from N 0.000 %NC 0.00 0
781 93.638 49.444 109.181 -80.049
782 92.504 161.532 163.692 161.914
783 92.400 79.300 166.340 18.265
784 92.211 43.407 100.190 -78.164
785 91.315 48.907 132.696-108.891
786 92.101 44.308 142.174 -37.180
787 91.543 57.077 162.411 176.702
788 91.512 80.393 93.481 -68.312
789 93.046 38.515 138.392 -7.636
790 95.125 66.150 0.000 0.000
791 129.092 -47.053 0.000 0.000
792 92.395 69.517 99.954-103.836
793 92.460 25.661 104.668 -73.976
794 95.445-114.049 111.153 -82.256
795 95.951 155.939 0.000 0.000
796 128.762-105.193 103.748 -53.660
797 117.452-108.419 126.194-134.902
798 118.068-119.478 109.067-108.985
799 117.725-115.816 125.086-133.095
800 121.613 0.000 121.480 -79.843
801 # 39 total E -1.98929E+02 rmsd from N 0.000 %NC 0.00 0
802 93.626 40.287 112.416 -85.617
803 92.421 155.162 139.573-165.247
804 93.749 95.723 124.851 -42.859
805 92.232 -0.322 84.563 -83.847
806 91.539 -88.379 141.103-121.948
807 100.850 170.934 84.783-122.213
808 92.289 64.693 155.505-177.992
809 93.170 80.890 107.669-118.732
810 94.303 -89.599 135.114 -23.864
811 94.153 154.335 0.000 0.000
812 135.272 -54.478 0.000 0.000
813 91.735 64.131 103.091-108.093
814 92.369 32.636 108.992 -75.227
815 95.417-115.545 110.608 -82.067
816 95.560 153.293 0.000 0.000
817 130.366-104.206 103.123 -54.718
818 117.061-107.087 126.052-134.977
819 118.050-125.283 109.076-109.081
820 117.709-115.801 125.395-133.193
821 121.614 0.000 121.477 -79.842
822 # 40 total E -1.99437E+02 rmsd from N 0.000 %NC 0.00 0
823 93.637 47.451 109.324 -80.845
824 92.274 96.779 152.833-139.782
825 92.276 101.055 125.055 -42.598
826 93.515 6.770 90.199 -88.888
827 93.574 -95.280 138.789-129.485
828 93.505 146.129 136.029 58.017
829 92.246 67.704 133.476 -97.737
830 92.559 93.714 123.787 -96.435
831 93.611 36.198 137.810 -9.308
832 95.560 69.667 0.000 0.000
833 130.792 -53.378 0.000 0.000
834 92.259 68.698 99.699-103.211
835 92.469 28.194 105.843 -76.443
836 95.433-113.802 109.890 -82.597
837 96.095 156.248 0.000 0.000
838 128.760-103.358 103.387 -53.515
839 117.319-107.062 126.587-135.251
840 118.196-137.614 110.924-111.440
841 93.130 58.008 102.904-110.475
842 93.332 0.000 115.826 -76.606
843 # 41 total E -2.04319E+02 rmsd from N 0.000 %NC 0.00 0
844 93.636 48.241 109.388 -80.529
845 92.597 83.260 159.138 174.623
846 93.770 111.986 125.503 -39.999
847 125.534 -92.896 95.089 -92.475
848 91.250 66.480 119.742 -97.464
849 92.093 64.166 152.478 -10.272
850 91.446 47.867 138.859 -54.871
851 92.883 68.000 95.704-113.509
852 93.966 -97.591 139.685 -18.986
853 94.646 157.658 0.000 0.000
854 135.030 -53.974 0.000 0.000
855 92.192 63.791 99.537 -91.359
856 92.538 33.460 112.275 -77.428
857 95.498-115.452 110.672 -82.409
858 95.561 154.091 0.000 0.000
859 130.052-104.207 103.674 -54.315
860 117.052-106.554 125.982-134.786
861 118.116-139.094 110.040-110.403
862 93.089 57.758 105.774-115.652
863 93.332 0.000 115.833 -76.592
864 # 42 total E -2.03478E+02 rmsd from N 0.000 %NC 0.00 0
865 93.639 49.570 109.326 -80.117
866 92.494 160.467 161.550 161.870
867 92.721 79.490 164.471 19.288
868 92.616 41.630 100.952 -82.652
869 91.650 54.471 135.957-130.411
870 92.554 58.425 138.314 33.629
871 91.818 88.137 164.389 177.269
872 92.546 -18.138 95.342-105.608
873 118.352-151.404 141.262 -13.691
874 94.111 111.065 0.000 0.000
875 131.539 -53.371 0.000 0.000
876 127.152 107.103 116.234-115.621
877 92.263 -32.980 124.888 -14.480
878 90.610 -48.115 115.497 -76.301
879 93.838 72.958 0.000 0.000
880 129.550-112.684 117.202 -47.469
881 116.155-106.560 93.410 -88.310
882 117.585-138.497 114.316-117.476
883 93.278 58.060 126.822-150.571
884 93.330 0.000 115.834 -76.488
885 # 43 total E -2.10335E+02 rmsd from N 0.000 %NC 0.00 0
886 93.659 122.810 108.997 -81.147
887 119.021-117.782 147.348 -32.088
888 92.468 55.524 133.537 108.729
889 92.151 44.437 141.224 -86.900
890 91.444 42.882 131.291 -54.078
891 92.287 55.504 153.626 -5.706
892 91.444 43.616 150.718-134.886
893 92.981 70.094 95.051-101.575
894 93.827 -95.017 140.993 -15.538
895 94.560 154.579 0.000 0.000
896 133.455 -49.247 0.000 0.000
897 91.988 65.404 99.172 -95.511
898 92.567 30.932 104.037 -73.364
899 95.773-114.903 112.020 -81.329
900 95.495 154.560 0.000 0.000
901 129.957-104.569 104.183 -54.006
902 117.127-106.576 125.981-134.758
903 118.105-138.954 109.952-110.311
904 93.097 57.749 105.191-114.710
905 93.332 0.000 115.837 -76.584
906 # 44 total E -2.04623E+02 rmsd from N 0.000 %NC 0.00 0
907 93.628 45.450 112.338 -84.122
908 92.497 156.080 142.765-173.810
909 93.602 95.037 124.600 -43.546
910 92.254 -0.380 81.514 -80.881
911 91.473 -87.872 141.648-111.028
912 103.371 171.585 84.951-123.399
913 92.006 81.192 157.593 172.601
914 92.679 69.366 117.674-136.765
915 94.088 140.619 136.345 -8.550
916 130.162 -66.507 0.000 0.000
917 128.388 -46.518 0.000 0.000
918 107.191 -28.899 127.433-143.175
919 91.502 98.353 113.233 -74.466
920 91.644 -21.066 105.038 -76.811
921 107.262 -45.811 0.000 0.000
922 128.692 -63.532 105.120 -61.627
923 118.469-110.615 125.429-131.203
924 117.640-137.971 116.940-120.157
925 93.197 58.363 128.250-152.290
926 93.334 0.000 115.501 -76.726
927 # 45 total E -2.04056E+02 rmsd from N 0.000 %NC 0.00 0
928 93.659 122.770 108.914 -81.134
929 118.707-121.204 151.959 -30.786
930 92.711 58.450 139.335 104.934
931 92.387 45.759 134.915 -79.749
932 91.524 47.111 122.584 -54.591
933 93.290 50.599 152.618 -17.399
934 92.898 112.029 146.610-141.974
935 91.236 -27.566 135.672-149.884
936 90.549 -58.392 132.118 -43.044
937 93.379 12.200 0.000 0.000
938 109.231 -58.800 0.000 0.000
939 86.631 -28.124 99.704-101.361
940 93.066 123.473 112.415 -74.110
941 94.909 13.719 130.959 -44.396
942 128.857-133.362 0.000 0.000
943 128.099 -88.860 123.009 -48.583
944 117.538-107.526 126.190-136.406
945 117.910-137.579 113.586-114.554
946 93.247 58.210 128.809-152.448
947 93.333 0.000 115.845 -76.484
948 # 46 total E -2.05129E+02 rmsd from N 0.000 %NC 0.00 0
949 93.635 49.968 111.255 -81.966
950 92.071 75.792 144.052-137.350
951 92.501 52.681 131.710 110.087
952 92.415 43.432 144.067 -86.568
953 91.439 43.547 132.363 -60.840
954 92.287 57.565 152.916 -3.784
955 91.451 43.106 150.504-131.154
956 92.982 72.795 93.879-103.362
957 93.892 -93.141 136.361 -17.372
958 94.651 155.710 0.000 0.000
959 135.670 -53.586 0.000 0.000
960 92.390 61.618 100.442 -99.879
961 92.747 48.132 105.590 -74.082
962 93.611 50.345 105.769 -81.386
963 95.013 67.299 0.000 0.000
964 123.031 -77.763 138.115-164.724
965 118.022-109.703 116.053-121.440
966 117.969-118.210 113.490-115.449
967 117.770-115.825 121.897-127.442
968 121.613 0.000 121.477 -79.863
969 # 47 total E -2.01197E+02 rmsd from N 0.000 %NC 0.00 0
970 93.639 49.709 109.432 -80.185
971 92.495 159.287 160.161 161.203
972 92.837 82.059 164.046 20.629
973 92.794 40.714 100.724 -82.919
974 91.672 59.623 113.978 -87.331
975 92.892 58.220 144.057 -26.452
976 92.578 113.390 158.523-159.682
977 90.858 -30.228 133.713-142.173
978 91.284 -57.313 80.694 -82.805
979 92.822 13.326 0.000 0.000
980 116.630 -73.285 0.000 0.000
981 94.141 40.565 82.568 -70.153
982 121.440 -66.952 134.256 11.616
983 92.992 -21.532 115.653 -75.614
984 95.740 112.062 0.000 0.000
985 134.675-142.749 126.897 -28.195
986 117.782-105.410 125.019-133.135
987 118.127-125.702 108.584-108.374
988 117.853-115.818 124.177-132.340
989 121.613 0.000 121.479 -79.848
990 # 48 total E -2.01279E+02 rmsd from N 0.000 %NC 0.00 0
991 93.638 49.548 109.227 -80.068
992 92.501 161.122 163.008 163.245
993 92.543 80.169 165.298 20.581
994 92.304 43.156 101.636 -82.119
995 91.335 51.373 124.624 -73.978
996 92.338 49.195 151.009 -26.555
997 91.641 59.487 161.968 177.731
998 92.285 67.231 108.843-106.467
999 93.532 142.727 138.097 -11.319
1000 134.293 -77.167 0.000 0.000
1001 132.706 -41.078 0.000 0.000
1002 92.597 63.606 102.656-110.747
1003 92.883 49.706 107.283 -75.064
1004 93.668 49.603 110.023 -80.387
1005 95.012 67.359 0.000 0.000
1006 122.781 -77.304 137.479-163.437
1007 118.023-108.158 115.074-119.881
1008 117.898-137.664 117.404-121.095
1009 93.133 57.878 102.060-103.198
1010 93.335 0.000 115.846 -76.661
1011 # 49 total E -2.00565E+02 rmsd from N 0.000 %NC 0.00 0
1012 93.641 49.808 109.443 -80.180
1013 92.491 159.950 160.075 161.372
1014 92.821 81.527 163.365 23.952
1015 92.633 40.743 101.743 -85.018
1016 91.626 56.586 128.064 -93.754
1017 93.161 58.176 151.789 -17.393
1018 92.278 79.524 163.970-162.582
1019 118.959 -69.562 125.467-128.354
1020 95.595 172.386 144.698 -7.913
1021 132.553 -46.394 0.000 0.000
1022 126.276 -56.750 0.000 0.000
1023 115.376 -48.119 117.899-123.943
1024 90.500 82.206 112.890 -74.491
1025 91.157 -5.880 109.623 -76.653
1026 106.282 -57.468 0.000 0.000
1027 133.159 -53.258 137.215-158.004
1028 119.807-111.879 114.940-119.969
1029 118.700-137.870 121.474-125.537
1030 93.065 57.973 101.262-100.196
1031 93.334 0.000 115.653 -76.767
1032 # 50 total E -2.04996E+02 rmsd from N 0.000 %NC 0.00 0
1033 93.659 122.710 108.978 -81.138
1034 118.764-118.454 148.615 -31.836
1035 92.524 55.683 135.354 108.105
1036 92.112 45.549 137.867 -83.302
1037 91.384 43.546 129.652 -50.618
1038 92.375 50.025 154.703 -15.469
1039 91.485 59.266 149.095-141.938
1040 92.212 70.110 108.247-106.777
1041 93.252 141.926 139.013 -5.977
1042 130.288 -58.706 0.000 0.000
1043 123.845 -57.995 0.000 0.000
1044 92.083 54.427 131.712-158.115
1045 93.170 26.227 110.876 -75.756
1046 96.061 -95.209 121.008-116.735
1047 123.530-175.148 0.000 0.000
1048 131.672 -89.778 95.799 -62.021
1049 116.816-107.107 127.367-139.679
1050 118.177-137.983 109.452-109.187
1051 93.116 57.995 103.268-113.082
1052 93.333 0.000 115.830 -76.570
1053 # 51 total E -2.02077E+02 rmsd from N 0.000 %NC 0.00 0
1054 93.638 48.494 109.522 -80.565
1055 92.593 83.030 157.357 168.976
1056 93.748 112.736 125.535 -40.311
1057 124.982 -92.407 93.962 -91.761
1058 91.263 68.205 119.644 -97.333
1059 92.327 62.016 154.157 -4.620
1060 91.358 56.876 140.369 -59.886
1061 92.108 66.315 101.660-119.917
1062 93.385 153.787 132.675 1.740
1063 94.062 127.967 0.000 0.000
1064 132.716 -62.240 0.000 0.000
1065 109.037 -37.701 97.184 -90.712
1066 91.498 92.530 113.114 -74.469
1067 91.766 -19.937 102.622 -78.462
1068 110.079 -30.028 0.000 0.000
1069 134.991 -74.053 127.981-134.598
1070 118.679-111.821 112.889-117.608
1071 117.757-136.756 128.019-136.332
1072 93.134 58.043 101.835 -99.499
1073 93.333 0.000 115.778 -76.705
1074 # 52 total E -2.07674E+02 rmsd from N 0.000 %NC 0.00 0
1075 93.660 122.727 108.902 -81.000
1076 118.579-117.353 152.061 -32.352
1077 92.589 53.950 140.697 104.477
1078 92.170 44.632 128.399 -74.332
1079 91.521 42.645 136.646-147.739
1080 92.207 44.991 147.712 -23.320
1081 91.187 51.298 155.463-164.708
1082 91.109 68.903 81.916 -63.932
1083 92.253 43.304 134.099 5.573
1084 94.422 48.580 0.000 0.000
1085 94.884 41.817 0.000 0.000
1086 92.169 46.222 94.793 -98.861
1087 91.881 49.432 110.369 -83.853
1088 92.976 47.768 108.887-120.245
1089 94.993 67.254 0.000 0.000
1090 122.360 -78.010 137.585-166.615
1091 118.032-108.048 115.065-119.711
1092 117.934-137.678 117.254-120.897
1093 93.133 57.829 102.184-103.679
1094 93.333 0.000 115.864 -76.656
1095 # 53 total E -2.06295E+02 rmsd from N 0.000 %NC 0.00 0
1096 93.659 122.787 109.005 -81.149
1097 119.016-117.686 147.312 -32.159
1098 92.465 55.544 133.504 108.711
1099 92.148 44.422 141.227 -86.896
1100 91.442 42.932 131.329 -53.974
1101 92.286 55.608 153.643 -5.398
1102 91.439 43.671 150.722-135.062
1103 92.971 70.102 95.043-101.746
1104 93.825 -95.046 140.409 -16.395
1105 94.558 154.841 0.000 0.000
1106 133.498 -49.494 0.000 0.000
1107 91.986 65.303 99.155 -95.595
1108 92.570 30.971 104.048 -73.379
1109 95.860-115.104 112.109 -81.310
1110 95.512 154.856 0.000 0.000
1111 129.947-104.692 103.768 -54.496
1112 117.232-107.112 125.897-134.770
1113 118.033-127.940 108.534-108.417
1114 117.699-115.810 125.669-134.083
1115 121.611 0.000 121.479 -79.840
1116 # 54 total E -2.13451E+02 rmsd from N 0.000 %NC 0.00 0
1117 93.639 49.044 109.115 -80.020
1118 92.507 161.904 165.285 165.099
1119 92.338 78.282 166.754 16.838
1120 92.231 43.124 100.293 -77.542
1121 91.301 48.998 141.601-122.698
1122 92.078 42.237 140.838 -44.896
1123 91.506 57.945 162.089-179.423
1124 91.850 74.611 89.648 -59.624
1125 93.312 101.555 134.507 8.859
1126 128.181 -15.773 0.000 0.000
1127 125.844 -71.227 0.000 0.000
1128 110.958 -52.764 98.000 -87.545
1129 89.814 76.633 112.553 -74.426
1130 90.717 1.670 110.720 -76.267
1131 102.815 -70.244 0.000 0.000
1132 128.902 -44.377 140.312 173.468
1133 122.194-161.781 109.406-113.043
1134 92.754 116.061 103.030-104.202
1135 93.502 22.757 84.812 -91.109
1136 93.378 0.000 120.079 -77.416
1137 # 55 total E -2.02013E+02 rmsd from N 0.000 %NC 0.00 0
1138 93.640 49.973 109.603 -80.270
1139 92.492 160.380 157.887 157.640
1140 92.849 82.755 160.870 31.924
1141 92.535 41.042 105.104 -91.850
1142 91.447 55.974 129.223 -98.074
1143 92.308 56.326 152.130 -21.195
1144 91.502 68.613 163.732-163.392
1145 91.863 74.271 111.775-127.277
1146 93.732 56.497 138.184 -17.659
1147 131.111-156.800 0.000 0.000
1148 133.823 -30.048 0.000 0.000
1149 110.165 -29.527 125.276-137.978
1150 91.706 94.693 113.367 -74.414
1151 91.921 -20.847 101.620 -76.902
1152 110.473 -36.180 0.000 0.000
1153 132.571 -68.873 73.502 -67.504
1154 117.169-107.173 125.280-132.224
1155 118.433-138.342 118.282-121.086
1156 93.099 57.653 99.148-105.793
1157 93.333 0.000 115.710 -76.800
1158 # 56 total E -2.07876E+02 rmsd from N 0.000 %NC 0.00 0
1159 93.659 122.700 108.924 -81.124
1160 118.689-118.223 149.221 -32.645
1161 92.539 54.375 136.609 107.386
1162 92.065 45.965 134.796 -79.247
1163 91.429 41.942 126.572 -46.951
1164 92.566 45.860 153.933 -24.070
1165 91.512 54.447 151.157-146.320
1166 91.813 86.758 105.518 -92.878
1167 93.119 37.629 138.935 -12.329
1168 95.341 66.210 0.000 0.000
1169 130.897 -52.462 0.000 0.000
1170 92.361 69.170 100.139-103.904
1171 92.418 27.454 107.895 -76.254
1172 95.497-113.625 108.313 -81.833
1173 96.119 156.559 0.000 0.000
1174 128.711-103.259 103.339 -53.427
1175 117.348-107.112 126.697-135.371
1176 118.190-137.607 110.890-111.402
1177 93.127 58.030 102.876-110.274
1178 93.333 0.000 115.825 -76.595
1179 # 57 total E -1.99626E+02 rmsd from N 0.000 %NC 0.00 0
1180 93.636 49.563 109.498 -80.222
1181 92.487 159.692 159.285 160.960
1182 92.868 82.390 162.717 25.929
1183 92.593 41.258 102.683 -87.124
1184 91.595 55.893 130.368-102.640
1185 92.671 58.265 151.946 -25.777
1186 91.779 77.781 163.958-170.974
1187 92.803 144.627 117.073-135.393
1188 93.910 -64.358 115.825 -68.262
1189 129.659 -43.767 0.000 0.000
1190 125.857 -53.888 0.000 0.000
1191 91.962 53.973 130.899-157.155
1192 93.098 26.438 109.812 -75.058
1193 94.961 -94.275 125.271-116.856
1194 124.566-179.528 0.000 0.000
1195 129.849 -97.743 100.850 -58.473
1196 116.688-106.683 127.249-137.226
1197 118.162-138.054 109.624-109.610
1198 93.112 57.970 103.112-113.077
1199 93.332 0.000 115.827 -76.570
1200 # 58 total E -2.13657E+02 rmsd from N 0.000 %NC 0.00 0
1201 93.637 49.184 109.112 -80.023
1202 92.509 161.881 165.219 164.989
1203 92.339 78.310 166.726 16.846
1204 92.238 43.095 100.313 -77.628
1205 91.299 49.130 141.579-122.700
1206 92.078 42.191 140.855 -44.825
1207 91.504 58.202 162.049-178.663
1208 91.860 73.419 89.547 -59.590
1209 93.282 102.067 135.587 -0.836
1210 128.644 -17.349 0.000 0.000
1211 125.741 -70.592 0.000 0.000
1212 110.794 -51.756 97.783 -86.920
1213 89.835 77.162 112.566 -74.438
1214 90.746 1.078 110.406 -76.314
1215 102.468 -70.735 0.000 0.000
1216 129.985 -45.124 139.966 173.528
1217 120.698-146.399 104.959-107.409
1218 118.842-113.227 112.531-113.149
1219 93.050 61.888 103.762-112.618
1220 93.331 0.000 115.186 -76.691
1221 # 59 total E -2.08771E+02 rmsd from N 0.000 %NC 0.00 0
1222 93.636 47.263 109.767 -80.911
1223 92.095 74.172 140.625 -48.747
1224 92.537 51.739 125.624 115.924
1225 92.499 45.031 146.426 -89.190
1226 91.409 42.483 133.157 -58.129
1227 92.387 55.638 153.725 -2.652
1228 91.291 54.273 146.778-134.275
1229 92.058 65.029 102.212-109.370
1230 93.258 155.818 132.378 2.313
1231 94.152 123.740 0.000 0.000
1232 132.603 -60.854 0.000 0.000
1233 111.860 -38.369 122.947-133.484
1234 91.485 90.515 113.215 -74.443
1235 91.934 -17.707 103.749 -76.690
1236 111.559 -30.132 0.000 0.000
1237 133.802 -77.637 107.226 -61.850
1238 118.121-109.962 119.213-123.419
1239 117.834-136.899 118.778-122.267
1240 93.210 58.546 128.463-151.249
1241 93.333 0.000 115.720 -76.543
1242 # 60 total E -2.04695E+02 rmsd from N 0.000 %NC 0.00 0
1243 93.660 122.645 108.930 -81.118
1244 118.656-118.441 149.340 -32.504
1245 92.546 54.509 136.702 107.260
1246 92.077 45.990 134.811 -79.248
1247 91.435 42.159 126.824 -47.120
1248 92.578 46.119 153.986 -24.013
1249 91.527 56.123 150.943-146.183
1250 91.901 89.839 106.795 -94.607
1251 93.235 36.408 138.671 -6.814
1252 95.328 71.274 0.000 0.000
1253 131.939 -60.048 0.000 0.000
1254 92.877 67.247 101.800-109.350
1255 93.170 40.736 107.676 -76.275
1256 93.895 53.890 108.706 -83.615
1257 94.783 66.298 0.000 0.000
1258 122.683 -76.835 139.444-168.967
1259 117.977-109.596 116.284-121.904
1260 117.983-118.299 113.482-115.410
1261 117.763-115.829 121.724-127.235
1262 121.617 0.000 121.479 -79.864
1263 # 61 total E -2.05138E+02 rmsd from N 0.000 %NC 0.00 0
1264 93.639 49.527 109.166 -80.043
1265 92.500 161.088 165.049 167.168
1266 92.451 76.940 166.741 11.689
1267 92.574 43.298 98.040 -75.782
1268 91.615 50.234 143.979-120.710
1269 92.450 47.933 137.545 -70.655
1270 91.964 59.053 163.344-166.624
1271 93.113 137.692 104.254 119.077
1272 118.105 -64.101 137.053 -31.116
1273 126.986 -15.177 0.000 0.000
1274 129.552 -62.894 0.000 0.000
1275 102.243 -29.567 126.637-144.444
1276 91.098 95.077 112.931 -74.215
1277 91.099 -15.816 110.463 -75.860
1278 101.597 -63.389 0.000 0.000
1279 126.440 -47.926 151.721 -60.688
1280 119.313-144.822 119.871-128.282
1281 120.232-108.095 107.705-104.231
1282 117.599-115.923 122.145-130.239
1283 121.639 0.000 121.479 -80.020
1284 # 62 total E -2.06089E+02 rmsd from N 0.000 %NC 0.00 0
1285 93.636 44.399 109.281 -81.097
1286 92.059 75.499 142.451-106.561
1287 92.472 49.589 113.786 125.802
1288 92.560 45.241 155.104 -97.078
1289 91.467 40.605 132.075 -59.603
1290 92.349 58.618 151.796 -3.273
1291 91.427 42.243 144.349-130.081
1292 93.037 74.469 92.846-102.201
1293 93.768 -91.266 136.016 -16.847
1294 94.553 156.383 0.000 0.000
1295 134.100 -59.062 0.000 0.000
1296 92.167 56.362 133.034-159.567
1297 93.133 26.853 106.287 -73.514
1298 96.462 -93.441 116.179 -84.467
1299 123.397-174.599 0.000 0.000
1300 131.146 -82.751 113.455 -63.072
1301 117.233-106.351 118.259-124.891
1302 117.718-137.426 113.591-115.385
1303 93.272 58.197 126.342-149.309
1304 93.333 0.000 115.865 -76.348
1305 # 63 total E -2.02594E+02 rmsd from N 0.000 %NC 0.00 0
1306 93.638 50.314 109.657 -80.303
1307 92.482 157.966 157.213 156.973
1308 93.034 82.520 160.681 28.876
1309 92.915 39.109 104.428 -91.304
1310 91.888 62.564 128.113-131.884
1311 92.805 65.053 148.353 -10.889
1312 91.857 123.317 158.514-156.774
1313 92.016 -24.374 127.488-141.993
1314 91.420 -59.761 104.224 -64.039
1315 93.870 16.388 0.000 0.000
1316 114.283 -57.033 0.000 0.000
1317 97.564 -30.709 97.637 -98.018
1318 93.723 103.577 113.013 -75.252
1319 125.508-124.113 118.548 -83.820
1320 95.959 157.303 0.000 0.000
1321 127.412 -95.839 84.740 -66.326
1322 118.328-110.874 122.725-129.979
1323 117.907-114.482 111.620-113.092
1324 118.042-115.777 113.508-115.546
1325 121.609 0.000 121.450 -79.864
1326 # 64 total E -1.99448E+02 rmsd from N 0.000 %NC 0.00 0
1327 93.631 41.960 110.796 -83.665
1328 92.541 155.079 144.306-173.174
1329 93.579 94.971 124.808 -43.757
1330 92.474 -0.377 79.883 -79.805
1331 91.340 -87.451 141.127-110.625
1332 104.317 168.828 148.182 11.985
1333 92.138 75.037 157.011 170.992
1334 92.882 121.035 117.570-128.627
1335 93.546 80.307 134.171 -10.738
1336 96.962 76.595 0.000 0.000
1337 134.423 -96.330 0.000 0.000
1338 115.255 -54.038 121.929-129.967
1339 90.118 74.324 112.548 -74.330
1340 90.959 3.849 111.537 -76.281
1341 104.956 -61.208 0.000 0.000
1342 133.734 -62.963 158.965 -41.655
1343 119.808-112.333 106.301-108.000
1344 116.858-138.402 124.886-132.975
1345 93.167 58.075 130.804-155.657
1346 93.331 0.000 115.721 -76.619
1347 # 65 total E -1.99223E+02 rmsd from N 0.000 %NC 0.00 0
1348 93.639 49.967 109.550 -80.233
1349 92.489 160.211 158.622 158.583
1350 92.788 82.367 161.378 31.249
1351 92.451 41.121 104.100 -89.484
1352 91.444 53.782 126.561 -85.027
1353 92.368 53.194 150.630 -26.799
1354 91.781 52.969 166.207-159.692
1355 92.964 79.360 103.143-108.598
1356 93.689 -88.900 101.676 -64.663
1357 94.371 161.219 0.000 0.000
1358 138.408 -55.250 0.000 0.000
1359 93.033 57.462 97.923-103.228
1360 93.633 105.582 108.821 -76.343
1361 92.865 -17.927 128.560-147.945
1362 101.583 -76.358 0.000 0.000
1363 120.865-116.946 111.215 -44.540
1364 116.805-106.325 122.120-129.171
1365 118.130-137.798 111.151-112.051
1366 93.131 57.977 102.887-110.188
1367 93.333 0.000 115.865 -76.570
1368 # 66 total E -2.00295E+02 rmsd from N 0.000 %NC 0.00 0
1369 93.638 48.186 109.384 -80.522
1370 92.598 83.228 159.118 174.764
1371 93.770 112.048 125.488 -40.005
1372 125.524 -92.874 95.096 -92.514
1373 91.253 66.453 119.707 -97.478
1374 92.095 64.241 152.474 -10.029
1375 91.443 47.969 139.027 -54.831
1376 92.880 67.950 95.719-113.624
1377 93.962 -97.541 138.957 -18.609
1378 94.644 157.891 0.000 0.000
1379 135.007 -54.075 0.000 0.000
1380 92.184 63.725 99.551 -91.541
1381 92.542 33.372 112.202 -77.442
1382 95.602-115.640 110.788 -82.378
1383 95.579 154.444 0.000 0.000
1384 130.082-104.138 103.185 -54.819
1385 117.164-107.110 125.940-134.838
1386 118.038-127.064 108.663-108.578
1387 117.698-115.810 125.776-134.167
1388 121.610 0.000 121.479 -79.839
1389 # 67 total E -1.99955E+02 rmsd from N 0.000 %NC 0.00 0
1390 93.639 49.701 109.413 -80.174
1391 92.496 159.438 160.384 161.294
1392 92.817 81.869 164.094 20.856
1393 92.769 40.521 100.718 -82.743
1394 91.646 59.941 113.893 -85.492
1395 92.885 57.758 144.790 -26.652
1396 92.715 112.916 158.181-158.389
1397 90.800 -30.341 133.899-143.534
1398 91.035 -57.712 90.168 -77.304
1399 92.651 17.117 0.000 0.000
1400 116.175 -78.215 0.000 0.000
1401 92.781 52.934 100.305 -98.503
1402 129.845 -72.840 119.038 -78.066
1403 118.056 175.881 116.325 -81.122
1404 95.306 83.818 0.000 0.000
1405 127.771 -90.474 97.590 -59.048
1406 117.223-107.572 126.010-134.569
1407 118.146-137.556 110.954-111.424
1408 93.129 58.030 102.744-108.769
1409 93.333 0.000 115.829 -76.584
1410 # 68 total E -2.07093E+02 rmsd from N 0.000 %NC 0.00 0
1411 93.662 122.836 108.976 -81.142
1412 118.863-118.349 148.510 -31.758
1413 92.517 55.481 135.133 108.366
1414 92.089 45.359 137.906 -83.532
1415 91.368 43.451 129.483 -50.113
1416 92.344 49.145 154.811 -14.916
1417 91.424 59.456 148.949-141.055
1418 92.149 63.681 108.583-106.258
1419 93.726 135.922 134.575 -3.134
1420 130.171 -69.927 0.000 0.000
1421 128.074 -47.986 0.000 0.000
1422 106.949 -28.955 128.659-145.400
1423 91.530 98.316 113.237 -74.446
1424 91.669 -20.873 105.261 -76.881
1425 106.969 -45.836 0.000 0.000
1426 128.926 -64.667 101.729 -62.085
1427 118.484-112.801 126.646-133.312
1428 117.762-128.514 114.352-116.804
1429 117.350-115.778 132.912-145.414
1430 121.600 0.000 121.489 -79.780
1431 # 69 total E -1.99050E+02 rmsd from N 0.000 %NC 0.00 0
1432 93.639 49.486 109.249 -80.078
1433 92.503 161.232 162.776 163.773
1434 92.573 80.410 164.976 21.486
1435 92.320 42.993 102.222 -83.531
1436 91.355 51.536 127.467 -71.404
1437 92.291 49.905 151.679 -23.811
1438 91.607 60.684 162.393 176.353
1439 92.251 63.127 109.432-109.207
1440 93.699 143.949 154.139 4.271
1441 136.684 -84.301 0.000 0.000
1442 134.414 -38.137 0.000 0.000
1443 92.818 65.999 101.295-105.623
1444 93.093 44.435 107.205 -75.450
1445 116.710-177.592 111.739 -86.806
1446 95.191 126.929 0.000 0.000
1447 128.323 -92.276 94.337 -59.811
1448 117.102-106.039 127.017-136.090
1449 117.925-139.335 110.731-111.236
1450 93.054 58.729 107.772-116.790
1451 93.330 0.000 115.178 -76.734
1452 # 70 total E -2.05622E+02 rmsd from N 0.000 %NC 0.00 0
1453 93.638 49.986 109.527 -80.243
1454 92.487 158.644 157.778 157.615
1455 92.992 83.131 161.493 27.594
1456 92.920 39.914 104.422 -90.264
1457 91.842 61.223 125.776-125.268
1458 92.848 64.482 142.395 -17.306
1459 92.213 116.944 159.643-161.256
1460 91.005 -27.863 126.954-136.832
1461 91.047 -60.011 78.125 -87.622
1462 92.669 15.709 0.000 0.000
1463 113.651 -73.779 0.000 0.000
1464 117.979 12.630 110.693-112.973
1465 93.376 -51.718 110.656 -73.656
1466 91.425 -6.057 112.656 -76.418
1467 121.624 -21.526 0.000 0.000
1468 122.199 -75.393 130.590 148.300
1469 117.726-109.071 118.165-125.714
1470 117.926-136.943 118.482-122.118
1471 93.148 58.020 102.013-102.920
1472 93.333 0.000 115.840 -76.643
1473 # 71 total E -2.08179E+02 rmsd from N 0.000 %NC 0.00 0
1474 93.639 49.406 109.204 -80.054
1475 92.504 161.337 163.456 163.567
1476 92.504 79.915 165.564 20.205
1477 92.269 43.228 101.646 -81.726
1478 91.310 51.116 124.398 -72.341
1479 92.324 47.555 151.334 -27.293
1480 91.557 61.466 161.508 179.967
1481 92.179 63.403 110.817-106.020
1482 93.756 136.262 134.585 -3.832
1483 130.105 -69.891 0.000 0.000
1484 128.061 -47.833 0.000 0.000
1485 106.987 -28.912 128.706-145.461
1486 91.532 98.374 113.238 -74.444
1487 91.671 -20.909 105.253 -76.837
1488 106.985 -45.784 0.000 0.000
1489 128.895 -64.732 101.707 -62.092
1490 118.477-112.809 126.635-133.305
1491 117.766-128.212 114.346-116.800
1492 117.353-115.800 132.916-145.448
1493 121.604 0.000 121.489 -79.781
1494 # 72 total E -2.04093E+02 rmsd from N 0.000 %NC 0.00 0
1495 93.635 50.051 111.733 -82.414
1496 92.497 86.628 138.149 143.026
1497 94.090 109.873 165.213 -1.969
1498 128.677 -95.435 108.949 -88.345
1499 91.173 68.085 120.802 -96.811
1500 92.054 58.085 151.304 -28.159
1501 91.279 69.913 124.860 -71.765
1502 92.229 57.857 113.665-126.848
1503 93.447 103.624 137.909 4.564
1504 130.378 -15.106 0.000 0.000
1505 125.835 -71.466 0.000 0.000
1506 109.881 -49.708 97.573 -88.006
1507 89.959 78.285 112.303 -74.140
1508 90.852 0.377 109.643 -76.484
1509 102.196 -71.605 0.000 0.000
1510 129.135 -44.909 151.433 30.969
1511 121.165-146.604 107.942-107.528
1512 118.771-113.526 112.861-114.092
1513 93.052 61.832 104.606-114.360
1514 93.339 0.000 115.198 -76.683
1515 # 73 total E -1.98445E+02 rmsd from N 0.000 %NC 0.00 0
1516 93.638 49.430 109.115 -80.034
1517 92.505 161.826 165.306 166.964
1518 92.382 77.690 166.666 15.328
1519 92.391 42.056 99.539 -77.063
1520 91.425 50.132 142.873-122.624
1521 92.254 43.898 139.174 -46.622
1522 91.976 59.141 164.991-165.816
1523 93.360 106.544 113.228 109.147
1524 124.458 -58.553 117.998 -79.478
1525 126.155 -46.983 0.000 0.000
1526 123.667 -89.947 0.000 0.000
1527 91.619 36.903 138.235-168.758
1528 93.540 45.006 110.167 -74.322
1529 94.430 -68.585 113.455 -74.458
1530 124.688 -29.740 0.000 0.000
1531 127.595 -55.711 140.668 70.258
1532 118.728-112.605 126.759-134.869
1533 118.795-139.399 134.644-142.378
1534 93.024 57.453 101.937-101.420
1535 93.335 0.000 115.688 -76.907
1536 # 74 total E -1.99596E+02 rmsd from N 0.000 %NC 0.00 0
1537 93.659 122.697 108.835 -81.107
1538 118.685-121.507 153.589 -31.862
1539 92.751 58.129 142.013 103.375
1540 92.467 44.931 131.596 -76.941
1541 91.544 48.292 120.703 -55.085
1542 93.161 49.575 151.924 -23.751
1543 92.674 110.544 148.088-146.539
1544 91.493 -29.503 136.717-135.648
1545 91.224 -59.191 92.449-102.512
1546 93.132 13.940 0.000 0.000
1547 116.745-104.770 0.000 0.000
1548 92.669 35.397 101.900-101.685
1549 94.769 95.347 111.376 -74.701
1550 92.680 -11.146 120.516 -78.403
1551 104.304 -96.236 0.000 0.000
1552 126.246-116.160 112.919 -44.251
1553 116.758-106.634 141.652-159.383
1554 118.105-137.212 111.672-112.853
1555 93.148 58.074 102.323-107.043
1556 93.333 0.000 115.856 -76.578
1557 # 75 total E -2.07145E+02 rmsd from N 0.000 %NC 0.00 0
1558 93.638 49.637 109.354 -80.136
1559 92.499 159.603 161.260 162.120
1560 92.754 81.424 164.441 20.313
1561 92.676 41.154 100.395 -81.665
1562 91.569 59.373 114.150 -80.241
1563 92.845 53.292 146.082 -28.485
1564 92.630 113.623 156.416-152.865
1565 91.047 -27.590 136.752-143.921
1566 90.571 -57.968 132.029 -43.065
1567 93.575 11.512 0.000 0.000
1568 109.224 -58.333 0.000 0.000
1569 86.878 -28.268 100.486-103.328
1570 93.043 123.487 112.446 -74.092
1571 94.875 13.861 130.634 -45.273
1572 128.742-133.177 0.000 0.000
1573 128.081 -89.090 123.299 -48.062
1574 117.541-107.525 126.646-137.164
1575 117.919-137.580 113.545-114.457
1576 93.248 58.208 128.858-152.523
1577 93.333 0.000 115.845 -76.484
1578 # 76 total E -1.99990E+02 rmsd from N 0.000 %NC 0.00 0
1579 93.638 50.024 109.547 -80.215
1580 92.492 160.205 158.621 157.591
1581 92.741 82.281 161.118 32.639
1582 92.395 41.630 104.026 -88.774
1583 91.360 53.942 127.073 -86.379
1584 92.367 51.809 151.592 -31.478
1585 91.768 67.159 165.040-167.513
1586 92.477 72.132 113.532-118.537
1587 112.057-157.702 142.886 -16.933
1588 135.283 -70.979 0.000 0.000
1589 128.029 -34.335 0.000 0.000
1590 92.152 68.340 100.626-104.214
1591 92.614 24.554 104.879 -74.875
1592 95.556-113.075 113.708 -80.665
1593 95.595 153.375 0.000 0.000
1594 131.466-105.423 109.063 -52.104
1595 116.897-106.795 127.128-137.284
1596 118.308-138.817 110.729-110.949
1597 93.092 57.865 102.751-108.185
1598 93.332 0.000 115.817 -76.579
1599 # 77 total E -2.09921E+02 rmsd from N 0.000 %NC 0.00 0
1600 93.639 49.283 109.164 -80.032
1601 92.504 161.618 164.354 163.523
1602 92.385 78.830 166.381 18.037
1603 92.229 43.080 100.334 -78.227
1604 91.315 49.400 138.026-117.208
1605 92.136 43.170 140.983 -38.173
1606 91.669 59.610 162.640-178.321
1607 91.688 85.443 90.229 -64.775
1608 93.252 37.548 137.075 -5.265
1609 95.641 69.381 0.000 0.000
1610 132.116 -68.241 0.000 0.000
1611 92.880 68.196 100.850-104.727
1612 93.572 4.210 118.650 -80.123
1613 120.415-167.187 119.932-124.444
1614 95.018 82.735 0.000 0.000
1615 129.977 -92.584 96.674 -59.422
1616 117.391-107.065 125.707-133.549
1617 118.059-137.486 110.883-111.738
1618 93.133 57.382 102.799-111.070
1619 93.335 0.000 115.976 -76.803
1620 # 78 total E -2.00486E+02 rmsd from N 0.000 %NC 0.00 0
1621 93.638 49.418 109.232 -80.076
1622 92.497 161.334 162.848 162.136
1623 92.470 79.269 165.888 18.699
1624 92.273 42.507 99.727 -78.728
1625 91.383 48.881 131.326-107.593
1626 92.173 44.375 141.456 -34.338
1627 91.618 57.316 166.302-178.480
1628 92.032 74.712 92.730 -69.111
1629 93.631 45.520 138.581 10.881
1630 124.830-152.277 0.000 0.000
1631 95.433 55.582 0.000 0.000
1632 93.766 66.377 99.088-104.313
1633 94.106 -15.859 107.197 -82.501
1634 120.639 -95.820 129.620-127.531
1635 94.476 148.795 0.000 0.000
1636 131.725 -86.021 89.081 -65.405
1637 116.159-102.258 123.606-132.369
1638 117.840-138.899 109.902-110.291
1639 93.229 57.844 122.349-143.962
1640 93.335 0.000 115.762 -76.638
1641 # 79 total E -2.06877E+02 rmsd from N 0.000 %NC 0.00 0
1642 93.639 50.176 109.735 -80.339
1643 92.485 158.079 156.310 155.241
1644 93.023 82.713 159.542 32.153
1645 92.864 40.105 105.160 -92.769
1646 91.844 62.398 126.928-131.085
1647 92.779 64.718 147.877 -13.156
1648 91.875 122.913 157.538-158.491
1649 92.048 -24.286 128.241-141.927
1650 91.365 -59.627 104.192 -63.416
1651 93.870 16.053 0.000 0.000
1652 114.090 -56.831 0.000 0.000
1653 97.346 -30.678 97.752 -98.291
1654 93.717 103.150 112.997 -75.274
1655 126.116-123.639 118.621 -83.880
1656 95.959 157.355 0.000 0.000
1657 127.395 -93.428 83.214 -67.136
1658 118.300-108.903 122.358-129.308
1659 117.953-135.135 113.809-116.218
1660 93.208 58.417 98.845 -92.510
1661 93.333 0.000 115.926 -76.501
1662 # 80 total E -2.04065E+02 rmsd from N 0.000 %NC 0.00 0
1663 93.640 46.276 107.931 -79.496
1664 92.813 155.368 154.607-119.278
1665 131.145 -95.784 106.846 -98.362
1666 93.922 42.232 166.123-175.063
1667 91.720 43.578 133.511 -76.448
1668 92.509 58.490 155.155 -8.590
1669 91.426 46.754 140.537-117.715
1670 92.785 76.389 96.891-105.685
1671 93.782 -99.153 134.849 -19.932
1672 94.830 156.917 0.000 0.000
1673 135.866 -66.753 0.000 0.000
1674 92.620 58.879 105.108-105.979
1675 92.870 47.811 112.992 -80.646
1676 93.671 50.172 104.642 -83.719
1677 94.986 67.381 0.000 0.000
1678 122.782 -77.473 138.095-165.155
1679 118.040-108.093 115.249-120.163
1680 117.905-137.704 117.305-120.942
1681 93.132 57.803 101.996-103.153
1682 93.334 0.000 115.857 -76.676
1683 # 81 total E -2.00680E+02 rmsd from N 0.000 %NC 0.00 0
1684 93.638 47.452 109.329 -80.845
1685 92.279 96.056 152.741-139.323
1686 92.270 101.081 125.062 -42.594
1687 93.525 6.811 90.294 -89.008
1688 93.586 -95.240 138.699-129.132
1689 93.520 146.163 135.939 57.611
1690 92.247 68.454 133.319 -97.594
1691 92.596 94.531 124.523 -97.036
1692 93.715 35.645 137.694 -5.977
1693 95.611 75.861 0.000 0.000
1694 132.050 -62.072 0.000 0.000
1695 92.781 65.888 101.601-109.082
1696 93.287 40.441 107.250 -77.624
1697 93.960 54.372 109.745 -83.334
1698 94.846 67.052 0.000 0.000
1699 122.956 -78.308 139.296-170.123
1700 118.055-108.135 115.465-120.549
1701 117.876-137.660 117.305-120.928
1702 93.138 57.857 102.294-103.394
1703 93.334 0.000 115.858 -76.648
1704 # 82 total E -1.98673E+02 rmsd from N 0.000 %NC 0.00 0
1705 93.639 48.538 109.263 -80.311
1706 92.562 89.411 160.055 164.318
1707 93.753 108.641 126.882 -40.498
1708 122.009-101.671 100.925 -92.390
1709 91.756 70.001 128.241-146.240
1710 93.093 97.050 133.308 -82.180
1711 92.184 41.716 133.393 -82.773
1712 120.503-101.436 99.927-106.447
1713 121.625 -76.346 106.414 -70.969
1714 94.776 60.013 0.000 0.000
1715 95.672 42.195 0.000 0.000
1716 92.641 46.893 104.964-109.754
1717 91.989 46.835 105.090 -81.497
1718 93.145 50.697 108.720 -83.629
1719 94.869 67.885 0.000 0.000
1720 121.618 -76.148 137.485-167.045
1721 117.982-107.950 114.976-119.557
1722 117.893-137.832 117.403-121.129
1723 93.151 57.819 101.466-102.983
1724 93.334 0.000 115.879 -76.640
1725 # 83 total E -2.01039E+02 rmsd from N 0.000 %NC 0.00 0
1726 93.639 48.648 108.830 -80.066
1727 92.554 165.177 176.430-164.086
1728 91.987 76.134 169.921 13.826
1729 92.099 44.739 101.964 -65.371
1730 91.280 46.928 121.260 -57.927
1731 92.280 45.252 148.110 -38.201
1732 91.552 57.672 159.390-173.186
1733 91.788 87.056 106.886 -88.420
1734 93.198 35.398 138.211 -28.274
1735 95.413 72.413 0.000 0.000
1736 130.050 -60.709 0.000 0.000
1737 92.526 66.627 134.951-163.312
1738 93.001 17.912 108.535 -74.208
1739 95.737 -99.085 102.030 -75.621
1740 124.406 179.527 0.000 0.000
1741 128.919 -89.937 100.336 -74.390
1742 116.034-163.627 120.281-129.695
1743 93.059 114.614 132.854-159.968
1744 93.187 28.606 101.349-103.446
1745 93.346 0.000 116.109 -76.689
1746 # 84 total E -2.05603E+02 rmsd from N 0.000 %NC 0.00 0
1747 93.636 48.085 109.587 -81.056
1748 92.630 171.004 147.821 -8.522
1749 92.812 75.110 150.549 96.944
1750 92.473 43.152 140.104 -83.625
1751 91.496 45.300 129.542 -43.718
1752 92.334 55.880 153.654 -9.142
1753 91.498 44.158 150.934-135.015
1754 92.933 73.475 95.622-102.622
1755 93.846 -92.387 135.963 -18.965
1756 94.638 156.146 0.000 0.000
1757 135.867 -54.307 0.000 0.000
1758 92.380 61.396 100.481-100.964
1759 92.744 48.241 105.617 -74.104
1760 93.609 50.250 105.622 -81.512
1761 95.012 67.249 0.000 0.000
1762 123.002 -77.710 138.031-164.542
1763 118.021-109.689 115.973-121.324
1764 117.976-118.246 113.356-115.279
1765 117.758-115.828 122.217-127.916
1766 121.615 0.000 121.479 -79.862
1767 # 85 total E -2.02861E+02 rmsd from N 0.000 %NC 0.00 0
1768 118.125-143.784 111.008 -82.885
1769 122.250-171.985 167.601-158.338
1770 92.559 81.021 170.629 20.041
1771 92.602 41.643 110.910 -65.208
1772 91.497 56.318 116.584 -72.429
1773 92.846 52.707 147.228 -28.642
1774 92.735 114.200 153.392-152.936
1775 90.828 -29.651 137.101-147.651
1776 90.730 -55.540 111.153 -56.180
1777 94.202 10.935 0.000 0.000
1778 110.188 -61.149 0.000 0.000
1779 87.396 -29.305 101.720-104.578
1780 92.994 116.730 108.287 -75.772
1781 95.965 39.316 131.138 -50.000
1782 95.928 76.369 0.000 0.000
1783 120.948 -88.421 124.383 -41.720
1784 117.313-106.182 124.055-130.800
1785 117.490-139.376 114.702-116.610
1786 93.227 57.839 129.789-154.657
1787 93.326 0.000 115.846 -76.531
1788 # 86 total E -2.02054E+02 rmsd from N 0.000 %NC 0.00 0
1789 93.640 49.724 109.444 -80.189
1790 92.488 159.838 159.980 161.714
1791 92.844 81.397 163.461 22.906
1792 92.648 41.289 101.724 -85.394
1793 91.641 55.225 128.445 -93.929
1794 93.036 59.433 154.681 -6.340
1795 91.997 69.352 165.242-173.086
1796 108.413 -69.146 115.137-123.820
1797 120.641-174.846 148.482 2.548
1798 132.350 -53.572 0.000 0.000
1799 127.125 -56.048 0.000 0.000
1800 107.801 -31.842 122.924-135.625
1801 91.252 95.697 113.283 -74.425
1802 91.479 -19.429 103.551 -78.172
1803 105.487 -48.753 0.000 0.000
1804 130.087 -55.637 96.608-114.646
1805 122.735-161.696 120.642-128.557
1806 92.918 113.710 100.117 -90.276
1807 93.056 31.497 97.177-102.350
1808 93.333 0.000 113.728 -76.647
1809 # 87 total E -1.99134E+02 rmsd from N 0.000 %NC 0.00 0
1810 93.657 122.786 109.012 -81.145
1811 118.930-117.737 147.395 -32.089
1812 92.462 55.909 133.576 108.467
1813 92.155 44.338 141.369 -87.084
1814 91.450 43.192 131.482 -55.341
1815 92.322 56.261 153.519 -4.138
1816 91.446 43.606 150.613-134.920
1817 92.942 71.389 94.675-102.417
1818 93.947 -93.508 136.177 -18.235
1819 94.648 157.613 0.000 0.000
1820 136.474 -53.078 0.000 0.000
1821 92.805 60.400 99.332 -96.694
1822 93.438 63.529 109.854 -75.679
1823 93.874 129.165 109.799-115.630
1824 135.467 -90.049 0.000 0.000
1825 127.738 -91.358 95.442 -60.131
1826 117.032-107.349 125.676-134.359
1827 118.168-137.535 110.494-110.869
1828 93.128 58.045 102.961-111.191
1829 93.333 0.000 115.850 -76.569
1830 # 88 total E -1.99172E+02 rmsd from N 0.000 %NC 0.00 0
1831 93.639 48.261 108.880 -80.167
1832 92.564 165.668 176.430-164.763
1833 92.170 77.546 169.104 12.810
1834 92.468 45.687 103.406 -62.917
1835 91.646 48.810 127.311 -69.014
1836 93.151 61.623 147.920 -30.495
1837 92.402 62.457 160.434 172.716
1838 119.089-119.822 111.436-107.625
1839 123.472 -79.191 143.064 -28.754
1840 95.223 89.047 0.000 0.000
1841 133.317 -32.658 0.000 0.000
1842 92.328 63.609 100.866-106.434
1843 92.672 45.213 105.479 -77.568
1844 93.530 58.279 105.812 -83.941
1845 95.111 73.328 0.000 0.000
1846 123.201 -86.754 89.601 -61.723
1847 117.245-106.857 126.579-135.300
1848 118.062-137.753 110.809-111.541
1849 93.095 54.654 102.328-109.370
1850 93.345 0.000 116.444 -77.817
1851 # 89 total E -2.04400E+02 rmsd from N 0.000 %NC 0.00 0
1852 93.637 48.918 109.205 -80.050
1853 92.503 161.169 163.665 164.774
1854 92.519 79.749 165.767 18.983
1855 92.315 43.140 100.483 -80.059
1856 91.401 51.321 124.791 -73.839
1857 92.398 50.114 150.050 -30.629
1858 91.805 56.492 162.318-178.342
1859 92.683 90.924 106.574-103.892
1860 93.627 -82.611 97.761 -68.990
1861 94.437 166.443 0.000 0.000
1862 135.690 -50.687 0.000 0.000
1863 109.849 -30.018 126.357-139.904
1864 91.755 94.254 112.928 -74.325
1865 91.857 -21.053 103.910 -76.803
1866 110.568 -34.842 0.000 0.000
1867 132.541 -73.088 80.711 -66.983
1868 117.104-109.551 123.564-130.213
1869 118.184-137.543 117.049-119.508
1870 93.100 58.266 102.824-111.797
1871 93.333 0.000 115.659 -76.648
1872 # 90 total E -2.09217E+02 rmsd from N 0.000 %NC 0.00 0
1873 93.636 48.073 109.575 -81.032
1874 92.623 170.636 148.225 -8.807
1875 92.850 75.557 150.329 97.292
1876 92.419 43.344 138.600 -82.503
1877 91.430 45.919 128.851 -44.728
1878 92.378 54.034 154.091 -7.208
1879 91.312 54.343 150.397-140.363
1880 92.003 64.679 103.149-108.449
1881 93.275 157.961 132.274 -0.296
1882 94.140 123.774 0.000 0.000
1883 132.583 -60.798 0.000 0.000
1884 111.826 -38.382 123.031-133.629
1885 91.487 90.605 113.218 -74.444
1886 91.935 -17.793 103.758 -76.743
1887 111.493 -30.081 0.000 0.000
1888 133.866 -77.654 107.272 -61.821
1889 118.117-109.972 119.312-123.571
1890 117.839-137.027 118.750-122.212
1891 93.209 58.396 128.450-151.230
1892 93.333 0.000 115.723 -76.542
1893 # 91 total E -2.01493E+02 rmsd from N 0.000 %NC 0.00 0
1894 93.640 48.425 108.834 -80.064
1895 92.547 165.059 176.422-163.868
1896 92.054 76.497 169.728 14.159
1897 92.131 44.885 102.558 -67.051
1898 91.320 46.926 121.953 -56.061
1899 92.347 47.058 149.824 -31.815
1900 91.677 53.980 159.448-179.765
1901 91.891 72.305 104.167 -91.596
1902 93.150 73.462 150.645 2.863
1903 95.237 61.089 0.000 0.000
1904 124.977-135.158 0.000 0.000
1905 121.590 120.123 123.053-128.482
1906 127.315 -94.492 116.299 -72.660
1907 93.868 55.241 113.414 -76.013
1908 95.203 79.259 0.000 0.000
1909 123.796 -84.880 123.089 -44.173
1910 116.859-105.009 122.985-131.268
1911 118.036-139.499 114.499-115.992
1912 93.197 57.857 128.309-151.932
1913 93.332 0.000 115.783 -76.510
1914 # 92 total E -1.98804E+02 rmsd from N 0.000 %NC 0.00 0
1915 93.639 49.481 109.164 -80.040
1916 92.493 161.208 164.163 165.162
1917 92.526 75.286 166.422 9.913
1918 92.494 44.807 98.491 -78.370
1919 91.506 48.548 123.630 -66.116
1920 92.557 49.473 154.820 -14.994
1921 91.661 57.984 160.706 169.505
1922 92.531 81.808 106.950-103.311
1923 93.724-113.596 130.392 -34.900
1924 94.792 151.665 0.000 0.000
1925 138.055 -80.580 0.000 0.000
1926 118.480 -96.582 107.989-112.655
1927 93.512 75.168 112.838 -74.577
1928 126.345 -87.143 122.206 -81.852
1929 95.284 161.706 0.000 0.000
1930 130.352 -87.705 92.541 -61.074
1931 117.200-106.751 126.616-135.458
1932 118.450-137.161 109.336-109.500
1933 93.144 57.333 97.734-107.031
1934 93.337 0.000 115.174 -77.596
1935 # 93 total E -2.00257E+02 rmsd from N 0.000 %NC 0.00 0
1936 93.615 48.480 144.352-132.923
1937 92.660 172.796 147.309 -5.325
1938 92.682 73.842 149.253 98.893
1939 92.108 48.605 141.613 -83.820
1940 91.233 41.549 124.931 -41.983
1941 92.272 49.217 153.127 -23.478
1942 91.511 58.481 146.371-137.725
1943 91.732 68.458 107.818-101.808
1944 92.892 95.441 138.892 -6.384
1945 94.876 97.936 0.000 0.000
1946 130.179 -61.682 0.000 0.000
1947 117.680 -77.067 118.814-125.002
1948 93.556 77.879 112.872 -74.517
1949 122.187 -97.784 121.310 -80.927
1950 126.821-166.291 0.000 0.000
1951 127.857 -80.362 149.272-140.310
1952 118.171-109.443 117.130-124.714
1953 118.068-138.694 113.405-115.851
1954 92.962 51.308 106.238-116.524
1955 93.358 0.000 117.045 -79.114
1956 # 94 total E -2.09273E+02 rmsd from N 0.000 %NC 0.00 0
1957 93.659 122.786 109.014 -81.153
1958 118.969-117.679 147.216 -32.015
1959 92.461 55.811 133.262 108.707
1960 92.156 44.376 141.619 -87.266
1961 91.457 43.084 131.467 -55.062
1962 92.317 56.426 153.663 -3.905
1963 91.444 43.297 150.540-134.834
1964 92.957 71.740 94.414-102.328
1965 93.947 -93.685 136.217 -17.880
1966 94.619 155.656 0.000 0.000
1967 135.746 -52.158 0.000 0.000
1968 92.383 61.627 100.301 -99.410
1969 92.728 48.311 105.210 -73.373
1970 93.610 49.972 105.816 -81.433
1971 95.003 66.920 0.000 0.000
1972 122.830 -77.466 137.916-164.546
1973 118.015-108.051 115.234-120.153
1974 117.902-137.735 117.262-120.884
1975 93.134 57.819 102.079-103.369
1976 93.334 0.000 115.862 -76.660
1977 # 95 total E -2.11284E+02 rmsd from N 0.000 %NC 0.00 0
1978 93.662 122.714 108.848 -80.955
1979 118.334-118.176 153.415 -33.352
1980 92.638 53.313 142.844 103.067
1981 92.245 44.212 125.129 -71.698
1982 91.551 43.655 139.903-150.003
1983 92.337 43.265 147.835 -32.102
1984 91.379 55.864 155.361-167.723
1985 91.851 75.454 85.787 -63.068
1986 93.279 101.967 135.370 -1.779
1987 128.379 -17.566 0.000 0.000
1988 125.779 -70.514 0.000 0.000
1989 110.901 -52.017 97.816 -86.869
1990 89.815 76.996 112.557 -74.439
1991 90.730 1.205 110.508 -76.293
1992 102.531 -70.650 0.000 0.000
1993 130.057 -45.113 139.864 170.343
1994 120.640-146.255 104.507-107.400
1995 118.825-113.228 112.466-113.029
1996 93.051 61.928 103.661-112.393
1997 93.335 0.000 115.185 -76.691
1998 # 96 total E -2.01693E+02 rmsd from N 0.000 %NC 0.00 0
1999 93.636 47.776 109.515 -80.999
2000 92.609 170.400 149.269 -10.046
2001 92.850 74.458 152.915 96.572
2002 92.381 44.198 135.183 -79.010
2003 91.416 45.147 127.267 -40.321
2004 92.395 49.406 153.714 -21.708
2005 91.569 54.903 151.258-144.286
2006 91.840 78.104 105.540-102.596
2007 92.805 75.652 133.873 -6.090
2008 96.823 80.471 0.000 0.000
2009 133.805 -96.917 0.000 0.000
2010 116.075 -55.506 123.569-131.994
2011 90.100 74.036 112.546 -74.301
2012 90.931 4.093 111.825 -76.302
2013 105.568 -58.572 0.000 0.000
2014 134.074 -64.880 158.695 -32.793
2015 119.864-112.708 105.391-105.864
2016 116.994-131.995 122.400-129.369
2017 117.246-115.838 135.342-149.095
2018 121.604 0.000 121.483 -79.772
2019 # 97 total E -2.12703E+02 rmsd from N 0.000 %NC 0.00 0
2020 93.641 49.093 109.229 -80.080
2021 92.504 161.357 163.482 163.575
2022 92.501 79.872 165.581 20.180
2023 92.266 43.230 101.632 -81.687
2024 91.307 51.067 124.401 -72.233
2025 92.318 47.466 151.351 -27.349
2026 91.552 61.251 161.518 179.861
2027 92.170 63.430 110.706-105.747
2028 93.723 136.305 135.923 -3.853
2029 130.227 -68.161 0.000 0.000
2030 127.851 -48.237 0.000 0.000
2031 107.202 -29.481 127.251-142.838
2032 91.460 98.180 113.226 -74.472
2033 91.643 -20.869 104.874 -77.106
2034 106.794 -46.030 0.000 0.000
2035 129.399 -62.980 104.164 -62.001
2036 118.630-110.971 125.728-131.511
2037 117.676-137.891 116.564-119.624
2038 93.191 58.327 128.128-152.031
2039 93.334 0.000 115.482 -76.754
2040 # 98 total E -1.98867E+02 rmsd from N 0.000 %NC 0.00 0
2041 93.638 49.348 109.181 -80.047
2042 92.505 161.387 163.752 162.186
2043 92.409 79.379 166.242 18.514
2044 92.225 43.290 100.401 -78.526
2045 91.319 49.284 134.814-113.243
2046 92.100 44.319 142.061 -36.346
2047 91.576 57.502 162.424 178.240
2048 91.534 84.177 91.686 -67.097
2049 93.100 35.382 140.155 -10.885
2050 94.927 63.369 0.000 0.000
2051 126.207 -35.098 0.000 0.000
2052 92.492 65.094 127.872-150.756
2053 92.608 2.811 103.995 -75.009
2054 110.149 -84.600 112.686 -78.756
2055 136.416 -41.914 0.000 0.000
2056 128.799 -80.495 87.427 -65.570
2057 117.113-109.869 126.317-135.791
2058 118.058-117.322 108.788-108.517
2059 117.718-115.823 124.550-132.403
2060 121.613 0.000 121.483 -79.847
2061 # 99 total E -2.09065E+02 rmsd from N 0.000 %NC 0.00 0
2062 93.659 122.701 108.930 -81.119
2063 118.666-118.428 149.314 -32.516
2064 92.548 54.505 136.671 107.291
2065 92.077 45.994 134.857 -79.294
2066 91.435 42.142 126.824 -47.133
2067 92.582 46.127 153.990 -23.973
2068 91.526 56.052 150.928-146.038
2069 91.901 89.821 106.740 -94.582
2070 93.236 36.465 138.687 -6.644
2071 95.331 71.191 0.000 0.000
2072 131.994 -60.033 0.000 0.000
2073 92.874 67.221 101.822-109.445
2074 93.154 40.945 107.671 -76.236
2075 93.885 53.589 108.727 -83.680
2076 94.763 65.763 0.000 0.000
2077 122.341 -76.445 139.287-168.102
2078 117.967-107.937 115.490-120.649
2079 117.921-137.766 117.223-120.786
2080 93.130 57.848 101.955-103.432
2081 93.333 0.000 115.853 -76.653
2082 # 100 total E -2.01405E+02 rmsd from N 0.000 %NC 0.00 0
2083 93.639 48.964 108.993 -79.993
2084 92.517 162.568 168.155 171.553
2085 92.304 77.583 167.363 14.970
2086 92.200 44.465 98.916 -73.504
2087 91.314 49.192 125.719 -66.870
2088 92.263 49.342 150.150 -34.026
2089 91.582 56.366 159.986 176.487
2090 91.872 68.456 107.427 -98.195
2091 92.979 88.169 148.706 12.858
2092 94.554 61.018 0.000 0.000
2093 123.057 -50.712 0.000 0.000
2094 117.061-140.506 122.732-130.490
2095 129.808-168.093 156.419-149.259
2096 119.107 -72.598 123.824 -79.828
2097 95.230 57.358 0.000 0.000
2098 130.470 -99.081 104.936 -54.575
2099 117.013-106.905 125.453-133.659
2100 118.191-139.840 114.172-114.769
2101 93.263 75.430 101.057-105.295
2102 93.299 0.000 111.104 -72.729
2103 # 101 total E -2.02975E+02 rmsd from N 0.000 %NC 0.00 0
2104 93.640 50.168 109.377 -80.157
2105 92.498 159.509 160.763 161.523
2106 92.786 81.802 164.282 20.610
2107 92.717 41.150 100.601 -82.222
2108 91.619 59.375 114.224 -83.984
2109 92.865 56.126 146.164 -27.839
2110 92.613 114.392 157.312-157.933
2111 91.214 -28.032 135.706-144.387
2112 90.676 -57.903 103.747 -59.208
2113 93.586 13.367 0.000 0.000
2114 113.190 -56.278 0.000 0.000
2115 94.634 -29.210 98.140 -98.856
2116 93.660 100.922 112.844 -75.426
2117 128.244-126.450 120.817 -81.812
2118 131.879-110.003 0.000 0.000
2119 127.007 -85.109 152.290-178.963
2120 118.015-108.473 116.466-123.567
2121 118.011-137.007 116.731-119.787
2122 93.154 57.923 102.067-103.686
2123 93.334 0.000 115.883 -76.638
2124 # 102 total E -2.03699E+02 rmsd from N 0.000 %NC 0.00 0
2125 93.660 122.781 108.993 -81.146
2126 118.912-118.706 148.579 -31.321
2127 92.544 55.945 134.977 108.374
2128 92.088 45.802 138.356 -83.650
2129 91.388 42.939 129.859 -50.196
2130 92.427 50.459 154.587 -14.769
2131 91.560 56.350 149.319-141.794
2132 92.031 76.690 105.777-104.686
2133 93.397 124.536 129.736 27.389
2134 94.298 53.635 0.000 0.000
2135 123.619 -71.495 0.000 0.000
2136 116.408 -84.403 122.054-129.632
2137 93.138 66.055 113.179 -74.372
2138 94.524 43.484 113.959 -76.877
2139 95.775 82.958 0.000 0.000
2140 128.437 -84.966 123.698 135.164
2141 117.957-107.661 116.269-125.177
2142 117.914-138.075 116.464-119.334
2143 93.126 57.755 102.173-104.148
2144 93.334 0.000 115.874 -76.648
2145 # 103 total E -2.02805E+02 rmsd from N 0.000 %NC 0.00 0
2146 93.630 44.008 111.953 -83.994
2147 92.471 153.087 143.864-173.798
2148 93.491 95.021 124.622 -43.803
2149 92.392 0.187 81.222 -80.375
2150 91.499 -87.880 142.511-112.484
2151 103.939 169.212 85.287-126.044
2152 92.062 74.661 155.665 177.517
2153 93.076 106.793 116.590-130.512
2154 129.014 -8.270 143.995 -31.010
2155 130.771 -28.471 0.000 0.000
2156 127.442 -60.550 0.000 0.000
2157 100.738 -28.160 129.518-150.512
2158 91.409 97.021 113.251 -74.397
2159 91.204 -17.476 113.285 -74.969
2160 100.287 -65.524 0.000 0.000
2161 125.334 -48.407 113.755-127.716
2162 118.183-111.431 123.306-131.677
2163 118.688-139.253 118.450-121.830
2164 93.051 58.214 129.530-151.515
2165 93.334 0.000 115.615 -76.577
2166 # 104 total E -1.99032E+02 rmsd from N 0.000 %NC 0.00 0
2167 93.659 122.804 108.968 -81.144
2168 118.850-117.996 148.357 -32.188
2169 92.510 55.197 135.157 108.410
2170 92.070 45.547 137.663 -83.068
2171 91.361 43.012 129.217 -49.669
2172 92.315 48.763 154.761 -16.365
2173 91.404 55.813 149.356-142.055
2174 92.085 67.961 106.286-102.445
2175 93.052 67.349 138.226 -15.998
2176 127.317 10.266 0.000 0.000
2177 130.463 -31.424 0.000 0.000
2178 92.706 71.952 100.969-104.796
2179 92.331 17.599 106.237 -74.263
2180 109.554-108.642 104.802 -84.986
2181 95.876 157.854 0.000 0.000
2182 129.424 -99.233 100.356 -56.656
2183 117.215-107.032 125.719-134.314
2184 118.208-137.846 110.388-110.737
2185 93.116 58.037 103.072-112.392
2186 93.333 0.000 115.823 -76.587
2187 # 105 total E -2.01908E+02 rmsd from N 0.000 %NC 0.00 0
2188 93.640 49.414 109.072 -80.011
2189 92.511 161.976 165.917 166.841
2190 92.378 78.318 166.680 16.825
2191 92.223 44.076 99.765 -76.788
2192 91.330 49.500 123.496 -68.111
2193 92.387 47.626 150.533 -30.361
2194 91.697 58.713 160.881 177.335
2195 92.249 82.130 108.598-100.116
2196 93.304 121.501 137.824 -7.710
2197 119.481 19.430 0.000 0.000
2198 124.347 -57.835 0.000 0.000
2199 117.110 -75.657 120.848-126.994
2200 92.773 67.401 113.712 -74.579
2201 94.159 44.017 113.825 -76.698
2202 95.702 80.869 0.000 0.000
2203 126.616 -85.058 144.376-159.505
2204 117.964-107.629 117.335-124.947
2205 117.952-137.996 116.319-119.191
2206 93.123 57.723 102.144-104.076
2207 93.333 0.000 115.861 -76.647
2208 # 106 total E -2.04999E+02 rmsd from N 0.000 %NC 0.00 0
2209 93.639 49.389 109.204 -80.056
2210 92.504 161.161 163.449 163.793
2211 92.516 79.821 165.563 19.725
2212 92.280 43.457 101.201 -81.136
2213 91.331 50.839 124.303 -72.846
2214 92.313 48.929 150.934 -27.132
2215 91.585 57.516 161.585 175.986
2216 91.874 70.313 107.551-104.058
2217 93.011 77.516 133.298 -3.420
2218 94.376 104.152 0.000 0.000
2219 137.477 -32.867 0.000 0.000
2220 107.896 -24.258 123.513-136.104
2221 92.673 92.300 113.313 -74.451
2222 91.444 -25.133 104.049 -74.482
2223 104.358 -92.379 0.000 0.000
2224 126.436-107.727 106.519 -51.436
2225 116.960-106.430 127.353-136.781
2226 118.128-137.716 110.661-111.101
2227 93.132 58.058 102.782-110.394
2228 93.333 0.000 115.833 -76.565
2229 # 107 total E -2.03369E+02 rmsd from N 0.000 %NC 0.00 0
2230 93.638 48.316 109.529 -80.614
2231 92.601 82.346 157.904 172.340
2232 93.793 113.150 125.484 -40.042
2233 125.257 -93.008 95.546 -92.849
2234 91.304 66.285 119.440 -96.822
2235 92.162 63.960 152.308 -7.568
2236 91.494 46.318 140.171 -54.871
2237 92.914 70.783 94.371-112.423
2238 94.031 -96.483 136.193 -17.660
2239 94.748 157.779 0.000 0.000
2240 134.615 -59.576 0.000 0.000
2241 92.489 56.553 101.358 -97.404
2242 92.898 48.032 114.989 -79.037
2243 93.697 49.385 106.178-113.562
2244 95.036 67.643 0.000 0.000
2245 123.078 -77.885 138.177-166.426
2246 118.031-108.076 115.253-120.164
2247 117.864-137.724 117.347-121.022
2248 93.144 57.765 101.953-102.994
2249 93.333 0.000 115.860 -76.690
2250 # 108 total E -2.06280E+02 rmsd from N 0.000 %NC 0.00 0
2251 93.659 122.820 109.044 -81.095
2252 119.120-116.377 148.424 -31.073
2253 92.467 56.846 133.725 107.416
2254 92.111 43.278 137.580 -82.297
2255 91.528 44.579 140.086-158.867
2256 92.367 49.802 150.248 3.752
2257 91.949 59.863 150.877-134.065
2258 92.943 136.037 107.078 119.149
2259 118.354 -63.521 134.983 -37.727
2260 127.166 -15.017 0.000 0.000
2261 129.538 -62.852 0.000 0.000
2262 102.224 -29.527 126.753-144.655
2263 91.098 95.102 112.920 -74.194
2264 91.103 -15.750 110.545 -75.960
2265 101.673 -63.411 0.000 0.000
2266 126.196 -48.437 155.166 -45.423
2267 119.183-142.688 117.773-123.185
2268 119.712-114.535 108.530-106.016
2269 92.975 62.130 104.679-119.132
2270 93.331 0.000 114.751 -76.771
2271 # 109 total E -2.06971E+02 rmsd from N 0.000 %NC 0.00 0
2272 93.639 49.288 109.169 -80.052
2273 92.497 161.293 164.423 166.620
2274 92.473 77.519 166.256 14.294
2275 92.488 42.258 98.819 -77.357
2276 91.510 49.800 142.698-121.928
2277 92.310 45.841 139.019 -55.001
2278 91.923 57.974 166.519-169.121
2279 93.004 115.794 99.923 114.777
2280 115.867 -94.417 140.536 -23.082
2281 94.877 56.890 0.000 0.000
2282 95.382 40.509 0.000 0.000
2283 92.626 46.307 86.773-100.792
2284 91.921 48.414 109.577 -85.140
2285 93.161 47.407 108.255-118.234
2286 95.011 67.488 0.000 0.000
2287 122.977 -77.915 137.553-171.896
2288 118.005-107.989 115.117-119.789
2289 117.936-137.815 117.246-120.873
2290 93.127 57.797 102.269-103.817
2291 93.333 0.000 115.868 -76.658
2292 # 110 total E -2.12233E+02 rmsd from N 0.000 %NC 0.00 0
2293 93.638 48.935 109.114 -80.019
2294 92.509 161.902 165.327 165.011
2295 92.335 78.280 166.763 16.905
2296 92.228 43.106 100.311 -77.510
2297 91.298 49.001 141.823-123.080
2298 92.074 42.148 140.811 -44.535
2299 91.513 57.640 162.097-179.221
2300 91.855 74.262 88.675 -58.904
2301 93.351 101.270 136.336 13.978
2302 128.212 -14.435 0.000 0.000
2303 125.930 -71.555 0.000 0.000
2304 111.069 -53.163 98.035 -88.031
2305 89.758 75.985 112.220 -74.189
2306 90.682 2.301 110.956 -76.246
2307 102.977 -70.587 0.000 0.000
2308 128.629 -44.130 153.414 52.597
2309 122.146-163.082 110.842-115.883
2310 92.838 117.623 103.341-103.110
2311 93.510 97.812 86.945 -94.227
2312 93.358 0.000 115.421 -71.601
2313 # 111 total E -2.09537E+02 rmsd from N 0.000 %NC 0.00 0
2314 93.639 49.414 109.187 -80.049
2315 92.504 161.518 163.624 161.555
2316 92.397 79.250 166.326 18.511
2317 92.210 43.390 100.199 -78.177
2318 91.315 48.903 132.795-109.026
2319 92.099 44.209 142.168 -37.144
2320 91.540 56.928 162.450 176.965
2321 91.506 80.155 93.255 -68.015
2322 93.043 38.400 138.394 -7.016
2323 95.113 66.030 0.000 0.000
2324 128.928 -46.618 0.000 0.000
2325 92.403 69.563 99.935-103.818
2326 92.456 25.529 104.615 -74.009
2327 95.417-113.716 111.340 -82.264
2328 95.932 155.806 0.000 0.000
2329 128.866-104.405 104.396 -52.945
2330 117.340-106.935 126.508-135.154
2331 118.185-137.658 110.891-111.409
2332 93.129 58.008 102.867-110.333
2333 93.333 0.000 115.822 -76.604
2334 # 112 total E -2.11030E+02 rmsd from N 0.000 %NC 0.00 0
2335 93.630 48.869 112.618 -83.715
2336 92.049 83.325 132.005 141.668
2337 91.948 67.944 166.496 15.330
2338 91.879 43.767 92.492 -72.000
2339 91.146 48.205 123.374 -55.523
2340 92.098 46.423 150.143 -32.105
2341 91.512 58.034 162.366-170.037
2342 92.113 62.845 108.175 -95.566
2343 93.343 104.876 137.549 18.178
2344 129.802 -13.169 0.000 0.000
2345 125.870 -69.730 0.000 0.000
2346 112.441 -52.853 114.060-119.675
2347 89.610 75.149 112.330 -74.258
2348 90.810 2.922 110.443 -76.461
2349 102.677 -72.192 0.000 0.000
2350 128.034 -45.836 156.529 49.412
2351 122.277-162.166 116.807-121.814
2352 92.830 115.513 103.895 -97.540
2353 93.362 26.669 90.557 -96.433
2354 93.355 0.000 118.022 -76.325
2355 # 113 total E -2.09854E+02 rmsd from N 0.000 %NC 0.00 0
2356 93.639 49.389 109.190 -80.054
2357 92.505 161.613 163.562 162.275
2358 92.433 79.432 165.954 19.551
2359 92.207 43.268 100.585 -79.047
2360 91.321 49.685 135.549-116.655
2361 92.139 45.228 142.375 -32.168
2362 91.679 59.256 162.522 178.045
2363 91.735 85.668 90.617 -69.341
2364 93.148 71.451 128.646 30.411
2365 95.132 80.792 0.000 0.000
2366 130.958 -80.688 0.000 0.000
2367 130.570 101.888 115.004-111.639
2368 92.519 -36.713 124.090 -14.685
2369 91.046 -42.890 114.745 -76.238
2370 94.009 76.092 0.000 0.000
2371 129.529-122.541 121.261 -36.013
2372 116.799-105.359 123.579-133.094
2373 117.164-141.040 112.708-114.031
2374 93.241 57.669 130.908-157.267
2375 93.332 0.000 115.878 -76.445
2376 # 114 total E -2.00440E+02 rmsd from N 0.000 %NC 0.00 0
2377 93.639 49.644 109.192 -80.060
2378 92.502 161.101 163.563 164.411
2379 92.522 79.785 165.739 19.063
2380 92.316 43.145 100.510 -80.127
2381 91.403 51.340 124.781 -74.069
2382 92.400 50.136 150.060 -30.556
2383 91.808 56.556 162.317-178.354
2384 92.679 91.070 106.613-103.985
2385 93.636 -82.653 97.709 -69.058
2386 94.439 166.392 0.000 0.000
2387 135.774 -50.807 0.000 0.000
2388 109.644 -29.833 127.034-141.114
2389 91.765 94.371 112.928 -74.320
2390 91.855 -20.989 104.003 -76.751
2391 110.453 -35.249 0.000 0.000
2392 132.429 -72.764 80.186 -67.368
2393 117.143-111.826 123.643-130.517
2394 118.115-115.887 114.982-116.657
2395 117.700-115.808 123.672-131.199
2396 121.611 0.000 121.473 -79.847
2397 # 115 total E -2.09451E+02 rmsd from N 0.000 %NC 0.00 0
2398 93.634 50.033 111.256 -81.966
2399 92.070 75.801 144.053-137.373
2400 92.500 52.681 131.707 110.090
2401 92.415 43.436 144.068 -86.565
2402 91.439 43.543 132.352 -60.752
2403 92.286 57.572 152.916 -3.796
2404 91.451 43.086 150.509-131.177
2405 92.984 72.809 93.863-103.350
2406 93.893 -93.143 136.383 -17.316
2407 94.651 155.650 0.000 0.000
2408 135.685 -53.530 0.000 0.000
2409 92.388 61.592 100.407 -99.830
2410 92.742 48.171 105.567 -74.061
2411 93.612 50.170 105.799 -81.353
2412 95.002 67.074 0.000 0.000
2413 122.841 -77.588 137.939-164.702
2414 118.026-108.065 115.228-120.134
2415 117.901-137.701 117.274-120.901
2416 93.135 57.847 102.075-103.358
2417 93.334 0.000 115.861 -76.660
2418 # 116 total E -2.00028E+02 rmsd from N 0.000 %NC 0.00 0
2419 93.640 49.660 109.262 -80.086
2420 92.494 160.468 162.457 163.013
2421 92.580 81.025 164.986 21.827
2422 92.310 42.589 101.616 -82.459
2423 91.395 51.953 124.403 -74.971
2424 92.361 49.170 150.106 -29.909
2425 91.785 55.520 163.438-172.060
2426 92.882 82.004 106.063-103.421
2427 93.534 -95.845 101.697 -66.083
2428 94.305 132.733 0.000 0.000
2429 133.726 -57.558 0.000 0.000
2430 117.157-131.044 130.073-139.691
2431 125.208-124.488 129.983 -24.725
2432 93.785 57.086 113.896 -79.115
2433 95.181 75.944 0.000 0.000
2434 124.772 -81.891 88.149 -64.819
2435 116.578-106.204 125.086-133.912
2436 118.173-139.282 110.555-110.963
2437 93.083 57.735 104.710-111.462
2438 93.333 0.000 115.857 -76.577
2439 # 117 total E -2.00960E+02 rmsd from N 0.000 %NC 0.00 0
2440 93.639 49.174 109.151 -80.033
2441 92.505 161.649 164.382 163.295
2442 92.369 78.886 166.426 18.140
2443 92.177 43.311 100.267 -77.963
2444 91.284 48.718 137.816-116.856
2445 92.002 43.186 141.731 -38.105
2446 91.417 53.883 162.304 176.658
2447 91.228 72.300 88.396 -61.642
2448 92.301 44.568 133.589 6.438
2449 94.560 49.411 0.000 0.000
2450 95.023 43.761 0.000 0.000
2451 92.798 43.717 95.886 -99.797
2452 93.329 96.576 107.602 -85.633
2453 92.619 -12.984 126.741-162.203
2454 102.856 -82.557 0.000 0.000
2455 122.085-115.368 110.735 -45.691
2456 116.829-106.349 123.250-130.783
2457 118.155-137.742 111.049-111.828
2458 93.131 57.978 102.844-109.971
2459 93.333 0.000 115.862 -76.571
2460 # 118 total E -2.09662E+02 rmsd from N 0.000 %NC 0.00 0
2461 93.639 49.309 109.148 -80.035
2462 92.504 161.665 164.366 163.267
2463 92.361 78.804 166.464 18.129
2464 92.164 43.315 100.163 -77.809
2465 91.278 48.540 137.317-115.594
2466 91.991 43.070 141.758 -37.928
2467 91.385 52.995 162.402 176.336
2468 91.172 69.767 88.193 -61.266
2469 92.260 43.920 134.104 5.653
2470 94.429 49.165 0.000 0.000
2471 94.921 41.799 0.000 0.000
2472 92.183 46.298 95.173 -98.381
2473 91.884 49.455 110.354 -84.069
2474 92.977 47.833 108.797-120.276
2475 94.993 67.204 0.000 0.000
2476 122.332 -78.016 137.539-166.359
2477 118.030-108.048 115.058-119.698
2478 117.934-137.676 117.253-120.897
2479 93.133 57.826 102.180-103.672
2480 93.334 0.000 115.864 -76.656
2481 # 119 total E -2.00749E+02 rmsd from N 0.000 %NC 0.00 0
2482 93.638 47.407 108.954 -80.555
2483 92.491 166.052 165.095 -21.766
2484 92.613 74.847 174.980 16.189
2485 92.080 44.823 108.201 -56.840
2486 91.247 45.498 121.968 -44.791
2487 92.149 43.763 148.509 -41.189
2488 91.331 56.284 156.216-160.997
2489 91.428 79.804 106.441 -84.306
2490 92.309 39.480 136.097 5.970
2491 94.145 52.840 0.000 0.000
2492 94.147 49.601 0.000 0.000
2493 91.731 50.169 98.021-110.193
2494 92.342 51.671 104.236 -81.187
2495 94.978-102.419 109.860 -84.025
2496 95.425 155.680 0.000 0.000
2497 129.498 -84.286 86.466 -64.315
2498 116.749-106.848 125.897-134.875
2499 118.438-119.494 109.786-109.937
2500 117.826-115.777 120.061-124.783
2501 121.615 0.000 121.417 -79.897
2502 # 120 total E -2.05455E+02 rmsd from N 0.000 %NC 0.00 0
2503 93.639 49.202 109.231 -80.059
2504 92.501 161.300 162.812 162.785
2505 92.541 79.706 165.078 21.089
2506 92.279 42.777 101.596 -82.334
2507 91.279 50.839 125.381 -74.230
2508 92.236 47.162 151.562 -28.771
2509 91.443 63.959 163.228 175.476
2510 92.047 60.944 113.263-107.908
2511 93.682 109.737 160.355 -15.535
2512 127.632 -77.515 0.000 0.000
2513 125.735 -60.342 0.000 0.000
2514 91.701 52.967 101.276-105.364
2515 92.697 26.984 108.751 -74.156
2516 105.525 -87.532 144.674 -41.772
2517 126.900 0.311 0.000 0.000
2518 132.515 -80.248 121.324 -53.240
2519 118.981-105.036 124.890-131.056
2520 117.328-138.624 116.463-119.316
2521 93.264 58.140 126.538-150.796
2522 93.333 0.000 115.701 -76.573
2523 # 121 total E -2.03827E+02 rmsd from N 0.000 %NC 0.00 0
2524 93.627 41.502 111.276 -84.509
2525 92.529 157.040 142.714-174.242
2526 93.671 95.301 124.624 -43.357
2527 92.214 -0.691 82.276 -81.370
2528 91.450 -87.493 141.033-112.009
2529 102.895 171.366 84.367-121.363
2530 91.987 74.498 157.927 173.346
2531 92.726 60.108 114.030-129.152
2532 93.958-179.953 131.997 -10.247
2533 94.237 118.690 0.000 0.000
2534 132.742 -62.820 0.000 0.000
2535 112.277 -40.829 122.548-132.653
2536 91.364 88.967 113.194 -74.458
2537 91.851 -15.363 103.091 -74.153
2538 111.747 -31.808 0.000 0.000
2539 133.584 -76.442 109.976 -60.806
2540 118.224-109.995 119.720-123.804
2541 117.733-137.342 119.030-122.607
2542 93.205 58.365 128.562-151.551
2543 93.334 0.000 115.721 -76.549
2544 # 122 total E -2.11132E+02 rmsd from N 0.000 %NC 0.00 0
2545 93.659 122.722 108.851 -80.958
2546 118.367-118.310 153.453 -33.081
2547 92.634 53.258 142.781 103.123
2548 92.243 44.238 125.192 -71.717
2549 91.556 43.544 139.804-150.079
2550 92.345 43.295 147.830 -32.221
2551 91.382 55.586 155.447-167.852
2552 91.843 76.559 85.809 -62.974
2553 93.315 101.319 134.322 8.131
2554 127.965 -15.995 0.000 0.000
2555 125.883 -71.191 0.000 0.000
2556 111.042 -52.969 98.007 -87.433
2557 89.805 76.527 112.546 -74.427
2558 90.709 1.739 110.793 -76.251
2559 102.891 -70.069 0.000 0.000
2560 128.986 -44.447 140.140 169.915
2561 122.150-161.818 108.771-112.703
2562 92.748 116.091 103.075-104.055
2563 93.514 22.513 84.621 -91.033
2564 93.379 0.000 120.160 -77.521
2565 # 123 total E -2.11624E+02 rmsd from N 0.000 %NC 0.00 0
2566 93.659 122.755 108.977 -81.140
2567 118.847-118.369 148.504 -31.742
2568 92.517 55.434 135.132 108.376
2569 92.086 45.345 137.884 -83.515
2570 91.366 43.438 129.476 -50.030
2571 92.339 49.042 154.821 -14.988
2572 91.422 59.257 148.962-140.991
2573 92.140 63.685 108.487-105.997
2574 93.697 135.904 135.907 -3.011
2575 130.278 -68.304 0.000 0.000
2576 127.845 -48.300 0.000 0.000
2577 107.205 -29.584 127.195-142.747
2578 91.449 98.118 113.225 -74.474
2579 91.645 -20.777 104.833 -77.170
2580 106.753 -46.132 0.000 0.000
2581 129.432 -62.921 104.101 -61.945
2582 118.631-111.017 125.922-131.792
2583 117.676-137.914 116.542-119.581
2584 93.190 58.305 128.145-152.017
2585 93.333 0.000 115.481 -76.754
2586 # 124 total E -2.06465E+02 rmsd from N 0.000 %NC 0.00 0
2587 93.639 49.744 109.449 -80.201
2588 92.496 159.351 159.780 160.333
2589 92.827 81.881 164.385 19.560
2590 92.862 40.293 100.474 -82.641
2591 91.767 59.264 114.050 -92.609
2592 93.014 61.624 140.429 -22.655
2593 92.610 113.213 160.412-162.461
2594 91.067 -28.634 131.356-142.992
2595 90.543 -59.054 102.034 -64.214
2596 93.147 15.056 0.000 0.000
2597 114.154 -57.331 0.000 0.000
2598 97.780 -31.454 97.578 -97.463
2599 93.484 99.546 113.015 -75.240
2600 125.583-114.635 114.907 -82.411
2601 119.017 177.694 0.000 0.000
2602 129.684 -91.777 99.746 -61.057
2603 116.959-106.877 124.029-132.605
2604 118.244-138.157 110.246-110.511
2605 93.124 57.966 104.030-113.459
2606 93.333 0.000 115.834 -76.590
2607 # 125 total E -2.00045E+02 rmsd from N 0.000 %NC 0.00 0
2608 93.638 50.045 109.591 -80.269
2609 92.526 165.668 156.312 141.209
2610 92.737 82.700 156.503 41.503
2611 92.537 43.086 111.451 -98.564
2612 91.406 54.881 129.165 -90.504
2613 92.426 56.469 152.967 -14.658
2614 91.415 77.504 161.172-149.509
2615 91.854 68.668 115.991-135.299
2616 93.688 23.907 139.621 -17.737
2617 121.759 -14.351 0.000 0.000
2618 124.871 -59.530 0.000 0.000
2619 123.187 146.049 118.738-121.144
2620 93.566 80.033 109.182 -80.644
2621 94.300 55.445 125.702-151.960
2622 95.394 73.958 0.000 0.000
2623 123.300 -87.122 89.927 -61.665
2624 117.041-106.598 126.548-135.418
2625 117.917-138.837 110.888-111.488
2626 93.237 47.650 100.192-107.468
2627 93.370 0.000 120.352 -78.801
2628 # 126 total E -2.04653E+02 rmsd from N 0.000 %NC 0.00 0
2629 93.640 49.719 109.261 -80.020
2630 92.502 161.545 164.772 167.985
2631 92.394 76.933 166.814 13.254
2632 92.379 43.640 98.491 -76.885
2633 91.470 47.848 144.002-124.280
2634 92.238 43.277 135.609 -85.497
2635 91.550 57.971 163.524-178.452
2636 92.372 94.100 120.043 154.283
2637 94.476 34.149 135.621 -19.314
2638 143.274 -97.164 0.000 0.000
2639 133.082 -40.091 0.000 0.000
2640 105.879 -29.228 98.560 -95.074
2641 91.719 97.167 112.886 -74.280
2642 91.680 -19.414 105.286 -76.215
2643 106.808 -43.304 0.000 0.000
2644 130.324 -62.323 145.820 61.427
2645 118.620-113.984 113.108-116.352
2646 118.775-137.116 123.995-129.673
2647 93.088 57.895 96.465 -97.866
2648 93.334 0.000 115.638 -76.892
2649 # 127 total E -2.03371E+02 rmsd from N 0.000 %NC 0.00 0
2650 93.659 122.701 108.903 -81.000
2651 118.576-117.379 152.049 -32.310
2652 92.588 53.953 140.666 104.491
2653 92.169 44.636 128.440 -74.367
2654 91.522 42.649 136.651-147.836
2655 92.208 44.993 147.694 -23.189
2656 91.186 51.296 155.448-164.536
2657 91.110 68.836 81.841 -63.933
2658 92.252 43.302 134.095 5.600
2659 94.421 48.591 0.000 0.000
2660 94.881 41.815 0.000 0.000
2661 92.168 46.243 94.772 -98.902
2662 91.885 49.385 110.389 -83.864
2663 92.978 47.951 108.823-120.200
2664 94.999 67.453 0.000 0.000
2665 122.548 -78.118 137.724-166.634
2666 118.025-109.663 115.831-120.927
2667 117.986-118.101 113.481-115.470
2668 117.764-115.833 122.153-127.824
2669 121.616 0.000 121.480 -79.863
2670 # 128 total E -2.09368E+02 rmsd from N 0.000 %NC 0.00 0
2671 93.638 49.446 109.156 -80.040
2672 92.504 161.510 164.172 162.863
2673 92.389 79.082 166.379 18.121
2674 92.216 43.329 100.342 -78.202
2675 91.318 49.105 136.773-115.358
2676 92.111 43.920 141.717 -38.414
2677 91.573 58.100 162.310 178.104
2678 91.568 84.788 91.442 -65.630
2679 93.122 39.134 135.853 -18.904
2680 95.455 70.550 0.000 0.000
2681 130.093 -69.817 0.000 0.000
2682 92.593 66.421 132.443-159.380
2683 93.409 17.082 114.766 -78.497
2684 97.202 -92.721 121.178-141.266
2685 129.218-174.506 0.000 0.000
2686 129.737 -83.328 89.836 -65.414
2687 116.780-107.134 124.258-132.991
2688 118.213-137.878 109.647-109.722
2689 93.117 58.044 103.397-114.511
2690 93.333 0.000 115.832 -76.569
2691 # 129 total E -2.05022E+02 rmsd from N 0.000 %NC 0.00 0
2692 93.639 50.006 109.428 -80.189
2693 92.495 159.318 160.143 160.986
2694 92.833 82.018 164.038 20.769
2695 92.788 40.734 100.748 -82.918
2696 91.667 59.618 113.945 -87.151
2697 92.887 58.166 144.109 -26.464
2698 92.578 113.335 158.489-159.859
2699 90.872 -30.205 133.733-142.176
2700 91.286 -57.344 80.712 -82.815
2701 92.821 13.312 0.000 0.000
2702 116.627 -73.316 0.000 0.000
2703 94.153 40.563 81.980 -69.414
2704 121.380 -66.918 134.316 11.283
2705 92.993 -21.572 115.642 -75.622
2706 95.761 111.744 0.000 0.000
2707 134.874-142.015 126.986 -27.855
2708 117.717-104.687 125.143-133.160
2709 118.257-137.948 109.858-110.046
2710 93.163 58.120 102.681-112.737
2711 93.333 0.000 115.807 -76.566
2712 # 130 total E -2.00102E+02 rmsd from N 0.000 %NC 0.00 0
2713 93.638 49.387 109.119 -80.023
2714 92.508 161.755 165.004 165.407
2715 92.409 78.812 166.362 17.967
2716 92.222 43.629 100.471 -78.624
2717 91.299 49.891 123.759 -69.602
2718 92.272 46.877 150.995 -29.696
2719 91.529 57.745 161.147 177.434
2720 92.100 68.479 108.467-100.283
2721 93.056 66.754 138.084 -16.993
2722 127.003 10.292 0.000 0.000
2723 130.311 -31.055 0.000 0.000
2724 92.716 72.110 100.943-104.723
2725 92.324 17.344 105.897 -74.007
2726 109.449-108.478 104.848 -84.866
2727 95.876 157.944 0.000 0.000
2728 129.402 -99.530 100.579 -56.495
2729 117.220-107.021 125.757-134.364
2730 118.198-137.812 110.406-110.761
2731 93.119 58.016 103.049-112.355
2732 93.334 0.000 115.823 -76.588
2733 # 131 total E -2.05344E+02 rmsd from N 0.000 %NC 0.00 0
2734 93.640 48.441 108.836 -80.066
2735 92.563 165.547 176.437-163.849
2736 91.919 75.814 170.035 13.899
2737 92.066 44.450 102.363 -65.048
2738 91.233 46.925 122.532 -56.122
2739 92.159 43.415 149.119 -38.847
2740 91.328 57.530 159.152-170.363
2741 91.435 80.623 108.021 -86.964
2742 92.299 39.690 132.953 11.393
2743 94.070 50.828 0.000 0.000
2744 94.298 46.089 0.000 0.000
2745 91.827 47.707 97.868-106.439
2746 92.250 54.008 109.825 -86.703
2747 94.378-102.315 109.767-125.067
2748 95.339 153.313 0.000 0.000
2749 129.865 -83.745 87.403 -63.758
2750 116.499-104.748 126.139-135.146
2751 118.617-138.133 111.436-112.106
2752 93.127 57.517 103.164-107.900
2753 93.335 0.000 115.894 -76.765
2754 # 132 total E -2.04968E+02 rmsd from N 0.000 %NC 0.00 0
2755 93.638 48.471 109.504 -80.551
2756 92.589 83.205 157.584 171.274
2757 93.746 112.703 125.586 -40.098
2758 124.865 -92.955 94.370 -92.139
2759 91.231 69.135 121.005 -94.649
2760 92.320 55.740 152.392 -23.001
2761 91.523 62.541 135.551 -60.655
2762 92.290 65.527 108.942-120.053
2763 93.703 138.583 136.308 -6.357
2764 130.130 -67.118 0.000 0.000
2765 128.130 -46.810 0.000 0.000
2766 107.195 -28.960 127.475-143.249
2767 91.510 98.536 113.233 -74.467
2768 91.638 -21.123 105.028 -76.871
2769 107.037 -45.941 0.000 0.000
2770 128.922 -63.198 104.592 -61.884
2771 118.561-110.717 125.472-131.188
2772 117.650-137.984 116.905-120.131
2773 93.192 58.311 128.179-152.132
2774 93.333 0.000 115.493 -76.737
2775 # 133 total E -2.05480E+02 rmsd from N 0.000 %NC 0.00 0
2776 93.641 47.489 108.115 -79.547
2777 92.739 157.919 144.360-109.845
2778 132.084 -95.773 105.449 -99.287
2779 93.772 44.042 166.088-177.082
2780 91.563 43.412 133.195 -72.868
2781 92.445 52.379 154.506 -16.755
2782 91.268 57.472 136.404-116.845
2783 92.204 65.222 107.033-107.118
2784 93.344 104.153 137.915 4.097
2785 130.034 -15.798 0.000 0.000
2786 125.874 -71.061 0.000 0.000
2787 110.303 -50.519 97.612 -87.241
2788 89.937 78.004 112.603 -74.444
2789 90.829 0.477 109.916 -76.401
2790 102.357 -70.852 0.000 0.000
2791 129.633 -45.331 138.898 170.288
2792 120.990-146.361 107.705-108.864
2793 118.775-113.482 112.973-113.983
2794 93.049 61.844 104.204-113.437
2795 93.335 0.000 115.207 -76.687
2796 # 134 total E -2.00592E+02 rmsd from N 0.000 %NC 0.00 0
2797 93.633 50.169 111.582 -82.208
2798 92.475 89.042 137.249 139.514
2799 93.913 106.510 166.285 2.470
2800 126.300-101.132 111.573 -87.739
2801 91.346 67.275 121.988-129.569
2802 92.139 68.337 140.466 -37.947
2803 91.700 57.599 114.951 -71.442
2804 92.204 98.274 98.981 -94.362
2805 93.233 70.032 128.744 31.682
2806 95.109 80.876 0.000 0.000
2807 130.576 -80.445 0.000 0.000
2808 130.646 101.253 114.928-111.482
2809 92.516 -36.765 124.137 -14.504
2810 91.042 -42.889 114.753 -76.235
2811 94.017 75.845 0.000 0.000
2812 129.669-120.828 121.259 -36.540
2813 116.886-105.743 125.063-135.242
2814 117.480-140.625 112.907-114.023
2815 93.227 57.769 131.466-157.353
2816 93.333 0.000 115.860 -76.444
2817 # 135 total E -2.02686E+02 rmsd from N 0.000 %NC 0.00 0
2818 93.639 49.427 109.192 -80.055
2819 92.493 160.875 163.611 163.929
2820 92.486 78.155 166.197 15.680
2821 92.365 43.032 100.306 -80.303
2822 91.370 50.051 126.210 -73.627
2823 92.216 50.936 151.389 -26.232
2824 91.617 54.716 162.830 166.398
2825 92.157 78.023 105.352-104.413
2826 93.522 15.855 138.593 -17.143
2827 126.090-147.850 0.000 0.000
2828 94.687 65.570 0.000 0.000
2829 92.195 60.558 100.117-109.363
2830 92.054 48.470 105.742 -81.095
2831 93.168 51.086 112.651-117.502
2832 94.902 68.168 0.000 0.000
2833 122.279 -73.652 137.244-164.742
2834 118.020-107.469 115.255-120.088
2835 118.068-136.204 117.134-120.676
2836 93.137 58.357 99.276-101.675
2837 93.333 0.000 115.743 -76.578
2838 # 136 total E -2.02620E+02 rmsd from N 0.000 %NC 0.00 0
2839 93.639 49.303 109.182 -80.054
2840 92.496 161.171 164.285 166.052
2841 92.477 77.527 166.248 14.112
2842 92.488 42.284 98.801 -77.387
2843 91.513 49.792 142.662-121.890
2844 92.312 45.884 138.992 -55.171
2845 91.924 57.956 166.491-169.395
2846 93.002 115.864 99.938 114.793
2847 115.832 -94.451 140.510 -23.106
2848 94.875 56.907 0.000 0.000
2849 95.380 40.516 0.000 0.000
2850 92.628 46.307 86.785-100.783
2851 91.931 48.372 109.593 -85.232
2852 93.165 47.607 108.175-118.155
2853 95.020 67.704 0.000 0.000
2854 123.164 -78.102 137.672-171.968
2855 117.999-109.545 115.898-121.028
2856 117.989-118.652 113.400-115.352
2857 117.739-115.830 122.554-128.400
2858 121.615 0.000 121.478 -79.861
2859 # 137 total E -2.01693E+02 rmsd from N 0.000 %NC 0.00 0
2860 93.633 50.022 111.604 -82.245
2861 92.477 88.935 137.281 139.955
2862 93.942 106.970 166.179 2.452
2863 126.432-101.029 111.833 -88.111
2864 91.344 66.940 121.882-128.097
2865 92.111 65.140 139.375 -47.542
2866 91.551 60.496 113.797 -69.102
2867 92.114 96.163 105.743 -96.648
2868 93.333 36.035 138.576 -7.004
2869 95.341 72.763 0.000 0.000
2870 131.727 -61.050 0.000 0.000
2871 92.887 66.946 101.792-109.395
2872 93.192 40.919 107.927 -76.064
2873 93.884 53.631 108.991 -83.501
2874 94.754 65.789 0.000 0.000
2875 122.311 -76.493 139.180-168.281
2876 117.973-107.955 115.404-120.493
2877 117.927-137.764 117.272-120.865
2878 93.128 57.830 101.968-103.398
2879 93.333 0.000 115.855 -76.658
2880 # 138 total E -1.99807E+02 rmsd from N 0.000 %NC 0.00 0
2881 93.639 49.434 109.394 -80.159
2882 92.498 159.646 160.728 162.067
2883 92.795 81.698 164.285 20.314
2884 92.736 40.850 100.465 -82.227
2885 91.630 59.377 114.181 -85.250
2886 92.861 56.256 144.723 -27.603
2887 92.623 113.327 157.918-156.859
2888 91.094 -28.484 134.954-141.869
2889 90.873 -58.187 89.600 -72.328
2890 92.952 13.675 0.000 0.000
2891 113.104 -64.424 0.000 0.000
2892 95.658 -27.592 99.112 -98.478
2893 93.500 119.294 113.355 -75.413
2894 94.389 119.447 125.218-134.218
2895 135.472-100.092 0.000 0.000
2896 127.592 -92.101 95.905 -59.793
2897 117.063-107.276 125.696-134.368
2898 118.175-137.458 110.513-110.892
2899 93.135 58.159 102.989-111.270
2900 93.333 0.000 115.841 -76.571
2901 # 139 total E -2.02961E+02 rmsd from N 0.000 %NC 0.00 0
2902 93.640 49.527 109.263 -80.081
2903 92.504 160.267 162.819 163.767
2904 92.645 80.428 164.942 19.749
2905 92.605 40.816 100.538 -80.767
2906 91.442 59.869 116.732 -68.937
2907 92.699 49.586 146.971 -33.449
2908 92.559 111.466 154.724-149.054
2909 91.322 -29.675 138.159-133.180
2910 91.206 -58.801 91.913-102.667
2911 93.283 13.598 0.000 0.000
2912 116.938-104.251 0.000 0.000
2913 92.729 35.168 100.806-100.580
2914 94.806 95.405 111.402 -74.710
2915 92.698 -11.023 120.414 -78.244
2916 104.488 -96.061 0.000 0.000
2917 126.190-115.714 112.637 -44.535
2918 116.784-106.624 140.963-158.342
2919 118.113-137.231 111.612-112.715
2920 93.150 58.081 102.268-106.994
2921 93.333 0.000 115.855 -76.578
2922 # 140 total E -2.03693E+02 rmsd from N 0.000 %NC 0.00 0
2923 93.639 49.616 109.221 -80.010
2924 92.506 158.263 163.205 157.202
2925 92.341 78.475 166.226 18.229
2926 92.175 45.777 101.082 -79.548
2927 91.263 47.856 124.143 -69.929
2928 92.289 50.341 151.792 -24.054
2929 91.679 59.129 155.036 151.903
2930 92.327 93.767 108.080-104.813
2931 94.004 -93.232 130.529 -31.011
2932 131.190 -50.056 0.000 0.000
2933 94.486 70.645 0.000 0.000
2934 92.090 52.804 87.819 -88.627
2935 91.892 50.281 108.955 -80.866
2936 92.816 62.427 109.196-116.589
2937 94.834 75.271 0.000 0.000
2938 120.662 -83.592 91.854 -60.350
2939 117.368-106.946 127.896-136.920
2940 118.092-135.342 111.110-111.838
2941 93.146 58.557 98.418-104.303
2942 93.331 0.000 115.916 -76.314
2943 # 141 total E -1.99552E+02 rmsd from N 0.000 %NC 0.00 0
2944 93.639 49.467 109.228 -80.065
2945 92.500 160.931 162.878 160.624
2946 92.461 79.857 165.784 19.832
2947 92.242 43.319 100.738 -79.585
2948 91.330 49.923 133.840-114.577
2949 92.129 45.063 142.443 -32.041
2950 91.603 60.064 162.316 179.428
2951 91.711 74.141 91.318 -69.847
2952 92.867 84.421 139.728 9.452
2953 94.584 65.260 0.000 0.000
2954 122.147 -89.755 0.000 0.000
2955 121.262 15.643 110.234-112.432
2956 92.045 -53.906 110.597 -74.148
2957 91.153 -2.359 127.578 34.485
2958 123.408 -25.215 0.000 0.000
2959 122.558 -76.946 86.568 -66.232
2960 116.869-108.134 120.900-126.761
2961 118.086-137.633 112.059-113.343
2962 93.121 58.051 103.466-110.940
2963 93.333 0.000 115.823 -76.584
2964 # 142 total E -1.99666E+02 rmsd from N 0.000 %NC 0.00 0
2965 93.639 49.530 109.345 -80.133
2966 92.491 159.496 161.244 162.440
2967 92.708 80.949 164.686 20.163
2968 92.552 41.477 100.397 -81.999
2969 91.558 54.765 130.573 -96.900
2970 92.540 57.819 151.355 -31.601
2971 91.773 69.417 162.728-178.188
2972 92.400 140.119 113.590-124.616
2973 93.400 -69.210 138.406 -24.556
2974 94.939 56.900 0.000 0.000
2975 134.459 -86.210 0.000 0.000
2976 117.247 -84.173 121.275-128.385
2977 93.065 68.137 109.797 -74.312
2978 94.310 49.726 113.871 -76.885
2979 95.623 77.010 0.000 0.000
2980 122.949 -85.249 123.789 148.201
2981 118.122-108.409 119.534-127.393
2982 118.128-137.630 117.089-119.888
2983 93.145 57.802 101.169 -99.848
2984 93.334 0.000 115.877 -76.667
2985 # 143 total E -1.99857E+02 rmsd from N 0.000 %NC 0.00 0
2986 93.640 49.623 109.399 -80.198
2987 92.483 160.097 160.553 165.449
2988 92.904 78.766 164.492 14.638
2989 92.919 40.311 99.228 -83.293
2990 91.895 54.964 126.935 -86.036
2991 93.516 63.069 151.989 9.820
2992 91.845 70.655 168.172-164.967
2993 114.187 -36.773 114.456-126.035
2994 94.519 131.683 139.319 -12.614
2995 131.423 -4.803 0.000 0.000
2996 127.015 -70.197 0.000 0.000
2997 113.768 -54.504 119.539-127.084
2998 89.539 73.312 112.366 -74.267
2999 90.651 4.695 111.684 -76.665
3000 103.735 -69.563 0.000 0.000
3001 129.435 -50.755 162.904 -21.583
3002 119.576-112.568 118.273-123.091
3003 118.790-136.824 122.365-126.081
3004 93.050 58.140 100.622 -99.414
3005 93.333 0.000 115.673 -76.762
3006 # 144 total E -2.01569E+02 rmsd from N 0.000 %NC 0.00 0
3007 93.657 122.384 108.649 -81.143
3008 118.487-116.769 152.825 -36.843
3009 92.630 52.872 142.922 102.846
3010 91.971 44.859 125.292 -74.145
3011 91.295 43.592 128.504 -46.863
3012 92.244 50.044 156.127 -18.841
3013 91.562 58.209 151.760 164.758
3014 92.224 90.761 107.511-104.053
3015 93.889 -92.726 130.005 -31.173
3016 131.355 -51.509 0.000 0.000
3017 94.520 71.176 0.000 0.000
3018 92.126 52.919 87.385 -88.218
3019 91.888 50.312 108.151 -80.475
3020 92.821 63.590 110.136-117.195
3021 94.774 72.073 0.000 0.000
3022 119.484 -85.816 96.127 -56.361
3023 117.235-107.523 129.769-139.473
3024 118.311-135.907 111.095-111.476
3025 93.099 58.683 99.252-103.415
3026 93.334 0.000 115.886 -76.335
3027 # 145 total E -2.02026E+02 rmsd from N 0.000 %NC 0.00 0
3028 93.639 49.407 109.141 -80.033
3029 92.504 161.528 164.453 163.336
3030 92.371 78.765 166.434 17.920
3031 92.194 43.236 100.256 -77.961
3032 91.287 49.052 139.123-118.733
3033 92.023 43.205 141.480 -39.201
3034 91.481 54.802 162.259 178.679
3035 91.384 76.145 87.983 -61.033
3036 92.434 53.116 133.662 4.984
3037 94.496 50.511 0.000 0.000
3038 94.830 66.772 0.000 0.000
3039 114.086 -29.783 115.600-122.462
3040 93.039 72.487 112.117 -75.050
3041 94.230 27.494 119.408-117.529
3042 96.200 78.995 0.000 0.000
3043 124.304 -79.584 136.335-169.174
3044 118.101-108.142 114.911-119.299
3045 117.959-137.626 117.297-120.979
3046 93.137 57.840 102.142-103.595
3047 93.334 0.000 115.867 -76.656
3048 # 146 total E -2.00173E+02 rmsd from N 0.000 %NC 0.00 0
3049 93.644 48.199 108.047 -79.351
3050 92.740 154.743 142.038-100.986
3051 131.934 -94.689 101.081 -98.872
3052 93.721 44.134 164.147-164.571
3053 91.655 43.502 143.271-111.572
3054 92.415 56.456 150.380 10.665
3055 91.787 59.637 139.077-119.697
3056 92.958 136.249 107.470 120.898
3057 117.849 -63.731 134.905 -36.572
3058 127.201 -14.994 0.000 0.000
3059 129.666 -62.689 0.000 0.000
3060 102.354 -29.568 126.532-144.182
3061 91.087 95.054 112.926 -74.201
3062 91.103 -15.729 110.381 -76.033
3063 101.825 -63.085 0.000 0.000
3064 126.233 -48.764 153.161 -46.481
3065 119.207-142.525 116.087-120.110
3066 119.720-114.411 108.611-106.239
3067 92.975 62.110 104.353-118.839
3068 93.333 0.000 114.757 -76.773
3069 # 147 total E -2.07649E+02 rmsd from N 0.000 %NC 0.00 0
3070 93.659 122.664 108.934 -81.120
3071 118.654-118.403 149.255 -32.508
3072 92.544 54.581 136.587 107.340
3073 92.078 45.937 135.040 -79.557
3074 91.431 42.287 127.131 -47.311
3075 92.563 46.327 154.129 -23.421
3076 91.523 57.078 150.766-145.774
3077 91.896 90.530 107.579 -96.276
3078 93.272 34.092 138.221 -28.654
3079 95.433 72.784 0.000 0.000
3080 130.565 -60.691 0.000 0.000
3081 92.522 65.342 131.619-158.057
3082 93.133 18.048 108.575 -74.940
3083 97.010 -93.531 102.322 -75.424
3084 126.755-175.074 0.000 0.000
3085 129.737 -83.917 90.515 -65.052
3086 116.801-107.165 124.219-132.882
3087 118.208-137.858 109.717-109.818
3088 93.118 58.109 103.335-114.225
3089 93.333 0.000 115.831 -76.570
3090 # 148 total E -2.01710E+02 rmsd from N 0.000 %NC 0.00 0
3091 93.639 49.342 109.156 -80.033
3092 92.506 161.647 164.385 164.748
3093 92.448 79.104 166.028 18.729
3094 92.234 43.581 100.776 -79.656
3095 91.300 50.137 124.011 -70.866
3096 92.316 47.114 150.992 -29.347
3097 91.591 58.848 161.392 176.814
3098 92.108 71.540 109.092-101.984
3099 93.184 112.022 150.163 -33.256
3100 126.987 -54.816 0.000 0.000
3101 124.366 -80.139 0.000 0.000
3102 92.013 42.879 131.349-157.442
3103 93.611 41.939 109.514 -74.520
3104 94.957 -80.495 112.585 -87.346
3105 126.088 -11.027 0.000 0.000
3106 130.003 -80.452 116.938 -51.321
3107 118.622-106.912 132.768-143.734
3108 117.701-132.598 112.948-114.054
3109 117.536-115.811 129.962-141.872
3110 121.602 0.000 121.497 -79.801
3111 # 149 total E -2.02790E+02 rmsd from N 0.000 %NC 0.00 0
3112 93.659 122.754 109.001 -81.162
3113 118.971-117.437 147.438 -32.082
3114 92.477 55.809 133.559 108.535
3115 92.147 44.634 140.689 -86.466
3116 91.436 42.890 131.568 -56.231
3117 92.321 55.955 152.269 -4.020
3118 91.457 44.865 151.452-137.247
3119 92.958 68.471 95.540-102.842
3120 93.834 -96.036 133.907 -15.914
3121 94.312 157.847 0.000 0.000
3122 134.240 -46.966 0.000 0.000
3123 92.101 57.769 100.088 -91.663
3124 92.617 16.151 105.518 -74.651
3125 109.512 -87.584 116.095 -81.894
3126 129.916 -85.951 0.000 0.000
3127 127.533 -99.691 145.041 154.462
3128 117.864-107.552 126.448-138.497
3129 118.072-137.304 114.528-115.978
3130 93.140 57.943 102.063-104.848
3131 93.332 0.000 115.846 -76.630
3132 # 150 total E -2.00378E+02 rmsd from N 0.000 %NC 0.00 0
3133 93.639 49.452 109.218 -80.063
3134 92.503 161.195 162.918 160.951
3135 92.461 79.726 165.912 19.114
3136 92.255 43.401 100.434 -79.145
3137 91.332 49.877 131.536-109.673
3138 92.146 45.673 142.459 -34.637
3139 91.647 59.832 162.209 178.477
3140 91.726 81.478 94.633 -71.911
3141 93.001 70.613 134.140 15.072
3142 94.872 139.969 0.000 0.000
3143 129.933 -21.404 0.000 0.000
3144 114.744 -56.247 115.030-122.093
3145 93.486 75.157 112.812 -74.536
3146 120.132-110.891 119.852 -83.159
3147 95.123 51.700 0.000 0.000
3148 133.208-111.118 113.246 -48.089
3149 117.106-106.233 129.132-143.044
3150 118.024-137.759 113.887-115.455
3151 93.152 57.990 102.385-106.293
3152 93.333 0.000 115.815 -76.581
3153 # 151 total E -2.07057E+02 rmsd from N 0.000 %NC 0.00 0
3154 117.063-149.941 150.229-158.337
3155 125.014 -99.865 140.548 -69.807
3156 92.592 57.384 141.821 102.242
3157 92.019 43.822 130.081 -75.154
3158 91.425 44.412 135.662-150.573
3159 92.175 47.260 145.644 -10.722
3160 91.419 62.740 155.370-157.133
3161 92.044 60.255 84.305 -76.102
3162 93.870 134.037 134.741 -0.275
3163 130.470 -69.671 0.000 0.000
3164 127.540 -49.714 0.000 0.000
3165 107.173 -30.268 127.160-142.664
3166 91.380 97.388 113.217 -74.476
3167 91.639 -19.989 104.523 -77.370
3168 106.450 -47.085 0.000 0.000
3169 129.739 -62.216 102.941 -61.425
3170 118.693-111.541 128.257-135.250
3171 117.806-137.176 115.879-118.484
3172 93.185 58.452 127.623-150.755
3173 93.332 0.000 115.454 -76.772
3174 # 152 total E -2.00472E+02 rmsd from N 0.000 %NC 0.00 0
3175 93.638 49.501 109.163 -80.045
3176 92.505 161.538 164.167 165.087
3177 92.483 79.252 165.855 18.878
3178 92.264 43.604 100.724 -79.979
3179 91.340 50.531 124.774 -70.533
3180 92.354 48.925 151.082 -27.045
3181 91.671 58.128 161.453 175.658
3182 92.040 76.173 107.915-103.760
3183 93.418 124.444 129.959 26.862
3184 94.311 54.156 0.000 0.000
3185 123.871 -71.757 0.000 0.000
3186 116.428 -84.230 122.006-129.551
3187 93.123 65.924 113.175 -74.374
3188 94.495 43.819 113.953 -76.874
3189 95.759 83.453 0.000 0.000
3190 128.154 -84.755 122.976 134.821
3191 117.954-109.127 117.106-126.565
3192 117.997-119.610 112.748-114.060
3193 117.727-115.853 122.650-128.666
3194 121.618 0.000 121.494 -79.867
3195 # 153 total E -2.05815E+02 rmsd from N 0.000 %NC 0.00 0
3196 93.640 49.388 109.241 -80.066
3197 92.499 161.326 162.942 162.885
3198 92.530 79.660 165.177 20.869
3199 92.276 42.781 101.523 -82.086
3200 91.276 50.926 125.470 -74.302
3201 92.234 46.826 151.668 -29.237
3202 91.416 64.519 163.003 177.281
3203 92.041 61.046 113.884-107.851
3204 93.666 108.315 157.120 -20.889
3205 126.368 -67.844 0.000 0.000
3206 122.951 -67.949 0.000 0.000
3207 91.529 50.381 101.251-105.050
3208 93.308 32.497 109.537 -74.413
3209 96.084 -92.533 141.790 -24.570
3210 126.099 1.779 0.000 0.000
3211 131.895 -79.340 121.023 -53.062
3212 118.856-105.197 125.244-131.554
3213 117.292-138.790 116.610-119.501
3214 93.259 58.191 126.960-151.390
3215 93.334 0.000 115.695 -76.577
3216 # 154 total E -2.00760E+02 rmsd from N 0.000 %NC 0.00 0
3217 93.640 49.677 109.330 -80.128
3218 92.502 160.430 161.578 162.556
3219 92.709 80.837 164.356 21.401
3220 92.626 40.816 101.228 -82.694
3221 91.590 57.466 133.865-121.061
3222 92.515 54.249 140.831 -23.954
3223 91.999 105.358 160.417-159.156
3224 93.141 -24.690 119.690-109.638
3225 94.799 -74.134 135.279 -27.503
3226 117.167 -48.119 0.000 0.000
3227 94.162 69.100 0.000 0.000
3228 92.353 58.544 89.546 -90.443
3229 91.552 60.479 111.519 -78.921
3230 92.479 45.372 107.149-125.956
3231 94.089 58.058 0.000 0.000
3232 110.676 -58.020 127.643 147.720
3233 117.521-104.661 118.871-125.829
3234 118.398-135.757 114.868-116.935
3235 93.151 57.688 97.650-107.113
3236 93.334 0.000 115.761 -77.004
3237 # 155 total E -1.98995E+02 rmsd from N 0.000 %NC 0.00 0
3238 93.640 49.453 109.121 -80.031
3239 92.505 161.624 164.852 164.437
3240 92.359 78.567 166.568 17.324
3241 92.211 43.271 100.198 -77.711
3242 91.294 48.984 140.452-120.632
3243 92.023 43.075 141.153 -42.048
3244 91.459 55.013 162.069 178.633
3245 91.367 77.175 88.402 -59.840
3246 92.419 51.254 134.471 4.312
3247 94.317 52.767 0.000 0.000
3248 94.504 67.804 0.000 0.000
3249 114.059 -34.599 115.832-123.318
3250 91.980 79.908 111.882 -75.062
3251 91.877 -7.735 121.558-121.450
3252 113.516 -39.661 0.000 0.000
3253 134.823 -79.611 66.493 -74.576
3254 117.433-112.125 116.630-121.796
3255 117.651-114.572 137.039-149.438
3256 117.914-115.795 117.335-120.215
3257 121.610 0.000 121.453 -79.866
3258 # 156 total E -2.07378E+02 rmsd from N 0.000 %NC 0.00 0
3259 93.643 49.677 109.224 -80.012
3260 92.507 161.463 164.778 166.904
3261 92.405 77.232 166.774 13.465
3262 92.402 43.954 98.939 -77.162
3263 91.461 48.470 143.212-123.230
3264 92.317 44.848 136.438 -84.829
3265 91.852 59.401 162.343 179.589
3266 92.593 111.431 117.465 147.244
3267 128.022 -25.577 138.700 -36.803
3268 131.179 -24.259 0.000 0.000
3269 126.974 -60.901 0.000 0.000
3270 100.870 -27.397 128.988-149.941
3271 91.408 96.960 113.121 -74.386
3272 91.209 -16.923 113.814 -74.729
3273 100.610 -63.445 0.000 0.000
3274 123.964 -48.826 129.356-128.607
3275 119.713-159.073 123.076-129.490
3276 92.645 110.952 96.394 -91.944
3277 93.254 31.151 90.773 -94.861
3278 93.347 0.000 107.782 -82.151
3279 # 157 total E -2.06906E+02 rmsd from N 0.000 %NC 0.00 0
3280 93.637 48.045 109.587 -81.052
3281 92.633 171.108 147.815 -8.434
3282 92.826 75.195 150.357 97.447
3283 92.456 43.515 140.150 -83.746
3284 91.481 44.905 129.605 -44.670
3285 92.326 55.482 153.091 -8.870
3286 91.468 43.872 150.870-135.562
3287 92.962 71.151 95.494-101.867
3288 93.738 -94.304 139.688 -17.317
3289 94.583 155.105 0.000 0.000
3290 133.373 -50.404 0.000 0.000
3291 91.964 65.312 99.264 -95.089
3292 92.546 31.166 104.730 -74.440
3293 95.762-115.088 112.225 -81.265
3294 95.534 154.615 0.000 0.000
3295 129.928-104.648 103.743 -54.481
3296 117.212-107.182 125.904-134.775
3297 118.042-127.451 108.607-108.499
3298 117.694-115.810 125.738-134.126
3299 121.611 0.000 121.479 -79.840
3300 # 158 total E -2.03805E+02 rmsd from N 0.000 %NC 0.00 0
3301 93.659 122.751 108.985 -81.155
3302 118.808-118.272 148.322 -31.779
3303 92.517 55.803 134.909 108.428
3304 92.084 45.764 138.474 -83.906
3305 91.369 43.113 129.447 -50.915
3306 92.341 50.469 154.581 -14.482
3307 91.455 55.752 149.099-141.648
3308 91.847 70.290 105.439-104.641
3309 92.979 77.501 133.324 -3.068
3310 94.383 104.246 0.000 0.000
3311 137.497 -32.908 0.000 0.000
3312 107.878 -24.294 123.513-136.112
3313 92.666 92.324 113.313 -74.451
3314 91.441 -25.129 104.057 -74.525
3315 104.402 -92.119 0.000 0.000
3316 126.450-107.881 106.618 -51.357
3317 116.961-106.432 127.216-136.581
3318 118.125-137.626 110.662-111.115
3319 93.128 58.119 102.846-110.517
3320 93.333 0.000 115.833 -76.566
3321 # 159 total E -2.03901E+02 rmsd from N 0.000 %NC 0.00 0
3322 93.659 122.708 108.925 -81.124
3323 118.693-118.259 149.235 -32.616
3324 92.537 54.416 136.603 107.376
3325 92.065 45.976 134.838 -79.289
3326 91.427 41.963 126.597 -46.970
3327 92.564 45.929 153.951 -23.966
3328 91.514 54.575 151.118-146.298
3329 91.817 86.991 105.615 -93.151
3330 93.121 37.665 138.922 -12.562
3331 95.344 66.256 0.000 0.000
3332 130.964 -52.680 0.000 0.000
3333 92.358 69.150 100.142-103.900
3334 92.420 27.488 107.937 -76.198
3335 95.533-113.973 108.200 -81.820
3336 96.132 156.683 0.000 0.000
3337 128.638-104.021 102.663 -54.152
3338 117.463-108.587 126.259-134.915
3339 118.069-119.257 109.130-109.075
3340 117.723-115.815 124.990-132.943
3341 121.613 0.000 121.480 -79.843
3342 # 160 total E -1.99508E+02 rmsd from N 0.000 %NC 0.00 0
3343 93.640 49.594 109.190 -79.979
3344 92.502 158.551 163.414 157.808
3345 92.351 78.601 166.294 17.923
3346 92.198 45.737 101.120 -79.525
3347 91.274 47.898 124.189 -70.168
3348 92.301 50.474 152.011 -23.560
3349 91.678 59.300 155.131 152.067
3350 92.321 93.703 108.154-105.101
3351 94.030 -93.177 130.555 -30.873
3352 131.161 -50.119 0.000 0.000
3353 94.497 70.557 0.000 0.000
3354 92.097 52.833 87.757 -88.530
3355 91.905 50.524 108.901 -80.797
3356 92.823 62.902 109.169-116.443
3357 94.842 75.101 0.000 0.000
3358 120.727 -83.972 92.063 -60.914
3359 117.493-109.154 127.191-136.050
3360 118.061-115.512 109.819-110.082
3361 117.914-115.829 116.099-120.668
3362 121.616 0.000 121.471 -79.873
3363 # 161 total E -2.09211E+02 rmsd from N 0.000 %NC 0.00 0
3364 93.639 49.182 109.240 -80.052
3365 92.497 160.677 163.983 166.106
3366 92.556 77.879 165.995 13.199
3367 92.590 44.086 98.795 -77.819
3368 91.608 49.341 142.881-123.527
3369 92.457 53.067 137.904 -75.236
3370 91.899 63.188 163.190 163.435
3371 93.076 156.860 90.999 110.985
3372 116.854 -61.891 146.486 -20.366
3373 126.170 -17.677 0.000 0.000
3374 125.266 -68.806 0.000 0.000
3375 113.651 -53.888 126.528-139.073
3376 89.560 73.343 112.653 -74.329
3377 90.519 4.025 110.959 -76.291
3378 104.663 -69.759 0.000 0.000
3379 125.786 -51.150 107.040-121.238
3380 122.982 135.010 113.962-118.596
3381 92.857 120.257 106.122 -66.331
3382 92.687 43.333 102.147-115.638
3383 93.289 0.000 105.321 -77.560
3384 # 162 total E -2.06086E+02 rmsd from N 0.000 %NC 0.00 0
3385 93.640 47.275 108.102 -79.511
3386 92.740 158.213 144.309-109.237
3387 132.025 -95.927 105.570 -99.398
3388 93.786 43.779 166.209-175.587
3389 91.563 43.832 133.240 -74.390
3390 92.424 53.929 154.433 -14.788
3391 91.303 57.143 137.073-118.456
3392 92.231 65.514 106.063-109.158
3393 93.666 136.565 135.998 -3.333
3394 130.318 -68.180 0.000 0.000
3395 127.971 -47.958 0.000 0.000
3396 107.203 -29.417 127.281-142.894
3397 91.468 98.210 113.227 -74.473
3398 91.641 -20.907 104.883 -77.109
3399 106.861 -46.006 0.000 0.000
3400 129.340 -63.030 104.193 -62.015
3401 118.600-110.928 125.713-131.533
3402 117.668-137.955 116.645-119.734
3403 93.189 58.298 128.130-151.995
3404 93.333 0.000 115.523 -76.764
3405 # 163 total E -2.06439E+02 rmsd from N 0.000 %NC 0.00 0
3406 93.637 48.089 109.509 -81.002
3407 92.608 170.345 149.277 -9.953
3408 92.848 74.437 152.918 96.579
3409 92.379 44.188 135.172 -79.000
3410 91.414 45.143 127.260 -40.298
3411 92.390 49.343 153.713 -21.735
3412 91.565 54.764 151.261-144.299
3413 91.835 77.812 105.469-102.425
3414 92.790 75.450 134.804 -7.430
3415 96.805 80.730 0.000 0.000
3416 133.861 -96.267 0.000 0.000
3417 116.333 -56.144 120.884-127.821
3418 90.064 73.808 112.520 -74.301
3419 90.945 4.304 111.852 -76.351
3420 105.599 -58.271 0.000 0.000
3421 134.312 -64.703 159.074 -30.140
3422 119.986-112.110 104.934-105.073
3423 116.651-139.061 125.544-134.383
3424 93.170 57.931 130.999-156.399
3425 93.333 0.000 115.734 -76.624
3426 # 164 total E -2.05939E+02 rmsd from N 0.000 %NC 0.00 0
3427 93.639 49.318 109.159 -80.037
3428 92.505 161.596 164.267 163.246
3429 92.389 78.952 166.342 18.218
3430 92.225 43.116 100.397 -78.327
3431 91.313 49.438 137.863-117.157
3432 92.134 43.304 141.277 -37.846
3433 91.667 59.646 162.540-178.693
3434 91.678 85.845 90.173 -65.005
3435 93.251 37.810 136.728 -6.621
3436 95.629 69.324 0.000 0.000
3437 132.063 -68.258 0.000 0.000
3438 92.883 68.234 100.851-104.727
3439 93.573 4.498 118.536 -80.228
3440 120.412-167.346 119.829-124.401
3441 95.031 82.888 0.000 0.000
3442 129.782 -92.456 95.898 -60.358
3443 117.488-108.945 125.294-133.192
3444 118.043-118.376 108.960-109.138
3445 117.695-115.823 124.341-132.216
3446 121.614 0.000 121.483 -79.847
3447 # 165 total E -2.06346E+02 rmsd from N 0.000 %NC 0.00 0
3448 93.640 49.390 109.187 -80.049
3449 92.504 161.386 163.608 161.449
3450 92.407 79.310 166.365 17.938
3451 92.239 43.521 100.102 -78.046
3452 91.331 49.051 131.939-106.828
3453 92.143 44.642 142.181 -39.308
3454 91.566 58.766 162.171 177.397
3455 91.603 84.200 96.376 -70.552
3456 93.161 38.246 138.023 -6.663
3457 95.203 72.432 0.000 0.000
3458 131.538 -58.854 0.000 0.000
3459 92.848 67.126 101.848-109.647
3460 93.187 41.111 105.814 -74.421
3461 93.862 53.877 109.616 -83.808
3462 94.801 66.363 0.000 0.000
3463 122.711 -77.180 139.357-168.500
3464 117.997-109.608 116.210-121.780
3465 117.978-118.357 113.591-115.568
3466 117.763-115.830 121.744-127.256
3467 121.614 0.000 121.478 -79.864
3468 # 166 total E -2.09931E+02 rmsd from N 0.000 %NC 0.00 0
3469 93.637 48.305 109.582 -81.058
3470 92.629 171.003 147.814 -8.523
3471 92.812 75.127 150.543 96.955
3472 92.474 43.155 140.128 -83.649
3473 91.497 45.292 129.544 -43.760
3474 92.335 55.897 153.654 -9.117
3475 91.498 44.146 150.924-134.993
3476 92.936 73.492 95.603-102.628
3477 93.847 -92.383 135.968 -18.944
3478 94.638 156.094 0.000 0.000
3479 135.887 -54.281 0.000 0.000
3480 92.380 61.364 100.464-100.956
3481 92.739 48.307 105.608 -74.073
3482 93.609 50.048 105.600 -81.513
3483 95.002 67.045 0.000 0.000
3484 122.848 -77.674 137.866-164.563
3485 118.023-108.056 115.211-120.100
3486 117.906-137.716 117.272-120.902
3487 93.134 57.857 102.077-103.363
3488 93.333 0.000 115.862 -76.660
3489 # 167 total E -1.99175E+02 rmsd from N 0.000 %NC 0.00 0
3490 93.639 49.910 109.281 -80.107
3491 92.497 160.200 162.020 162.241
3492 92.686 80.054 164.645 19.557
3493 92.431 44.684 100.023 -80.536
3494 91.476 49.313 130.471 -90.574
3495 92.385 61.728 149.649 -29.528
3496 91.834 54.753 157.466 133.939
3497 93.033 156.339 102.837-112.543
3498 93.530 -69.982 85.637 -75.804
3499 93.082 35.988 0.000 0.000
3500 117.937 -83.037 0.000 0.000
3501 120.503 13.884 110.809-112.471
3502 93.170 -51.565 111.288 -73.537
3503 91.488 -6.784 112.341 -77.583
3504 121.350 -20.993 0.000 0.000
3505 122.277 -74.828 132.622 146.401
3506 117.736-109.170 117.863-125.573
3507 117.922-136.825 118.448-122.050
3508 93.147 58.110 102.015-102.948
3509 93.334 0.000 115.823 -76.638
3510 # 168 total E -2.03275E+02 rmsd from N 0.000 %NC 0.00 0
3511 93.629 44.989 112.015 -83.998
3512 92.507 156.235 142.859-174.200
3513 93.594 94.998 124.584 -43.567
3514 92.250 -0.394 81.456 -80.785
3515 91.471 -87.761 141.625-110.421
3516 103.457 171.454 84.989-123.559
3517 91.989 82.114 157.455 172.241
3518 92.642 67.902 118.242-137.747
3519 93.613 113.341 141.007 11.394
3520 130.210 -10.782 0.000 0.000
3521 126.519 -68.736 0.000 0.000
3522 112.743 -52.404 117.916-125.305
3523 89.675 75.310 112.396 -74.260
3524 90.804 2.553 110.550 -76.381
3525 103.294 -70.203 0.000 0.000
3526 129.473 -49.001 159.002 36.039
3527 119.730-115.631 116.434-120.138
3528 119.242-133.762 121.145-124.341
3529 93.075 58.655 98.883 -96.614
3530 93.333 0.000 115.648 -76.759
3531 # 169 total E -2.03225E+02 rmsd from N 0.000 %NC 0.00 0
3532 93.630 82.410 114.269 -82.784
3533 92.166 133.651 134.381-142.561
3534 92.065 95.492 124.393 -43.194
3535 93.517 8.592 83.009 -83.237
3536 93.562 -92.313 145.340-132.205
3537 93.903 148.611 91.559-109.192
3538 92.672 65.428 149.440-118.676
3539 93.539 149.346 94.336 115.011
3540 117.774 -61.511 147.711 -22.093
3541 126.805 -15.775 0.000 0.000
3542 125.329 -68.861 0.000 0.000
3543 113.644 -53.686 125.906-138.016
3544 89.553 73.296 112.657 -74.334
3545 90.518 4.220 110.925 -76.296
3546 104.573 -70.211 0.000 0.000
3547 125.463 -51.911 106.011-121.859
3548 123.030 134.199 111.824-115.075
3549 92.794 121.759 107.118 -67.120
3550 92.763 41.658 101.854-115.725
3551 93.295 0.000 107.896 -76.327
3552 # 170 total E -2.07816E+02 rmsd from N 0.000 %NC 0.00 0
3553 93.641 49.200 109.215 -80.052
3554 92.497 160.869 164.219 166.561
3555 92.529 77.580 166.162 12.909
3556 92.594 43.369 98.562 -77.359
3557 91.613 49.875 143.127-122.919
3558 92.472 50.219 138.226 -70.751
3559 91.936 64.658 164.738 178.688
3560 93.234 147.378 94.489 110.812
3561 117.983 -66.010 152.313 -25.819
3562 127.049 -13.779 0.000 0.000
3563 127.254 -65.867 0.000 0.000
3564 114.507 -54.785 110.000-112.740
3565 89.482 72.833 112.541 -74.295
3566 90.632 5.140 110.805 -76.619
3567 104.285 -69.506 0.000 0.000
3568 127.472 -53.348 106.242-123.640
3569 121.073-166.918 107.787-113.467
3570 124.878-138.053 106.418 -99.321
3571 93.010 59.080 100.205-108.404
3572 93.333 0.000 115.017 -76.783
3573 # 171 total E -1.99688E+02 rmsd from N 0.000 %NC 0.00 0
3574 117.970-147.503 110.930 -82.829
3575 122.297-169.218 167.925-155.505
3576 92.441 79.423 171.626 19.925
3577 92.231 43.458 110.385 -64.641
3578 91.301 47.331 133.618-106.248
3579 92.079 45.047 142.175 -38.980
3580 91.525 56.148 159.748-171.516
3581 91.526 80.375 94.473 -69.065
3582 93.044 38.413 138.463 -7.634
3583 95.130 66.109 0.000 0.000
3584 129.150 -47.162 0.000 0.000
3585 92.395 69.504 99.951-103.812
3586 92.459 25.696 104.815 -74.053
3587 95.447-114.054 111.074 -82.238
3588 95.959 155.953 0.000 0.000
3589 128.757-105.152 103.703 -53.670
3590 117.455-108.420 126.201-134.909
3591 118.069-119.483 109.073-108.993
3592 117.721-115.820 125.087-133.086
3593 121.611 0.000 121.480 -79.843
3594 # 172 total E -2.01091E+02 rmsd from N 0.000 %NC 0.00 0
3595 93.636 49.337 109.222 -80.070
3596 92.510 161.615 163.247 164.542
3597 92.573 81.143 165.502 19.646
3598 92.487 41.047 101.193 -80.936
3599 91.379 55.937 129.425 -92.221
3600 92.583 52.393 151.744 -33.356
3601 91.494 76.560 160.415-165.053
3602 92.200 112.306 121.074-125.054
3603 93.672 -50.651 100.407 -71.363
3604 94.818 81.335 0.000 0.000
3605 130.841 -77.801 0.000 0.000
3606 128.760 105.248 118.680-117.931
3607 93.647 38.672 101.421 -73.910
3608 123.998 -90.052 119.818 -90.520
3609 95.072 160.966 0.000 0.000
3610 130.006 -89.796 105.149 -60.227
3611 117.198-107.025 122.186-129.856
3612 117.966-137.104 111.629-112.309
3613 93.260 58.244 126.155-148.241
3614 93.330 0.000 115.820 -76.510
3615 # 173 total E -2.02078E+02 rmsd from N 0.000 %NC 0.00 0
3616 93.637 49.396 109.199 -80.006
3617 92.505 161.644 165.722 167.857
3618 92.338 76.781 167.260 12.361
3619 92.376 44.265 98.552 -75.650
3620 91.472 48.035 144.695-123.389
3621 92.183 44.098 135.511 -83.636
3622 91.556 55.637 161.412-177.042
3623 92.510 92.009 121.001 148.340
3624 92.688 -78.965 134.219 -22.497
3625 94.476 139.732 0.000 0.000
3626 131.294 -59.041 0.000 0.000
3627 91.842 52.290 132.205-157.938
3628 93.032 30.012 106.182 -72.456
3629 95.853 -93.855 117.716-113.783
3630 124.260-173.577 0.000 0.000
3631 130.161 -87.823 93.631 -63.012
3632 117.048-109.086 124.614-133.304
3633 118.062-119.062 108.601-108.348
3634 117.721-115.825 125.122-133.351
3635 121.612 0.000 121.481 -79.842
3636 # 174 total E -1.99073E+02 rmsd from N 0.000 %NC 0.00 0
3637 93.639 48.307 109.526 -80.616
3638 92.602 82.499 157.936 172.532
3639 93.791 113.124 125.494 -40.038
3640 125.272 -93.031 95.569 -92.860
3641 91.299 66.321 119.448 -96.906
3642 92.160 64.026 152.273 -7.688
3643 91.493 46.401 140.152 -55.018
3644 92.912 70.747 94.413-112.511
3645 94.038 -96.443 136.210 -17.742
3646 94.747 157.832 0.000 0.000
3647 134.617 -59.539 0.000 0.000
3648 92.486 56.699 101.433 -97.515
3649 92.893 48.069 114.974 -79.036
3650 93.687 49.543 106.086-113.477
3651 95.042 67.908 0.000 0.000
3652 123.229 -77.907 138.333-166.445
3653 118.037-109.732 116.066-121.439
3654 117.951-118.113 113.494-115.476
3655 117.784-115.826 121.832-127.343
3656 121.615 0.000 121.477 -79.864
3657 # 175 total E -2.05956E+02 rmsd from N 0.000 %NC 0.00 0
3658 93.661 122.833 108.992 -81.046
3659 118.672-117.521 150.350 -31.630
3660 92.534 56.831 136.445 104.611
3661 92.210 43.447 134.182 -79.011
3662 91.600 44.681 140.287-158.234
3663 92.456 52.591 149.892 -2.549
3664 92.039 63.721 156.339-143.277
3665 93.032 156.010 92.251 111.069
3666 117.236 -61.569 146.356 -21.079
3667 126.326 -17.397 0.000 0.000
3668 125.275 -68.814 0.000 0.000
3669 113.648 -53.855 126.203-138.547
3670 89.558 73.338 112.654 -74.331
3671 90.520 4.074 110.951 -76.295
3672 104.643 -69.860 0.000 0.000
3673 125.716 -51.347 106.721-121.476
3674 122.999 134.941 113.614-117.844
3675 92.864 120.473 106.404 -66.559
3676 92.695 43.186 102.408-116.029
3677 93.291 0.000 105.722 -77.283
3678 # 176 total E -2.10505E+02 rmsd from N 0.000 %NC 0.00 0
3679 93.635 49.932 111.264 -81.962
3680 92.067 75.806 144.023-137.321
3681 92.498 52.380 132.031 110.036
3682 92.399 43.572 143.484 -86.075
3683 91.414 43.357 132.233 -59.844
3684 92.238 56.536 152.869 -5.629
3685 91.442 43.539 150.744-131.654
3686 92.993 70.978 94.662-102.638
3687 93.749 -94.742 140.396 -16.241
3688 94.572 154.520 0.000 0.000
3689 133.409 -49.910 0.000 0.000
3690 91.973 65.404 99.194 -95.350
3691 92.546 31.038 104.619 -74.278
3692 95.724-114.974 112.049 -81.334
3693 95.511 154.363 0.000 0.000
3694 129.960-104.468 104.047 -54.087
3695 117.107-106.575 125.977-134.764
3696 118.125-138.992 109.938-110.283
3697 93.092 57.794 105.391-115.030
3698 93.333 0.000 115.841 -76.597
3699 # 177 total E -2.05764E+02 rmsd from N 0.000 %NC 0.00 0
3700 93.640 49.506 109.173 -80.046
3701 92.505 161.378 163.820 162.193
3702 92.411 79.362 166.233 18.548
3703 92.229 43.361 100.480 -78.599
3704 91.330 49.306 135.609-114.411
3705 92.125 44.276 141.942 -37.117
3706 91.584 58.744 162.279 178.364
3707 91.570 84.267 92.026 -67.119
3708 93.024 42.225 135.702 -11.594
3709 95.570 66.341 0.000 0.000
3710 132.760 -69.152 0.000 0.000
3711 92.779 66.946 100.801-104.206
3712 93.150 9.353 114.471 -78.068
3713 111.904-105.008 124.916-132.283
3714 134.038-104.808 0.000 0.000
3715 126.190 -88.179 91.033 -62.142
3716 117.002-107.162 126.464-135.858
3717 118.203-137.582 110.267-110.513
3718 93.125 58.074 102.908-112.429
3719 93.333 0.000 115.847 -76.563
3720 # 178 total E -2.12182E+02 rmsd from N 0.000 %NC 0.00 0
3721 93.631 48.548 112.676 -83.793
3722 92.073 83.152 132.764 143.462
3723 92.093 71.257 165.648 16.945
3724 91.976 42.875 94.654 -76.671
3725 91.178 50.365 125.148 -61.563
3726 92.117 47.939 150.890 -29.517
3727 91.513 60.860 162.757-172.267
3728 92.154 63.565 110.501-103.470
3729 93.705 135.877 135.825 -3.343
3730 130.258 -68.294 0.000 0.000
3731 127.825 -48.545 0.000 0.000
3732 107.220 -29.629 127.162-142.701
3733 91.446 98.068 113.224 -74.474
3734 91.641 -20.746 104.781 -77.192
3735 106.738 -46.110 0.000 0.000
3736 129.489 -62.906 104.039 -61.934
3737 118.650-111.082 126.068-132.008
3738 117.687-137.880 116.460-119.450
3739 93.191 58.306 128.130-152.012
3740 93.335 0.000 115.478 -76.758
3741 # 179 total E -2.00468E+02 rmsd from N 0.000 %NC 0.00 0
3742 93.632 38.384 111.477 -83.418
3743 92.365 139.180 141.319-147.683
3744 92.155 95.348 125.395 -42.676
3745 93.382 8.255 84.668 -82.376
3746 93.119 -94.723 145.320-127.530
3747 93.799 148.542 136.795 52.578
3748 92.343 65.698 144.366-117.923
3749 92.765 99.098 121.894-101.661
3750 93.376 70.989 128.154 30.729
3751 95.200 84.397 0.000 0.000
3752 129.917 -79.750 0.000 0.000
3753 130.283 98.959 114.617-111.308
3754 92.390 -38.261 123.809 -8.809
3755 91.109 -41.648 114.955 -76.102
3756 94.139 78.364 0.000 0.000
3757 129.675-115.917 119.824 -39.541
3758 117.426-106.161 127.425-138.946
3759 118.210-138.254 112.512-113.333
3760 93.140 57.875 101.687-105.070
3761 93.331 0.000 115.814 -76.610
3762 # 180 total E -1.99910E+02 rmsd from N 0.000 %NC 0.00 0
3763 93.639 49.660 108.803 -80.070
3764 92.545 164.893 176.419-164.649
3765 92.076 76.842 169.656 14.308
3766 92.161 44.389 102.610 -67.378
3767 91.320 47.927 122.470 -56.530
3768 92.237 47.255 149.675 -33.836
3769 91.574 59.343 159.247-177.447
3770 91.748 76.203 108.755 -95.894
3771 93.302 45.843 143.973 18.913
3772 95.191 73.727 0.000 0.000
3773 126.317 -32.007 0.000 0.000
3774 93.280 82.993 127.925-150.351
3775 123.969 -97.605 110.331 -77.452
3776 126.872 -75.681 123.343 -80.767
3777 95.499 77.116 0.000 0.000
3778 127.015 -79.401 120.524 -49.315
3779 116.471-109.476 100.593 -76.965
3780 116.540-139.448 128.875-140.152
3781 93.155 59.121 133.012-158.730
3782 93.328 0.000 115.201 -76.393
3783 # 181 total E -2.02388E+02 rmsd from N 0.000 %NC 0.00 0
3784 93.638 49.734 109.201 -80.060
3785 92.505 161.151 163.368 163.591
3786 92.522 80.019 165.505 19.934
3787 92.301 43.223 101.331 -81.291
3788 91.332 51.347 124.691 -73.835
3789 92.334 48.759 151.038 -27.967
3790 91.604 61.145 161.624 178.796
3791 92.233 69.192 110.363-106.709
3792 93.291 141.158 139.066 -6.232
3793 130.243 -59.100 0.000 0.000
3794 123.689 -57.705 0.000 0.000
3795 92.084 54.674 131.490-157.616
3796 93.175 25.885 110.499 -75.520
3797 96.149 -95.289 122.411-116.391
3798 123.580-174.932 0.000 0.000
3799 131.646 -89.737 95.129 -62.705
3800 116.910-108.646 127.145-139.544
3801 118.066-119.061 108.101-107.410
3802 117.728-115.832 124.830-133.234
3803 121.610 0.000 121.481 -79.843
3804 # 182 total E -2.02410E+02 rmsd from N 0.000 %NC 0.00 0
3805 93.640 49.674 109.382 -80.158
3806 92.492 158.847 160.810 162.511
3807 92.876 82.746 163.807 20.978
3808 92.866 39.650 101.105 -83.146
3809 91.791 61.511 129.606-101.098
3810 93.272 62.052 150.078 -33.328
3811 92.428 167.745 158.543-161.215
3812 119.677 178.476 122.324 120.057
3813 122.072 -63.126 144.936 -24.132
3814 126.822 -13.948 0.000 0.000
3815 127.941 -66.208 0.000 0.000
3816 113.497 -51.934 111.994-116.106
3817 89.687 74.633 112.358 -74.224
3818 90.771 3.836 110.639 -76.543
3819 103.603 -71.072 0.000 0.000
3820 127.177 -51.780 153.158 -2.565
3821 121.361-165.922 101.466 -98.493
3822 126.574-143.273 105.739 -98.646
3823 92.984 58.361 101.067-115.980
3824 93.329 0.000 115.043 -76.709
3825 # 183 total E -2.08229E+02 rmsd from N 0.000 %NC 0.00 0
3826 93.640 48.854 108.956 -79.990
3827 92.521 162.922 169.253 174.375
3828 92.253 77.301 167.697 14.807
3829 92.179 44.424 99.287 -72.993
3830 91.325 48.542 122.574 -60.936
3831 92.265 47.003 150.106 -32.335
3832 91.596 59.156 160.195 178.990
3833 92.109 60.599 110.588-101.181
3834 93.241 129.492 143.952 15.777
3835 131.615 -30.176 0.000 0.000
3836 126.009 -65.175 0.000 0.000
3837 106.195 -35.172 119.883-131.358
3838 90.768 91.883 113.173 -74.445
3839 91.301 -14.421 103.303 -77.596
3840 103.125 -59.573 0.000 0.000
3841 128.730 -47.423 127.998 -64.489
3842 123.413-159.644 111.222-108.622
3843 92.985 112.696 100.890 -93.926
3844 93.052 87.389 96.303 -94.747
3845 93.395 0.000 114.866 -80.589
3846 # 184 total E -2.08607E+02 rmsd from N 0.000 %NC 0.00 0
3847 116.923-151.259 149.690-158.964
3848 125.044-101.141 141.642 -79.387
3849 92.594 56.097 148.593 97.854
3850 92.071 43.688 121.675 -68.403
3851 91.421 44.666 142.648-151.124
3852 92.158 43.085 146.047 -35.932
3853 91.391 56.443 156.472-171.073
3854 91.841 74.652 86.708 -61.845
3855 93.280 101.918 135.372 -1.529
3856 128.470 -17.514 0.000 0.000
3857 125.770 -70.530 0.000 0.000
3858 110.852 -51.910 97.804 -86.884
3859 89.823 77.072 112.560 -74.440
3860 90.737 1.148 110.466 -76.301
3861 102.502 -70.692 0.000 0.000
3862 130.033 -45.097 139.889 170.997
3863 120.659-146.309 104.585-107.328
3864 118.825-113.254 112.480-113.077
3865 93.045 61.869 103.709-112.497
3866 93.332 0.000 115.187 -76.690
3867 # 185 total E -2.05355E+02 rmsd from N 0.000 %NC 0.00 0
3868 93.639 48.940 109.285 -80.271
3869 92.471 159.935 162.954-170.434
3870 92.788 78.213 164.889 18.387
3871 92.460 45.887 114.252 -61.147
3872 91.634 51.958 135.397-115.862
3873 93.019 69.172 144.398 -43.459
3874 92.267 57.495 160.570-175.183
3875 117.989-103.687 108.318-107.181
3876 120.665 -86.117 109.820 -67.733
3877 95.092 56.517 0.000 0.000
3878 96.109 40.994 0.000 0.000
3879 92.937 47.351 104.170 -92.304
3880 92.152 47.850 105.333 -83.291
3881 93.179 52.404 108.049 -84.134
3882 95.070 63.048 0.000 0.000
3883 121.430 -96.468 126.430 -41.100
3884 117.316-106.565 120.789-126.955
3885 117.279-142.087 114.660-116.923
3886 93.352 47.192 128.000-151.309
3887 93.370 0.000 118.293 -80.061
3888 # 186 total E -2.08209E+02 rmsd from N 0.000 %NC 0.00 0
3889 93.639 49.460 109.212 -80.063
3890 92.503 161.272 163.097 161.689
3891 92.457 79.994 165.677 20.503
3892 92.217 43.007 101.057 -80.039
3893 91.315 50.100 135.023-118.134
3894 92.127 44.387 142.693 -25.815
3895 91.660 61.346 162.766-178.816
3896 92.040 69.511 87.351 -69.891
3897 93.911 131.670 135.391 14.158
3898 127.749 -78.983 0.000 0.000
3899 133.795 -41.426 0.000 0.000
3900 107.086 -27.612 124.737-138.413
3901 92.107 92.596 113.230 -74.413
3902 91.631 -22.508 104.431 -76.358
3903 104.324-100.083 0.000 0.000
3904 127.309-114.408 111.694 -46.263
3905 115.709-108.879 128.450-139.989
3906 117.094-137.669 146.490-165.282
3907 93.120 58.135 102.062-107.513
3908 93.333 0.000 115.729 -76.621
3909 # 187 total E -2.02600E+02 rmsd from N 0.000 %NC 0.00 0
3910 93.629 122.936 142.970-132.224
3911 119.003-118.188 147.890 -31.598
3912 92.505 55.795 134.209 108.978
3913 92.113 45.994 139.668 -85.019
3914 91.417 42.436 129.961 -51.200
3915 92.348 52.474 154.344 -14.172
3916 91.598 51.880 149.797-139.896
3917 92.577 85.347 102.146-103.643
3918 93.667 -82.006 134.445 -21.063
3919 94.823 166.612 0.000 0.000
3920 135.817 -50.310 0.000 0.000
3921 110.394 -30.603 126.376-139.490
3922 91.780 93.881 113.014 -74.334
3923 91.889 -20.730 104.908 -77.056
3924 110.891 -34.158 0.000 0.000
3925 132.621 -73.615 81.382 -66.700
3926 117.137-109.550 123.668-130.336
3927 118.173-137.381 116.875-119.338
3928 93.100 58.244 102.803-111.681
3929 93.334 0.000 115.691 -76.675
3930 # 188 total E -2.05303E+02 rmsd from N 0.000 %NC 0.00 0
3931 93.638 50.577 110.259 -80.666
3932 92.459 159.725 150.896 148.762
3933 92.929 81.339 149.552 44.305
3934 92.648 44.365 107.119-101.803
3935 91.584 54.709 128.176 -90.686
3936 93.064 59.798 154.620 -0.241
3937 91.986 68.688 163.467-138.908
3938 109.919 -72.201 114.000-125.258
3939 121.133-173.688 144.884 9.803
3940 132.164 -58.446 0.000 0.000
3941 128.677 -50.213 0.000 0.000
3942 109.020 -31.873 122.451-134.150
3943 91.296 96.478 113.323 -74.445
3944 91.598 -20.469 102.852 -78.404
3945 107.135 -44.544 0.000 0.000
3946 131.377 -60.402 99.133-118.401
3947 119.250-113.033 116.363-122.937
3948 118.408-136.239 117.111-119.453
3949 93.172 58.666 128.400-150.347
3950 93.332 0.000 115.559 -76.590
3951 # 189 total E -2.08503E+02 rmsd from N 0.000 %NC 0.00 0
3952 93.639 49.093 109.165 -80.035
3953 92.500 161.246 165.269 167.887
3954 92.444 76.924 166.801 11.651
3955 92.567 43.261 98.061 -75.665
3956 91.614 50.321 144.231-121.332
3957 92.453 47.671 137.654 -69.963
3958 91.962 59.112 163.141-165.133
3959 93.137 137.285 104.381 118.636
3960 117.847 -64.557 136.976 -31.169
3961 127.131 -15.382 0.000 0.000
3962 129.518 -62.829 0.000 0.000
3963 102.252 -29.507 126.609-144.374
3964 91.106 95.143 112.933 -74.212
3965 91.105 -15.859 110.514 -75.861
3966 101.641 -63.217 0.000 0.000
3967 126.389 -48.192 151.728 -59.009
3968 119.264-143.849 119.405-127.177
3969 119.639-114.572 107.997-105.034
3970 92.973 62.211 105.245-120.516
3971 93.331 0.000 114.705 -76.759
3972 # 190 total E -2.03770E+02 rmsd from N 0.000 %NC 0.00 0
3973 93.660 122.947 109.020 -81.183
3974 119.303-117.761 148.024 -30.873
3975 92.550 59.214 133.391 108.586
3976 92.229 45.442 141.772 -88.163
3977 91.563 44.514 132.757 -62.566
3978 93.083 60.037 154.862 -2.978
3979 91.930 67.509 148.616-139.711
3980 109.715 -70.498 113.281-120.673
3981 121.395-173.613 145.074 9.825
3982 132.110 -58.397 0.000 0.000
3983 128.674 -50.265 0.000 0.000
3984 109.044 -31.947 122.418-134.086
3985 91.290 96.404 113.321 -74.446
3986 91.599 -20.375 102.819 -78.419
3987 107.179 -44.580 0.000 0.000
3988 131.344 -60.399 99.084-118.250
3989 119.261-113.035 116.486-123.090
3990 118.418-136.243 117.138-119.460
3991 93.167 58.726 128.476-150.421
3992 93.333 0.000 115.560 -76.591
3993 # 191 total E -2.01845E+02 rmsd from N 0.000 %NC 0.00 0
3994 93.657 122.644 109.044 -81.092
3995 119.138-116.580 148.571 -30.884
3996 92.472 56.876 133.799 107.249
3997 92.114 43.271 137.509 -82.218
3998 91.531 44.583 140.180-158.191
3999 92.363 49.909 150.142 3.834
4000 91.960 59.848 151.111-134.084
4001 92.922 136.410 106.857 119.665
4002 118.577 -63.101 134.995 -37.745
4003 127.028 -14.859 0.000 0.000
4004 129.550 -62.925 0.000 0.000
4005 102.216 -29.594 126.761-144.658
4006 91.089 95.028 112.917 -74.199
4007 91.099 -15.703 110.466 -75.969
4008 101.626 -63.582 0.000 0.000
4009 126.244 -48.122 155.279 -46.823
4010 119.230-143.724 118.439-124.568
4011 120.234-108.259 108.136-105.105
4012 117.602-110.153 121.534-129.317
4013 94.587 0.000 116.544 -76.832
4014 # 192 total E -2.04281E+02 rmsd from N 0.000 %NC 0.00 0
4015 93.659 122.873 109.017 -81.193
4016 119.284-117.593 147.446 -30.928
4017 92.482 56.600 132.723 109.492
4018 92.069 45.206 140.803 -86.624
4019 91.368 43.235 130.515 -55.194
4020 92.341 54.191 154.102 -4.084
4021 91.289 54.143 149.120-140.037
4022 91.989 64.878 102.665-108.102
4023 93.258 156.434 132.587 -0.105
4024 94.252 124.109 0.000 0.000
4025 132.987 -61.416 0.000 0.000
4026 111.394 -37.154 125.231-137.279
4027 91.523 91.069 113.240 -74.437
4028 91.947 -17.791 103.701 -78.105
4029 111.415 -30.642 0.000 0.000
4030 133.273 -78.752 100.947 -61.185
4031 117.786-112.868 123.173-129.129
4032 117.996-116.586 115.797-117.613
4033 117.593-115.850 126.806-134.839
4034 121.610 0.000 121.483 -79.831
4035 # 193 total E -2.00606E+02 rmsd from N 0.000 %NC 0.00 0
4036 93.638 48.864 109.473 -80.537
4037 92.587 83.544 157.860 171.554
4038 93.748 112.365 125.590 -40.156
4039 124.559 -93.251 93.928 -91.946
4040 91.233 70.663 121.489-103.011
4041 92.358 56.913 152.919 -23.568
4042 91.412 70.335 135.639 -64.678
4043 92.253 57.972 113.403-128.798
4044 93.476 103.041 138.608 5.767
4045 130.738 -14.712 0.000 0.000
4046 125.890 -69.027 0.000 0.000
4047 112.247 -51.517 111.180-115.533
4048 89.668 75.948 112.316 -74.206
4049 90.880 2.302 110.099 -76.534
4050 102.205 -73.208 0.000 0.000
4051 128.827 -46.097 152.102 33.176
4052 121.588-151.756 109.164-109.171
4053 119.608-107.946 108.428-106.606
4054 117.691-115.820 120.572-126.661
4055 121.619 0.000 121.476 -79.880
4056 # 194 total E -2.04412E+02 rmsd from N 0.000 %NC 0.00 0
4057 93.638 40.529 107.442 -80.451
4058 92.835 153.116 155.276-120.160
4059 130.979 -96.963 106.748 -97.886
4060 93.949 42.618 165.797-173.104
4061 91.743 43.227 133.035 -74.682
4062 92.555 58.724 154.620 -2.674
4063 91.322 45.522 140.853-117.980
4064 92.800 70.201 95.541-104.972
4065 93.687-102.650 137.384 -17.916
4066 94.755 157.528 0.000 0.000
4067 134.035 -57.142 0.000 0.000
4068 92.066 64.413 104.688 -94.170
4069 92.398 33.554 111.966 -80.590
4070 95.332-115.605 110.793 -82.406
4071 95.608 153.317 0.000 0.000
4072 130.392-103.252 102.396 -54.929
4073 116.933-106.152 126.167-135.032
4074 118.103-139.241 110.385-110.861
4075 93.085 57.776 106.286-116.350
4076 93.331 0.000 115.830 -76.585
4077 # 195 total E -2.10272E+02 rmsd from N 0.000 %NC 0.00 0
4078 93.636 49.330 109.109 -80.024
4079 92.507 161.818 165.220 164.978
4080 92.343 78.299 166.735 16.753
4081 92.240 43.114 100.293 -77.612
4082 91.300 49.131 141.735-122.893
4083 92.078 42.161 140.796 -45.193
4084 91.503 58.377 162.001-178.581
4085 91.866 73.328 89.434 -59.326
4086 93.319 101.686 135.122 -2.864
4087 128.706 -16.656 0.000 0.000
4088 125.745 -70.706 0.000 0.000
4089 110.810 -51.803 97.736 -86.847
4090 89.837 77.114 112.568 -74.437
4091 90.745 1.215 110.439 -76.303
4092 102.503 -70.786 0.000 0.000
4093 129.704 -45.004 139.922 173.279
4094 121.240-152.804 105.030-107.374
4095 119.458-107.861 109.950-109.322
4096 117.719-115.830 119.024-124.175
4097 121.617 0.000 121.470 -79.887
4098 # 196 total E -2.02199E+02 rmsd from N 0.000 %NC 0.00 0
4099 93.638 49.696 109.395 -80.155
4100 92.496 160.611 160.517 161.169
4101 92.741 81.056 163.721 23.610
4102 92.487 42.144 102.976 -86.832
4103 91.479 52.708 125.177 -80.271
4104 92.538 55.523 152.519 -1.127
4105 91.401 52.886 165.286 177.294
4106 91.982 64.365 100.926-110.200
4107 93.224 148.051 136.075 -21.071
4108 94.587 126.394 0.000 0.000
4109 135.223 -58.826 0.000 0.000
4110 109.404 -30.315 123.853-136.060
4111 91.941 91.649 113.278 -74.558
4112 91.704 -17.631 102.446 -81.241
4113 106.970 -78.262 0.000 0.000
4114 131.028-111.127 109.828 -49.855
4115 117.026-106.352 129.811-140.903
4116 118.104-137.874 110.888-111.347
4117 93.125 58.061 102.768-110.199
4118 93.332 0.000 115.805 -76.582
4119 # 197 total E -2.04145E+02 rmsd from N 0.000 %NC 0.00 0
4120 93.638 48.786 109.196 -80.036
4121 92.502 161.305 163.911 163.954
4122 92.476 79.425 165.828 19.289
4123 92.262 43.352 101.000 -80.361
4124 91.315 50.680 124.121 -71.377
4125 92.318 48.063 150.839 -28.577
4126 91.626 58.506 161.660 177.537
4127 92.270 68.244 108.543-103.335
4128 93.432 136.149 136.533 -18.324
4129 134.543 -86.454 0.000 0.000
4130 130.052 -37.813 0.000 0.000
4131 92.233 68.352 100.651-104.477
4132 92.606 26.686 105.678 -74.984
4133 95.323-115.696 111.734 -80.932
4134 95.283 150.436 0.000 0.000
4135 132.495-102.721 105.220 -53.866
4136 116.255-104.001 123.763-131.718
4137 117.455-139.672 111.674-112.669
4138 93.268 57.859 126.903-151.962
4139 93.333 0.000 115.854 -76.479
4140 # 198 total E -2.04605E+02 rmsd from N 0.000 %NC 0.00 0
4141 93.638 49.863 109.348 -80.137
4142 92.497 159.651 161.270 161.938
4143 92.746 81.331 164.436 20.486
4144 92.669 41.066 100.416 -81.641
4145 91.563 59.378 114.382 -80.051
4146 92.854 53.888 146.194 -28.205
4147 92.679 114.610 156.783-154.094
4148 90.810 -29.674 136.750-146.785
4149 90.746 -55.495 110.926 -56.282
4150 94.250 10.826 0.000 0.000
4151 110.216 -61.048 0.000 0.000
4152 87.549 -29.595 101.103-104.283
4153 92.934 116.399 108.727 -77.354
4154 95.989 39.551 129.354-145.009
4155 95.971 76.703 0.000 0.000
4156 121.154 -90.332 122.919 -42.732
4157 117.330-106.994 124.467-131.890
4158 117.719-133.860 111.819-112.687
4159 117.452-115.803 132.780-145.592
4160 121.602 0.000 121.494 -79.778
4161 # 199 total E -2.00243E+02 rmsd from N 0.000 %NC 0.00 0
4162 93.634 49.979 111.625 -82.272
4163 92.477 88.777 137.195 140.043
4164 93.943 106.976 166.169 2.372
4165 126.582-100.838 111.721 -88.041
4166 91.329 66.830 121.001-126.530
4167 92.069 64.455 139.667 -46.470
4168 91.538 58.892 113.779 -68.529
4169 92.043 92.918 104.438 -95.175
4170 93.215 37.152 138.712 -12.557
4171 95.349 67.808 0.000 0.000
4172 130.874 -53.867 0.000 0.000
4173 92.356 68.966 100.148-103.953
4174 92.440 28.099 108.140 -75.885
4175 95.477-113.641 108.604 -81.999
4176 96.142 156.612 0.000 0.000
4177 128.729-103.059 103.194 -53.565
4178 117.338-107.122 126.656-135.315
4179 118.179-137.582 110.953-111.488
4180 93.130 58.022 102.885-110.325
4181 93.332 0.000 115.739 -76.577
4182 # 200 total E -2.10954E+02 rmsd from N 0.000 %NC 0.00 0
4183 93.636 48.133 109.589 -81.055
4184 92.635 171.079 147.844 -8.378
4185 92.824 75.117 150.420 97.434
4186 92.454 43.530 140.051 -83.627
4187 91.479 44.877 129.576 -44.304
4188 92.323 55.366 153.084 -9.299
4189 91.473 43.808 150.941-135.660
4190 92.972 71.180 95.516-101.680
4191 93.737 -94.214 140.366 -16.666
4192 94.585 154.842 0.000 0.000
4193 133.337 -50.142 0.000 0.000
4194 91.964 65.416 99.301 -95.146
4195 92.540 31.126 104.722 -74.464
4196 95.675-114.892 112.136 -81.280
4197 95.516 154.254 0.000 0.000
4198 129.935-104.473 104.134 -53.997
4199 117.096-106.608 125.997-134.776
4200 118.122-138.988 110.062-110.437
4201 93.093 57.775 105.364-114.773
4202 93.333 0.000 115.841 -76.587