Re: AMBER: parametrization problem

From: Carsten Detering <detering.u.washington.edu>
Date: Fri, 23 Jul 2004 13:33:01 -0700

Ross,

thanks for your help. I am pretty certain that I did not change the files.
I checked the off file, and the same thing, H1 got replaced by H0.
I attached both files, I hope this works. The leaprc.ff99 file is as of
February 7; I am using Amber 8.

Thanks for your help.

Carsten

Ross Walker wrote:
> Dear Carsten
>
>
>>For atom: .R<GLY 300>.A<HA3 5> Could not find type: H0
>>Parameter file was not saved.
>>
>>How come that it assigns type HO to these two atoms?
>>I didnt change anything neither in the leaprc file, nor the off file.
>
>
> Are you certain nothing was changed? Check the off file and see what atom
> types are assigned to these atoms. If these are regular glycine residues
> then those atoms should be type H1. Chances are something has changed in
> your off file. Also, check the leaprc.ff99 file, what is the modification
> date for this file?
>
> Something must have been changed in your files for this to happen. If you
> still have problems post you off file and leaprc.ff99 file and I'll take a
> look.
>
> All the best
> Ross
>
> /\
> \/
> |\oss Walker
>
> | Department of Molecular Biology TPC15 |
> | The Scripps Research Institute |
> | Tel:- +1 858 784 8889 | EMail:- ross.rosswalker.co.uk |
> | http://www.rosswalker.co.uk/ | PGP Key available on request |
>
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-- 
Carsten Detering
University of Washington
Seattle, WA 98195
Fon 206.543.5081
Fax 206.685.8665


!!index array str
 "complex2"
!entry.complex2.unit.atoms table str name str type int typex int resx int flags int seq int elmnt dbl chg
 "N" "N3" 0 1 131076 1 7 -0.202000
 "H2" "H" 0 1 131076 2 1 0.312000
 "H3" "H" 0 1 131076 3 1 0.312000
 "CD" "CT" 0 1 131076 4 6 -0.012000
 "HD2" "HP" 0 1 131076 5 1 0.100000
 "HD3" "HP" 0 1 131076 6 1 0.100000
 "CG" "CT" 0 1 131076 7 6 -0.121000
 "HG2" "HC" 0 1 131076 8 1 0.100000
 "HG3" "HC" 0 1 131076 9 1 0.100000
 "CB" "CT" 0 1 131076 10 6 -0.115000
 "HB2" "HC" 0 1 131076 11 1 0.100000
 "HB3" "HC" 0 1 131076 12 1 0.100000
 "CA" "CT" 0 1 131076 13 6 0.100000
 "HA" "HP" 0 1 131076 14 1 0.100000
 "C" "C" 0 1 131076 15 6 0.526000
 "O" "O" 0 1 131076 16 8 -0.500000
 "N" "N" 0 2 131076 1 7 -0.088116
 "CD" "CT" 0 2 131076 2 6 -0.011906
 "HD2" "H1" 0 2 131076 3 1 0.043951
 "HD3" "H1" 0 2 131076 4 1 0.043950
 "CG" "CT" 0 2 131076 5 6 0.013059
 "HG2" "HC" 0 2 131076 6 1 0.019574
 "HG3" "HC" 0 2 131076 7 1 0.019574
 "CB" "CT" 0 2 131076 8 6 -0.003351
 "HB2" "HC" 0 2 131076 9 1 0.019352
 "HB3" "HC" 0 2 131076 10 1 0.019352
 "CA" "CT" 0 2 131076 11 6 -0.034577
 "HA" "H1" 0 2 131076 12 1 0.059977
 "C" "C" 0 2 131076 13 6 0.333720
 "O" "O" 0 2 131076 14 8 -0.434559
 "N" "N" 0 3 131076 1 7 -0.528120
 "H" "H" 0 3 131076 2 1 0.281695
 "CA" "CT" 0 3 131076 3 6 0.031249
 "HA" "H1" 0 3 131076 4 1 0.085175
 "CB" "CT" 0 3 131076 5 6 -0.152267
 "HB2" "HC" 0 3 131076 6 1 0.054608
 "HB3" "HC" 0 3 131076 7 1 0.054608
 "CG" "CC" 0 3 131076 8 6 0.278406
 "ND1" "NB" 0 3 131076 9 7 -0.423316
 "CE1" "CR" 0 3 131076 10 6 0.025960
 "HE1" "H5" 0 3 131076 11 1 0.126832
 "NE2" "NA" 0 3 131076 12 7 -0.097984
 "HE2" "H" 0 3 131076 13 1 0.266865
 "CD2" "CW" 0 3 131076 14 6 -0.297563
 "HD2" "H4" 0 3 131076 15 1 0.160413
 "C" "C" 0 3 131076 16 6 0.662405
 "O" "O" 0 3 131076 17 8 -0.528966
 "N" "N" 0 4 131076 1 7 -0.374282
 "H" "H" 0 4 131076 2 1 0.253981
 "CA" "CT" 0 4 131076 3 6 -0.128844
 "HA2" "H0" 0 4 131076 4 1 0.088859
 "HA3" "H0" 0 4 131076 5 1 0.088859
 "C" "C" 0 4 131076 6 6 0.580584
 "O" "O" 0 4 131076 7 8 -0.509157
 "N" "N" 0 5 131076 1 7 -0.423392
 "H" "H" 0 5 131076 2 1 0.306811
 "CA" "CT" 0 5 131076 3 6 0.031633
 "HA" "H1" 0 5 131076 4 1 0.065100
 "CB" "CT" 0 5 131076 5 6 0.074772
 "HB2" "HC" 0 5 131076 6 1 -0.003535
 "HB3" "HC" 0 5 131076 7 1 -0.003535
 "CG" "CT" 0 5 131076 8 6 -0.033909
 "HG2" "HC" 0 5 131076 9 1 -0.004135
 "HG3" "HC" 0 5 131076 10 1 -0.004135
 "CD" "C" 0 5 131076 11 6 0.765188
 "OE1" "O2" 0 5 131076 12 8 -0.824035
 "OE2" "O2" 0 5 131076 13 8 -0.824035
 "C" "C" 0 5 131076 14 6 0.469735
 "O" "O" 0 5 131076 15 8 -0.592528
 "N" "N" 0 6 131076 1 7 -0.355153
 "H" "H" 0 6 131076 2 1 0.262417
 "CA" "CT" 0 6 131076 3 6 -0.101497
 "HA" "H1" 0 6 131076 4 1 0.136951
 "CB" "CT" 0 6 131076 5 6 -0.144399
 "HB2" "HC" 0 6 131076 6 1 0.052533
 "HB3" "HC" 0 6 131076 7 1 0.052533
 "CG" "CT" 0 6 131076 8 6 0.191982
 "HG" "HC" 0 6 131076 9 1 0.000825
 "CD1" "CT" 0 6 131076 10 6 -0.123036
 "HD11" "HC" 0 6 131076 11 1 0.022376
 "HD12" "HC" 0 6 131076 12 1 0.022376
 "HD13" "HC" 0 6 131076 13 1 0.022376
 "CD2" "CT" 0 6 131076 14 6 -0.123036
 "HD21" "HC" 0 6 131076 15 1 0.022376
 "HD22" "HC" 0 6 131076 16 1 0.022376
 "HD23" "HC" 0 6 131076 17 1 0.022376
 "C" "C" 0 6 131076 18 6 0.573471
 "O" "O" 0 6 131076 19 8 -0.557847
 "N" "N" 0 7 131076 1 7 -0.387353
 "H" "H" 0 7 131076 2 1 0.300605
 "CA" "CT" 0 7 131076 3 6 0.037470
 "HA" "H1" 0 7 131076 4 1 0.152255
 "CB" "CT" 0 7 131076 5 6 -0.032112
 "HB2" "HC" 0 7 131076 6 1 0.030995
 "HB3" "HC" 0 7 131076 7 1 0.030995
 "CG" "CT" 0 7 131076 8 6 -0.020264
 "HG2" "HC" 0 7 131076 9 1 0.030791
 "HG3" "HC" 0 7 131076 10 1 0.030791
 "CD" "C" 0 7 131076 11 6 0.667812
 "OE1" "O" 0 7 131076 12 8 -0.628483
 "NE2" "N" 0 7 131076 13 7 -0.883393
 "HE21" "H" 0 7 131076 14 1 0.408312
 "HE22" "H" 0 7 131076 15 1 0.408312
 "C" "C" 0 7 131076 16 6 0.418577
 "O" "O" 0 7 131076 17 8 -0.565310
 "N" "N" 0 8 131076 1 7 -0.487560
 "H" "H" 0 8 131076 2 1 0.263521
 "CA" "CT" 0 8 131076 3 6 0.009614
 "HA" "H1" 0 8 131076 4 1 0.095501
 "CB" "CT" 0 8 131076 5 6 -0.051853
 "HB2" "HC" 0 8 131076 6 1 0.019145
 "HB3" "HC" 0 8 131076 7 1 0.019145
 "CG" "CA" 0 8 131076 8 6 0.112601
 "CD1" "CA" 0 8 131076 9 6 -0.183461
 "HD1" "HA" 0 8 131076 10 1 0.132715
 "CE1" "CA" 0 8 131076 11 6 -0.181823
 "HE1" "HA" 0 8 131076 12 1 0.137303
 "CZ" "C" 0 8 131076 13 6 0.206277
 "OH" "OH" 0 8 131076 14 8 -0.421233
 "HH" "HO" 0 8 131076 15 1 0.329691
 "CE2" "CA" 0 8 131076 16 6 -0.181823
 "HE2" "HA" 0 8 131076 17 1 0.137303
 "CD2" "CA" 0 8 131076 18 6 -0.183461
 "HD2" "HA" 0 8 131076 19 1 0.132715
 "C" "C" 0 8 131076 20 6 0.622290
 "O" "O" 0 8 131076 21 8 -0.526607
 "N" "N" 0 9 131076 1 7 -0.355153
 "H" "H" 0 9 131076 2 1 0.262417
 "CA" "CT" 0 9 131076 3 6 -0.101497
 "HA" "H1" 0 9 131076 4 1 0.136951
 "CB" "CT" 0 9 131076 5 6 -0.144399
 "HB2" "HC" 0 9 131076 6 1 0.052533
 "HB3" "HC" 0 9 131076 7 1 0.052533
 "CG" "CT" 0 9 131076 8 6 0.191982
 "HG" "HC" 0 9 131076 9 1 0.000825
 "CD1" "CT" 0 9 131076 10 6 -0.123036
 "HD11" "HC" 0 9 131076 11 1 0.022376
 "HD12" "HC" 0 9 131076 12 1 0.022376
 "HD13" "HC" 0 9 131076 13 1 0.022376
 "CD2" "CT" 0 9 131076 14 6 -0.123036
 "HD21" "HC" 0 9 131076 15 1 0.022376
 "HD22" "HC" 0 9 131076 16 1 0.022376
 "HD23" "HC" 0 9 131076 17 1 0.022376
 "C" "C" 0 9 131076 18 6 0.573471
 "O" "O" 0 9 131076 19 8 -0.557847
 "N" "N" 0 10 131076 1 7 -0.374282
 "H" "H" 0 10 131076 2 1 0.253981
 "CA" "CT" 0 10 131076 3 6 -0.128844
 "HA2" "H0" 0 10 131076 4 1 0.088859
 "HA3" "H0" 0 10 131076 5 1 0.088859
 "C" "C" 0 10 131076 6 6 0.580584
 "O" "O" 0 10 131076 7 8 -0.509157
 "N" "N" 0 11 131076 1 7 -0.387353
 "H" "H" 0 11 131076 2 1 0.300605
 "CA" "CT" 0 11 131076 3 6 0.037470
 "HA" "H1" 0 11 131076 4 1 0.152255
 "CB" "CT" 0 11 131076 5 6 -0.032112
 "HB2" "HC" 0 11 131076 6 1 0.030995
 "HB3" "HC" 0 11 131076 7 1 0.030995
 "CG" "CT" 0 11 131076 8 6 -0.020264
 "HG2" "HC" 0 11 131076 9 1 0.030791
 "HG3" "HC" 0 11 131076 10 1 0.030791
 "CD" "C" 0 11 131076 11 6 0.667812
 "OE1" "O" 0 11 131076 12 8 -0.628483
 "NE2" "N" 0 11 131076 13 7 -0.883393
 "HE21" "H" 0 11 131076 14 1 0.408312
 "HE22" "H" 0 11 131076 15 1 0.408312
 "C" "C" 0 11 131076 16 6 0.418577
 "O" "O" 0 11 131076 17 8 -0.565310
 "N" "N" 0 12 131076 1 7 -0.451047
 "H" "H" 0 12 131076 2 1 0.328831
 "CA" "CT" 0 12 131076 3 6 -0.101874
 "HA" "H1" 0 12 131076 4 1 0.174193
 "CB" "CT" 0 12 131076 5 6 0.062238
 "HB" "HC" 0 12 131076 6 1 0.061662
 "CG2" "CT" 0 12 131076 7 6 -0.129989
 "HG21" "HC" 0 12 131076 8 1 0.030227
 "HG22" "HC" 0 12 131076 9 1 0.030227
 "HG23" "HC" 0 12 131076 10 1 0.030227
 "CG1" "CT" 0 12 131076 11 6 0.022230
 "HG12" "HC" 0 12 131076 12 1 0.011551
 "HG13" "HC" 0 12 131076 13 1 0.011551
 "CD1" "CT" 0 12 131076 14 6 -0.101251
 "HD11" "HC" 0 12 131076 15 1 0.023792
 "HD12" "HC" 0 12 131076 16 1 0.023792
 "HD13" "HC" 0 12 131076 17 1 0.023792
 "C" "C" 0 12 131076 18 6 0.569383
 "O" "O" 0 12 131076 19 8 -0.619535
 "N" "N" 0 13 131076 1 7 -0.387353
 "H" "H" 0 13 131076 2 1 0.300605
 "CA" "CT" 0 13 131076 3 6 0.037470
 "HA" "H1" 0 13 131076 4 1 0.152255
 "CB" "CT" 0 13 131076 5 6 -0.032112
 "HB2" "HC" 0 13 131076 6 1 0.030995
 "HB3" "HC" 0 13 131076 7 1 0.030995
 "CG" "CT" 0 13 131076 8 6 -0.020264
 "HG2" "HC" 0 13 131076 9 1 0.030791
 "HG3" "HC" 0 13 131076 10 1 0.030791
 "CD" "C" 0 13 131076 11 6 0.667812
 "OE1" "O" 0 13 131076 12 8 -0.628483
 "NE2" "N" 0 13 131076 13 7 -0.883393
 "HE21" "H" 0 13 131076 14 1 0.408312
 "HE22" "H" 0 13 131076 15 1 0.408312
 "C" "C" 0 13 131076 16 6 0.418577
 "O" "O" 0 13 131076 17 8 -0.565310
 "N" "N" 0 14 131076 1 7 -0.528120
 "H" "H" 0 14 131076 2 1 0.281695
 "CA" "CT" 0 14 131076 3 6 0.031249
 "HA" "H1" 0 14 131076 4 1 0.085175
 "CB" "CT" 0 14 131076 5 6 -0.152267
 "HB2" "HC" 0 14 131076 6 1 0.054608
 "HB3" "HC" 0 14 131076 7 1 0.054608
 "CG" "CC" 0 14 131076 8 6 0.278406
 "ND1" "NB" 0 14 131076 9 7 -0.423316
 "CE1" "CR" 0 14 131076 10 6 0.025960
 "HE1" "H5" 0 14 131076 11 1 0.126832
 "NE2" "NA" 0 14 131076 12 7 -0.097984
 "HE2" "H" 0 14 131076 13 1 0.266865
 "CD2" "CW" 0 14 131076 14 6 -0.297563
 "HD2" "H4" 0 14 131076 15 1 0.160413
 "C" "C" 0 14 131076 16 6 0.662405
 "O" "O" 0 14 131076 17 8 -0.528966
 "N" "N" 0 15 131076 1 7 -0.451047
 "H" "H" 0 15 131076 2 1 0.328831
 "CA" "CT" 0 15 131076 3 6 -0.101874
 "HA" "H1" 0 15 131076 4 1 0.174193
 "CB" "CT" 0 15 131076 5 6 0.062238
 "HB" "HC" 0 15 131076 6 1 0.061662
 "CG2" "CT" 0 15 131076 7 6 -0.129989
 "HG21" "HC" 0 15 131076 8 1 0.030227
 "HG22" "HC" 0 15 131076 9 1 0.030227
 "HG23" "HC" 0 15 131076 10 1 0.030227
 "CG1" "CT" 0 15 131076 11 6 0.022230
 "HG12" "HC" 0 15 131076 12 1 0.011551
 "HG13" "HC" 0 15 131076 13 1 0.011551
 "CD1" "CT" 0 15 131076 14 6 -0.101251
 "HD11" "HC" 0 15 131076 15 1 0.023792
 "HD12" "HC" 0 15 131076 16 1 0.023792
 "HD13" "HC" 0 15 131076 17 1 0.023792
 "C" "C" 0 15 131076 18 6 0.569383
 "O" "O" 0 15 131076 19 8 -0.619535
 "N" "N" 0 16 131076 1 7 -0.355153
 "H" "H" 0 16 131076 2 1 0.262417
 "CA" "CT" 0 16 131076 3 6 -0.101497
 "HA" "H1" 0 16 131076 4 1 0.136951
 "CB" "CT" 0 16 131076 5 6 -0.144399
 "HB2" "HC" 0 16 131076 6 1 0.052533
 "HB3" "HC" 0 16 131076 7 1 0.052533
 "CG" "CT" 0 16 131076 8 6 0.191982
 "HG" "HC" 0 16 131076 9 1 0.000825
 "CD1" "CT" 0 16 131076 10 6 -0.123036
 "HD11" "HC" 0 16 131076 11 1 0.022376
 "HD12" "HC" 0 16 131076 12 1 0.022376
 "HD13" "HC" 0 16 131076 13 1 0.022376
 "CD2" "CT" 0 16 131076 14 6 -0.123036
 "HD21" "HC" 0 16 131076 15 1 0.022376
 "HD22" "HC" 0 16 131076 16 1 0.022376
 "HD23" "HC" 0 16 131076 17 1 0.022376
 "C" "C" 0 16 131076 18 6 0.573471
 "O" "O" 0 16 131076 19 8 -0.557847
 "N" "N" 0 17 131076 1 7 -0.300879
 "H" "H" 0 17 131076 2 1 0.233693
 "CA" "CT" 0 17 131076 3 6 -0.131381
 "HA" "H1" 0 17 131076 4 1 0.053266
 "CB" "CT" 0 17 131076 5 6 0.036707
 "HB2" "HC" 0 17 131076 6 1 0.028012
 "HB3" "HC" 0 17 131076 7 1 0.028012
 "CG" "CT" 0 17 131076 8 6 0.012454
 "HG2" "HC" 0 17 131076 9 1 0.002964
 "HG3" "HC" 0 17 131076 10 1 0.002964
 "CD" "CT" 0 17 131076 11 6 0.126329
 "HD2" "H1" 0 17 131076 12 1 0.068148
 "HD3" "H1" 0 17 131076 13 1 0.068148
 "NE" "N2" 0 17 131076 14 7 -0.464890
 "HE" "H" 0 17 131076 15 1 0.326274
 "CZ" "CA" 0 17 131076 16 6 0.565543
 "NH1" "N2" 0 17 131076 17 7 -0.685774
 "HH11" "H" 0 17 131076 18 1 0.391052
 "HH12" "H" 0 17 131076 19 1 0.391052
 "NH2" "N2" 0 17 131076 20 7 -0.685774
 "HH21" "H" 0 17 131076 21 1 0.391052
 "HH22" "H" 0 17 131076 22 1 0.391052
 "C" "C" 0 17 131076 23 6 0.730308
 "O" "O" 0 17 131076 24 8 -0.578332
 "N" "N" 0 18 131076 1 7 -0.396165
 "H" "H" 0 18 131076 2 1 0.295187
 "CA" "CT" 0 18 131076 3 6 -0.073501
 "HA" "H1" 0 18 131076 4 1 0.140510
 "CB" "CT" 0 18 131076 5 6 -0.221371
 "HB2" "H1" 0 18 131076 6 1 0.146537
 "HB3" "H1" 0 18 131076 7 1 0.146537
 "SG" "SH" 0 18 131076 8 16 -0.285182
 "HG" "HS" 0 18 131076 9 1 0.189274
 "C" "C" 0 18 131076 10 6 0.643035
 "O" "O" 0 18 131076 11 8 -0.584861
 "N" "N" 0 19 131076 1 7 -0.374282
 "H" "H" 0 19 131076 2 1 0.253981
 "CA" "CT" 0 19 131076 3 6 -0.128844
 "HA2" "H0" 0 19 131076 4 1 0.088859
 "HA3" "H0" 0 19 131076 5 1 0.088859
 "C" "C" 0 19 131076 6 6 0.580584
 "O" "O" 0 19 131076 7 8 -0.509157
 "N" "N" 0 20 131076 1 7 -0.450087
 "H" "H" 0 20 131076 2 1 0.440048
 "CA" "CT" 0 20 131076 3 6 -0.051858
 "HA" "H1" 0 20 131076 4 1 -0.026204
 "CB" "CT" 0 20 131076 5 6 0.395217
 "HB" "HC" 0 20 131076 6 1 -0.115672
 "CG1" "CT" 0 20 131076 7 6 -0.090132
 "HG11" "HC" 0 20 131076 8 1 -0.008985
 "HG12" "HC" 0 20 131076 9 1 -0.008985
 "HG13" "HC" 0 20 131076 10 1 -0.008985
 "CG2" "CT" 0 20 131076 11 6 -0.090132
 "HG21" "HC" 0 20 131076 12 1 -0.008985
 "HG22" "HC" 0 20 131076 13 1 -0.008985
 "HG23" "HC" 0 20 131076 14 1 -0.008985
 "C" "C" 0 20 131076 15 6 0.447359
 "O" "O" 0 20 131076 16 8 -0.404629
 "N" "N" 0 21 131076 1 7 -0.300879
 "H" "H" 0 21 131076 2 1 0.233693
 "CA" "CT" 0 21 131076 3 6 -0.131381
 "HA" "H1" 0 21 131076 4 1 0.053266
 "CB" "CT" 0 21 131076 5 6 0.036707
 "HB2" "HC" 0 21 131076 6 1 0.028012
 "HB3" "HC" 0 21 131076 7 1 0.028012
 "CG" "CT" 0 21 131076 8 6 0.012454
 "HG2" "HC" 0 21 131076 9 1 0.002964
 "HG3" "HC" 0 21 131076 10 1 0.002964
 "CD" "CT" 0 21 131076 11 6 0.126329
 "HD2" "H1" 0 21 131076 12 1 0.068148
 "HD3" "H1" 0 21 131076 13 1 0.068148
 "NE" "N2" 0 21 131076 14 7 -0.464890
 "HE" "H" 0 21 131076 15 1 0.326274
 "CZ" "CA" 0 21 131076 16 6 0.565543
 "NH1" "N2" 0 21 131076 17 7 -0.685774
 "HH11" "H" 0 21 131076 18 1 0.391052
 "HH12" "H" 0 21 131076 19 1 0.391052
 "NH2" "N2" 0 21 131076 20 7 -0.685774
 "HH21" "H" 0 21 131076 21 1 0.391052
 "HH22" "H" 0 21 131076 22 1 0.391052
 "C" "C" 0 21 131076 23 6 0.730308
 "O" "O" 0 21 131076 24 8 -0.578332
 "N" "N" 0 22 131076 1 7 -0.435875
 "H" "H" 0 22 131076 2 1 0.251302
 "CA" "CT" 0 22 131076 3 6 -0.038773
 "HA" "H1" 0 22 131076 4 1 0.129478
 "CB" "CT" 0 22 131076 5 6 -0.108273
 "HB2" "HC" 0 22 131076 6 1 0.045214
 "HB3" "HC" 0 22 131076 7 1 0.045214
 "CG" "CT" 0 22 131076 8 6 0.033341
 "HG2" "HC" 0 22 131076 9 1 0.010208
 "HG3" "HC" 0 22 131076 10 1 0.010208
 "CD" "CT" 0 22 131076 11 6 -0.047841
 "HD2" "HC" 0 22 131076 12 1 0.070715
 "HD3" "HC" 0 22 131076 13 1 0.070715
 "CE" "CT" 0 22 131076 14 6 -0.069974
 "HE2" "HP" 0 22 131076 15 1 0.119522
 "HE3" "HP" 0 22 131076 16 1 0.119522
 "NZ" "N3" 0 22 131076 17 7 -0.250358
 "HZ1" "H" 0 22 131076 18 1 0.294561
 "HZ2" "H" 0 22 131076 19 1 0.294561
 "HZ3" "H" 0 22 131076 20 1 0.294561
 "C" "C" 0 22 131076 21 6 0.725129
 "O" "O" 0 22 131076 22 8 -0.563157
 "N" "N" 0 23 131076 1 7 -0.558201
 "H" "H" 0 23 131076 2 1 0.319676
 "CA" "CT" 0 23 131076 3 6 0.007225
 "HA" "H1" 0 23 131076 4 1 0.082375
 "CB" "CT" 0 23 131076 5 6 -0.047555
 "HB2" "HC" 0 23 131076 6 1 -0.014836
 "HB3" "HC" 0 23 131076 7 1 -0.014836
 "CG" "C" 0 23 131076 8 6 0.745168
 "OD1" "O2" 0 23 131076 9 8 -0.730385
 "OD2" "O2" 0 23 131076 10 8 -0.730385
 "C" "C" 0 23 131076 11 6 0.443199
 "O" "O" 0 23 131076 12 8 -0.501445
 "N" "N" 0 24 131076 1 7 -0.558201
 "H" "H" 0 24 131076 2 1 0.319676
 "CA" "CT" 0 24 131076 3 6 0.007225
 "HA" "H1" 0 24 131076 4 1 0.082375
 "CB" "CT" 0 24 131076 5 6 -0.047555
 "HB2" "HC" 0 24 131076 6 1 -0.014836
 "HB3" "HC" 0 24 131076 7 1 -0.014836
 "CG" "C" 0 24 131076 8 6 0.745168
 "OD1" "O2" 0 24 131076 9 8 -0.730385
 "OD2" "O2" 0 24 131076 10 8 -0.730385
 "C" "C" 0 24 131076 11 6 0.443199
 "O" "O" 0 24 131076 12 8 -0.501445
 "N" "N" 0 25 131076 1 7 -0.300879
 "H" "H" 0 25 131076 2 1 0.233693
 "CA" "CT" 0 25 131076 3 6 -0.131381
 "HA" "H1" 0 25 131076 4 1 0.053266
 "CB" "CT" 0 25 131076 5 6 0.036707
 "HB2" "HC" 0 25 131076 6 1 0.028012
 "HB3" "HC" 0 25 131076 7 1 0.028012
 "CG" "CT" 0 25 131076 8 6 0.012454
 "HG2" "HC" 0 25 131076 9 1 0.002964
 "HG3" "HC" 0 25 131076 10 1 0.002964
 "CD" "CT" 0 25 131076 11 6 0.126329
 "HD2" "H1" 0 25 131076 12 1 0.068148
 "HD3" "H1" 0 25 131076 13 1 0.068148
 "NE" "N2" 0 25 131076 14 7 -0.464890
 "HE" "H" 0 25 131076 15 1 0.326274
 "CZ" "CA" 0 25 131076 16 6 0.565543
 "NH1" "N2" 0 25 131076 17 7 -0.685774
 "HH11" "H" 0 25 131076 18 1 0.391052
 "HH12" "H" 0 25 131076 19 1 0.391052
 "NH2" "N2" 0 25 131076 20 7 -0.685774
 "HH21" "H" 0 25 131076 21 1 0.391052
 "HH22" "H" 0 25 131076 22 1 0.391052
 "C" "C" 0 25 131076 23 6 0.730308
 "O" "O" 0 25 131076 24 8 -0.578332
 "N" "N" 0 26 131076 1 7 -0.245382
 "H" "H" 0 26 131076 2 1 0.255339
 "CA" "CT" 0 26 131076 3 6 -0.271249
 "HA" "H1" 0 26 131076 4 1 0.163757
 "CB" "CT" 0 26 131076 5 6 0.237868
 "HB" "H1" 0 26 131076 6 1 0.044688
 "CG2" "CT" 0 26 131076 7 6 -0.176489
 "HG21" "HC" 0 26 131076 8 1 0.060019
 "HG22" "HC" 0 26 131076 9 1 0.060019
 "HG23" "HC" 0 26 131076 10 1 0.060019
 "OG1" "OH" 0 26 131076 11 8 -0.601931
 "HG1" "HO" 0 26 131076 12 1 0.405484
 "C" "C" 0 26 131076 13 6 0.559878
 "O" "O" 0 26 131076 14 8 -0.552020
 "N" "N" 0 27 131076 1 7 -0.374282
 "H" "H" 0 27 131076 2 1 0.253981
 "CA" "CT" 0 27 131076 3 6 -0.128844
 "HA2" "H0" 0 27 131076 4 1 0.088859
 "HA3" "H0" 0 27 131076 5 1 0.088859
 "C" "C" 0 27 131076 6 6 0.580584
 "O" "O" 0 27 131076 7 8 -0.509157
 "N" "N" 0 28 131076 1 7 -0.245382
 "H" "H" 0 28 131076 2 1 0.255339
 "CA" "CT" 0 28 131076 3 6 -0.271249
 "HA" "H1" 0 28 131076 4 1 0.163757
 "CB" "CT" 0 28 131076 5 6 0.237868
 "HB" "H1" 0 28 131076 6 1 0.044688
 "CG2" "CT" 0 28 131076 7 6 -0.176489
 "HG21" "HC" 0 28 131076 8 1 0.060019
 "HG22" "HC" 0 28 131076 9 1 0.060019
 "HG23" "HC" 0 28 131076 10 1 0.060019
 "OG1" "OH" 0 28 131076 11 8 -0.601931
 "HG1" "HO" 0 28 131076 12 1 0.405484
 "C" "C" 0 28 131076 13 6 0.559878
 "O" "O" 0 28 131076 14 8 -0.552020
 "N" "N" 0 29 131076 1 7 -0.374282
 "H" "H" 0 29 131076 2 1 0.253981
 "CA" "CT" 0 29 131076 3 6 -0.128844
 "HA2" "H0" 0 29 131076 4 1 0.088859
 "HA3" "H0" 0 29 131076 5 1 0.088859
 "C" "C" 0 29 131076 6 6 0.580584
 "O" "O" 0 29 131076 7 8 -0.509157
 "N" "N" 0 30 131076 1 7 -0.245382
 "H" "H" 0 30 131076 2 1 0.255339
 "CA" "CT" 0 30 131076 3 6 -0.271249
 "HA" "H1" 0 30 131076 4 1 0.163757
 "CB" "CT" 0 30 131076 5 6 0.237868
 "HB" "H1" 0 30 131076 6 1 0.044688
 "CG2" "CT" 0 30 131076 7 6 -0.176489
 "HG21" "HC" 0 30 131076 8 1 0.060019
 "HG22" "HC" 0 30 131076 9 1 0.060019
 "HG23" "HC" 0 30 131076 10 1 0.060019
 "OG1" "OH" 0 30 131076 11 8 -0.601931
 "HG1" "HO" 0 30 131076 12 1 0.405484
 "C" "C" 0 30 131076 13 6 0.559878
 "O" "O" 0 30 131076 14 8 -0.552020
 "N" "N" 0 31 131076 1 7 -0.355153
 "H" "H" 0 31 131076 2 1 0.262417
 "CA" "CT" 0 31 131076 3 6 -0.101497
 "HA" "H1" 0 31 131076 4 1 0.136951
 "CB" "CT" 0 31 131076 5 6 -0.144399
 "HB2" "HC" 0 31 131076 6 1 0.052533
 "HB3" "HC" 0 31 131076 7 1 0.052533
 "CG" "CT" 0 31 131076 8 6 0.191982
 "HG" "HC" 0 31 131076 9 1 0.000825
 "CD1" "CT" 0 31 131076 10 6 -0.123036
 "HD11" "HC" 0 31 131076 11 1 0.022376
 "HD12" "HC" 0 31 131076 12 1 0.022376
 "HD13" "HC" 0 31 131076 13 1 0.022376
 "CD2" "CT" 0 31 131076 14 6 -0.123036
 "HD21" "HC" 0 31 131076 15 1 0.022376
 "HD22" "HC" 0 31 131076 16 1 0.022376
 "HD23" "HC" 0 31 131076 17 1 0.022376
 "C" "C" 0 31 131076 18 6 0.573471
 "O" "O" 0 31 131076 19 8 -0.557847
 "N" "N" 0 32 131076 1 7 -0.541430
 "H" "H" 0 32 131076 2 1 0.345415
 "CA" "CT" 0 32 131076 3 6 0.118140
 "HA" "H1" 0 32 131076 4 1 0.142177
 "CB" "CT" 0 32 131076 5 6 0.146998
 "HB2" "H1" 0 32 131076 6 1 0.040081
 "HB3" "H1" 0 32 131076 7 1 0.040081
 "OG" "OH" 0 32 131076 8 8 -0.640312
 "HG" "HO" 0 32 131076 9 1 0.446255
 "C" "C" 0 32 131076 10 6 0.483424
 "O" "O" 0 32 131076 11 8 -0.580829
 "N" "N" 0 33 131076 1 7 -0.450087
 "H" "H" 0 33 131076 2 1 0.440048
 "CA" "CT" 0 33 131076 3 6 -0.051858
 "HA" "H1" 0 33 131076 4 1 -0.026204
 "CB" "CT" 0 33 131076 5 6 0.395217
 "HB" "HC" 0 33 131076 6 1 -0.115672
 "CG1" "CT" 0 33 131076 7 6 -0.090132
 "HG11" "HC" 0 33 131076 8 1 -0.008985
 "HG12" "HC" 0 33 131076 9 1 -0.008985
 "HG13" "HC" 0 33 131076 10 1 -0.008985
 "CG2" "CT" 0 33 131076 11 6 -0.090132
 "HG21" "HC" 0 33 131076 12 1 -0.008985
 "HG22" "HC" 0 33 131076 13 1 -0.008985
 "HG23" "HC" 0 33 131076 14 1 -0.008985
 "C" "C" 0 33 131076 15 6 0.447359
 "O" "O" 0 33 131076 16 8 -0.404629
 "N" "N" 0 34 131076 1 7 -0.371290
 "H" "H" 0 34 131076 2 1 0.234053
 "CA" "CT" 0 34 131076 3 6 -0.030057
 "HA" "H1" 0 34 131076 4 1 0.102448
 "CB" "CT" 0 34 131076 5 6 -0.098720
 "HB2" "HC" 0 34 131076 6 1 0.060989
 "HB3" "HC" 0 34 131076 7 1 0.060989
 "CG" "CA" 0 34 131076 8 6 0.021313
 "CD1" "CA" 0 34 131076 9 6 -0.083109
 "HD1" "HA" 0 34 131076 10 1 0.098466
 "CE1" "CA" 0 34 131076 11 6 -0.156974
 "HE1" "HA" 0 34 131076 12 1 0.123731
 "CZ" "CA" 0 34 131076 13 6 -0.099824
 "HZ" "HA" 0 34 131076 14 1 0.114679
 "CE2" "CA" 0 34 131076 15 6 -0.156974
 "HE2" "HA" 0 34 131076 16 1 0.123731
 "CD2" "CA" 0 34 131076 17 6 -0.083109
 "HD2" "HA" 0 34 131076 18 1 0.098466
 "C" "C" 0 34 131076 19 6 0.547987
 "O" "O" 0 34 131076 20 8 -0.506795
 "N" "N" 0 35 131076 1 7 -0.374282
 "H" "H" 0 35 131076 2 1 0.253981
 "CA" "CT" 0 35 131076 3 6 -0.128844
 "HA2" "H0" 0 35 131076 4 1 0.088859
 "HA3" "H0" 0 35 131076 5 1 0.088859
 "C" "C" 0 35 131076 6 6 0.580584
 "O" "O" 0 35 131076 7 8 -0.509157
 "N" "N" 0 36 131076 1 7 -0.394918
 "H" "H" 0 36 131076 2 1 0.280537
 "CA" "CT" 0 36 131076 3 6 -0.087681
 "HA" "H1" 0 36 131076 4 1 0.123080
 "CB" "CT" 0 36 131076 5 6 0.019227
 "HB2" "HC" 0 36 131076 6 1 0.048840
 "HB3" "HC" 0 36 131076 7 1 0.048840
 "CG" "CT" 0 36 131076 8 6 -0.208167
 "HG2" "H1" 0 36 131076 9 1 0.124228
 "HG3" "H1" 0 36 131076 10 1 0.124228
 "SD" "S" 0 36 131076 11 16 -0.211958
 "CE" "CT" 0 36 131076 12 6 -0.284698
 "HE1" "H1" 0 36 131076 13 1 0.128394
 "HE2" "H1" 0 36 131076 14 1 0.128394
 "HE3" "H1" 0 36 131076 15 1 0.128394
 "C" "C" 0 36 131076 16 6 0.599684
 "O" "O" 0 36 131076 17 8 -0.566424
 "N" "N" 0 37 131076 1 7 -0.387353
 "H" "H" 0 37 131076 2 1 0.300605
 "CA" "CT" 0 37 131076 3 6 0.037470
 "HA" "H1" 0 37 131076 4 1 0.152255
 "CB" "CT" 0 37 131076 5 6 -0.032112
 "HB2" "HC" 0 37 131076 6 1 0.030995
 "HB3" "HC" 0 37 131076 7 1 0.030995
 "CG" "CT" 0 37 131076 8 6 -0.020264
 "HG2" "HC" 0 37 131076 9 1 0.030791
 "HG3" "HC" 0 37 131076 10 1 0.030791
 "CD" "C" 0 37 131076 11 6 0.667812
 "OE1" "O" 0 37 131076 12 8 -0.628483
 "NE2" "N" 0 37 131076 13 7 -0.883393
 "HE21" "H" 0 37 131076 14 1 0.408312
 "HE22" "H" 0 37 131076 15 1 0.408312
 "C" "C" 0 37 131076 16 6 0.418577
 "O" "O" 0 37 131076 17 8 -0.565310
 "N" "N" 0 38 131076 1 7 -0.404773
 "H" "H" 0 38 131076 2 1 0.294276
 "CA" "CT" 0 38 131076 3 6 -0.027733
 "HA" "H1" 0 38 131076 4 1 0.120802
 "CB" "CT" 0 38 131076 5 6 -0.229951
 "HB1" "HC" 0 38 131076 6 1 0.077428
 "HB2" "HC" 0 38 131076 7 1 0.077428
 "HB3" "HC" 0 38 131076 8 1 0.077428
 "C" "C" 0 38 131076 9 6 0.570224
 "O" "O" 0 38 131076 10 8 -0.555129
 "N" "N" 0 39 131076 1 7 -0.300879
 "H" "H" 0 39 131076 2 1 0.233693
 "CA" "CT" 0 39 131076 3 6 -0.131381
 "HA" "H1" 0 39 131076 4 1 0.053266
 "CB" "CT" 0 39 131076 5 6 0.036707
 "HB2" "HC" 0 39 131076 6 1 0.028012
 "HB3" "HC" 0 39 131076 7 1 0.028012
 "CG" "CT" 0 39 131076 8 6 0.012454
 "HG2" "HC" 0 39 131076 9 1 0.002964
 "HG3" "HC" 0 39 131076 10 1 0.002964
 "CD" "CT" 0 39 131076 11 6 0.126329
 "HD2" "H1" 0 39 131076 12 1 0.068148
 "HD3" "H1" 0 39 131076 13 1 0.068148
 "NE" "N2" 0 39 131076 14 7 -0.464890
 "HE" "H" 0 39 131076 15 1 0.326274
 "CZ" "CA" 0 39 131076 16 6 0.565543
 "NH1" "N2" 0 39 131076 17 7 -0.685774
 "HH11" "H" 0 39 131076 18 1 0.391052
 "HH12" "H" 0 39 131076 19 1 0.391052
 "NH2" "N2" 0 39 131076 20 7 -0.685774
 "HH21" "H" 0 39 131076 21 1 0.391052
 "HH22" "H" 0 39 131076 22 1 0.391052
 "C" "C" 0 39 131076 23 6 0.730308
 "O" "O" 0 39 131076 24 8 -0.578332
 "N" "N" 0 40 131076 1 7 -0.487560
 "H" "H" 0 40 131076 2 1 0.263521
 "CA" "CT" 0 40 131076 3 6 0.009614
 "HA" "H1" 0 40 131076 4 1 0.095501
 "CB" "CT" 0 40 131076 5 6 -0.051853
 "HB2" "HC" 0 40 131076 6 1 0.019145
 "HB3" "HC" 0 40 131076 7 1 0.019145
 "CG" "CA" 0 40 131076 8 6 0.112601
 "CD1" "CA" 0 40 131076 9 6 -0.183461
 "HD1" "HA" 0 40 131076 10 1 0.132715
 "CE1" "CA" 0 40 131076 11 6 -0.181823
 "HE1" "HA" 0 40 131076 12 1 0.137303
 "CZ" "C" 0 40 131076 13 6 0.206277
 "OH" "OH" 0 40 131076 14 8 -0.421233
 "HH" "HO" 0 40 131076 15 1 0.329691
 "CE2" "CA" 0 40 131076 16 6 -0.181823
 "HE2" "HA" 0 40 131076 17 1 0.137303
 "CD2" "CA" 0 40 131076 18 6 -0.183461
 "HD2" "HA" 0 40 131076 19 1 0.132715
 "C" "C" 0 40 131076 20 6 0.622290
 "O" "O" 0 40 131076 21 8 -0.526607
 "N" "N" 0 41 131076 1 7 -0.541430
 "H" "H" 0 41 131076 2 1 0.345415
 "CA" "CT" 0 41 131076 3 6 0.118140
 "HA" "H1" 0 41 131076 4 1 0.142177
 "CB" "CT" 0 41 131076 5 6 0.146998
 "HB2" "H1" 0 41 131076 6 1 0.040081
 "HB3" "H1" 0 41 131076 7 1 0.040081
 "OG" "OH" 0 41 131076 8 8 -0.640312
 "HG" "HO" 0 41 131076 9 1 0.446255
 "C" "C" 0 41 131076 10 6 0.483424
 "O" "O" 0 41 131076 11 8 -0.580829
 "N" "N" 0 42 131076 1 7 -0.355153
 "H" "H" 0 42 131076 2 1 0.262417
 "CA" "CT" 0 42 131076 3 6 -0.101497
 "HA" "H1" 0 42 131076 4 1 0.136951
 "CB" "CT" 0 42 131076 5 6 -0.144399
 "HB2" "HC" 0 42 131076 6 1 0.052533
 "HB3" "HC" 0 42 131076 7 1 0.052533
 "CG" "CT" 0 42 131076 8 6 0.191982
 "HG" "HC" 0 42 131076 9 1 0.000825
 "CD1" "CT" 0 42 131076 10 6 -0.123036
 "HD11" "HC" 0 42 131076 11 1 0.022376
 "HD12" "HC" 0 42 131076 12 1 0.022376
 "HD13" "HC" 0 42 131076 13 1 0.022376
 "CD2" "CT" 0 42 131076 14 6 -0.123036
 "HD21" "HC" 0 42 131076 15 1 0.022376
 "HD22" "HC" 0 42 131076 16 1 0.022376
 "HD23" "HC" 0 42 131076 17 1 0.022376
 "C" "C" 0 42 131076 18 6 0.573471
 "O" "O" 0 42 131076 19 8 -0.557847
 "N" "N" 0 43 131076 1 7 -0.300879
 "H" "H" 0 43 131076 2 1 0.233693
 "CA" "CT" 0 43 131076 3 6 -0.131381
 "HA" "H1" 0 43 131076 4 1 0.053266
 "CB" "CT" 0 43 131076 5 6 0.036707
 "HB2" "HC" 0 43 131076 6 1 0.028012
 "HB3" "HC" 0 43 131076 7 1 0.028012
 "CG" "CT" 0 43 131076 8 6 0.012454
 "HG2" "HC" 0 43 131076 9 1 0.002964
 "HG3" "HC" 0 43 131076 10 1 0.002964
 "CD" "CT" 0 43 131076 11 6 0.126329
 "HD2" "H1" 0 43 131076 12 1 0.068148
 "HD3" "H1" 0 43 131076 13 1 0.068148
 "NE" "N2" 0 43 131076 14 7 -0.464890
 "HE" "H" 0 43 131076 15 1 0.326274
 "CZ" "CA" 0 43 131076 16 6 0.565543
 "NH1" "N2" 0 43 131076 17 7 -0.685774
 "HH11" "H" 0 43 131076 18 1 0.391052
 "HH12" "H" 0 43 131076 19 1 0.391052
 "NH2" "N2" 0 43 131076 20 7 -0.685774
 "HH21" "H" 0 43 131076 21 1 0.391052
 "HH22" "H" 0 43 131076 22 1 0.391052
 "C" "C" 0 43 131076 23 6 0.730308
 "O" "O" 0 43 131076 24 8 -0.578332
 "N" "N" 0 44 131076 1 7 -0.558201
 "H" "H" 0 44 131076 2 1 0.319676
 "CA" "CT" 0 44 131076 3 6 0.007225
 "HA" "H1" 0 44 131076 4 1 0.082375
 "CB" "CT" 0 44 131076 5 6 -0.047555
 "HB2" "HC" 0 44 131076 6 1 -0.014836
 "HB3" "HC" 0 44 131076 7 1 -0.014836
 "CG" "C" 0 44 131076 8 6 0.745168
 "OD1" "O2" 0 44 131076 9 8 -0.730385
 "OD2" "O2" 0 44 131076 10 8 -0.730385
 "C" "C" 0 44 131076 11 6 0.443199
 "O" "O" 0 44 131076 12 8 -0.501445
 "N" "N" 0 45 131076 1 7 -0.423392
 "H" "H" 0 45 131076 2 1 0.306811
 "CA" "CT" 0 45 131076 3 6 0.031633
 "HA" "H1" 0 45 131076 4 1 0.065100
 "CB" "CT" 0 45 131076 5 6 0.074772
 "HB2" "HC" 0 45 131076 6 1 -0.003535
 "HB3" "HC" 0 45 131076 7 1 -0.003535
 "CG" "CT" 0 45 131076 8 6 -0.033909
 "HG2" "HC" 0 45 131076 9 1 -0.004135
 "HG3" "HC" 0 45 131076 10 1 -0.004135
 "CD" "C" 0 45 131076 11 6 0.765188
 "OE1" "O2" 0 45 131076 12 8 -0.824035
 "OE2" "O2" 0 45 131076 13 8 -0.824035
 "C" "C" 0 45 131076 14 6 0.469735
 "O" "O" 0 45 131076 15 8 -0.592528
 "N" "N" 0 46 131076 1 7 -0.371290
 "H" "H" 0 46 131076 2 1 0.234053
 "CA" "CT" 0 46 131076 3 6 -0.030057
 "HA" "H1" 0 46 131076 4 1 0.102448
 "CB" "CT" 0 46 131076 5 6 -0.098720
 "HB2" "HC" 0 46 131076 6 1 0.060989
 "HB3" "HC" 0 46 131076 7 1 0.060989
 "CG" "CA" 0 46 131076 8 6 0.021313
 "CD1" "CA" 0 46 131076 9 6 -0.083109
 "HD1" "HA" 0 46 131076 10 1 0.098466
 "CE1" "CA" 0 46 131076 11 6 -0.156974
 "HE1" "HA" 0 46 131076 12 1 0.123731
 "CZ" "CA" 0 46 131076 13 6 -0.099824
 "HZ" "HA" 0 46 131076 14 1 0.114679
 "CE2" "CA" 0 46 131076 15 6 -0.156974
 "HE2" "HA" 0 46 131076 16 1 0.123731
 "CD2" "CA" 0 46 131076 17 6 -0.083109
 "HD2" "HA" 0 46 131076 18 1 0.098466
 "C" "C" 0 46 131076 19 6 0.547987
 "O" "O" 0 46 131076 20 8 -0.506795
 "N" "N" 0 47 131076 1 7 -0.088116
 "CD" "CT" 0 47 131076 2 6 -0.011906
 "HD2" "H1" 0 47 131076 3 1 0.043951
 "HD3" "H1" 0 47 131076 4 1 0.043950
 "CG" "CT" 0 47 131076 5 6 0.013059
 "HG2" "HC" 0 47 131076 6 1 0.019574
 "HG3" "HC" 0 47 131076 7 1 0.019574
 "CB" "CT" 0 47 131076 8 6 -0.003351
 "HB2" "HC" 0 47 131076 9 1 0.019352
 "HB3" "HC" 0 47 131076 10 1 0.019352
 "CA" "CT" 0 47 131076 11 6 -0.034577
 "HA" "H1" 0 47 131076 12 1 0.059977
 "C" "C" 0 47 131076 13 6 0.333720
 "O" "O" 0 47 131076 14 8 -0.434559
 "N" "N" 0 48 131076 1 7 -0.355153
 "H" "H" 0 48 131076 2 1 0.262417
 "CA" "CT" 0 48 131076 3 6 -0.101497
 "HA" "H1" 0 48 131076 4 1 0.136951
 "CB" "CT" 0 48 131076 5 6 -0.144399
 "HB2" "HC" 0 48 131076 6 1 0.052533
 "HB3" "HC" 0 48 131076 7 1 0.052533
 "CG" "CT" 0 48 131076 8 6 0.191982
 "HG" "HC" 0 48 131076 9 1 0.000825
 "CD1" "CT" 0 48 131076 10 6 -0.123036
 "HD11" "HC" 0 48 131076 11 1 0.022376
 "HD12" "HC" 0 48 131076 12 1 0.022376
 "HD13" "HC" 0 48 131076 13 1 0.022376
 "CD2" "CT" 0 48 131076 14 6 -0.123036
 "HD21" "HC" 0 48 131076 15 1 0.022376
 "HD22" "HC" 0 48 131076 16 1 0.022376
 "HD23" "HC" 0 48 131076 17 1 0.022376
 "C" "C" 0 48 131076 18 6 0.573471
 "O" "O" 0 48 131076 19 8 -0.557847
 "N" "N" 0 49 131076 1 7 -0.355153
 "H" "H" 0 49 131076 2 1 0.262417
 "CA" "CT" 0 49 131076 3 6 -0.101497
 "HA" "H1" 0 49 131076 4 1 0.136951
 "CB" "CT" 0 49 131076 5 6 -0.144399
 "HB2" "HC" 0 49 131076 6 1 0.052533
 "HB3" "HC" 0 49 131076 7 1 0.052533
 "CG" "CT" 0 49 131076 8 6 0.191982
 "HG" "HC" 0 49 131076 9 1 0.000825
 "CD1" "CT" 0 49 131076 10 6 -0.123036
 "HD11" "HC" 0 49 131076 11 1 0.022376
 "HD12" "HC" 0 49 131076 12 1 0.022376
 "HD13" "HC" 0 49 131076 13 1 0.022376
 "CD2" "CT" 0 49 131076 14 6 -0.123036
 "HD21" "HC" 0 49 131076 15 1 0.022376
 "HD22" "HC" 0 49 131076 16 1 0.022376
 "HD23" "HC" 0 49 131076 17 1 0.022376
 "C" "C" 0 49 131076 18 6 0.573471
 "O" "O" 0 49 131076 19 8 -0.557847
 "N" "N" 0 50 131076 1 7 -0.245382
 "H" "H" 0 50 131076 2 1 0.255339
 "CA" "CT" 0 50 131076 3 6 -0.271249
 "HA" "H1" 0 50 131076 4 1 0.163757
 "CB" "CT" 0 50 131076 5 6 0.237868
 "HB" "H1" 0 50 131076 6 1 0.044688
 "CG2" "CT" 0 50 131076 7 6 -0.176489
 "HG21" "HC" 0 50 131076 8 1 0.060019
 "HG22" "HC" 0 50 131076 9 1 0.060019
 "HG23" "HC" 0 50 131076 10 1 0.060019
 "OG1" "OH" 0 50 131076 11 8 -0.601931
 "HG1" "HO" 0 50 131076 12 1 0.405484
 "C" "C" 0 50 131076 13 6 0.559878
 "O" "O" 0 50 131076 14 8 -0.552020
 "N" "N" 0 51 131076 1 7 -0.245382
 "H" "H" 0 51 131076 2 1 0.255339
 "CA" "CT" 0 51 131076 3 6 -0.271249
 "HA" "H1" 0 51 131076 4 1 0.163757
 "CB" "CT" 0 51 131076 5 6 0.237868
 "HB" "H1" 0 51 131076 6 1 0.044688
 "CG2" "CT" 0 51 131076 7 6 -0.176489
 "HG21" "HC" 0 51 131076 8 1 0.060019
 "HG22" "HC" 0 51 131076 9 1 0.060019
 "HG23" "HC" 0 51 131076 10 1 0.060019
 "OG1" "OH" 0 51 131076 11 8 -0.601931
 "HG1" "HO" 0 51 131076 12 1 0.405484
 "C" "C" 0 51 131076 13 6 0.559878
 "O" "O" 0 51 131076 14 8 -0.552020
 "N" "N" 0 52 131076 1 7 -0.435875
 "H" "H" 0 52 131076 2 1 0.251302
 "CA" "CT" 0 52 131076 3 6 -0.038773
 "HA" "H1" 0 52 131076 4 1 0.129478
 "CB" "CT" 0 52 131076 5 6 -0.108273
 "HB2" "HC" 0 52 131076 6 1 0.045214
 "HB3" "HC" 0 52 131076 7 1 0.045214
 "CG" "CT" 0 52 131076 8 6 0.033341
 "HG2" "HC" 0 52 131076 9 1 0.010208
 "HG3" "HC" 0 52 131076 10 1 0.010208
 "CD" "CT" 0 52 131076 11 6 -0.047841
 "HD2" "HC" 0 52 131076 12 1 0.070715
 "HD3" "HC" 0 52 131076 13 1 0.070715
 "CE" "CT" 0 52 131076 14 6 -0.069974
 "HE2" "HP" 0 52 131076 15 1 0.119522
 "HE3" "HP" 0 52 131076 16 1 0.119522
 "NZ" "N3" 0 52 131076 17 7 -0.250358
 "HZ1" "H" 0 52 131076 18 1 0.294561
 "HZ2" "H" 0 52 131076 19 1 0.294561
 "HZ3" "H" 0 52 131076 20 1 0.294561
 "C" "C" 0 52 131076 21 6 0.725129
 "O" "O" 0 52 131076 22 8 -0.563157
 "N" "N" 0 53 131076 1 7 -0.300879
 "H" "H" 0 53 131076 2 1 0.233693
 "CA" "CT" 0 53 131076 3 6 -0.131381
 "HA" "H1" 0 53 131076 4 1 0.053266
 "CB" "CT" 0 53 131076 5 6 0.036707
 "HB2" "HC" 0 53 131076 6 1 0.028012
 "HB3" "HC" 0 53 131076 7 1 0.028012
 "CG" "CT" 0 53 131076 8 6 0.012454
 "HG2" "HC" 0 53 131076 9 1 0.002964
 "HG3" "HC" 0 53 131076 10 1 0.002964
 "CD" "CT" 0 53 131076 11 6 0.126329
 "HD2" "H1" 0 53 131076 12 1 0.068148
 "HD3" "H1" 0 53 131076 13 1 0.068148
 "NE" "N2" 0 53 131076 14 7 -0.464890
 "HE" "H" 0 53 131076 15 1 0.326274
 "CZ" "CA" 0 53 131076 16 6 0.565543
 "NH1" "N2" 0 53 131076 17 7 -0.685774
 "HH11" "H" 0 53 131076 18 1 0.391052
 "HH12" "H" 0 53 131076 19 1 0.391052
 "NH2" "N2" 0 53 131076 20 7 -0.685774
 "HH21" "H" 0 53 131076 21 1 0.391052
 "HH22" "H" 0 53 131076 22 1 0.391052
 "C" "C" 0 53 131076 23 6 0.730308
 "O" "O" 0 53 131076 24 8 -0.578332
 "N" "N" 0 54 131076 1 7 -0.450087
 "H" "H" 0 54 131076 2 1 0.440048
 "CA" "CT" 0 54 131076 3 6 -0.051858
 "HA" "H1" 0 54 131076 4 1 -0.026204
 "CB" "CT" 0 54 131076 5 6 0.395217
 "HB" "HC" 0 54 131076 6 1 -0.115672
 "CG1" "CT" 0 54 131076 7 6 -0.090132
 "HG11" "HC" 0 54 131076 8 1 -0.008985
 "HG12" "HC" 0 54 131076 9 1 -0.008985
 "HG13" "HC" 0 54 131076 10 1 -0.008985
 "CG2" "CT" 0 54 131076 11 6 -0.090132
 "HG21" "HC" 0 54 131076 12 1 -0.008985
 "HG22" "HC" 0 54 131076 13 1 -0.008985
 "HG23" "HC" 0 54 131076 14 1 -0.008985
 "C" "C" 0 54 131076 15 6 0.447359
 "O" "O" 0 54 131076 16 8 -0.404629
 "N" "N" 0 55 131076 1 7 -0.371290
 "H" "H" 0 55 131076 2 1 0.234053
 "CA" "CT" 0 55 131076 3 6 -0.030057
 "HA" "H1" 0 55 131076 4 1 0.102448
 "CB" "CT" 0 55 131076 5 6 -0.098720
 "HB2" "HC" 0 55 131076 6 1 0.060989
 "HB3" "HC" 0 55 131076 7 1 0.060989
 "CG" "CA" 0 55 131076 8 6 0.021313
 "CD1" "CA" 0 55 131076 9 6 -0.083109
 "HD1" "HA" 0 55 131076 10 1 0.098466
 "CE1" "CA" 0 55 131076 11 6 -0.156974
 "HE1" "HA" 0 55 131076 12 1 0.123731
 "CZ" "CA" 0 55 131076 13 6 -0.099824
 "HZ" "HA" 0 55 131076 14 1 0.114679
 "CE2" "CA" 0 55 131076 15 6 -0.156974
 "HE2" "HA" 0 55 131076 16 1 0.123731
 "CD2" "CA" 0 55 131076 17 6 -0.083109
 "HD2" "HA" 0 55 131076 18 1 0.098466
 "C" "C" 0 55 131076 19 6 0.547987
 "O" "O" 0 55 131076 20 8 -0.506795
 "N" "N" 0 56 131076 1 7 -0.427579
 "H" "H" 0 56 131076 2 1 0.241716
 "CA" "CT" 0 56 131076 3 6 -0.020082
 "HA" "H1" 0 56 131076 4 1 0.106629
 "CB" "CT" 0 56 131076 5 6 -0.098364
 "HB2" "HC" 0 56 131076 6 1 0.065424
 "HB3" "HC" 0 56 131076 7 1 0.065424
 "CG" "C*" 0 56 131076 8 6 -0.099797
 "CD1" "CW" 0 56 131076 9 6 -0.174053
 "HD1" "H4" 0 56 131076 10 1 0.170633
 "NE1" "NA" 0 56 131076 11 7 -0.298433
 "HE1" "H" 0 56 131076 12 1 0.322375
 "CE2" "CN" 0 56 131076 13 6 0.141523
 "CZ2" "CA" 0 56 131076 14 6 -0.210701
 "HZ2" "HA" 0 56 131076 15 1 0.125512
 "CH2" "CA" 0 56 131076 16 6 -0.133022
 "HH2" "HA" 0 56 131076 17 1 0.119467
 "CZ3" "CA" 0 56 131076 18 6 -0.164054
 "HZ3" "HA" 0 56 131076 19 1 0.119250
 "CE3" "CA" 0 56 131076 20 6 -0.153992
 "HE3" "HA" 0 56 131076 21 1 0.123084
 "CD2" "CB" 0 56 131076 22 6 0.089641
 "C" "C" 0 56 131076 23 6 0.584129
 "O" "O" 0 56 131076 24 8 -0.494730
 "N" "N" 0 57 131076 1 7 -0.435875
 "H" "H" 0 57 131076 2 1 0.251302
 "CA" "CT" 0 57 131076 3 6 -0.038773
 "HA" "H1" 0 57 131076 4 1 0.129478
 "CB" "CT" 0 57 131076 5 6 -0.108273
 "HB2" "HC" 0 57 131076 6 1 0.045214
 "HB3" "HC" 0 57 131076 7 1 0.045214
 "CG" "CT" 0 57 131076 8 6 0.033341
 "HG2" "HC" 0 57 131076 9 1 0.010208
 "HG3" "HC" 0 57 131076 10 1 0.010208
 "CD" "CT" 0 57 131076 11 6 -0.047841
 "HD2" "HC" 0 57 131076 12 1 0.070715
 "HD3" "HC" 0 57 131076 13 1 0.070715
 "CE" "CT" 0 57 131076 14 6 -0.069974
 "HE2" "HP" 0 57 131076 15 1 0.119522
 "HE3" "HP" 0 57 131076 16 1 0.119522
 "NZ" "N3" 0 57 131076 17 7 -0.250358
 "HZ1" "H" 0 57 131076 18 1 0.294561
 "HZ2" "H" 0 57 131076 19 1 0.294561
 "HZ3" "H" 0 57 131076 20 1 0.294561
 "C" "C" 0 57 131076 21 6 0.725129
 "O" "O" 0 57 131076 22 8 -0.563157
 "N" "N" 0 58 131076 1 7 -0.374282
 "H" "H" 0 58 131076 2 1 0.253981
 "CA" "CT" 0 58 131076 3 6 -0.128844
 "HA2" "H0" 0 58 131076 4 1 0.088859
 "HA3" "H0" 0 58 131076 5 1 0.088859
 "C" "C" 0 58 131076 6 6 0.580584
 "O" "O" 0 58 131076 7 8 -0.509157
 "N" "N" 0 59 131076 1 7 -0.450087
 "H" "H" 0 59 131076 2 1 0.440048
 "CA" "CT" 0 59 131076 3 6 -0.051858
 "HA" "H1" 0 59 131076 4 1 -0.026204
 "CB" "CT" 0 59 131076 5 6 0.395217
 "HB" "HC" 0 59 131076 6 1 -0.115672
 "CG1" "CT" 0 59 131076 7 6 -0.090132
 "HG11" "HC" 0 59 131076 8 1 -0.008985
 "HG12" "HC" 0 59 131076 9 1 -0.008985
 "HG13" "HC" 0 59 131076 10 1 -0.008985
 "CG2" "CT" 0 59 131076 11 6 -0.090132
 "HG21" "HC" 0 59 131076 12 1 -0.008985
 "HG22" "HC" 0 59 131076 13 1 -0.008985
 "HG23" "HC" 0 59 131076 14 1 -0.008985
 "C" "C" 0 59 131076 15 6 0.447359
 "O" "O" 0 59 131076 16 8 -0.404629
 "N" "N" 0 60 131076 1 7 -0.355153
 "H" "H" 0 60 131076 2 1 0.262417
 "CA" "CT" 0 60 131076 3 6 -0.101497
 "HA" "H1" 0 60 131076 4 1 0.136951
 "CB" "CT" 0 60 131076 5 6 -0.144399
 "HB2" "HC" 0 60 131076 6 1 0.052533
 "HB3" "HC" 0 60 131076 7 1 0.052533
 "CG" "CT" 0 60 131076 8 6 0.191982
 "HG" "HC" 0 60 131076 9 1 0.000825
 "CD1" "CT" 0 60 131076 10 6 -0.123036
 "HD11" "HC" 0 60 131076 11 1 0.022376
 "HD12" "HC" 0 60 131076 12 1 0.022376
 "HD13" "HC" 0 60 131076 13 1 0.022376
 "CD2" "CT" 0 60 131076 14 6 -0.123036
 "HD21" "HC" 0 60 131076 15 1 0.022376
 "HD22" "HC" 0 60 131076 16 1 0.022376
 "HD23" "HC" 0 60 131076 17 1 0.022376
 "C" "C" 0 60 131076 18 6 0.573471
 "O" "O" 0 60 131076 19 8 -0.557847
 "N" "N" 0 61 131076 1 7 -0.423392
 "H" "H" 0 61 131076 2 1 0.306811
 "CA" "CT" 0 61 131076 3 6 0.031633
 "HA" "H1" 0 61 131076 4 1 0.065100
 "CB" "CT" 0 61 131076 5 6 0.074772
 "HB2" "HC" 0 61 131076 6 1 -0.003535
 "HB3" "HC" 0 61 131076 7 1 -0.003535
 "CG" "CT" 0 61 131076 8 6 -0.033909
 "HG2" "HC" 0 61 131076 9 1 -0.004135
 "HG3" "HC" 0 61 131076 10 1 -0.004135
 "CD" "C" 0 61 131076 11 6 0.765188
 "OE1" "O2" 0 61 131076 12 8 -0.824035
 "OE2" "O2" 0 61 131076 13 8 -0.824035
 "C" "C" 0 61 131076 14 6 0.469735
 "O" "O" 0 61 131076 15 8 -0.592528
 "N" "N" 0 62 131076 1 7 -0.423392
 "H" "H" 0 62 131076 2 1 0.306811
 "CA" "CT" 0 62 131076 3 6 0.031633
 "HA" "H1" 0 62 131076 4 1 0.065100
 "CB" "CT" 0 62 131076 5 6 0.074772
 "HB2" "HC" 0 62 131076 6 1 -0.003535
 "HB3" "HC" 0 62 131076 7 1 -0.003535
 "CG" "CT" 0 62 131076 8 6 -0.033909
 "HG2" "HC" 0 62 131076 9 1 -0.004135
 "HG3" "HC" 0 62 131076 10 1 -0.004135
 "CD" "C" 0 62 131076 11 6 0.765188
 "OE1" "O2" 0 62 131076 12 8 -0.824035
 "OE2" "O2" 0 62 131076 13 8 -0.824035
 "C" "C" 0 62 131076 14 6 0.469735
 "O" "O" 0 62 131076 15 8 -0.592528
 "N" "N" 0 63 131076 1 7 -0.355153
 "H" "H" 0 63 131076 2 1 0.262417
 "CA" "CT" 0 63 131076 3 6 -0.101497
 "HA" "H1" 0 63 131076 4 1 0.136951
 "CB" "CT" 0 63 131076 5 6 -0.144399
 "HB2" "HC" 0 63 131076 6 1 0.052533
 "HB3" "HC" 0 63 131076 7 1 0.052533
 "CG" "CT" 0 63 131076 8 6 0.191982
 "HG" "HC" 0 63 131076 9 1 0.000825
 "CD1" "CT" 0 63 131076 10 6 -0.123036
 "HD11" "HC" 0 63 131076 11 1 0.022376
 "HD12" "HC" 0 63 131076 12 1 0.022376
 "HD13" "HC" 0 63 131076 13 1 0.022376
 "CD2" "CT" 0 63 131076 14 6 -0.123036
 "HD21" "HC" 0 63 131076 15 1 0.022376
 "HD22" "HC" 0 63 131076 16 1 0.022376
 "HD23" "HC" 0 63 131076 17 1 0.022376
 "C" "C" 0 63 131076 18 6 0.573471
 "O" "O" 0 63 131076 19 8 -0.557847
 "N" "N" 0 64 131076 1 7 -0.355153
 "H" "H" 0 64 131076 2 1 0.262417
 "CA" "CT" 0 64 131076 3 6 -0.101497
 "HA" "H1" 0 64 131076 4 1 0.136951
 "CB" "CT" 0 64 131076 5 6 -0.144399
 "HB2" "HC" 0 64 131076 6 1 0.052533
 "HB3" "HC" 0 64 131076 7 1 0.052533
 "CG" "CT" 0 64 131076 8 6 0.191982
 "HG" "HC" 0 64 131076 9 1 0.000825
 "CD1" "CT" 0 64 131076 10 6 -0.123036
 "HD11" "HC" 0 64 131076 11 1 0.022376
 "HD12" "HC" 0 64 131076 12 1 0.022376
 "HD13" "HC" 0 64 131076 13 1 0.022376
 "CD2" "CT" 0 64 131076 14 6 -0.123036
 "HD21" "HC" 0 64 131076 15 1 0.022376
 "HD22" "HC" 0 64 131076 16 1 0.022376
 "HD23" "HC" 0 64 131076 17 1 0.022376
 "C" "C" 0 64 131076 18 6 0.573471
 "O" "O" 0 64 131076 19 8 -0.557847
 "N" "N" 0 65 131076 1 7 -0.427579
 "H" "H" 0 65 131076 2 1 0.241716
 "CA" "CT" 0 65 131076 3 6 -0.020082
 "HA" "H1" 0 65 131076 4 1 0.106629
 "CB" "CT" 0 65 131076 5 6 -0.098364
 "HB2" "HC" 0 65 131076 6 1 0.065424
 "HB3" "HC" 0 65 131076 7 1 0.065424
 "CG" "C*" 0 65 131076 8 6 -0.099797
 "CD1" "CW" 0 65 131076 9 6 -0.174053
 "HD1" "H4" 0 65 131076 10 1 0.170633
 "NE1" "NA" 0 65 131076 11 7 -0.298433
 "HE1" "H" 0 65 131076 12 1 0.322375
 "CE2" "CN" 0 65 131076 13 6 0.141523
 "CZ2" "CA" 0 65 131076 14 6 -0.210701
 "HZ2" "HA" 0 65 131076 15 1 0.125512
 "CH2" "CA" 0 65 131076 16 6 -0.133022
 "HH2" "HA" 0 65 131076 17 1 0.119467
 "CZ3" "CA" 0 65 131076 18 6 -0.164054
 "HZ3" "HA" 0 65 131076 19 1 0.119250
 "CE3" "CA" 0 65 131076 20 6 -0.153992
 "HE3" "HA" 0 65 131076 21 1 0.123084
 "CD2" "CB" 0 65 131076 22 6 0.089641
 "C" "C" 0 65 131076 23 6 0.584129
 "O" "O" 0 65 131076 24 8 -0.494730
 "N" "N" 0 66 131076 1 7 -0.371290
 "H" "H" 0 66 131076 2 1 0.234053
 "CA" "CT" 0 66 131076 3 6 -0.030057
 "HA" "H1" 0 66 131076 4 1 0.102448
 "CB" "CT" 0 66 131076 5 6 -0.098720
 "HB2" "HC" 0 66 131076 6 1 0.060989
 "HB3" "HC" 0 66 131076 7 1 0.060989
 "CG" "CA" 0 66 131076 8 6 0.021313
 "CD1" "CA" 0 66 131076 9 6 -0.083109
 "HD1" "HA" 0 66 131076 10 1 0.098466
 "CE1" "CA" 0 66 131076 11 6 -0.156974
 "HE1" "HA" 0 66 131076 12 1 0.123731
 "CZ" "CA" 0 66 131076 13 6 -0.099824
 "HZ" "HA" 0 66 131076 14 1 0.114679
 "CE2" "CA" 0 66 131076 15 6 -0.156974
 "HE2" "HA" 0 66 131076 16 1 0.123731
 "CD2" "CA" 0 66 131076 17 6 -0.083109
 "HD2" "HA" 0 66 131076 18 1 0.098466
 "C" "C" 0 66 131076 19 6 0.547987
 "O" "O" 0 66 131076 20 8 -0.506795
 "N" "N" 0 67 131076 1 7 -0.451047
 "H" "H" 0 67 131076 2 1 0.328831
 "CA" "CT" 0 67 131076 3 6 -0.101874
 "HA" "H1" 0 67 131076 4 1 0.174193
 "CB" "CT" 0 67 131076 5 6 0.062238
 "HB" "HC" 0 67 131076 6 1 0.061662
 "CG2" "CT" 0 67 131076 7 6 -0.129989
 "HG21" "HC" 0 67 131076 8 1 0.030227
 "HG22" "HC" 0 67 131076 9 1 0.030227
 "HG23" "HC" 0 67 131076 10 1 0.030227
 "CG1" "CT" 0 67 131076 11 6 0.022230
 "HG12" "HC" 0 67 131076 12 1 0.011551
 "HG13" "HC" 0 67 131076 13 1 0.011551
 "CD1" "CT" 0 67 131076 14 6 -0.101251
 "HD11" "HC" 0 67 131076 15 1 0.023792
 "HD12" "HC" 0 67 131076 16 1 0.023792
 "HD13" "HC" 0 67 131076 17 1 0.023792
 "C" "C" 0 67 131076 18 6 0.569383
 "O" "O" 0 67 131076 19 8 -0.619535
 "N" "N" 0 68 131076 1 7 -0.435875
 "H" "H" 0 68 131076 2 1 0.251302
 "CA" "CT" 0 68 131076 3 6 -0.038773
 "HA" "H1" 0 68 131076 4 1 0.129478
 "CB" "CT" 0 68 131076 5 6 -0.108273
 "HB2" "HC" 0 68 131076 6 1 0.045214
 "HB3" "HC" 0 68 131076 7 1 0.045214
 "CG" "CT" 0 68 131076 8 6 0.033341
 "HG2" "HC" 0 68 131076 9 1 0.010208
 "HG3" "HC" 0 68 131076 10 1 0.010208
 "CD" "CT" 0 68 131076 11 6 -0.047841
 "HD2" "HC" 0 68 131076 12 1 0.070715
 "HD3" "HC" 0 68 131076 13 1 0.070715
 "CE" "CT" 0 68 131076 14 6 -0.069974
 "HE2" "HP" 0 68 131076 15 1 0.119522
 "HE3" "HP" 0 68 131076 16 1 0.119522
 "NZ" "N3" 0 68 131076 17 7 -0.250358
 "HZ1" "H" 0 68 131076 18 1 0.294561
 "HZ2" "H" 0 68 131076 19 1 0.294561
 "HZ3" "H" 0 68 131076 20 1 0.294561
 "C" "C" 0 68 131076 21 6 0.725129
 "O" "O" 0 68 131076 22 8 -0.563157
 "N" "N" 0 69 131076 1 7 -0.374282
 "H" "H" 0 69 131076 2 1 0.253981
 "CA" "CT" 0 69 131076 3 6 -0.128844
 "HA2" "H0" 0 69 131076 4 1 0.088859
 "HA3" "H0" 0 69 131076 5 1 0.088859
 "C" "C" 0 69 131076 6 6 0.580584
 "O" "O" 0 69 131076 7 8 -0.509157
 "N" "N" 0 70 131076 1 7 -0.541430
 "H" "H" 0 70 131076 2 1 0.345415
 "CA" "CT" 0 70 131076 3 6 0.118140
 "HA" "H1" 0 70 131076 4 1 0.142177
 "CB" "CT" 0 70 131076 5 6 0.146998
 "HB2" "H1" 0 70 131076 6 1 0.040081
 "HB3" "H1" 0 70 131076 7 1 0.040081
 "OG" "OH" 0 70 131076 8 8 -0.640312
 "HG" "HO" 0 70 131076 9 1 0.446255
 "C" "C" 0 70 131076 10 6 0.483424
 "O" "O" 0 70 131076 11 8 -0.580829
 "N" "N" 0 71 131076 1 7 -0.245382
 "H" "H" 0 71 131076 2 1 0.255339
 "CA" "CT" 0 71 131076 3 6 -0.271249
 "HA" "H1" 0 71 131076 4 1 0.163757
 "CB" "CT" 0 71 131076 5 6 0.237868
 "HB" "H1" 0 71 131076 6 1 0.044688
 "CG2" "CT" 0 71 131076 7 6 -0.176489
 "HG21" "HC" 0 71 131076 8 1 0.060019
 "HG22" "HC" 0 71 131076 9 1 0.060019
 "HG23" "HC" 0 71 131076 10 1 0.060019
 "OG1" "OH" 0 71 131076 11 8 -0.601931
 "HG1" "HO" 0 71 131076 12 1 0.405484
 "C" "C" 0 71 131076 13 6 0.559878
 "O" "O" 0 71 131076 14 8 -0.552020
 "N" "N" 0 72 131076 1 7 -0.430106
 "H" "H" 0 72 131076 2 1 0.254543
 "CA" "CT" 0 72 131076 3 6 0.044609
 "HA" "H1" 0 72 131076 4 1 0.059601
 "CB" "CT" 0 72 131076 5 6 -0.093650
 "HB2" "HC" 0 72 131076 6 1 0.043321
 "HB3" "HC" 0 72 131076 7 1 0.043321
 "CG" "C" 0 72 131076 8 6 0.583519
 "OD1" "O" 0 72 131076 9 8 -0.526813
 "ND2" "N" 0 72 131076 10 7 -0.781735
 "HD21" "H" 0 72 131076 11 1 0.355079
 "HD22" "H" 0 72 131076 12 1 0.355079
 "C" "C" 0 72 131076 13 6 0.617141
 "O" "O" 0 72 131076 14 8 -0.523909
 "N" "N" 0 73 131076 1 7 -0.404773
 "H" "H" 0 73 131076 2 1 0.294276
 "CA" "CT" 0 73 131076 3 6 -0.027733
 "HA" "H1" 0 73 131076 4 1 0.120802
 "CB" "CT" 0 73 131076 5 6 -0.229951
 "HB1" "HC" 0 73 131076 6 1 0.077428
 "HB2" "HC" 0 73 131076 7 1 0.077428
 "HB3" "HC" 0 73 131076 8 1 0.077428
 "C" "C" 0 73 131076 9 6 0.570224
 "O" "O" 0 73 131076 10 8 -0.555129
 "N" "N" 0 74 131076 1 7 -0.435875
 "H" "H" 0 74 131076 2 1 0.251302
 "CA" "CT" 0 74 131076 3 6 -0.038773
 "HA" "H1" 0 74 131076 4 1 0.129478
 "CB" "CT" 0 74 131076 5 6 -0.108273
 "HB2" "HC" 0 74 131076 6 1 0.045214
 "HB3" "HC" 0 74 131076 7 1 0.045214
 "CG" "CT" 0 74 131076 8 6 0.033341
 "HG2" "HC" 0 74 131076 9 1 0.010208
 "HG3" "HC" 0 74 131076 10 1 0.010208
 "CD" "CT" 0 74 131076 11 6 -0.047841
 "HD2" "HC" 0 74 131076 12 1 0.070715
 "HD3" "HC" 0 74 131076 13 1 0.070715
 "CE" "CT" 0 74 131076 14 6 -0.069974
 "HE2" "HP" 0 74 131076 15 1 0.119522
 "HE3" "HP" 0 74 131076 16 1 0.119522
 "NZ" "N3" 0 74 131076 17 7 -0.250358
 "HZ1" "H" 0 74 131076 18 1 0.294561
 "HZ2" "H" 0 74 131076 19 1 0.294561
 "HZ3" "H" 0 74 131076 20 1 0.294561
 "C" "C" 0 74 131076 21 6 0.725129
 "O" "O" 0 74 131076 22 8 -0.563157
 "N" "N" 0 75 131076 1 7 -0.423392
 "H" "H" 0 75 131076 2 1 0.306811
 "CA" "CT" 0 75 131076 3 6 0.031633
 "HA" "H1" 0 75 131076 4 1 0.065100
 "CB" "CT" 0 75 131076 5 6 0.074772
 "HB2" "HC" 0 75 131076 6 1 -0.003535
 "HB3" "HC" 0 75 131076 7 1 -0.003535
 "CG" "CT" 0 75 131076 8 6 -0.033909
 "HG2" "HC" 0 75 131076 9 1 -0.004135
 "HG3" "HC" 0 75 131076 10 1 -0.004135
 "CD" "C" 0 75 131076 11 6 0.765188
 "OE1" "O2" 0 75 131076 12 8 -0.824035
 "OE2" "O2" 0 75 131076 13 8 -0.824035
 "C" "C" 0 75 131076 14 6 0.469735
 "O" "O" 0 75 131076 15 8 -0.592528
 "N" "N" 0 76 131076 1 7 -0.355153
 "H" "H" 0 76 131076 2 1 0.262417
 "CA" "CT" 0 76 131076 3 6 -0.101497
 "HA" "H1" 0 76 131076 4 1 0.136951
 "CB" "CT" 0 76 131076 5 6 -0.144399
 "HB2" "HC" 0 76 131076 6 1 0.052533
 "HB3" "HC" 0 76 131076 7 1 0.052533
 "CG" "CT" 0 76 131076 8 6 0.191982
 "HG" "HC" 0 76 131076 9 1 0.000825
 "CD1" "CT" 0 76 131076 10 6 -0.123036
 "HD11" "HC" 0 76 131076 11 1 0.022376
 "HD12" "HC" 0 76 131076 12 1 0.022376
 "HD13" "HC" 0 76 131076 13 1 0.022376
 "CD2" "CT" 0 76 131076 14 6 -0.123036
 "HD21" "HC" 0 76 131076 15 1 0.022376
 "HD22" "HC" 0 76 131076 16 1 0.022376
 "HD23" "HC" 0 76 131076 17 1 0.022376
 "C" "C" 0 76 131076 18 6 0.573471
 "O" "O" 0 76 131076 19 8 -0.557847
 "N" "N" 0 77 131076 1 7 -0.541430
 "H" "H" 0 77 131076 2 1 0.345415
 "CA" "CT" 0 77 131076 3 6 0.118140
 "HA" "H1" 0 77 131076 4 1 0.142177
 "CB" "CT" 0 77 131076 5 6 0.146998
 "HB2" "H1" 0 77 131076 6 1 0.040081
 "HB3" "H1" 0 77 131076 7 1 0.040081
 "OG" "OH" 0 77 131076 8 8 -0.640312
 "HG" "HO" 0 77 131076 9 1 0.446255
 "C" "C" 0 77 131076 10 6 0.483424
 "O" "O" 0 77 131076 11 8 -0.580829
 "N" "N" 0 78 131076 1 7 -0.541430
 "H" "H" 0 78 131076 2 1 0.345415
 "CA" "CT" 0 78 131076 3 6 0.118140
 "HA" "H1" 0 78 131076 4 1 0.142177
 "CB" "CT" 0 78 131076 5 6 0.146998
 "HB2" "H1" 0 78 131076 6 1 0.040081
 "HB3" "H1" 0 78 131076 7 1 0.040081
 "OG" "OH" 0 78 131076 8 8 -0.640312
 "HG" "HO" 0 78 131076 9 1 0.446255
 "C" "C" 0 78 131076 10 6 0.483424
 "O" "O" 0 78 131076 11 8 -0.580829
 "N" "N" 0 79 131076 1 7 -0.435875
 "H" "H" 0 79 131076 2 1 0.251302
 "CA" "CT" 0 79 131076 3 6 -0.038773
 "HA" "H1" 0 79 131076 4 1 0.129478
 "CB" "CT" 0 79 131076 5 6 -0.108273
 "HB2" "HC" 0 79 131076 6 1 0.045214
 "HB3" "HC" 0 79 131076 7 1 0.045214
 "CG" "CT" 0 79 131076 8 6 0.033341
 "HG2" "HC" 0 79 131076 9 1 0.010208
 "HG3" "HC" 0 79 131076 10 1 0.010208
 "CD" "CT" 0 79 131076 11 6 -0.047841
 "HD2" "HC" 0 79 131076 12 1 0.070715
 "HD3" "HC" 0 79 131076 13 1 0.070715
 "CE" "CT" 0 79 131076 14 6 -0.069974
 "HE2" "HP" 0 79 131076 15 1 0.119522
 "HE3" "HP" 0 79 131076 16 1 0.119522
 "NZ" "N3" 0 79 131076 17 7 -0.250358
 "HZ1" "H" 0 79 131076 18 1 0.294561
 "HZ2" "H" 0 79 131076 19 1 0.294561
 "HZ3" "H" 0 79 131076 20 1 0.294561
 "C" "C" 0 79 131076 21 6 0.725129
 "O" "O" 0 79 131076 22 8 -0.563157
 "N" "N" 0 80 131076 1 7 -0.374282
 "H" "H" 0 80 131076 2 1 0.253981
 "CA" "CT" 0 80 131076 3 6 -0.128844
 "HA2" "H0" 0 80 131076 4 1 0.088859
 "HA3" "H0" 0 80 131076 5 1 0.088859
 "C" "C" 0 80 131076 6 6 0.580584
 "O" "O" 0 80 131076 7 8 -0.509157
 "N" "N" 0 81 131076 1 7 -0.450087
 "H" "H" 0 81 131076 2 1 0.440048
 "CA" "CT" 0 81 131076 3 6 -0.051858
 "HA" "H1" 0 81 131076 4 1 -0.026204
 "CB" "CT" 0 81 131076 5 6 0.395217
 "HB" "HC" 0 81 131076 6 1 -0.115672
 "CG1" "CT" 0 81 131076 7 6 -0.090132
 "HG11" "HC" 0 81 131076 8 1 -0.008985
 "HG12" "HC" 0 81 131076 9 1 -0.008985
 "HG13" "HC" 0 81 131076 10 1 -0.008985
 "CG2" "CT" 0 81 131076 11 6 -0.090132
 "HG21" "HC" 0 81 131076 12 1 -0.008985
 "HG22" "HC" 0 81 131076 13 1 -0.008985
 "HG23" "HC" 0 81 131076 14 1 -0.008985
 "C" "C" 0 81 131076 15 6 0.447359
 "O" "O" 0 81 131076 16 8 -0.404629
 "N" "N" 0 82 131076 1 7 -0.435875
 "H" "H" 0 82 131076 2 1 0.251302
 "CA" "CT" 0 82 131076 3 6 -0.038773
 "HA" "H1" 0 82 131076 4 1 0.129478
 "CB" "CT" 0 82 131076 5 6 -0.108273
 "HB2" "HC" 0 82 131076 6 1 0.045214
 "HB3" "HC" 0 82 131076 7 1 0.045214
 "CG" "CT" 0 82 131076 8 6 0.033341
 "HG2" "HC" 0 82 131076 9 1 0.010208
 "HG3" "HC" 0 82 131076 10 1 0.010208
 "CD" "CT" 0 82 131076 11 6 -0.047841
 "HD2" "HC" 0 82 131076 12 1 0.070715
 "HD3" "HC" 0 82 131076 13 1 0.070715
 "CE" "CT" 0 82 131076 14 6 -0.069974
 "HE2" "HP" 0 82 131076 15 1 0.119522
 "HE3" "HP" 0 82 131076 16 1 0.119522
 "NZ" "N3" 0 82 131076 17 7 -0.250358
 "HZ1" "H" 0 82 131076 18 1 0.294561
 "HZ2" "H" 0 82 131076 19 1 0.294561
 "HZ3" "H" 0 82 131076 20 1 0.294561
 "C" "C" 0 82 131076 21 6 0.725129
 "O" "O" 0 82 131076 22 8 -0.563157
 "N" "N" 0 83 131076 1 7 -0.451047
 "H" "H" 0 83 131076 2 1 0.328831
 "CA" "CT" 0 83 131076 3 6 -0.101874
 "HA" "H1" 0 83 131076 4 1 0.174193
 "CB" "CT" 0 83 131076 5 6 0.062238
 "HB" "HC" 0 83 131076 6 1 0.061662
 "CG2" "CT" 0 83 131076 7 6 -0.129989
 "HG21" "HC" 0 83 131076 8 1 0.030227
 "HG22" "HC" 0 83 131076 9 1 0.030227
 "HG23" "HC" 0 83 131076 10 1 0.030227
 "CG1" "CT" 0 83 131076 11 6 0.022230
 "HG12" "HC" 0 83 131076 12 1 0.011551
 "HG13" "HC" 0 83 131076 13 1 0.011551
 "CD1" "CT" 0 83 131076 14 6 -0.101251
 "HD11" "HC" 0 83 131076 15 1 0.023792
 "HD12" "HC" 0 83 131076 16 1 0.023792
 "HD13" "HC" 0 83 131076 17 1 0.023792
 "C" "C" 0 83 131076 18 6 0.569383
 "O" "O" 0 83 131076 19 8 -0.619535
 "N" "N" 0 84 131076 1 7 -0.427579
 "H" "H" 0 84 131076 2 1 0.241716
 "CA" "CT" 0 84 131076 3 6 -0.020082
 "HA" "H1" 0 84 131076 4 1 0.106629
 "CB" "CT" 0 84 131076 5 6 -0.098364
 "HB2" "HC" 0 84 131076 6 1 0.065424
 "HB3" "HC" 0 84 131076 7 1 0.065424
 "CG" "C*" 0 84 131076 8 6 -0.099797
 "CD1" "CW" 0 84 131076 9 6 -0.174053
 "HD1" "H4" 0 84 131076 10 1 0.170633
 "NE1" "NA" 0 84 131076 11 7 -0.298433
 "HE1" "H" 0 84 131076 12 1 0.322375
 "CE2" "CN" 0 84 131076 13 6 0.141523
 "CZ2" "CA" 0 84 131076 14 6 -0.210701
 "HZ2" "HA" 0 84 131076 15 1 0.125512
 "CH2" "CA" 0 84 131076 16 6 -0.133022
 "HH2" "HA" 0 84 131076 17 1 0.119467
 "CZ3" "CA" 0 84 131076 18 6 -0.164054
 "HZ3" "HA" 0 84 131076 19 1 0.119250
 "CE3" "CA" 0 84 131076 20 6 -0.153992
 "HE3" "HA" 0 84 131076 21 1 0.123084
 "CD2" "CB" 0 84 131076 22 6 0.089641
 "C" "C" 0 84 131076 23 6 0.584129
 "O" "O" 0 84 131076 24 8 -0.494730
 "N" "N" 0 85 131076 1 7 -0.558201
 "H" "H" 0 85 131076 2 1 0.319676
 "CA" "CT" 0 85 131076 3 6 0.007225
 "HA" "H1" 0 85 131076 4 1 0.082375
 "CB" "CT" 0 85 131076 5 6 -0.047555
 "HB2" "HC" 0 85 131076 6 1 -0.014836
 "HB3" "HC" 0 85 131076 7 1 -0.014836
 "CG" "C" 0 85 131076 8 6 0.745168
 "OD1" "O2" 0 85 131076 9 8 -0.730385
 "OD2" "O2" 0 85 131076 10 8 -0.730385
 "C" "C" 0 85 131076 11 6 0.443199
 "O" "O" 0 85 131076 12 8 -0.501445
 "N" "N" 0 86 131076 1 7 -0.404773
 "H" "H" 0 86 131076 2 1 0.294276
 "CA" "CT" 0 86 131076 3 6 -0.027733
 "HA" "H1" 0 86 131076 4 1 0.120802
 "CB" "CT" 0 86 131076 5 6 -0.229951
 "HB1" "HC" 0 86 131076 6 1 0.077428
 "HB2" "HC" 0 86 131076 7 1 0.077428
 "HB3" "HC" 0 86 131076 8 1 0.077428
 "C" "C" 0 86 131076 9 6 0.570224
 "O" "O" 0 86 131076 10 8 -0.555129
 "N" "N" 0 87 131076 1 7 -0.430106
 "H" "H" 0 87 131076 2 1 0.254543
 "CA" "CT" 0 87 131076 3 6 0.044609
 "HA" "H1" 0 87 131076 4 1 0.059601
 "CB" "CT" 0 87 131076 5 6 -0.093650
 "HB2" "HC" 0 87 131076 6 1 0.043321
 "HB3" "HC" 0 87 131076 7 1 0.043321
 "CG" "C" 0 87 131076 8 6 0.583519
 "OD1" "O" 0 87 131076 9 8 -0.526813
 "ND2" "N" 0 87 131076 10 7 -0.781735
 "HD21" "H" 0 87 131076 11 1 0.355079
 "HD22" "H" 0 87 131076 12 1 0.355079
 "C" "C" 0 87 131076 13 6 0.617141
 "O" "O" 0 87 131076 14 8 -0.523909
 "N" "N" 0 88 131076 1 7 -0.374282
 "H" "H" 0 88 131076 2 1 0.253981
 "CA" "CT" 0 88 131076 3 6 -0.128844
 "HA2" "H0" 0 88 131076 4 1 0.088859
 "HA3" "H0" 0 88 131076 5 1 0.088859
 "C" "C" 0 88 131076 6 6 0.580584
 "O" "O" 0 88 131076 7 8 -0.509157
 "N" "N" 0 89 131076 1 7 -0.541430
 "H" "H" 0 89 131076 2 1 0.345415
 "CA" "CT" 0 89 131076 3 6 0.118140
 "HA" "H1" 0 89 131076 4 1 0.142177
 "CB" "CT" 0 89 131076 5 6 0.146998
 "HB2" "H1" 0 89 131076 6 1 0.040081
 "HB3" "H1" 0 89 131076 7 1 0.040081
 "OG" "OH" 0 89 131076 8 8 -0.640312
 "HG" "HO" 0 89 131076 9 1 0.446255
 "C" "C" 0 89 131076 10 6 0.483424
 "O" "O" 0 89 131076 11 8 -0.580829
 "N" "N" 0 90 131076 1 7 -0.300879
 "H" "H" 0 90 131076 2 1 0.233693
 "CA" "CT" 0 90 131076 3 6 -0.131381
 "HA" "H1" 0 90 131076 4 1 0.053266
 "CB" "CT" 0 90 131076 5 6 0.036707
 "HB2" "HC" 0 90 131076 6 1 0.028012
 "HB3" "HC" 0 90 131076 7 1 0.028012
 "CG" "CT" 0 90 131076 8 6 0.012454
 "HG2" "HC" 0 90 131076 9 1 0.002964
 "HG3" "HC" 0 90 131076 10 1 0.002964
 "CD" "CT" 0 90 131076 11 6 0.126329
 "HD2" "H1" 0 90 131076 12 1 0.068148
 "HD3" "H1" 0 90 131076 13 1 0.068148
 "NE" "N2" 0 90 131076 14 7 -0.464890
 "HE" "H" 0 90 131076 15 1 0.326274
 "CZ" "CA" 0 90 131076 16 6 0.565543
 "NH1" "N2" 0 90 131076 17 7 -0.685774
 "HH11" "H" 0 90 131076 18 1 0.391052
 "HH12" "H" 0 90 131076 19 1 0.391052
 "NH2" "N2" 0 90 131076 20 7 -0.685774
 "HH21" "H" 0 90 131076 21 1 0.391052
 "HH22" "H" 0 90 131076 22 1 0.391052
 "C" "C" 0 90 131076 23 6 0.730308
 "O" "O" 0 90 131076 24 8 -0.578332
 "N" "N" 0 91 131076 1 7 -0.558201
 "H" "H" 0 91 131076 2 1 0.319676
 "CA" "CT" 0 91 131076 3 6 0.007225
 "HA" "H1" 0 91 131076 4 1 0.082375
 "CB" "CT" 0 91 131076 5 6 -0.047555
 "HB2" "HC" 0 91 131076 6 1 -0.014836
 "HB3" "HC" 0 91 131076 7 1 -0.014836
 "CG" "C" 0 91 131076 8 6 0.745168
 "OD1" "O2" 0 91 131076 9 8 -0.730385
 "OD2" "O2" 0 91 131076 10 8 -0.730385
 "C" "C" 0 91 131076 11 6 0.443199
 "O" "O" 0 91 131076 12 8 -0.501445
 "N" "N" 0 92 131076 1 7 -0.371290
 "H" "H" 0 92 131076 2 1 0.234053
 "CA" "CT" 0 92 131076 3 6 -0.030057
 "HA" "H1" 0 92 131076 4 1 0.102448
 "CB" "CT" 0 92 131076 5 6 -0.098720
 "HB2" "HC" 0 92 131076 6 1 0.060989
 "HB3" "HC" 0 92 131076 7 1 0.060989
 "CG" "CA" 0 92 131076 8 6 0.021313
 "CD1" "CA" 0 92 131076 9 6 -0.083109
 "HD1" "HA" 0 92 131076 10 1 0.098466
 "CE1" "CA" 0 92 131076 11 6 -0.156974
 "HE1" "HA" 0 92 131076 12 1 0.123731
 "CZ" "CA" 0 92 131076 13 6 -0.099824
 "HZ" "HA" 0 92 131076 14 1 0.114679
 "CE2" "CA" 0 92 131076 15 6 -0.156974
 "HE2" "HA" 0 92 131076 16 1 0.123731
 "CD2" "CA" 0 92 131076 17 6 -0.083109
 "HD2" "HA" 0 92 131076 18 1 0.098466
 "C" "C" 0 92 131076 19 6 0.547987
 "O" "O" 0 92 131076 20 8 -0.506795
 "N" "N" 0 93 131076 1 7 -0.355153
 "H" "H" 0 93 131076 2 1 0.262417
 "CA" "CT" 0 93 131076 3 6 -0.101497
 "HA" "H1" 0 93 131076 4 1 0.136951
 "CB" "CT" 0 93 131076 5 6 -0.144399
 "HB2" "HC" 0 93 131076 6 1 0.052533
 "HB3" "HC" 0 93 131076 7 1 0.052533
 "CG" "CT" 0 93 131076 8 6 0.191982
 "HG" "HC" 0 93 131076 9 1 0.000825
 "CD1" "CT" 0 93 131076 10 6 -0.123036
 "HD11" "HC" 0 93 131076 11 1 0.022376
 "HD12" "HC" 0 93 131076 12 1 0.022376
 "HD13" "HC" 0 93 131076 13 1 0.022376
 "CD2" "CT" 0 93 131076 14 6 -0.123036
 "HD21" "HC" 0 93 131076 15 1 0.022376
 "HD22" "HC" 0 93 131076 16 1 0.022376
 "HD23" "HC" 0 93 131076 17 1 0.022376
 "C" "C" 0 93 131076 18 6 0.573471
 "O" "O" 0 93 131076 19 8 -0.557847
 "N" "N" 0 94 131076 1 7 -0.558201
 "H" "H" 0 94 131076 2 1 0.319676
 "CA" "CT" 0 94 131076 3 6 0.007225
 "HA" "H1" 0 94 131076 4 1 0.082375
 "CB" "CT" 0 94 131076 5 6 -0.047555
 "HB2" "HC" 0 94 131076 6 1 -0.014836
 "HB3" "HC" 0 94 131076 7 1 -0.014836
 "CG" "C" 0 94 131076 8 6 0.745168
 "OD1" "O2" 0 94 131076 9 8 -0.730385
 "OD2" "O2" 0 94 131076 10 8 -0.730385
 "C" "C" 0 94 131076 11 6 0.443199
 "O" "O" 0 94 131076 12 8 -0.501445
 "N" "N" 0 95 131076 1 7 -0.541430
 "H" "H" 0 95 131076 2 1 0.345415
 "CA" "CT" 0 95 131076 3 6 0.118140
 "HA" "H1" 0 95 131076 4 1 0.142177
 "CB" "CT" 0 95 131076 5 6 0.146998
 "HB2" "H1" 0 95 131076 6 1 0.040081
 "HB3" "H1" 0 95 131076 7 1 0.040081
 "OG" "OH" 0 95 131076 8 8 -0.640312
 "HG" "HO" 0 95 131076 9 1 0.446255
 "C" "C" 0 95 131076 10 6 0.483424
 "O" "O" 0 95 131076 11 8 -0.580829
 "N" "N" 0 96 131076 1 7 -0.355153
 "H" "H" 0 96 131076 2 1 0.262417
 "CA" "CT" 0 96 131076 3 6 -0.101497
 "HA" "H1" 0 96 131076 4 1 0.136951
 "CB" "CT" 0 96 131076 5 6 -0.144399
 "HB2" "HC" 0 96 131076 6 1 0.052533
 "HB3" "HC" 0 96 131076 7 1 0.052533
 "CG" "CT" 0 96 131076 8 6 0.191982
 "HG" "HC" 0 96 131076 9 1 0.000825
 "CD1" "CT" 0 96 131076 10 6 -0.123036
 "HD11" "HC" 0 96 131076 11 1 0.022376
 "HD12" "HC" 0 96 131076 12 1 0.022376
 "HD13" "HC" 0 96 131076 13 1 0.022376
 "CD2" "CT" 0 96 131076 14 6 -0.123036
 "HD21" "HC" 0 96 131076 15 1 0.022376
 "HD22" "HC" 0 96 131076 16 1 0.022376
 "HD23" "HC" 0 96 131076 17 1 0.022376
 "C" "C" 0 96 131076 18 6 0.573471
 "O" "O" 0 96 131076 19 8 -0.557847
 "N" "N" 0 97 131076 1 7 -0.374282
 "H" "H" 0 97 131076 2 1 0.253981
 "CA" "CT" 0 97 131076 3 6 -0.128844
 "HA2" "H0" 0 97 131076 4 1 0.088859
 "HA3" "H0" 0 97 131076 5 1 0.088859
 "C" "C" 0 97 131076 6 6 0.580584
 "O" "O" 0 97 131076 7 8 -0.509157
 "N" "N" 0 98 131076 1 7 -0.371290
 "H" "H" 0 98 131076 2 1 0.234053
 "CA" "CT" 0 98 131076 3 6 -0.030057
 "HA" "H1" 0 98 131076 4 1 0.102448
 "CB" "CT" 0 98 131076 5 6 -0.098720
 "HB2" "HC" 0 98 131076 6 1 0.060989
 "HB3" "HC" 0 98 131076 7 1 0.060989
 "CG" "CA" 0 98 131076 8 6 0.021313
 "CD1" "CA" 0 98 131076 9 6 -0.083109
 "HD1" "HA" 0 98 131076 10 1 0.098466
 "CE1" "CA" 0 98 131076 11 6 -0.156974
 "HE1" "HA" 0 98 131076 12 1 0.123731
 "CZ" "CA" 0 98 131076 13 6 -0.099824
 "HZ" "HA" 0 98 131076 14 1 0.114679
 "CE2" "CA" 0 98 131076 15 6 -0.156974
 "HE2" "HA" 0 98 131076 16 1 0.123731
 "CD2" "CA" 0 98 131076 17 6 -0.083109
 "HD2" "HA" 0 98 131076 18 1 0.098466
 "C" "C" 0 98 131076 19 6 0.547987
 "O" "O" 0 98 131076 20 8 -0.506795
 "N" "N" 0 99 131076 1 7 -0.541430
 "H" "H" 0 99 131076 2 1 0.345415
 "CA" "CT" 0 99 131076 3 6 0.118140
 "HA" "H1" 0 99 131076 4 1 0.142177
 "CB" "CT" 0 99 131076 5 6 0.146998
 "HB2" "H1" 0 99 131076 6 1 0.040081
 "HB3" "H1" 0 99 131076 7 1 0.040081
 "OG" "OH" 0 99 131076 8 8 -0.640312
 "HG" "HO" 0 99 131076 9 1 0.446255
 "C" "C" 0 99 131076 10 6 0.483424
 "O" "O" 0 99 131076 11 8 -0.580829
 "N" "N" 0 100 131076 1 7 -0.245382
 "H" "H" 0 100 131076 2 1 0.255339
 "CA" "CT" 0 100 131076 3 6 -0.271249
 "HA" "H1" 0 100 131076 4 1 0.163757
 "CB" "CT" 0 100 131076 5 6 0.237868
 "HB" "H1" 0 100 131076 6 1 0.044688
 "CG2" "CT" 0 100 131076 7 6 -0.176489
 "HG21" "HC" 0 100 131076 8 1 0.060019
 "HG22" "HC" 0 100 131076 9 1 0.060019
 "HG23" "HC" 0 100 131076 10 1 0.060019
 "OG1" "OH" 0 100 131076 11 8 -0.601931
 "HG1" "HO" 0 100 131076 12 1 0.405484
 "C" "C" 0 100 131076 13 6 0.559878
 "O" "O" 0 100 131076 14 8 -0.552020
 "N" "N" 0 101 131076 1 7 -0.300879
 "H" "H" 0 101 131076 2 1 0.233693
 "CA" "CT" 0 101 131076 3 6 -0.131381
 "HA" "H1" 0 101 131076 4 1 0.053266
 "CB" "CT" 0 101 131076 5 6 0.036707
 "HB2" "HC" 0 101 131076 6 1 0.028012
 "HB3" "HC" 0 101 131076 7 1 0.028012
 "CG" "CT" 0 101 131076 8 6 0.012454
 "HG2" "HC" 0 101 131076 9 1 0.002964
 "HG3" "HC" 0 101 131076 10 1 0.002964
 "CD" "CT" 0 101 131076 11 6 0.126329
 "HD2" "H1" 0 101 131076 12 1 0.068148
 "HD3" "H1" 0 101 131076 13 1 0.068148
 "NE" "N2" 0 101 131076 14 7 -0.464890
 "HE" "H" 0 101 131076 15 1 0.326274
 "CZ" "CA" 0 101 131076 16 6 0.565543
 "NH1" "N2" 0 101 131076 17 7 -0.685774
 "HH11" "H" 0 101 131076 18 1 0.391052
 "HH12" "H" 0 101 131076 19 1 0.391052
 "NH2" "N2" 0 101 131076 20 7 -0.685774
 "HH21" "H" 0 101 131076 21 1 0.391052
 "HH22" "H" 0 101 131076 22 1 0.391052
 "C" "C" 0 101 131076 23 6 0.730308
 "O" "O" 0 101 131076 24 8 -0.578332
 "N" "N" 0 102 131076 1 7 -0.423392
 "H" "H" 0 102 131076 2 1 0.306811
 "CA" "CT" 0 102 131076 3 6 0.031633
 "HA" "H1" 0 102 131076 4 1 0.065100
 "CB" "CT" 0 102 131076 5 6 0.074772
 "HB2" "HC" 0 102 131076 6 1 -0.003535
 "HB3" "HC" 0 102 131076 7 1 -0.003535
 "CG" "CT" 0 102 131076 8 6 -0.033909
 "HG2" "HC" 0 102 131076 9 1 -0.004135
 "HG3" "HC" 0 102 131076 10 1 -0.004135
 "CD" "C" 0 102 131076 11 6 0.765188
 "OE1" "O2" 0 102 131076 12 8 -0.824035
 "OE2" "O2" 0 102 131076 13 8 -0.824035
 "C" "C" 0 102 131076 14 6 0.469735
 "O" "O" 0 102 131076 15 8 -0.592528
 "N" "N" 0 103 131076 1 7 -0.423392
 "H" "H" 0 103 131076 2 1 0.306811
 "CA" "CT" 0 103 131076 3 6 0.031633
 "HA" "H1" 0 103 131076 4 1 0.065100
 "CB" "CT" 0 103 131076 5 6 0.074772
 "HB2" "HC" 0 103 131076 6 1 -0.003535
 "HB3" "HC" 0 103 131076 7 1 -0.003535
 "CG" "CT" 0 103 131076 8 6 -0.033909
 "HG2" "HC" 0 103 131076 9 1 -0.004135
 "HG3" "HC" 0 103 131076 10 1 -0.004135
 "CD" "C" 0 103 131076 11 6 0.765188
 "OE1" "O2" 0 103 131076 12 8 -0.824035
 "OE2" "O2" 0 103 131076 13 8 -0.824035
 "C" "C" 0 103 131076 14 6 0.469735
 "O" "O" 0 103 131076 15 8 -0.592528
 "N" "N" 0 104 131076 1 7 -0.374282
 "H" "H" 0 104 131076 2 1 0.253981
 "CA" "CT" 0 104 131076 3 6 -0.128844
 "HA2" "H0" 0 104 131076 4 1 0.088859
 "HA3" "H0" 0 104 131076 5 1 0.088859
 "C" "C" 0 104 131076 6 6 0.580584
 "O" "O" 0 104 131076 7 8 -0.509157
 "N" "N" 0 105 131076 1 7 -0.558201
 "H" "H" 0 105 131076 2 1 0.319676
 "CA" "CT" 0 105 131076 3 6 0.007225
 "HA" "H1" 0 105 131076 4 1 0.082375
 "CB" "CT" 0 105 131076 5 6 -0.047555
 "HB2" "HC" 0 105 131076 6 1 -0.014836
 "HB3" "HC" 0 105 131076 7 1 -0.014836
 "CG" "C" 0 105 131076 8 6 0.745168
 "OD1" "O2" 0 105 131076 9 8 -0.730385
 "OD2" "O2" 0 105 131076 10 8 -0.730385
 "C" "C" 0 105 131076 11 6 0.443199
 "O" "O" 0 105 131076 12 8 -0.501445
 "N" "N" 0 106 131076 1 7 -0.355153
 "H" "H" 0 106 131076 2 1 0.262417
 "CA" "CT" 0 106 131076 3 6 -0.101497
 "HA" "H1" 0 106 131076 4 1 0.136951
 "CB" "CT" 0 106 131076 5 6 -0.144399
 "HB2" "HC" 0 106 131076 6 1 0.052533
 "HB3" "HC" 0 106 131076 7 1 0.052533
 "CG" "CT" 0 106 131076 8 6 0.191982
 "HG" "HC" 0 106 131076 9 1 0.000825
 "CD1" "CT" 0 106 131076 10 6 -0.123036
 "HD11" "HC" 0 106 131076 11 1 0.022376
 "HD12" "HC" 0 106 131076 12 1 0.022376
 "HD13" "HC" 0 106 131076 13 1 0.022376
 "CD2" "CT" 0 106 131076 14 6 -0.123036
 "HD21" "HC" 0 106 131076 15 1 0.022376
 "HD22" "HC" 0 106 131076 16 1 0.022376
 "HD23" "HC" 0 106 131076 17 1 0.022376
 "C" "C" 0 106 131076 18 6 0.573471
 "O" "O" 0 106 131076 19 8 -0.557847
 "N" "N" 0 107 131076 1 7 -0.374282
 "H" "H" 0 107 131076 2 1 0.253981
 "CA" "CT" 0 107 131076 3 6 -0.128844
 "HA2" "H0" 0 107 131076 4 1 0.088859
 "HA3" "H0" 0 107 131076 5 1 0.088859
 "C" "C" 0 107 131076 6 6 0.580584
 "O" "O" 0 107 131076 7 8 -0.509157
 "N" "N" 0 108 131076 1 7 -0.088116
 "CD" "CT" 0 108 131076 2 6 -0.011906
 "HD2" "H1" 0 108 131076 3 1 0.043951
 "HD3" "H1" 0 108 131076 4 1 0.043950
 "CG" "CT" 0 108 131076 5 6 0.013059
 "HG2" "HC" 0 108 131076 6 1 0.019574
 "HG3" "HC" 0 108 131076 7 1 0.019574
 "CB" "CT" 0 108 131076 8 6 -0.003351
 "HB2" "HC" 0 108 131076 9 1 0.019352
 "HB3" "HC" 0 108 131076 10 1 0.019352
 "CA" "CT" 0 108 131076 11 6 -0.034577
 "HA" "H1" 0 108 131076 12 1 0.059977
 "C" "C" 0 108 131076 13 6 0.333720
 "O" "O" 0 108 131076 14 8 -0.434559
 "N" "N" 0 109 131076 1 7 -0.450087
 "H" "H" 0 109 131076 2 1 0.440048
 "CA" "CT" 0 109 131076 3 6 -0.051858
 "HA" "H1" 0 109 131076 4 1 -0.026204
 "CB" "CT" 0 109 131076 5 6 0.395217
 "HB" "HC" 0 109 131076 6 1 -0.115672
 "CG1" "CT" 0 109 131076 7 6 -0.090132
 "HG11" "HC" 0 109 131076 8 1 -0.008985
 "HG12" "HC" 0 109 131076 9 1 -0.008985
 "HG13" "HC" 0 109 131076 10 1 -0.008985
 "CG2" "CT" 0 109 131076 11 6 -0.090132
 "HG21" "HC" 0 109 131076 12 1 -0.008985
 "HG22" "HC" 0 109 131076 13 1 -0.008985
 "HG23" "HC" 0 109 131076 14 1 -0.008985
 "C" "C" 0 109 131076 15 6 0.447359
 "O" "O" 0 109 131076 16 8 -0.404629
 "N" "N" 0 110 131076 1 7 -0.487560
 "H" "H" 0 110 131076 2 1 0.263521
 "CA" "CT" 0 110 131076 3 6 0.009614
 "HA" "H1" 0 110 131076 4 1 0.095501
 "CB" "CT" 0 110 131076 5 6 -0.051853
 "HB2" "HC" 0 110 131076 6 1 0.019145
 "HB3" "HC" 0 110 131076 7 1 0.019145
 "CG" "CA" 0 110 131076 8 6 0.112601
 "CD1" "CA" 0 110 131076 9 6 -0.183461
 "HD1" "HA" 0 110 131076 10 1 0.132715
 "CE1" "CA" 0 110 131076 11 6 -0.181823
 "HE1" "HA" 0 110 131076 12 1 0.137303
 "CZ" "C" 0 110 131076 13 6 0.206277
 "OH" "OH" 0 110 131076 14 8 -0.421233
 "HH" "HO" 0 110 131076 15 1 0.329691
 "CE2" "CA" 0 110 131076 16 6 -0.181823
 "HE2" "HA" 0 110 131076 17 1 0.137303
 "CD2" "CA" 0 110 131076 18 6 -0.183461
 "HD2" "HA" 0 110 131076 19 1 0.132715
 "C" "C" 0 110 131076 20 6 0.622290
 "O" "O" 0 110 131076 21 8 -0.526607
 "N" "N" 0 111 131076 1 7 -0.374282
 "H" "H" 0 111 131076 2 1 0.253981
 "CA" "CT" 0 111 131076 3 6 -0.128844
 "HA2" "H0" 0 111 131076 4 1 0.088859
 "HA3" "H0" 0 111 131076 5 1 0.088859
 "C" "C" 0 111 131076 6 6 0.580584
 "O" "O" 0 111 131076 7 8 -0.509157
 "N" "N" 0 112 131076 1 7 -0.371290
 "H" "H" 0 112 131076 2 1 0.234053
 "CA" "CT" 0 112 131076 3 6 -0.030057
 "HA" "H1" 0 112 131076 4 1 0.102448
 "CB" "CT" 0 112 131076 5 6 -0.098720
 "HB2" "HC" 0 112 131076 6 1 0.060989
 "HB3" "HC" 0 112 131076 7 1 0.060989
 "CG" "CA" 0 112 131076 8 6 0.021313
 "CD1" "CA" 0 112 131076 9 6 -0.083109
 "HD1" "HA" 0 112 131076 10 1 0.098466
 "CE1" "CA" 0 112 131076 11 6 -0.156974
 "HE1" "HA" 0 112 131076 12 1 0.123731
 "CZ" "CA" 0 112 131076 13 6 -0.099824
 "HZ" "HA" 0 112 131076 14 1 0.114679
 "CE2" "CA" 0 112 131076 15 6 -0.156974
 "HE2" "HA" 0 112 131076 16 1 0.123731
 "CD2" "CA" 0 112 131076 17 6 -0.083109
 "HD2" "HA" 0 112 131076 18 1 0.098466
 "C" "C" 0 112 131076 19 6 0.547987
 "O" "O" 0 112 131076 20 8 -0.506795
 "N" "N" 0 113 131076 1 7 -0.387353
 "H" "H" 0 113 131076 2 1 0.300605
 "CA" "CT" 0 113 131076 3 6 0.037470
 "HA" "H1" 0 113 131076 4 1 0.152255
 "CB" "CT" 0 113 131076 5 6 -0.032112
 "HB2" "HC" 0 113 131076 6 1 0.030995
 "HB3" "HC" 0 113 131076 7 1 0.030995
 "CG" "CT" 0 113 131076 8 6 -0.020264
 "HG2" "HC" 0 113 131076 9 1 0.030791
 "HG3" "HC" 0 113 131076 10 1 0.030791
 "CD" "C" 0 113 131076 11 6 0.667812
 "OE1" "O" 0 113 131076 12 8 -0.628483
 "NE2" "N" 0 113 131076 13 7 -0.883393
 "HE21" "H" 0 113 131076 14 1 0.408312
 "HE22" "H" 0 113 131076 15 1 0.408312
 "C" "C" 0 113 131076 16 6 0.418577
 "O" "O" 0 113 131076 17 8 -0.565310
 "N" "N" 0 114 131076 1 7 -0.427579
 "H" "H" 0 114 131076 2 1 0.241716
 "CA" "CT" 0 114 131076 3 6 -0.020082
 "HA" "H1" 0 114 131076 4 1 0.106629
 "CB" "CT" 0 114 131076 5 6 -0.098364
 "HB2" "HC" 0 114 131076 6 1 0.065424
 "HB3" "HC" 0 114 131076 7 1 0.065424
 "CG" "C*" 0 114 131076 8 6 -0.099797
 "CD1" "CW" 0 114 131076 9 6 -0.174053
 "HD1" "H4" 0 114 131076 10 1 0.170633
 "NE1" "NA" 0 114 131076 11 7 -0.298433
 "HE1" "H" 0 114 131076 12 1 0.322375
 "CE2" "CN" 0 114 131076 13 6 0.141523
 "CZ2" "CA" 0 114 131076 14 6 -0.210701
 "HZ2" "HA" 0 114 131076 15 1 0.125512
 "CH2" "CA" 0 114 131076 16 6 -0.133022
 "HH2" "HA" 0 114 131076 17 1 0.119467
 "CZ3" "CA" 0 114 131076 18 6 -0.164054
 "HZ3" "HA" 0 114 131076 19 1 0.119250
 "CE3" "CA" 0 114 131076 20 6 -0.153992
 "HE3" "HA" 0 114 131076 21 1 0.123084
 "CD2" "CB" 0 114 131076 22 6 0.089641
 "C" "C" 0 114 131076 23 6 0.584129
 "O" "O" 0 114 131076 24 8 -0.494730
 "N" "N" 0 115 131076 1 7 -0.300879
 "H" "H" 0 115 131076 2 1 0.233693
 "CA" "CT" 0 115 131076 3 6 -0.131381
 "HA" "H1" 0 115 131076 4 1 0.053266
 "CB" "CT" 0 115 131076 5 6 0.036707
 "HB2" "HC" 0 115 131076 6 1 0.028012
 "HB3" "HC" 0 115 131076 7 1 0.028012
 "CG" "CT" 0 115 131076 8 6 0.012454
 "HG2" "HC" 0 115 131076 9 1 0.002964
 "HG3" "HC" 0 115 131076 10 1 0.002964
 "CD" "CT" 0 115 131076 11 6 0.126329
 "HD2" "H1" 0 115 131076 12 1 0.068148
 "HD3" "H1" 0 115 131076 13 1 0.068148
 "NE" "N2" 0 115 131076 14 7 -0.464890
 "HE" "H" 0 115 131076 15 1 0.326274
 "CZ" "CA" 0 115 131076 16 6 0.565543
 "NH1" "N2" 0 115 131076 17 7 -0.685774
 "HH11" "H" 0 115 131076 18 1 0.391052
 "HH12" "H" 0 115 131076 19 1 0.391052
 "NH2" "N2" 0 115 131076 20 7 -0.685774
 "HH21" "H" 0 115 131076 21 1 0.391052
 "HH22" "H" 0 115 131076 22 1 0.391052
 "C" "C" 0 115 131076 23 6 0.730308
 "O" "O" 0 115 131076 24 8 -0.578332
 "N" "N" 0 116 131076 1 7 -0.528120
 "H" "H" 0 116 131076 2 1 0.281695
 "CA" "CT" 0 116 131076 3 6 0.031249
 "HA" "H1" 0 116 131076 4 1 0.085175
 "CB" "CT" 0 116 131076 5 6 -0.152267
 "HB2" "HC" 0 116 131076 6 1 0.054608
 "HB3" "HC" 0 116 131076 7 1 0.054608
 "CG" "CC" 0 116 131076 8 6 0.278406
 "ND1" "NB" 0 116 131076 9 7 -0.423316
 "CE1" "CR" 0 116 131076 10 6 0.025960
 "HE1" "H5" 0 116 131076 11 1 0.126832
 "NE2" "NA" 0 116 131076 12 7 -0.097984
 "HE2" "H" 0 116 131076 13 1 0.266865
 "CD2" "CW" 0 116 131076 14 6 -0.297563
 "HD2" "H4" 0 116 131076 15 1 0.160413
 "C" "C" 0 116 131076 16 6 0.662405
 "O" "O" 0 116 131076 17 8 -0.528966
 "N" "N" 0 117 131076 1 7 -0.371290
 "H" "H" 0 117 131076 2 1 0.234053
 "CA" "CT" 0 117 131076 3 6 -0.030057
 "HA" "H1" 0 117 131076 4 1 0.102448
 "CB" "CT" 0 117 131076 5 6 -0.098720
 "HB2" "HC" 0 117 131076 6 1 0.060989
 "HB3" "HC" 0 117 131076 7 1 0.060989
 "CG" "CA" 0 117 131076 8 6 0.021313
 "CD1" "CA" 0 117 131076 9 6 -0.083109
 "HD1" "HA" 0 117 131076 10 1 0.098466
 "CE1" "CA" 0 117 131076 11 6 -0.156974
 "HE1" "HA" 0 117 131076 12 1 0.123731
 "CZ" "CA" 0 117 131076 13 6 -0.099824
 "HZ" "HA" 0 117 131076 14 1 0.114679
 "CE2" "CA" 0 117 131076 15 6 -0.156974
 "HE2" "HA" 0 117 131076 16 1 0.123731
 "CD2" "CA" 0 117 131076 17 6 -0.083109
 "HD2" "HA" 0 117 131076 18 1 0.098466
 "C" "C" 0 117 131076 19 6 0.547987
 "O" "O" 0 117 131076 20 8 -0.506795
 "N" "N" 0 118 131076 1 7 -0.374282
 "H" "H" 0 118 131076 2 1 0.253981
 "CA" "CT" 0 118 131076 3 6 -0.128844
 "HA2" "H0" 0 118 131076 4 1 0.088859
 "HA3" "H0" 0 118 131076 5 1 0.088859
 "C" "C" 0 118 131076 6 6 0.580584
 "O" "O" 0 118 131076 7 8 -0.509157
 "N" "N" 0 119 131076 1 7 -0.404773
 "H" "H" 0 119 131076 2 1 0.294276
 "CA" "CT" 0 119 131076 3 6 -0.027733
 "HA" "H1" 0 119 131076 4 1 0.120802
 "CB" "CT" 0 119 131076 5 6 -0.229951
 "HB1" "HC" 0 119 131076 6 1 0.077428
 "HB2" "HC" 0 119 131076 7 1 0.077428
 "HB3" "HC" 0 119 131076 8 1 0.077428
 "C" "C" 0 119 131076 9 6 0.570224
 "O" "O" 0 119 131076 10 8 -0.555129
 "N" "N" 0 120 131076 1 7 -0.423392
 "H" "H" 0 120 131076 2 1 0.306811
 "CA" "CT" 0 120 131076 3 6 0.031633
 "HA" "H1" 0 120 131076 4 1 0.065100
 "CB" "CT" 0 120 131076 5 6 0.074772
 "HB2" "HC" 0 120 131076 6 1 -0.003535
 "HB3" "HC" 0 120 131076 7 1 -0.003535
 "CG" "CT" 0 120 131076 8 6 -0.033909
 "HG2" "HC" 0 120 131076 9 1 -0.004135
 "HG3" "HC" 0 120 131076 10 1 -0.004135
 "CD" "C" 0 120 131076 11 6 0.765188
 "OE1" "O2" 0 120 131076 12 8 -0.824035
 "OE2" "O2" 0 120 131076 13 8 -0.824035
 "C" "C" 0 120 131076 14 6 0.469735
 "O" "O" 0 120 131076 15 8 -0.592528
 "N" "N" 0 121 131076 1 7 -0.487560
 "H" "H" 0 121 131076 2 1 0.263521
 "CA" "CT" 0 121 131076 3 6 0.009614
 "HA" "H1" 0 121 131076 4 1 0.095501
 "CB" "CT" 0 121 131076 5 6 -0.051853
 "HB2" "HC" 0 121 131076 6 1 0.019145
 "HB3" "HC" 0 121 131076 7 1 0.019145
 "CG" "CA" 0 121 131076 8 6 0.112601
 "CD1" "CA" 0 121 131076 9 6 -0.183461
 "HD1" "HA" 0 121 131076 10 1 0.132715
 "CE1" "CA" 0 121 131076 11 6 -0.181823
 "HE1" "HA" 0 121 131076 12 1 0.137303
 "CZ" "C" 0 121 131076 13 6 0.206277
 "OH" "OH" 0 121 131076 14 8 -0.421233
 "HH" "HO" 0 121 131076 15 1 0.329691
 "CE2" "CA" 0 121 131076 16 6 -0.181823
 "HE2" "HA" 0 121 131076 17 1 0.137303
 "CD2" "CA" 0 121 131076 18 6 -0.183461
 "HD2" "HA" 0 121 131076 19 1 0.132715
 "C" "C" 0 121 131076 20 6 0.622290
 "O" "O" 0 121 131076 21 8 -0.526607
 "N" "N" 0 122 131076 1 7 -0.300879
 "H" "H" 0 122 131076 2 1 0.233693
 "CA" "CT" 0 122 131076 3 6 -0.131381
 "HA" "H1" 0 122 131076 4 1 0.053266
 "CB" "CT" 0 122 131076 5 6 0.036707
 "HB2" "HC" 0 122 131076 6 1 0.028012
 "HB3" "HC" 0 122 131076 7 1 0.028012
 "CG" "CT" 0 122 131076 8 6 0.012454
 "HG2" "HC" 0 122 131076 9 1 0.002964
 "HG3" "HC" 0 122 131076 10 1 0.002964
 "CD" "CT" 0 122 131076 11 6 0.126329
 "HD2" "H1" 0 122 131076 12 1 0.068148
 "HD3" "H1" 0 122 131076 13 1 0.068148
 "NE" "N2" 0 122 131076 14 7 -0.464890
 "HE" "H" 0 122 131076 15 1 0.326274
 "CZ" "CA" 0 122 131076 16 6 0.565543
 "NH1" "N2" 0 122 131076 17 7 -0.685774
 "HH11" "H" 0 122 131076 18 1 0.391052
 "HH12" "H" 0 122 131076 19 1 0.391052
 "NH2" "N2" 0 122 131076 20 7 -0.685774
 "HH21" "H" 0 122 131076 21 1 0.391052
 "HH22" "H" 0 122 131076 22 1 0.391052
 "C" "C" 0 122 131076 23 6 0.730308
 "O" "O" 0 122 131076 24 8 -0.578332
 "N" "N" 0 123 131076 1 7 -0.558201
 "H" "H" 0 123 131076 2 1 0.319676
 "CA" "CT" 0 123 131076 3 6 0.007225
 "HA" "H1" 0 123 131076 4 1 0.082375
 "CB" "CT" 0 123 131076 5 6 -0.047555
 "HB2" "HC" 0 123 131076 6 1 -0.014836
 "HB3" "HC" 0 123 131076 7 1 -0.014836
 "CG" "C" 0 123 131076 8 6 0.745168
 "OD1" "O2" 0 123 131076 9 8 -0.730385
 "OD2" "O2" 0 123 131076 10 8 -0.730385
 "C" "C" 0 123 131076 11 6 0.443199
 "O" "O" 0 123 131076 12 8 -0.501445
 "N" "N" 0 124 131076 1 7 -0.394918
 "H" "H" 0 124 131076 2 1 0.280537
 "CA" "CT" 0 124 131076 3 6 -0.087681
 "HA" "H1" 0 124 131076 4 1 0.123080
 "CB" "CT" 0 124 131076 5 6 0.019227
 "HB2" "HC" 0 124 131076 6 1 0.048840
 "HB3" "HC" 0 124 131076 7 1 0.048840
 "CG" "CT" 0 124 131076 8 6 -0.208167
 "HG2" "H1" 0 124 131076 9 1 0.124228
 "HG3" "H1" 0 124 131076 10 1 0.124228
 "SD" "S" 0 124 131076 11 16 -0.211958
 "CE" "CT" 0 124 131076 12 6 -0.284698
 "HE1" "H1" 0 124 131076 13 1 0.128394
 "HE2" "H1" 0 124 131076 14 1 0.128394
 "HE3" "H1" 0 124 131076 15 1 0.128394
 "C" "C" 0 124 131076 16 6 0.599684
 "O" "O" 0 124 131076 17 8 -0.566424
 "N" "N" 0 125 131076 1 7 -0.423392
 "H" "H" 0 125 131076 2 1 0.306811
 "CA" "CT" 0 125 131076 3 6 0.031633
 "HA" "H1" 0 125 131076 4 1 0.065100
 "CB" "CT" 0 125 131076 5 6 0.074772
 "HB2" "HC" 0 125 131076 6 1 -0.003535
 "HB3" "HC" 0 125 131076 7 1 -0.003535
 "CG" "CT" 0 125 131076 8 6 -0.033909
 "HG2" "HC" 0 125 131076 9 1 -0.004135
 "HG3" "HC" 0 125 131076 10 1 -0.004135
 "CD" "C" 0 125 131076 11 6 0.765188
 "OE1" "O2" 0 125 131076 12 8 -0.824035
 "OE2" "O2" 0 125 131076 13 8 -0.824035
 "C" "C" 0 125 131076 14 6 0.469735
 "O" "O" 0 125 131076 15 8 -0.592528
 "N" "N" 0 126 131076 1 7 -0.541430
 "H" "H" 0 126 131076 2 1 0.345415
 "CA" "CT" 0 126 131076 3 6 0.118140
 "HA" "H1" 0 126 131076 4 1 0.142177
 "CB" "CT" 0 126 131076 5 6 0.146998
 "HB2" "H1" 0 126 131076 6 1 0.040081
 "HB3" "H1" 0 126 131076 7 1 0.040081
 "OG" "OH" 0 126 131076 8 8 -0.640312
 "HG" "HO" 0 126 131076 9 1 0.446255
 "C" "C" 0 126 131076 10 6 0.483424
 "O" "O" 0 126 131076 11 8 -0.580829
 "N" "N" 0 127 131076 1 7 -0.558201
 "H" "H" 0 127 131076 2 1 0.319676
 "CA" "CT" 0 127 131076 3 6 0.007225
 "HA" "H1" 0 127 131076 4 1 0.082375
 "CB" "CT" 0 127 131076 5 6 -0.047555
 "HB2" "HC" 0 127 131076 6 1 -0.014836
 "HB3" "HC" 0 127 131076 7 1 -0.014836
 "CG" "C" 0 127 131076 8 6 0.745168
 "OD1" "O2" 0 127 131076 9 8 -0.730385
 "OD2" "O2" 0 127 131076 10 8 -0.730385
 "C" "C" 0 127 131076 11 6 0.443199
 "O" "O" 0 127 131076 12 8 -0.501445
 "N" "N" 0 128 131076 1 7 -0.487560
 "H" "H" 0 128 131076 2 1 0.263521
 "CA" "CT" 0 128 131076 3 6 0.009614
 "HA" "H1" 0 128 131076 4 1 0.095501
 "CB" "CT" 0 128 131076 5 6 -0.051853
 "HB2" "HC" 0 128 131076 6 1 0.019145
 "HB3" "HC" 0 128 131076 7 1 0.019145
 "CG" "CA" 0 128 131076 8 6 0.112601
 "CD1" "CA" 0 128 131076 9 6 -0.183461
 "HD1" "HA" 0 128 131076 10 1 0.132715
 "CE1" "CA" 0 128 131076 11 6 -0.181823
 "HE1" "HA" 0 128 131076 12 1 0.137303
 "CZ" "C" 0 128 131076 13 6 0.206277
 "OH" "OH" 0 128 131076 14 8 -0.421233
 "HH" "HO" 0 128 131076 15 1 0.329691
 "CE2" "CA" 0 128 131076 16 6 -0.181823
 "HE2" "HA" 0 128 131076 17 1 0.137303
 "CD2" "CA" 0 128 131076 18 6 -0.183461
 "HD2" "HA" 0 128 131076 19 1 0.132715
 "C" "C" 0 128 131076 20 6 0.622290
 "O" "O" 0 128 131076 21 8 -0.526607
 "N" "N" 0 129 131076 1 7 -0.541430
 "H" "H" 0 129 131076 2 1 0.345415
 "CA" "CT" 0 129 131076 3 6 0.118140
 "HA" "H1" 0 129 131076 4 1 0.142177
 "CB" "CT" 0 129 131076 5 6 0.146998
 "HB2" "H1" 0 129 131076 6 1 0.040081
 "HB3" "H1" 0 129 131076 7 1 0.040081
 "OG" "OH" 0 129 131076 8 8 -0.640312
 "HG" "HO" 0 129 131076 9 1 0.446255
 "C" "C" 0 129 131076 10 6 0.483424
 "O" "O" 0 129 131076 11 8 -0.580829
 "N" "N" 0 130 131076 1 7 -0.374282
 "H" "H" 0 130 131076 2 1 0.253981
 "CA" "CT" 0 130 131076 3 6 -0.128844
 "HA2" "H0" 0 130 131076 4 1 0.088859
 "HA3" "H0" 0 130 131076 5 1 0.088859
 "C" "C" 0 130 131076 6 6 0.580584
 "O" "O" 0 130 131076 7 8 -0.509157
 "N" "N" 0 131 131076 1 7 -0.387353
 "H" "H" 0 131 131076 2 1 0.300605
 "CA" "CT" 0 131 131076 3 6 0.037470
 "HA" "H1" 0 131 131076 4 1 0.152255
 "CB" "CT" 0 131 131076 5 6 -0.032112
 "HB2" "HC" 0 131 131076 6 1 0.030995
 "HB3" "HC" 0 131 131076 7 1 0.030995
 "CG" "CT" 0 131 131076 8 6 -0.020264
 "HG2" "HC" 0 131 131076 9 1 0.030791
 "HG3" "HC" 0 131 131076 10 1 0.030791
 "CD" "C" 0 131 131076 11 6 0.667812
 "OE1" "O" 0 131 131076 12 8 -0.628483
 "NE2" "N" 0 131 131076 13 7 -0.883393
 "HE21" "H" 0 131 131076 14 1 0.408312
 "HE22" "H" 0 131 131076 15 1 0.408312
 "C" "C" 0 131 131076 16 6 0.418577
 "O" "O" 0 131 131076 17 8 -0.565310
 "N" "N" 0 132 131076 1 7 -0.374282
 "H" "H" 0 132 131076 2 1 0.253981
 "CA" "CT" 0 132 131076 3 6 -0.128844
 "HA2" "H0" 0 132 131076 4 1 0.088859
 "HA3" "H0" 0 132 131076 5 1 0.088859
 "C" "C" 0 132 131076 6 6 0.580584
 "O" "O" 0 132 131076 7 8 -0.509157
 "N" "N" 0 133 131076 1 7 -0.450087
 "H" "H" 0 133 131076 2 1 0.440048
 "CA" "CT" 0 133 131076 3 6 -0.051858
 "HA" "H1" 0 133 131076 4 1 -0.026204
 "CB" "CT" 0 133 131076 5 6 0.395217
 "HB" "HC" 0 133 131076 6 1 -0.115672
 "CG1" "CT" 0 133 131076 7 6 -0.090132
 "HG11" "HC" 0 133 131076 8 1 -0.008985
 "HG12" "HC" 0 133 131076 9 1 -0.008985
 "HG13" "HC" 0 133 131076 10 1 -0.008985
 "CG2" "CT" 0 133 131076 11 6 -0.090132
 "HG21" "HC" 0 133 131076 12 1 -0.008985
 "HG22" "HC" 0 133 131076 13 1 -0.008985
 "HG23" "HC" 0 133 131076 14 1 -0.008985
 "C" "C" 0 133 131076 15 6 0.447359
 "O" "O" 0 133 131076 16 8 -0.404629
 "N" "N" 0 134 131076 1 7 -0.558201
 "H" "H" 0 134 131076 2 1 0.319676
 "CA" "CT" 0 134 131076 3 6 0.007225
 "HA" "H1" 0 134 131076 4 1 0.082375
 "CB" "CT" 0 134 131076 5 6 -0.047555
 "HB2" "HC" 0 134 131076 6 1 -0.014836
 "HB3" "HC" 0 134 131076 7 1 -0.014836
 "CG" "C" 0 134 131076 8 6 0.745168
 "OD1" "O2" 0 134 131076 9 8 -0.730385
 "OD2" "O2" 0 134 131076 10 8 -0.730385
 "C" "C" 0 134 131076 11 6 0.443199
 "O" "O" 0 134 131076 12 8 -0.501445
 "N" "N" 0 135 131076 1 7 -0.387353
 "H" "H" 0 135 131076 2 1 0.300605
 "CA" "CT" 0 135 131076 3 6 0.037470
 "HA" "H1" 0 135 131076 4 1 0.152255
 "CB" "CT" 0 135 131076 5 6 -0.032112
 "HB2" "HC" 0 135 131076 6 1 0.030995
 "HB3" "HC" 0 135 131076 7 1 0.030995
 "CG" "CT" 0 135 131076 8 6 -0.020264
 "HG2" "HC" 0 135 131076 9 1 0.030791
 "HG3" "HC" 0 135 131076 10 1 0.030791
 "CD" "C" 0 135 131076 11 6 0.667812
 "OE1" "O" 0 135 131076 12 8 -0.628483
 "NE2" "N" 0 135 131076 13 7 -0.883393
 "HE21" "H" 0 135 131076 14 1 0.408312
 "HE22" "H" 0 135 131076 15 1 0.408312
 "C" "C" 0 135 131076 16 6 0.418577
 "O" "O" 0 135 131076 17 8 -0.565310
 "N" "N" 0 136 131076 1 7 -0.355153
 "H" "H" 0 136 131076 2 1 0.262417
 "CA" "CT" 0 136 131076 3 6 -0.101497
 "HA" "H1" 0 136 131076 4 1 0.136951
 "CB" "CT" 0 136 131076 5 6 -0.144399
 "HB2" "HC" 0 136 131076 6 1 0.052533
 "HB3" "HC" 0 136 131076 7 1 0.052533
 "CG" "CT" 0 136 131076 8 6 0.191982
 "HG" "HC" 0 136 131076 9 1 0.000825
 "CD1" "CT" 0 136 131076 10 6 -0.123036
 "HD11" "HC" 0 136 131076 11 1 0.022376
 "HD12" "HC" 0 136 131076 12 1 0.022376
 "HD13" "HC" 0 136 131076 13 1 0.022376
 "CD2" "CT" 0 136 131076 14 6 -0.123036
 "HD21" "HC" 0 136 131076 15 1 0.022376
 "HD22" "HC" 0 136 131076 16 1 0.022376
 "HD23" "HC" 0 136 131076 17 1 0.022376
 "C" "C" 0 136 131076 18 6 0.573471
 "O" "O" 0 136 131076 19 8 -0.557847
 "N" "N" 0 137 131076 1 7 -0.387353
 "H" "H" 0 137 131076 2 1 0.300605
 "CA" "CT" 0 137 131076 3 6 0.037470
 "HA" "H1" 0 137 131076 4 1 0.152255
 "CB" "CT" 0 137 131076 5 6 -0.032112
 "HB2" "HC" 0 137 131076 6 1 0.030995
 "HB3" "HC" 0 137 131076 7 1 0.030995
 "CG" "CT" 0 137 131076 8 6 -0.020264
 "HG2" "HC" 0 137 131076 9 1 0.030791
 "HG3" "HC" 0 137 131076 10 1 0.030791
 "CD" "C" 0 137 131076 11 6 0.667812
 "OE1" "O" 0 137 131076 12 8 -0.628483
 "NE2" "N" 0 137 131076 13 7 -0.883393
 "HE21" "H" 0 137 131076 14 1 0.408312
 "HE22" "H" 0 137 131076 15 1 0.408312
 "C" "C" 0 137 131076 16 6 0.418577
 "O" "O" 0 137 131076 17 8 -0.565310
 "N" "N" 0 138 131076 1 7 -0.300879
 "H" "H" 0 138 131076 2 1 0.233693
 "CA" "CT" 0 138 131076 3 6 -0.131381
 "HA" "H1" 0 138 131076 4 1 0.053266
 "CB" "CT" 0 138 131076 5 6 0.036707
 "HB2" "HC" 0 138 131076 6 1 0.028012
 "HB3" "HC" 0 138 131076 7 1 0.028012
 "CG" "CT" 0 138 131076 8 6 0.012454
 "HG2" "HC" 0 138 131076 9 1 0.002964
 "HG3" "HC" 0 138 131076 10 1 0.002964
 "CD" "CT" 0 138 131076 11 6 0.126329
 "HD2" "H1" 0 138 131076 12 1 0.068148
 "HD3" "H1" 0 138 131076 13 1 0.068148
 "NE" "N2" 0 138 131076 14 7 -0.464890
 "HE" "H" 0 138 131076 15 1 0.326274
 "CZ" "CA" 0 138 131076 16 6 0.565543
 "NH1" "N2" 0 138 131076 17 7 -0.685774
 "HH11" "H" 0 138 131076 18 1 0.391052
 "HH12" "H" 0 138 131076 19 1 0.391052
 "NH2" "N2" 0 138 131076 20 7 -0.685774
 "HH21" "H" 0 138 131076 21 1 0.391052
 "HH22" "H" 0 138 131076 22 1 0.391052
 "C" "C" 0 138 131076 23 6 0.730308
 "O" "O" 0 138 131076 24 8 -0.578332
 "N" "N" 0 139 131076 1 7 -0.450087
 "H" "H" 0 139 131076 2 1 0.440048
 "CA" "CT" 0 139 131076 3 6 -0.051858
 "HA" "H1" 0 139 131076 4 1 -0.026204
 "CB" "CT" 0 139 131076 5 6 0.395217
 "HB" "HC" 0 139 131076 6 1 -0.115672
 "CG1" "CT" 0 139 131076 7 6 -0.090132
 "HG11" "HC" 0 139 131076 8 1 -0.008985
 "HG12" "HC" 0 139 131076 9 1 -0.008985
 "HG13" "HC" 0 139 131076 10 1 -0.008985
 "CG2" "CT" 0 139 131076 11 6 -0.090132
 "HG21" "HC" 0 139 131076 12 1 -0.008985
 "HG22" "HC" 0 139 131076 13 1 -0.008985
 "HG23" "HC" 0 139 131076 14 1 -0.008985
 "C" "C" 0 139 131076 15 6 0.447359
 "O" "O" 0 139 131076 16 8 -0.404629
 "N" "N" 0 140 131076 1 7 -0.451047
 "H" "H" 0 140 131076 2 1 0.328831
 "CA" "CT" 0 140 131076 3 6 -0.101874
 "HA" "H1" 0 140 131076 4 1 0.174193
 "CB" "CT" 0 140 131076 5 6 0.062238
 "HB" "HC" 0 140 131076 6 1 0.061662
 "CG2" "CT" 0 140 131076 7 6 -0.129989
 "HG21" "HC" 0 140 131076 8 1 0.030227
 "HG22" "HC" 0 140 131076 9 1 0.030227
 "HG23" "HC" 0 140 131076 10 1 0.030227
 "CG1" "CT" 0 140 131076 11 6 0.022230
 "HG12" "HC" 0 140 131076 12 1 0.011551
 "HG13" "HC" 0 140 131076 13 1 0.011551
 "CD1" "CT" 0 140 131076 14 6 -0.101251
 "HD11" "HC" 0 140 131076 15 1 0.023792
 "HD12" "HC" 0 140 131076 16 1 0.023792
 "HD13" "HC" 0 140 131076 17 1 0.023792
 "C" "C" 0 140 131076 18 6 0.569383
 "O" "O" 0 140 131076 19 8 -0.619535
 "N" "N" 0 141 131076 1 7 -0.558201
 "H" "H" 0 141 131076 2 1 0.319676
 "CA" "CT" 0 141 131076 3 6 0.007225
 "HA" "H1" 0 141 131076 4 1 0.082375
 "CB" "CT" 0 141 131076 5 6 -0.047555
 "HB2" "HC" 0 141 131076 6 1 -0.014836
 "HB3" "HC" 0 141 131076 7 1 -0.014836
 "CG" "C" 0 141 131076 8 6 0.745168
 "OD1" "O2" 0 141 131076 9 8 -0.730385
 "OD2" "O2" 0 141 131076 10 8 -0.730385
 "C" "C" 0 141 131076 11 6 0.443199
 "O" "O" 0 141 131076 12 8 -0.501445
 "N" "N" 0 142 131076 1 7 -0.245382
 "H" "H" 0 142 131076 2 1 0.255339
 "CA" "CT" 0 142 131076 3 6 -0.271249
 "HA" "H1" 0 142 131076 4 1 0.163757
 "CB" "CT" 0 142 131076 5 6 0.237868
 "HB" "H1" 0 142 131076 6 1 0.044688
 "CG2" "CT" 0 142 131076 7 6 -0.176489
 "HG21" "HC" 0 142 131076 8 1 0.060019
 "HG22" "HC" 0 142 131076 9 1 0.060019
 "HG23" "HC" 0 142 131076 10 1 0.060019
 "OG1" "OH" 0 142 131076 11 8 -0.601931
 "HG1" "HO" 0 142 131076 12 1 0.405484
 "C" "C" 0 142 131076 13 6 0.559878
 "O" "O" 0 142 131076 14 8 -0.552020
 "N" "N" 0 143 131076 1 7 -0.451047
 "H" "H" 0 143 131076 2 1 0.328831
 "CA" "CT" 0 143 131076 3 6 -0.101874
 "HA" "H1" 0 143 131076 4 1 0.174193
 "CB" "CT" 0 143 131076 5 6 0.062238
 "HB" "HC" 0 143 131076 6 1 0.061662
 "CG2" "CT" 0 143 131076 7 6 -0.129989
 "HG21" "HC" 0 143 131076 8 1 0.030227
 "HG22" "HC" 0 143 131076 9 1 0.030227
 "HG23" "HC" 0 143 131076 10 1 0.030227
 "CG1" "CT" 0 143 131076 11 6 0.022230
 "HG12" "HC" 0 143 131076 12 1 0.011551
 "HG13" "HC" 0 143 131076 13 1 0.011551
 "CD1" "CT" 0 143 131076 14 6 -0.101251
 "HD11" "HC" 0 143 131076 15 1 0.023792
 "HD12" "HC" 0 143 131076 16 1 0.023792
 "HD13" "HC" 0 143 131076 17 1 0.023792
 "C" "C" 0 143 131076 18 6 0.569383
 "O" "O" 0 143 131076 19 8 -0.619535
 "N" "N" 0 144 131076 1 7 -0.435875
 "H" "H" 0 144 131076 2 1 0.251302
 "CA" "CT" 0 144 131076 3 6 -0.038773
 "HA" "H1" 0 144 131076 4 1 0.129478
 "CB" "CT" 0 144 131076 5 6 -0.108273
 "HB2" "HC" 0 144 131076 6 1 0.045214
 "HB3" "HC" 0 144 131076 7 1 0.045214
 "CG" "CT" 0 144 131076 8 6 0.033341
 "HG2" "HC" 0 144 131076 9 1 0.010208
 "HG3" "HC" 0 144 131076 10 1 0.010208
 "CD" "CT" 0 144 131076 11 6 -0.047841
 "HD2" "HC" 0 144 131076 12 1 0.070715
 "HD3" "HC" 0 144 131076 13 1 0.070715
 "CE" "CT" 0 144 131076 14 6 -0.069974
 "HE2" "HP" 0 144 131076 15 1 0.119522
 "HE3" "HP" 0 144 131076 16 1 0.119522
 "NZ" "N3" 0 144 131076 17 7 -0.250358
 "HZ1" "H" 0 144 131076 18 1 0.294561
 "HZ2" "H" 0 144 131076 19 1 0.294561
 "HZ3" "H" 0 144 131076 20 1 0.294561
 "C" "C" 0 144 131076 21 6 0.725129
 "O" "O" 0 144 131076 22 8 -0.563157
 "N" "N" 0 145 131076 1 7 -0.245382
 "H" "H" 0 145 131076 2 1 0.255339
 "CA" "CT" 0 145 131076 3 6 -0.271249
 "HA" "H1" 0 145 131076 4 1 0.163757
 "CB" "CT" 0 145 131076 5 6 0.237868
 "HB" "H1" 0 145 131076 6 1 0.044688
 "CG2" "CT" 0 145 131076 7 6 -0.176489
 "HG21" "HC" 0 145 131076 8 1 0.060019
 "HG22" "HC" 0 145 131076 9 1 0.060019
 "HG23" "HC" 0 145 131076 10 1 0.060019
 "OG1" "OH" 0 145 131076 11 8 -0.601931
 "HG1" "HO" 0 145 131076 12 1 0.405484
 "C" "C" 0 145 131076 13 6 0.559878
 "O" "O" 0 145 131076 14 8 -0.552020
 "N" "N" 0 146 131076 1 7 -0.430106
 "H" "H" 0 146 131076 2 1 0.254543
 "CA" "CT" 0 146 131076 3 6 0.044609
 "HA" "H1" 0 146 131076 4 1 0.059601
 "CB" "CT" 0 146 131076 5 6 -0.093650
 "HB2" "HC" 0 146 131076 6 1 0.043321
 "HB3" "HC" 0 146 131076 7 1 0.043321
 "CG" "C" 0 146 131076 8 6 0.583519
 "OD1" "O" 0 146 131076 9 8 -0.526813
 "ND2" "N" 0 146 131076 10 7 -0.781735
 "HD21" "H" 0 146 131076 11 1 0.355079
 "HD22" "H" 0 146 131076 12 1 0.355079
 "C" "C" 0 146 131076 13 6 0.617141
 "O" "O" 0 146 131076 14 8 -0.523909
 "N" "N" 0 147 131076 1 7 -0.088116
 "CD" "CT" 0 147 131076 2 6 -0.011906
 "HD2" "H1" 0 147 131076 3 1 0.043951
 "HD3" "H1" 0 147 131076 4 1 0.043950
 "CG" "CT" 0 147 131076 5 6 0.013059
 "HG2" "HC" 0 147 131076 6 1 0.019574
 "HG3" "HC" 0 147 131076 7 1 0.019574
 "CB" "CT" 0 147 131076 8 6 -0.003351
 "HB2" "HC" 0 147 131076 9 1 0.019352
 "HB3" "HC" 0 147 131076 10 1 0.019352
 "CA" "CT" 0 147 131076 11 6 -0.034577
 "HA" "H1" 0 147 131076 12 1 0.059977
 "C" "C" 0 147 131076 13 6 0.333720
 "O" "O" 0 147 131076 14 8 -0.434559
 "N" "N" 0 148 131076 1 7 -0.558201
 "H" "H" 0 148 131076 2 1 0.319676
 "CA" "CT" 0 148 131076 3 6 0.007225
 "HA" "H1" 0 148 131076 4 1 0.082375
 "CB" "CT" 0 148 131076 5 6 -0.047555
 "HB2" "HC" 0 148 131076 6 1 -0.014836
 "HB3" "HC" 0 148 131076 7 1 -0.014836
 "CG" "C" 0 148 131076 8 6 0.745168
 "OD1" "O2" 0 148 131076 9 8 -0.730385
 "OD2" "O2" 0 148 131076 10 8 -0.730385
 "C" "C" 0 148 131076 11 6 0.443199
 "O" "O" 0 148 131076 12 8 -0.501445
 "N" "N" 0 149 131076 1 7 -0.558201
 "H" "H" 0 149 131076 2 1 0.319676
 "CA" "CT" 0 149 131076 3 6 0.007225
 "HA" "H1" 0 149 131076 4 1 0.082375
 "CB" "CT" 0 149 131076 5 6 -0.047555
 "HB2" "HC" 0 149 131076 6 1 -0.014836
 "HB3" "HC" 0 149 131076 7 1 -0.014836
 "CG" "C" 0 149 131076 8 6 0.745168
 "OD1" "O2" 0 149 131076 9 8 -0.730385
 "OD2" "O2" 0 149 131076 10 8 -0.730385
 "C" "C" 0 149 131076 11 6 0.443199
 "O" "O" 0 149 131076 12 8 -0.501445
 "N" "N" 0 150 131076 1 7 -0.300879
 "H" "H" 0 150 131076 2 1 0.233693
 "CA" "CT" 0 150 131076 3 6 -0.131381
 "HA" "H1" 0 150 131076 4 1 0.053266
 "CB" "CT" 0 150 131076 5 6 0.036707
 "HB2" "HC" 0 150 131076 6 1 0.028012
 "HB3" "HC" 0 150 131076 7 1 0.028012
 "CG" "CT" 0 150 131076 8 6 0.012454
 "HG2" "HC" 0 150 131076 9 1 0.002964
 "HG3" "HC" 0 150 131076 10 1 0.002964
 "CD" "CT" 0 150 131076 11 6 0.126329
 "HD2" "H1" 0 150 131076 12 1 0.068148
 "HD3" "H1" 0 150 131076 13 1 0.068148
 "NE" "N2" 0 150 131076 14 7 -0.464890
 "HE" "H" 0 150 131076 15 1 0.326274
 "CZ" "CA" 0 150 131076 16 6 0.565543
 "NH1" "N2" 0 150 131076 17 7 -0.685774
 "HH11" "H" 0 150 131076 18 1 0.391052
 "HH12" "H" 0 150 131076 19 1 0.391052
 "NH2" "N2" 0 150 131076 20 7 -0.685774
 "HH21" "H" 0 150 131076 21 1 0.391052
 "HH22" "H" 0 150 131076 22 1 0.391052
 "C" "C" 0 150 131076 23 6 0.730308
 "O" "O" 0 150 131076 24 8 -0.578332
 "N" "N" 0 151 131076 1 7 -0.300879
 "H" "H" 0 151 131076 2 1 0.233693
 "CA" "CT" 0 151 131076 3 6 -0.131381
 "HA" "H1" 0 151 131076 4 1 0.053266
 "CB" "CT" 0 151 131076 5 6 0.036707
 "HB2" "HC" 0 151 131076 6 1 0.028012
 "HB3" "HC" 0 151 131076 7 1 0.028012
 "CG" "CT" 0 151 131076 8 6 0.012454
 "HG2" "HC" 0 151 131076 9 1 0.002964
 "HG3" "HC" 0 151 131076 10 1 0.002964
 "CD" "CT" 0 151 131076 11 6 0.126329
 "HD2" "H1" 0 151 131076 12 1 0.068148
 "HD3" "H1" 0 151 131076 13 1 0.068148
 "NE" "N2" 0 151 131076 14 7 -0.464890
 "HE" "H" 0 151 131076 15 1 0.326274
 "CZ" "CA" 0 151 131076 16 6 0.565543
 "NH1" "N2" 0 151 131076 17 7 -0.685774
 "HH11" "H" 0 151 131076 18 1 0.391052
 "HH12" "H" 0 151 131076 19 1 0.391052
 "NH2" "N2" 0 151 131076 20 7 -0.685774
 "HH21" "H" 0 151 131076 21 1 0.391052
 "HH22" "H" 0 151 131076 22 1 0.391052
 "C" "C" 0 151 131076 23 6 0.730308
 "O" "O" 0 151 131076 24 8 -0.578332
 "N" "N" 0 152 131076 1 7 -0.451047
 "H" "H" 0 152 131076 2 1 0.328831
 "CA" "CT" 0 152 131076 3 6 -0.101874
 "HA" "H1" 0 152 131076 4 1 0.174193
 "CB" "CT" 0 152 131076 5 6 0.062238
 "HB" "HC" 0 152 131076 6 1 0.061662
 "CG2" "CT" 0 152 131076 7 6 -0.129989
 "HG21" "HC" 0 152 131076 8 1 0.030227
 "HG22" "HC" 0 152 131076 9 1 0.030227
 "HG23" "HC" 0 152 131076 10 1 0.030227
 "CG1" "CT" 0 152 131076 11 6 0.022230
 "HG12" "HC" 0 152 131076 12 1 0.011551
 "HG13" "HC" 0 152 131076 13 1 0.011551
 "CD1" "CT" 0 152 131076 14 6 -0.101251
 "HD11" "HC" 0 152 131076 15 1 0.023792
 "HD12" "HC" 0 152 131076 16 1 0.023792
 "HD13" "HC" 0 152 131076 17 1 0.023792
 "C" "C" 0 152 131076 18 6 0.569383
 "O" "O" 0 152 131076 19 8 -0.619535
 "N" "N" 0 153 131076 1 7 -0.451047
 "H" "H" 0 153 131076 2 1 0.328831
 "CA" "CT" 0 153 131076 3 6 -0.101874
 "HA" "H1" 0 153 131076 4 1 0.174193
 "CB" "CT" 0 153 131076 5 6 0.062238
 "HB" "HC" 0 153 131076 6 1 0.061662
 "CG2" "CT" 0 153 131076 7 6 -0.129989
 "HG21" "HC" 0 153 131076 8 1 0.030227
 "HG22" "HC" 0 153 131076 9 1 0.030227
 "HG23" "HC" 0 153 131076 10 1 0.030227
 "CG1" "CT" 0 153 131076 11 6 0.022230
 "HG12" "HC" 0 153 131076 12 1 0.011551
 "HG13" "HC" 0 153 131076 13 1 0.011551
 "CD1" "CT" 0 153 131076 14 6 -0.101251
 "HD11" "HC" 0 153 131076 15 1 0.023792
 "HD12" "HC" 0 153 131076 16 1 0.023792
 "HD13" "HC" 0 153 131076 17 1 0.023792
 "C" "C" 0 153 131076 18 6 0.569383
 "O" "O" 0 153 131076 19 8 -0.619535
 "N" "N" 0 154 131076 1 7 -0.394918
 "H" "H" 0 154 131076 2 1 0.280537
 "CA" "CT" 0 154 131076 3 6 -0.087681
 "HA" "H1" 0 154 131076 4 1 0.123080
 "CB" "CT" 0 154 131076 5 6 0.019227
 "HB2" "HC" 0 154 131076 6 1 0.048840
 "HB3" "HC" 0 154 131076 7 1 0.048840
 "CG" "CT" 0 154 131076 8 6 -0.208167
 "HG2" "H1" 0 154 131076 9 1 0.124228
 "HG3" "H1" 0 154 131076 10 1 0.124228
 "SD" "S" 0 154 131076 11 16 -0.211958
 "CE" "CT" 0 154 131076 12 6 -0.284698
 "HE1" "H1" 0 154 131076 13 1 0.128394
 "HE2" "H1" 0 154 131076 14 1 0.128394
 "HE3" "H1" 0 154 131076 15 1 0.128394
 "C" "C" 0 154 131076 16 6 0.599684
 "O" "O" 0 154 131076 17 8 -0.566424
 "N" "N" 0 155 131076 1 7 -0.396165
 "H" "H" 0 155 131076 2 1 0.295187
 "CA" "CT" 0 155 131076 3 6 -0.073501
 "HA" "H1" 0 155 131076 4 1 0.140510
 "CB" "CT" 0 155 131076 5 6 -0.221371
 "HB2" "H1" 0 155 131076 6 1 0.146537
 "HB3" "H1" 0 155 131076 7 1 0.146537
 "SG" "SH" 0 155 131076 8 16 -0.285182
 "HG" "HS" 0 155 131076 9 1 0.189274
 "C" "C" 0 155 131076 10 6 0.643035
 "O" "O" 0 155 131076 11 8 -0.584861
 "N" "N" 0 156 131076 1 7 -0.404773
 "H" "H" 0 156 131076 2 1 0.294276
 "CA" "CT" 0 156 131076 3 6 -0.027733
 "HA" "H1" 0 156 131076 4 1 0.120802
 "CB" "CT" 0 156 131076 5 6 -0.229951
 "HB1" "HC" 0 156 131076 6 1 0.077428
 "HB2" "HC" 0 156 131076 7 1 0.077428
 "HB3" "HC" 0 156 131076 8 1 0.077428
 "C" "C" 0 156 131076 9 6 0.570224
 "O" "O" 0 156 131076 10 8 -0.555129
 "N" "N" 0 157 131076 1 7 -0.427579
 "H" "H" 0 157 131076 2 1 0.241716
 "CA" "CT" 0 157 131076 3 6 -0.020082
 "HA" "H1" 0 157 131076 4 1 0.106629
 "CB" "CT" 0 157 131076 5 6 -0.098364
 "HB2" "HC" 0 157 131076 6 1 0.065424
 "HB3" "HC" 0 157 131076 7 1 0.065424
 "CG" "C*" 0 157 131076 8 6 -0.099797
 "CD1" "CW" 0 157 131076 9 6 -0.174053
 "HD1" "H4" 0 157 131076 10 1 0.170633
 "NE1" "NA" 0 157 131076 11 7 -0.298433
 "HE1" "H" 0 157 131076 12 1 0.322375
 "CE2" "CN" 0 157 131076 13 6 0.141523
 "CZ2" "CA" 0 157 131076 14 6 -0.210701
 "HZ2" "HA" 0 157 131076 15 1 0.125512
 "CH2" "CA" 0 157 131076 16 6 -0.133022
 "HH2" "HA" 0 157 131076 17 1 0.119467
 "CZ3" "CA" 0 157 131076 18 6 -0.164054
 "HZ3" "HA" 0 157 131076 19 1 0.119250
 "CE3" "CA" 0 157 131076 20 6 -0.153992
 "HE3" "HA" 0 157 131076 21 1 0.123084
 "CD2" "CB" 0 157 131076 22 6 0.089641
 "C" "C" 0 157 131076 23 6 0.584129
 "O" "O" 0 157 131076 24 8 -0.494730
 "N" "N" 0 158 131076 1 7 -0.430106
 "H" "H" 0 158 131076 2 1 0.254543
 "CA" "CT" 0 158 131076 3 6 0.044609
 "HA" "H1" 0 158 131076 4 1 0.059601
 "CB" "CT" 0 158 131076 5 6 -0.093650
 "HB2" "HC" 0 158 131076 6 1 0.043321
 "HB3" "HC" 0 158 131076 7 1 0.043321
 "CG" "C" 0 158 131076 8 6 0.583519
 "OD1" "O" 0 158 131076 9 8 -0.526813
 "ND2" "N" 0 158 131076 10 7 -0.781735
 "HD21" "H" 0 158 131076 11 1 0.355079
 "HD22" "H" 0 158 131076 12 1 0.355079
 "C" "C" 0 158 131076 13 6 0.617141
 "O" "O" 0 158 131076 14 8 -0.523909
 "N" "N" 0 159 131076 1 7 -0.088116
 "CD" "CT" 0 159 131076 2 6 -0.011906
 "HD2" "H1" 0 159 131076 3 1 0.043951
 "HD3" "H1" 0 159 131076 4 1 0.043950
 "CG" "CT" 0 159 131076 5 6 0.013059
 "HG2" "HC" 0 159 131076 6 1 0.019574
 "HG3" "HC" 0 159 131076 7 1 0.019574
 "CB" "CT" 0 159 131076 8 6 -0.003351
 "HB2" "HC" 0 159 131076 9 1 0.019352
 "HB3" "HC" 0 159 131076 10 1 0.019352
 "CA" "CT" 0 159 131076 11 6 -0.034577
 "HA" "H1" 0 159 131076 12 1 0.059977
 "C" "C" 0 159 131076 13 6 0.333720
 "O" "O" 0 159 131076 14 8 -0.434559
 "N" "N" 0 160 131076 1 7 -0.300879
 "H" "H" 0 160 131076 2 1 0.233693
 "CA" "CT" 0 160 131076 3 6 -0.131381
 "HA" "H1" 0 160 131076 4 1 0.053266
 "CB" "CT" 0 160 131076 5 6 0.036707
 "HB2" "HC" 0 160 131076 6 1 0.028012
 "HB3" "HC" 0 160 131076 7 1 0.028012
 "CG" "CT" 0 160 131076 8 6 0.012454
 "HG2" "HC" 0 160 131076 9 1 0.002964
 "HG3" "HC" 0 160 131076 10 1 0.002964
 "CD" "CT" 0 160 131076 11 6 0.126329
 "HD2" "H1" 0 160 131076 12 1 0.068148
 "HD3" "H1" 0 160 131076 13 1 0.068148
 "NE" "N2" 0 160 131076 14 7 -0.464890
 "HE" "H" 0 160 131076 15 1 0.326274
 "CZ" "CA" 0 160 131076 16 6 0.565543
 "NH1" "N2" 0 160 131076 17 7 -0.685774
 "HH11" "H" 0 160 131076 18 1 0.391052
 "HH12" "H" 0 160 131076 19 1 0.391052
 "NH2" "N2" 0 160 131076 20 7 -0.685774
 "HH21" "H" 0 160 131076 21 1 0.391052
 "HH22" "H" 0 160 131076 22 1 0.391052
 "C" "C" 0 160 131076 23 6 0.730308
 "O" "O" 0 160 131076 24 8 -0.578332
 "N" "N" 0 161 131076 1 7 -0.558201
 "H" "H" 0 161 131076 2 1 0.319676
 "CA" "CT" 0 161 131076 3 6 0.007225
 "HA" "H1" 0 161 131076 4 1 0.082375
 "CB" "CT" 0 161 131076 5 6 -0.047555
 "HB2" "HC" 0 161 131076 6 1 -0.014836
 "HB3" "HC" 0 161 131076 7 1 -0.014836
 "CG" "C" 0 161 131076 8 6 0.745168
 "OD1" "O2" 0 161 131076 9 8 -0.730385
 "OD2" "O2" 0 161 131076 10 8 -0.730385
 "C" "C" 0 161 131076 11 6 0.443199
 "O" "O" 0 161 131076 12 8 -0.501445
 "N" "N" 0 162 131076 1 7 -0.355153
 "H" "H" 0 162 131076 2 1 0.262417
 "CA" "CT" 0 162 131076 3 6 -0.101497
 "HA" "H1" 0 162 131076 4 1 0.136951
 "CB" "CT" 0 162 131076 5 6 -0.144399
 "HB2" "HC" 0 162 131076 6 1 0.052533
 "HB3" "HC" 0 162 131076 7 1 0.052533
 "CG" "CT" 0 162 131076 8 6 0.191982
 "HG" "HC" 0 162 131076 9 1 0.000825
 "CD1" "CT" 0 162 131076 10 6 -0.123036
 "HD11" "HC" 0 162 131076 11 1 0.022376
 "HD12" "HC" 0 162 131076 12 1 0.022376
 "HD13" "HC" 0 162 131076 13 1 0.022376
 "CD2" "CT" 0 162 131076 14 6 -0.123036
 "HD21" "HC" 0 162 131076 15 1 0.022376
 "HD22" "HC" 0 162 131076 16 1 0.022376
 "HD23" "HC" 0 162 131076 17 1 0.022376
 "C" "C" 0 162 131076 18 6 0.573471
 "O" "O" 0 162 131076 19 8 -0.557847
 "N" "N" 0 163 131076 1 7 -0.088116
 "CD" "CT" 0 163 131076 2 6 -0.011906
 "HD2" "H1" 0 163 131076 3 1 0.043951
 "HD3" "H1" 0 163 131076 4 1 0.043950
 "CG" "CT" 0 163 131076 5 6 0.013059
 "HG2" "HC" 0 163 131076 6 1 0.019574
 "HG3" "HC" 0 163 131076 7 1 0.019574
 "CB" "CT" 0 163 131076 8 6 -0.003351
 "HB2" "HC" 0 163 131076 9 1 0.019352
 "HB3" "HC" 0 163 131076 10 1 0.019352
 "CA" "CT" 0 163 131076 11 6 -0.034577
 "HA" "H1" 0 163 131076 12 1 0.059977
 "C" "C" 0 163 131076 13 6 0.333720
 "O" "O" 0 163 131076 14 8 -0.434559
 "N" "N" 0 164 131076 1 7 -0.355153
 "H" "H" 0 164 131076 2 1 0.262417
 "CA" "CT" 0 164 131076 3 6 -0.101497
 "HA" "H1" 0 164 131076 4 1 0.136951
 "CB" "CT" 0 164 131076 5 6 -0.144399
 "HB2" "HC" 0 164 131076 6 1 0.052533
 "HB3" "HC" 0 164 131076 7 1 0.052533
 "CG" "CT" 0 164 131076 8 6 0.191982
 "HG" "HC" 0 164 131076 9 1 0.000825
 "CD1" "CT" 0 164 131076 10 6 -0.123036
 "HD11" "HC" 0 164 131076 11 1 0.022376
 "HD12" "HC" 0 164 131076 12 1 0.022376
 "HD13" "HC" 0 164 131076 13 1 0.022376
 "CD2" "CT" 0 164 131076 14 6 -0.123036
 "HD21" "HC" 0 164 131076 15 1 0.022376
 "HD22" "HC" 0 164 131076 16 1 0.022376
 "HD23" "HC" 0 164 131076 17 1 0.022376
 "C" "C" 0 164 131076 18 6 0.573471
 "O" "O" 0 164 131076 19 8 -0.557847
 "N" "N" 0 165 131076 1 7 -0.394918
 "H" "H" 0 165 131076 2 1 0.280537
 "CA" "CT" 0 165 131076 3 6 -0.087681
 "HA" "H1" 0 165 131076 4 1 0.123080
 "CB" "CT" 0 165 131076 5 6 0.019227
 "HB2" "HC" 0 165 131076 6 1 0.048840
 "HB3" "HC" 0 165 131076 7 1 0.048840
 "CG" "CT" 0 165 131076 8 6 -0.208167
 "HG2" "H1" 0 165 131076 9 1 0.124228
 "HG3" "H1" 0 165 131076 10 1 0.124228
 "SD" "S" 0 165 131076 11 16 -0.211958
 "CE" "CT" 0 165 131076 12 6 -0.284698
 "HE1" "H1" 0 165 131076 13 1 0.128394
 "HE2" "H1" 0 165 131076 14 1 0.128394
 "HE3" "H1" 0 165 131076 15 1 0.128394
 "C" "C" 0 165 131076 16 6 0.599684
 "O" "O" 0 165 131076 17 8 -0.566424
 "N" "N" 0 166 131076 1 7 -0.404773
 "H" "H" 0 166 131076 2 1 0.294276
 "CA" "CT" 0 166 131076 3 6 -0.027733
 "HA" "H1" 0 166 131076 4 1 0.120802
 "CB" "CT" 0 166 131076 5 6 -0.229951
 "HB1" "HC" 0 166 131076 6 1 0.077428
 "HB2" "HC" 0 166 131076 7 1 0.077428
 "HB3" "HC" 0 166 131076 8 1 0.077428
 "C" "C" 0 166 131076 9 6 0.570224
 "O" "O" 0 166 131076 10 8 -0.555129
 "N" "N" 0 167 131076 1 7 -0.355153
 "H" "H" 0 167 131076 2 1 0.262417
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 "CB" "CT" 0 167 131076 5 6 -0.144399
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 "HB3" "HC" 0 167 131076 7 1 0.052533
 "CG" "CT" 0 167 131076 8 6 0.191982
 "HG" "HC" 0 167 131076 9 1 0.000825
 "CD1" "CT" 0 167 131076 10 6 -0.123036
 "HD11" "HC" 0 167 131076 11 1 0.022376
 "HD12" "HC" 0 167 131076 12 1 0.022376
 "HD13" "HC" 0 167 131076 13 1 0.022376
 "CD2" "CT" 0 167 131076 14 6 -0.123036
 "HD21" "HC" 0 167 131076 15 1 0.022376
 "HD22" "HC" 0 167 131076 16 1 0.022376
 "HD23" "HC" 0 167 131076 17 1 0.022376
 "C" "C" 0 167 131076 18 6 0.573471
 "O" "O" 0 167 131076 19 8 -0.557847
 "N" "N" 0 168 131076 1 7 -0.088116
 "CD" "CT" 0 168 131076 2 6 -0.011906
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 "HD3" "H1" 0 168 131076 4 1 0.043950
 "CG" "CT" 0 168 131076 5 6 0.013059
 "HG2" "HC" 0 168 131076 6 1 0.019574
 "HG3" "HC" 0 168 131076 7 1 0.019574
 "CB" "CT" 0 168 131076 8 6 -0.003351
 "HB2" "HC" 0 168 131076 9 1 0.019352
 "HB3" "HC" 0 168 131076 10 1 0.019352
 "CA" "CT" 0 168 131076 11 6 -0.034577
 "HA" "H1" 0 168 131076 12 1 0.059977
 "C" "C" 0 168 131076 13 6 0.333720
 "O" "O" 0 168 131076 14 8 -0.434559
 "N" "N" 0 169 131076 1 7 -0.088116
 "CD" "CT" 0 169 131076 2 6 -0.011906
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 "HD3" "H1" 0 169 131076 4 1 0.043950
 "CG" "CT" 0 169 131076 5 6 0.013059
 "HG2" "HC" 0 169 131076 6 1 0.019574
 "HG3" "HC" 0 169 131076 7 1 0.019574
 "CB" "CT" 0 169 131076 8 6 -0.003351
 "HB2" "HC" 0 169 131076 9 1 0.019352
 "HB3" "HC" 0 169 131076 10 1 0.019352
 "CA" "CT" 0 169 131076 11 6 -0.034577
 "HA" "H1" 0 169 131076 12 1 0.059977
 "C" "C" 0 169 131076 13 6 0.333720
 "O" "O" 0 169 131076 14 8 -0.434559
 "N" "N" 0 170 131072 1 7 -0.396200
 "H" "H" 0 170 131072 2 1 0.295200
 "CA" "CT" 0 170 131072 3 6 -0.073500
 "HA" "H1" 0 170 131072 4 1 0.140500
 "CB" "CT" 0 170 131072 5 6 -0.221400
 "HB2" "H1" 0 170 131072 6 1 0.146500
 "HB3" "H1" 0 170 131072 7 1 0.146500
 "SG" "SH" 0 170 131072 8 16 -0.285200
 "C" "C" 0 170 131072 10 6 0.643000
 "O" "O" 0 170 131072 11 8 -0.584900
 "N" "N" 0 171 131076 1 7 -0.528120
 "H" "H" 0 171 131076 2 1 0.281695
 "CA" "CT" 0 171 131076 3 6 0.031249
 "HA" "H1" 0 171 131076 4 1 0.085175
 "CB" "CT" 0 171 131076 5 6 -0.152267
 "HB2" "HC" 0 171 131076 6 1 0.054608
 "HB3" "HC" 0 171 131076 7 1 0.054608
 "CG" "CC" 0 171 131076 8 6 0.278406
 "ND1" "NB" 0 171 131076 9 7 -0.423316
 "CE1" "CR" 0 171 131076 10 6 0.025960
 "HE1" "H5" 0 171 131076 11 1 0.126832
 "NE2" "NA" 0 171 131076 12 7 -0.097984
 "HE2" "H" 0 171 131076 13 1 0.266865
 "CD2" "CW" 0 171 131076 14 6 -0.297563
 "HD2" "H4" 0 171 131076 15 1 0.160413
 "C" "C" 0 171 131076 16 6 0.662405
 "O" "O" 0 171 131076 17 8 -0.528966
 "N" "N" 0 172 131076 1 7 -0.404773
 "H" "H" 0 172 131076 2 1 0.294276
 "CA" "CT" 0 172 131076 3 6 -0.027733
 "HA" "H1" 0 172 131076 4 1 0.120802
 "CB" "CT" 0 172 131076 5 6 -0.229951
 "HB1" "HC" 0 172 131076 6 1 0.077428
 "HB2" "HC" 0 172 131076 7 1 0.077428
 "HB3" "HC" 0 172 131076 8 1 0.077428
 "C" "C" 0 172 131076 9 6 0.570224
 "O" "O" 0 172 131076 10 8 -0.555129
 "N" "N" 0 173 131076 1 7 -0.355153
 "H" "H" 0 173 131076 2 1 0.262417
 "CA" "CT" 0 173 131076 3 6 -0.101497
 "HA" "H1" 0 173 131076 4 1 0.136951
 "CB" "CT" 0 173 131076 5 6 -0.144399
 "HB2" "HC" 0 173 131076 6 1 0.052533
 "HB3" "HC" 0 173 131076 7 1 0.052533
 "CG" "CT" 0 173 131076 8 6 0.191982
 "HG" "HC" 0 173 131076 9 1 0.000825
 "CD1" "CT" 0 173 131076 10 6 -0.123036
 "HD11" "HC" 0 173 131076 11 1 0.022376
 "HD12" "HC" 0 173 131076 12 1 0.022376
 "HD13" "HC" 0 173 131076 13 1 0.022376
 "CD2" "CT" 0 173 131076 14 6 -0.123036
 "HD21" "HC" 0 173 131076 15 1 0.022376
 "HD22" "HC" 0 173 131076 16 1 0.022376
 "HD23" "HC" 0 173 131076 17 1 0.022376
 "C" "C" 0 173 131076 18 6 0.573471
 "O" "O" 0 173 131076 19 8 -0.557847
 "N" "N" 0 174 131076 1 7 -0.396165
 "H" "H" 0 174 131076 2 1 0.295187
 "CA" "CT" 0 174 131076 3 6 -0.073501
 "HA" "H1" 0 174 131076 4 1 0.140510
 "CB" "CT" 0 174 131076 5 6 -0.221371
 "HB2" "H1" 0 174 131076 6 1 0.146537
 "HB3" "H1" 0 174 131076 7 1 0.146537
 "SG" "SH" 0 174 131076 8 16 -0.285182
 "HG" "HS" 0 174 131076 9 1 0.189274
 "C" "C" 0 174 131076 10 6 0.643035
 "O" "O" 0 174 131076 11 8 -0.584861
 "N" "N" 0 175 131076 1 7 -0.387353
 "H" "H" 0 175 131076 2 1 0.300605
 "CA" "CT" 0 175 131076 3 6 0.037470
 "HA" "H1" 0 175 131076 4 1 0.152255
 "CB" "CT" 0 175 131076 5 6 -0.032112
 "HB2" "HC" 0 175 131076 6 1 0.030995
 "HB3" "HC" 0 175 131076 7 1 0.030995
 "CG" "CT" 0 175 131076 8 6 -0.020264
 "HG2" "HC" 0 175 131076 9 1 0.030791
 "HG3" "HC" 0 175 131076 10 1 0.030791
 "CD" "C" 0 175 131076 11 6 0.667812
 "OE1" "O" 0 175 131076 12 8 -0.628483
 "NE2" "N" 0 175 131076 13 7 -0.883393
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 "HE22" "H" 0 175 131076 15 1 0.408312
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 "O" "O" 0 175 131076 17 8 -0.565310
 "N" "N" 0 176 131076 1 7 -0.371290
 "H" "H" 0 176 131076 2 1 0.234053
 "CA" "CT" 0 176 131076 3 6 -0.030057
 "HA" "H1" 0 176 131076 4 1 0.102448
 "CB" "CT" 0 176 131076 5 6 -0.098720
 "HB2" "HC" 0 176 131076 6 1 0.060989
 "HB3" "HC" 0 176 131076 7 1 0.060989
 "CG" "CA" 0 176 131076 8 6 0.021313
 "CD1" "CA" 0 176 131076 9 6 -0.083109
 "HD1" "HA" 0 176 131076 10 1 0.098466
 "CE1" "CA" 0 176 131076 11 6 -0.156974
 "HE1" "HA" 0 176 131076 12 1 0.123731
 "CZ" "CA" 0 176 131076 13 6 -0.099824
 "HZ" "HA" 0 176 131076 14 1 0.114679
 "CE2" "CA" 0 176 131076 15 6 -0.156974
 "HE2" "HA" 0 176 131076 16 1 0.123731
 "CD2" "CA" 0 176 131076 17 6 -0.083109
 "HD2" "HA" 0 176 131076 18 1 0.098466
 "C" "C" 0 176 131076 19 6 0.547987
 "O" "O" 0 176 131076 20 8 -0.506795
 "N" "N" 0 177 131076 1 7 -0.487560
 "H" "H" 0 177 131076 2 1 0.263521
 "CA" "CT" 0 177 131076 3 6 0.009614
 "HA" "H1" 0 177 131076 4 1 0.095501
 "CB" "CT" 0 177 131076 5 6 -0.051853
 "HB2" "HC" 0 177 131076 6 1 0.019145
 "HB3" "HC" 0 177 131076 7 1 0.019145
 "CG" "CA" 0 177 131076 8 6 0.112601
 "CD1" "CA" 0 177 131076 9 6 -0.183461
 "HD1" "HA" 0 177 131076 10 1 0.132715
 "CE1" "CA" 0 177 131076 11 6 -0.181823
 "HE1" "HA" 0 177 131076 12 1 0.137303
 "CZ" "C" 0 177 131076 13 6 0.206277
 "OH" "OH" 0 177 131076 14 8 -0.421233
 "HH" "HO" 0 177 131076 15 1 0.329691
 "CE2" "CA" 0 177 131076 16 6 -0.181823
 "HE2" "HA" 0 177 131076 17 1 0.137303
 "CD2" "CA" 0 177 131076 18 6 -0.183461
 "HD2" "HA" 0 177 131076 19 1 0.132715
 "C" "C" 0 177 131076 20 6 0.622290
 "O" "O" 0 177 131076 21 8 -0.526607
 "N" "N" 0 178 131076 1 7 -0.450087
 "H" "H" 0 178 131076 2 1 0.440048
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 "HA" "H1" 0 178 131076 4 1 -0.026204
 "CB" "CT" 0 178 131076 5 6 0.395217
 "HB" "HC" 0 178 131076 6 1 -0.115672
 "CG1" "CT" 0 178 131076 7 6 -0.090132
 "HG11" "HC" 0 178 131076 8 1 -0.008985
 "HG12" "HC" 0 178 131076 9 1 -0.008985
 "HG13" "HC" 0 178 131076 10 1 -0.008985
 "CG2" "CT" 0 178 131076 11 6 -0.090132
 "HG21" "HC" 0 178 131076 12 1 -0.008985
 "HG22" "HC" 0 178 131076 13 1 -0.008985
 "HG23" "HC" 0 178 131076 14 1 -0.008985
 "C" "C" 0 178 131076 15 6 0.447359
 "O" "O" 0 178 131076 16 8 -0.404629
 "N" "N" 0 179 131076 1 7 -0.450087
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 "CB" "CT" 0 179 131076 5 6 0.395217
 "HB" "HC" 0 179 131076 6 1 -0.115672
 "CG1" "CT" 0 179 131076 7 6 -0.090132
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 "HG12" "HC" 0 179 131076 9 1 -0.008985
 "HG13" "HC" 0 179 131076 10 1 -0.008985
 "CG2" "CT" 0 179 131076 11 6 -0.090132
 "HG21" "HC" 0 179 131076 12 1 -0.008985
 "HG22" "HC" 0 179 131076 13 1 -0.008985
 "HG23" "HC" 0 179 131076 14 1 -0.008985
 "C" "C" 0 179 131076 15 6 0.447359
 "O" "O" 0 179 131076 16 8 -0.404629
 "N" "N" 0 180 131076 1 7 -0.430106
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 "HA" "H1" 0 180 131076 4 1 0.059601
 "CB" "CT" 0 180 131076 5 6 -0.093650
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 "HB3" "HC" 0 180 131076 7 1 0.043321
 "CG" "C" 0 180 131076 8 6 0.583519
 "OD1" "O" 0 180 131076 9 8 -0.526813
 "ND2" "N" 0 180 131076 10 7 -0.781735
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 "O" "O" 0 180 131076 14 8 -0.523909
 "N" "N" 0 181 131076 1 7 -0.541430
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 "CA" "CT" 0 181 131076 3 6 0.118140
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 "CB" "CT" 0 181 131076 5 6 0.146998
 "HB2" "H1" 0 181 131076 6 1 0.040081
 "HB3" "H1" 0 181 131076 7 1 0.040081
 "OG" "OH" 0 181 131076 8 8 -0.640312
 "HG" "HO" 0 181 131076 9 1 0.446255
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 "O" "O" 0 181 131076 11 8 -0.580829
 "N" "N" 0 182 131076 1 7 -0.423392
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 "CD" "C" 0 182 131076 11 6 0.765188
 "OE1" "O2" 0 182 131076 12 8 -0.824035
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 "O" "O" 0 182 131076 15 8 -0.592528
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 "CG" "CT" 0 183 131076 8 6 0.191982
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 "HD22" "HC" 0 183 131076 16 1 0.022376
 "HD23" "HC" 0 183 131076 17 1 0.022376
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 "O" "O" 0 183 131076 19 8 -0.557847
 "N" "N" 0 184 131076 1 7 -0.541430
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 "OG" "OH" 0 184 131076 8 8 -0.640312
 "HG" "HO" 0 184 131076 9 1 0.446255
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 "O" "O" 0 184 131076 11 8 -0.580829
 "N" "N" 0 185 131076 1 7 -0.396165
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 "SG" "SH" 0 185 131076 8 16 -0.285182
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 "C" "C" 0 185 131076 10 6 0.643035
 "O" "O" 0 185 131076 11 8 -0.584861
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 "CG" "CT" 0 186 131076 8 6 -0.020264
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 "CD" "C" 0 186 131076 11 6 0.667812
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 "HE22" "H" 0 186 131076 15 1 0.408312
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 "HG" "HC" 0 187 131076 9 1 0.000825
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 "HD13" "HC" 0 187 131076 13 1 0.022376
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 "HD22" "HC" 0 187 131076 16 1 0.022376
 "HD23" "HC" 0 187 131076 17 1 0.022376
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 "O" "O" 0 187 131076 19 8 -0.557847
 "N" "N" 0 188 131076 1 7 -0.487560
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 "CG" "CA" 0 188 131076 8 6 0.112601
 "CD1" "CA" 0 188 131076 9 6 -0.183461
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 "CE1" "CA" 0 188 131076 11 6 -0.181823
 "HE1" "HA" 0 188 131076 12 1 0.137303
 "CZ" "C" 0 188 131076 13 6 0.206277
 "OH" "OH" 0 188 131076 14 8 -0.421233
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 "CE2" "CA" 0 188 131076 16 6 -0.181823
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 "CD2" "CA" 0 188 131076 18 6 -0.183461
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 "C" "C" 0 188 131076 20 6 0.622290
 "O" "O" 0 188 131076 21 8 -0.526607
 "N" "N" 0 189 131076 1 7 -0.387353
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 "CD" "C" 0 189 131076 11 6 0.667812
 "OE1" "O" 0 189 131076 12 8 -0.628483
 "NE2" "N" 0 189 131076 13 7 -0.883393
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 "O" "O" 0 189 131076 17 8 -0.565310
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 "CG" "CT" 0 190 131076 8 6 0.012454
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 "CD" "CT" 0 190 131076 11 6 0.126329
 "HD2" "H1" 0 190 131076 12 1 0.068148
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 "NE" "N2" 0 190 131076 14 7 -0.464890
 "HE" "H" 0 190 131076 15 1 0.326274
 "CZ" "CA" 0 190 131076 16 6 0.565543
 "NH1" "N2" 0 190 131076 17 7 -0.685774
 "HH11" "H" 0 190 131076 18 1 0.391052
 "HH12" "H" 0 190 131076 19 1 0.391052
 "NH2" "N2" 0 190 131076 20 7 -0.685774
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 "HH22" "H" 0 190 131076 22 1 0.391052
 "C" "C" 0 190 131076 23 6 0.730308
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 "OD2" "O2" 0 193 131076 10 8 -0.730385
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 "SD" "S" 0 194 131076 11 16 -0.211958
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 "O" "O" 0 194 131076 17 8 -0.566424
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 "HG" "HC" 0 196 131076 9 1 0.000825
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 "HG22" "HC" 0 198 131076 13 1 -0.008985
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 "O" "O" 0 198 131076 16 8 -0.404629
 "N" "N" 0 199 131076 1 7 -0.088116
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 "CG" "CT" 0 199 131076 5 6 0.013059
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 "CB" "CT" 0 199 131076 8 6 -0.003351
 "HB2" "HC" 0 199 131076 9 1 0.019352
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 "CA" "CT" 0 199 131076 11 6 -0.034577
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 "CG" "CA" 0 200 131076 8 6 0.021313
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 "CG" "C" 0 201 131076 8 6 0.583519
 "OD1" "O" 0 201 131076 9 8 -0.526813
 "ND2" "N" 0 201 131076 10 7 -0.781735
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 "HG22" "HC" 0 202 131076 9 1 0.030227
 "HG23" "HC" 0 202 131076 10 1 0.030227
 "CG1" "CT" 0 202 131076 11 6 0.022230
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 "CD1" "CT" 0 202 131076 14 6 -0.101251
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 "OG" "OH" 0 204 131076 8 8 -0.640312
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 "CG" "CA" 0 205 131076 8 6 0.112601
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 "HG3" "HC" 0 238 131076 10 1 -0.004135
 "CD" "C" 0 238 131076 11 6 0.765188
 "OE1" "O2" 0 238 131076 12 8 -0.824035
 "OE2" "O2" 0 238 131076 13 8 -0.824035
 "C" "C" 0 238 131076 14 6 0.469735
 "O" "O" 0 238 131076 15 8 -0.592528
 "N" "N" 0 239 131076 1 7 -0.088116
 "CD" "CT" 0 239 131076 2 6 -0.011906
 "HD2" "H1" 0 239 131076 3 1 0.043951
 "HD3" "H1" 0 239 131076 4 1 0.043950
 "CG" "CT" 0 239 131076 5 6 0.013059
 "HG2" "HC" 0 239 131076 6 1 0.019574
 "HG3" "HC" 0 239 131076 7 1 0.019574
 "CB" "CT" 0 239 131076 8 6 -0.003351
 "HB2" "HC" 0 239 131076 9 1 0.019352
 "HB3" "HC" 0 239 131076 10 1 0.019352
 "CA" "CT" 0 239 131076 11 6 -0.034577
 "HA" "H1" 0 239 131076 12 1 0.059977
 "C" "C" 0 239 131076 13 6 0.333720
 "O" "O" 0 239 131076 14 8 -0.434559
 "N" "N" 0 240 131076 1 7 -0.355153
 "H" "H" 0 240 131076 2 1 0.262417
 "CA" "CT" 0 240 131076 3 6 -0.101497
 "HA" "H1" 0 240 131076 4 1 0.136951
 "CB" "CT" 0 240 131076 5 6 -0.144399
 "HB2" "HC" 0 240 131076 6 1 0.052533
 "HB3" "HC" 0 240 131076 7 1 0.052533
 "CG" "CT" 0 240 131076 8 6 0.191982
 "HG" "HC" 0 240 131076 9 1 0.000825
 "CD1" "CT" 0 240 131076 10 6 -0.123036
 "HD11" "HC" 0 240 131076 11 1 0.022376
 "HD12" "HC" 0 240 131076 12 1 0.022376
 "HD13" "HC" 0 240 131076 13 1 0.022376
 "CD2" "CT" 0 240 131076 14 6 -0.123036
 "HD21" "HC" 0 240 131076 15 1 0.022376
 "HD22" "HC" 0 240 131076 16 1 0.022376
 "HD23" "HC" 0 240 131076 17 1 0.022376
 "C" "C" 0 240 131076 18 6 0.573471
 "O" "O" 0 240 131076 19 8 -0.557847
 "N" "N" 0 241 131076 1 7 -0.435875
 "H" "H" 0 241 131076 2 1 0.251302
 "CA" "CT" 0 241 131076 3 6 -0.038773
 "HA" "H1" 0 241 131076 4 1 0.129478
 "CB" "CT" 0 241 131076 5 6 -0.108273
 "HB2" "HC" 0 241 131076 6 1 0.045214
 "HB3" "HC" 0 241 131076 7 1 0.045214
 "CG" "CT" 0 241 131076 8 6 0.033341
 "HG2" "HC" 0 241 131076 9 1 0.010208
 "HG3" "HC" 0 241 131076 10 1 0.010208
 "CD" "CT" 0 241 131076 11 6 -0.047841
 "HD2" "HC" 0 241 131076 12 1 0.070715
 "HD3" "HC" 0 241 131076 13 1 0.070715
 "CE" "CT" 0 241 131076 14 6 -0.069974
 "HE2" "HP" 0 241 131076 15 1 0.119522
 "HE3" "HP" 0 241 131076 16 1 0.119522
 "NZ" "N3" 0 241 131076 17 7 -0.250358
 "HZ1" "H" 0 241 131076 18 1 0.294561
 "HZ2" "H" 0 241 131076 19 1 0.294561
 "HZ3" "H" 0 241 131076 20 1 0.294561
 "C" "C" 0 241 131076 21 6 0.725129
 "O" "O" 0 241 131076 22 8 -0.563157
 "N" "N" 0 242 131076 1 7 -0.451047
 "H" "H" 0 242 131076 2 1 0.328831
 "CA" "CT" 0 242 131076 3 6 -0.101874
 "HA" "H1" 0 242 131076 4 1 0.174193
 "CB" "CT" 0 242 131076 5 6 0.062238
 "HB" "HC" 0 242 131076 6 1 0.061662
 "CG2" "CT" 0 242 131076 7 6 -0.129989
 "HG21" "HC" 0 242 131076 8 1 0.030227
 "HG22" "HC" 0 242 131076 9 1 0.030227
 "HG23" "HC" 0 242 131076 10 1 0.030227
 "CG1" "CT" 0 242 131076 11 6 0.022230
 "HG12" "HC" 0 242 131076 12 1 0.011551
 "HG13" "HC" 0 242 131076 13 1 0.011551
 "CD1" "CT" 0 242 131076 14 6 -0.101251
 "HD11" "HC" 0 242 131076 15 1 0.023792
 "HD12" "HC" 0 242 131076 16 1 0.023792
 "HD13" "HC" 0 242 131076 17 1 0.023792
 "C" "C" 0 242 131076 18 6 0.569383
 "O" "O" 0 242 131076 19 8 -0.619535
 "N" "N" 0 243 131076 1 7 -0.387353
 "H" "H" 0 243 131076 2 1 0.300605
 "CA" "CT" 0 243 131076 3 6 0.037470
 "HA" "H1" 0 243 131076 4 1 0.152255
 "CB" "CT" 0 243 131076 5 6 -0.032112
 "HB2" "HC" 0 243 131076 6 1 0.030995
 "HB3" "HC" 0 243 131076 7 1 0.030995
 "CG" "CT" 0 243 131076 8 6 -0.020264
 "HG2" "HC" 0 243 131076 9 1 0.030791
 "HG3" "HC" 0 243 131076 10 1 0.030791
 "CD" "C" 0 243 131076 11 6 0.667812
 "OE1" "O" 0 243 131076 12 8 -0.628483
 "NE2" "N" 0 243 131076 13 7 -0.883393
 "HE21" "H" 0 243 131076 14 1 0.408312
 "HE22" "H" 0 243 131076 15 1 0.408312
 "C" "C" 0 243 131076 16 6 0.418577
 "O" "O" 0 243 131076 17 8 -0.565310
 "N" "N" 0 244 131076 1 7 -0.355153
 "H" "H" 0 244 131076 2 1 0.262417
 "CA" "CT" 0 244 131076 3 6 -0.101497
 "HA" "H1" 0 244 131076 4 1 0.136951
 "CB" "CT" 0 244 131076 5 6 -0.144399
 "HB2" "HC" 0 244 131076 6 1 0.052533
 "HB3" "HC" 0 244 131076 7 1 0.052533
 "CG" "CT" 0 244 131076 8 6 0.191982
 "HG" "HC" 0 244 131076 9 1 0.000825
 "CD1" "CT" 0 244 131076 10 6 -0.123036
 "HD11" "HC" 0 244 131076 11 1 0.022376
 "HD12" "HC" 0 244 131076 12 1 0.022376
 "HD13" "HC" 0 244 131076 13 1 0.022376
 "CD2" "CT" 0 244 131076 14 6 -0.123036
 "HD21" "HC" 0 244 131076 15 1 0.022376
 "HD22" "HC" 0 244 131076 16 1 0.022376
 "HD23" "HC" 0 244 131076 17 1 0.022376
 "C" "C" 0 244 131076 18 6 0.573471
 "O" "O" 0 244 131076 19 8 -0.557847
 "N" "N" 0 245 131076 1 7 -0.387353
 "H" "H" 0 245 131076 2 1 0.300605
 "CA" "CT" 0 245 131076 3 6 0.037470
 "HA" "H1" 0 245 131076 4 1 0.152255
 "CB" "CT" 0 245 131076 5 6 -0.032112
 "HB2" "HC" 0 245 131076 6 1 0.030995
 "HB3" "HC" 0 245 131076 7 1 0.030995
 "CG" "CT" 0 245 131076 8 6 -0.020264
 "HG2" "HC" 0 245 131076 9 1 0.030791
 "HG3" "HC" 0 245 131076 10 1 0.030791
 "CD" "C" 0 245 131076 11 6 0.667812
 "OE1" "O" 0 245 131076 12 8 -0.628483
 "NE2" "N" 0 245 131076 13 7 -0.883393
 "HE21" "H" 0 245 131076 14 1 0.408312
 "HE22" "H" 0 245 131076 15 1 0.408312
 "C" "C" 0 245 131076 16 6 0.418577
 "O" "O" 0 245 131076 17 8 -0.565310
 "N" "N" 0 246 131076 1 7 -0.300879
 "H" "H" 0 246 131076 2 1 0.233693
 "CA" "CT" 0 246 131076 3 6 -0.131381
 "HA" "H1" 0 246 131076 4 1 0.053266
 "CB" "CT" 0 246 131076 5 6 0.036707
 "HB2" "HC" 0 246 131076 6 1 0.028012
 "HB3" "HC" 0 246 131076 7 1 0.028012
 "CG" "CT" 0 246 131076 8 6 0.012454
 "HG2" "HC" 0 246 131076 9 1 0.002964
 "HG3" "HC" 0 246 131076 10 1 0.002964
 "CD" "CT" 0 246 131076 11 6 0.126329
 "HD2" "H1" 0 246 131076 12 1 0.068148
 "HD3" "H1" 0 246 131076 13 1 0.068148
 "NE" "N2" 0 246 131076 14 7 -0.464890
 "HE" "H" 0 246 131076 15 1 0.326274
 "CZ" "CA" 0 246 131076 16 6 0.565543
 "NH1" "N2" 0 246 131076 17 7 -0.685774
 "HH11" "H" 0 246 131076 18 1 0.391052
 "HH12" "H" 0 246 131076 19 1 0.391052
 "NH2" "N2" 0 246 131076 20 7 -0.685774
 "HH21" "H" 0 246 131076 21 1 0.391052
 "HH22" "H" 0 246 131076 22 1 0.391052
 "C" "C" 0 246 131076 23 6 0.730308
 "O" "O" 0 246 131076 24 8 -0.578332
 "N" "N" 0 247 131076 1 7 -0.423392
 "H" "H" 0 247 131076 2 1 0.306811
 "CA" "CT" 0 247 131076 3 6 0.031633
 "HA" "H1" 0 247 131076 4 1 0.065100
 "CB" "CT" 0 247 131076 5 6 0.074772
 "HB2" "HC" 0 247 131076 6 1 -0.003535
 "HB3" "HC" 0 247 131076 7 1 -0.003535
 "CG" "CT" 0 247 131076 8 6 -0.033909
 "HG2" "HC" 0 247 131076 9 1 -0.004135
 "HG3" "HC" 0 247 131076 10 1 -0.004135
 "CD" "C" 0 247 131076 11 6 0.765188
 "OE1" "O2" 0 247 131076 12 8 -0.824035
 "OE2" "O2" 0 247 131076 13 8 -0.824035
 "C" "C" 0 247 131076 14 6 0.469735
 "O" "O" 0 247 131076 15 8 -0.592528
 "N" "N" 0 248 131076 1 7 -0.088116
 "CD" "CT" 0 248 131076 2 6 -0.011906
 "HD2" "H1" 0 248 131076 3 1 0.043951
 "HD3" "H1" 0 248 131076 4 1 0.043950
 "CG" "CT" 0 248 131076 5 6 0.013059
 "HG2" "HC" 0 248 131076 6 1 0.019574
 "HG3" "HC" 0 248 131076 7 1 0.019574
 "CB" "CT" 0 248 131076 8 6 -0.003351
 "HB2" "HC" 0 248 131076 9 1 0.019352
 "HB3" "HC" 0 248 131076 10 1 0.019352
 "CA" "CT" 0 248 131076 11 6 -0.034577
 "HA" "H1" 0 248 131076 12 1 0.059977
 "C" "C" 0 248 131076 13 6 0.333720
 "O" "O" 0 248 131076 14 8 -0.434559
 "N" "N" 0 249 131076 1 7 -0.300879
 "H" "H" 0 249 131076 2 1 0.233693
 "CA" "CT" 0 249 131076 3 6 -0.131381
 "HA" "H1" 0 249 131076 4 1 0.053266
 "CB" "CT" 0 249 131076 5 6 0.036707
 "HB2" "HC" 0 249 131076 6 1 0.028012
 "HB3" "HC" 0 249 131076 7 1 0.028012
 "CG" "CT" 0 249 131076 8 6 0.012454
 "HG2" "HC" 0 249 131076 9 1 0.002964
 "HG3" "HC" 0 249 131076 10 1 0.002964
 "CD" "CT" 0 249 131076 11 6 0.126329
 "HD2" "H1" 0 249 131076 12 1 0.068148
 "HD3" "H1" 0 249 131076 13 1 0.068148
 "NE" "N2" 0 249 131076 14 7 -0.464890
 "HE" "H" 0 249 131076 15 1 0.326274
 "CZ" "CA" 0 249 131076 16 6 0.565543
 "NH1" "N2" 0 249 131076 17 7 -0.685774
 "HH11" "H" 0 249 131076 18 1 0.391052
 "HH12" "H" 0 249 131076 19 1 0.391052
 "NH2" "N2" 0 249 131076 20 7 -0.685774
 "HH21" "H" 0 249 131076 21 1 0.391052
 "HH22" "H" 0 249 131076 22 1 0.391052
 "C" "C" 0 249 131076 23 6 0.730308
 "O" "O" 0 249 131076 24 8 -0.578332
 "N" "N" 0 250 131076 1 7 -0.088116
 "CD" "CT" 0 250 131076 2 6 -0.011906
 "HD2" "H1" 0 250 131076 3 1 0.043951
 "HD3" "H1" 0 250 131076 4 1 0.043950
 "CG" "CT" 0 250 131076 5 6 0.013059
 "HG2" "HC" 0 250 131076 6 1 0.019574
 "HG3" "HC" 0 250 131076 7 1 0.019574
 "CB" "CT" 0 250 131076 8 6 -0.003351
 "HB2" "HC" 0 250 131076 9 1 0.019352
 "HB3" "HC" 0 250 131076 10 1 0.019352
 "CA" "CT" 0 250 131076 11 6 -0.034577
 "HA" "H1" 0 250 131076 12 1 0.059977
 "C" "C" 0 250 131076 13 6 0.333720
 "O" "O" 0 250 131076 14 8 -0.434559
 "N" "N" 0 251 131076 1 7 -0.371290
 "H" "H" 0 251 131076 2 1 0.234053
 "CA" "CT" 0 251 131076 3 6 -0.030057
 "HA" "H1" 0 251 131076 4 1 0.102448
 "CB" "CT" 0 251 131076 5 6 -0.098720
 "HB2" "HC" 0 251 131076 6 1 0.060989
 "HB3" "HC" 0 251 131076 7 1 0.060989
 "CG" "CA" 0 251 131076 8 6 0.021313
 "CD1" "CA" 0 251 131076 9 6 -0.083109
 "HD1" "HA" 0 251 131076 10 1 0.098466
 "CE1" "CA" 0 251 131076 11 6 -0.156974
 "HE1" "HA" 0 251 131076 12 1 0.123731
 "CZ" "CA" 0 251 131076 13 6 -0.099824
 "HZ" "HA" 0 251 131076 14 1 0.114679
 "CE2" "CA" 0 251 131076 15 6 -0.156974
 "HE2" "HA" 0 251 131076 16 1 0.123731
 "CD2" "CA" 0 251 131076 17 6 -0.083109
 "HD2" "HA" 0 251 131076 18 1 0.098466
 "C" "C" 0 251 131076 19 6 0.547987
 "O" "O" 0 251 131076 20 8 -0.506795
 "N" "N" 0 252 131076 1 7 -0.088116
 "CD" "CT" 0 252 131076 2 6 -0.011906
 "HD2" "H1" 0 252 131076 3 1 0.043951
 "HD3" "H1" 0 252 131076 4 1 0.043950
 "CG" "CT" 0 252 131076 5 6 0.013059
 "HG2" "HC" 0 252 131076 6 1 0.019574
 "HG3" "HC" 0 252 131076 7 1 0.019574
 "CB" "CT" 0 252 131076 8 6 -0.003351
 "HB2" "HC" 0 252 131076 9 1 0.019352
 "HB3" "HC" 0 252 131076 10 1 0.019352
 "CA" "CT" 0 252 131076 11 6 -0.034577
 "HA" "H1" 0 252 131076 12 1 0.059977
 "C" "C" 0 252 131076 13 6 0.333720
 "O" "O" 0 252 131076 14 8 -0.434559
 "N" "N" 0 253 131076 1 7 -0.435875
 "H" "H" 0 253 131076 2 1 0.251302
 "CA" "CT" 0 253 131076 3 6 -0.038773
 "HA" "H1" 0 253 131076 4 1 0.129478
 "CB" "CT" 0 253 131076 5 6 -0.108273
 "HB2" "HC" 0 253 131076 6 1 0.045214
 "HB3" "HC" 0 253 131076 7 1 0.045214
 "CG" "CT" 0 253 131076 8 6 0.033341
 "HG2" "HC" 0 253 131076 9 1 0.010208
 "HG3" "HC" 0 253 131076 10 1 0.010208
 "CD" "CT" 0 253 131076 11 6 -0.047841
 "HD2" "HC" 0 253 131076 12 1 0.070715
 "HD3" "HC" 0 253 131076 13 1 0.070715
 "CE" "CT" 0 253 131076 14 6 -0.069974
 "HE2" "HP" 0 253 131076 15 1 0.119522
 "HE3" "HP" 0 253 131076 16 1 0.119522
 "NZ" "N3" 0 253 131076 17 7 -0.250358
 "HZ1" "H" 0 253 131076 18 1 0.294561
 "HZ2" "H" 0 253 131076 19 1 0.294561
 "HZ3" "H" 0 253 131076 20 1 0.294561
 "C" "C" 0 253 131076 21 6 0.725129
 "O" "O" 0 253 131076 22 8 -0.563157
 "N" "N" 0 254 131076 1 7 -0.355153
 "H" "H" 0 254 131076 2 1 0.262417
 "CA" "CT" 0 254 131076 3 6 -0.101497
 "HA" "H1" 0 254 131076 4 1 0.136951
 "CB" "CT" 0 254 131076 5 6 -0.144399
 "HB2" "HC" 0 254 131076 6 1 0.052533
 "HB3" "HC" 0 254 131076 7 1 0.052533
 "CG" "CT" 0 254 131076 8 6 0.191982
 "HG" "HC" 0 254 131076 9 1 0.000825
 "CD1" "CT" 0 254 131076 10 6 -0.123036
 "HD11" "HC" 0 254 131076 11 1 0.022376
 "HD12" "HC" 0 254 131076 12 1 0.022376
 "HD13" "HC" 0 254 131076 13 1 0.022376
 "CD2" "CT" 0 254 131076 14 6 -0.123036
 "HD21" "HC" 0 254 131076 15 1 0.022376
 "HD22" "HC" 0 254 131076 16 1 0.022376
 "HD23" "HC" 0 254 131076 17 1 0.022376
 "C" "C" 0 254 131076 18 6 0.573471
 "O" "O" 0 254 131076 19 8 -0.557847
 "N" "N" 0 255 131076 1 7 -0.300879
 "H" "H" 0 255 131076 2 1 0.233693
 "CA" "CT" 0 255 131076 3 6 -0.131381
 "HA" "H1" 0 255 131076 4 1 0.053266
 "CB" "CT" 0 255 131076 5 6 0.036707
 "HB2" "HC" 0 255 131076 6 1 0.028012
 "HB3" "HC" 0 255 131076 7 1 0.028012
 "CG" "CT" 0 255 131076 8 6 0.012454
 "HG2" "HC" 0 255 131076 9 1 0.002964
 "HG3" "HC" 0 255 131076 10 1 0.002964
 "CD" "CT" 0 255 131076 11 6 0.126329
 "HD2" "H1" 0 255 131076 12 1 0.068148
 "HD3" "H1" 0 255 131076 13 1 0.068148
 "NE" "N2" 0 255 131076 14 7 -0.464890
 "HE" "H" 0 255 131076 15 1 0.326274
 "CZ" "CA" 0 255 131076 16 6 0.565543
 "NH1" "N2" 0 255 131076 17 7 -0.685774
 "HH11" "H" 0 255 131076 18 1 0.391052
 "HH12" "H" 0 255 131076 19 1 0.391052
 "NH2" "N2" 0 255 131076 20 7 -0.685774
 "HH21" "H" 0 255 131076 21 1 0.391052
 "HH22" "H" 0 255 131076 22 1 0.391052
 "C" "C" 0 255 131076 23 6 0.730308
 "O" "O" 0 255 131076 24 8 -0.578332
 "N" "N" 0 256 131076 1 7 -0.451047
 "H" "H" 0 256 131076 2 1 0.328831
 "CA" "CT" 0 256 131076 3 6 -0.101874
 "HA" "H1" 0 256 131076 4 1 0.174193
 "CB" "CT" 0 256 131076 5 6 0.062238
 "HB" "HC" 0 256 131076 6 1 0.061662
 "CG2" "CT" 0 256 131076 7 6 -0.129989
 "HG21" "HC" 0 256 131076 8 1 0.030227
 "HG22" "HC" 0 256 131076 9 1 0.030227
 "HG23" "HC" 0 256 131076 10 1 0.030227
 "CG1" "CT" 0 256 131076 11 6 0.022230
 "HG12" "HC" 0 256 131076 12 1 0.011551
 "HG13" "HC" 0 256 131076 13 1 0.011551
 "CD1" "CT" 0 256 131076 14 6 -0.101251
 "HD11" "HC" 0 256 131076 15 1 0.023792
 "HD12" "HC" 0 256 131076 16 1 0.023792
 "HD13" "HC" 0 256 131076 17 1 0.023792
 "C" "C" 0 256 131076 18 6 0.569383
 "O" "O" 0 256 131076 19 8 -0.619535
 "N" "N" 0 257 131076 1 7 -0.355153
 "H" "H" 0 257 131076 2 1 0.262417
 "CA" "CT" 0 257 131076 3 6 -0.101497
 "HA" "H1" 0 257 131076 4 1 0.136951
 "CB" "CT" 0 257 131076 5 6 -0.144399
 "HB2" "HC" 0 257 131076 6 1 0.052533
 "HB3" "HC" 0 257 131076 7 1 0.052533
 "CG" "CT" 0 257 131076 8 6 0.191982
 "HG" "HC" 0 257 131076 9 1 0.000825
 "CD1" "CT" 0 257 131076 10 6 -0.123036
 "HD11" "HC" 0 257 131076 11 1 0.022376
 "HD12" "HC" 0 257 131076 12 1 0.022376
 "HD13" "HC" 0 257 131076 13 1 0.022376
 "CD2" "CT" 0 257 131076 14 6 -0.123036
 "HD21" "HC" 0 257 131076 15 1 0.022376
 "HD22" "HC" 0 257 131076 16 1 0.022376
 "HD23" "HC" 0 257 131076 17 1 0.022376
 "C" "C" 0 257 131076 18 6 0.573471
 "O" "O" 0 257 131076 19 8 -0.557847
 "N" "N" 0 258 131076 1 7 -0.300879
 "H" "H" 0 258 131076 2 1 0.233693
 "CA" "CT" 0 258 131076 3 6 -0.131381
 "HA" "H1" 0 258 131076 4 1 0.053266
 "CB" "CT" 0 258 131076 5 6 0.036707
 "HB2" "HC" 0 258 131076 6 1 0.028012
 "HB3" "HC" 0 258 131076 7 1 0.028012
 "CG" "CT" 0 258 131076 8 6 0.012454
 "HG2" "HC" 0 258 131076 9 1 0.002964
 "HG3" "HC" 0 258 131076 10 1 0.002964
 "CD" "CT" 0 258 131076 11 6 0.126329
 "HD2" "H1" 0 258 131076 12 1 0.068148
 "HD3" "H1" 0 258 131076 13 1 0.068148
 "NE" "N2" 0 258 131076 14 7 -0.464890
 "HE" "H" 0 258 131076 15 1 0.326274
 "CZ" "CA" 0 258 131076 16 6 0.565543
 "NH1" "N2" 0 258 131076 17 7 -0.685774
 "HH11" "H" 0 258 131076 18 1 0.391052
 "HH12" "H" 0 258 131076 19 1 0.391052
 "NH2" "N2" 0 258 131076 20 7 -0.685774
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 "CG1" "CT" 0 263 131076 11 6 0.022230
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 "CA" "CT" 0 282 131076 3 6 -0.101874
 "HA" "H1" 0 282 131076 4 1 0.174193
 "CB" "CT" 0 282 131076 5 6 0.062238
 "HB" "HC" 0 282 131076 6 1 0.061662
 "CG2" "CT" 0 282 131076 7 6 -0.129989
 "HG21" "HC" 0 282 131076 8 1 0.030227
 "HG22" "HC" 0 282 131076 9 1 0.030227
 "HG23" "HC" 0 282 131076 10 1 0.030227
 "CG1" "CT" 0 282 131076 11 6 0.022230
 "HG12" "HC" 0 282 131076 12 1 0.011551
 "HG13" "HC" 0 282 131076 13 1 0.011551
 "CD1" "CT" 0 282 131076 14 6 -0.101251
 "HD11" "HC" 0 282 131076 15 1 0.023792
 "HD12" "HC" 0 282 131076 16 1 0.023792
 "HD13" "HC" 0 282 131076 17 1 0.023792
 "C" "C" 0 282 131076 18 6 0.569383
 "O" "O" 0 282 131076 19 8 -0.619535
 "N" "N" 0 283 131076 1 7 -0.435875
 "H" "H" 0 283 131076 2 1 0.251302
 "CA" "CT" 0 283 131076 3 6 -0.038773
 "HA" "H1" 0 283 131076 4 1 0.129478
 "CB" "CT" 0 283 131076 5 6 -0.108273
 "HB2" "HC" 0 283 131076 6 1 0.045214
 "HB3" "HC" 0 283 131076 7 1 0.045214
 "CG" "CT" 0 283 131076 8 6 0.033341
 "HG2" "HC" 0 283 131076 9 1 0.010208
 "HG3" "HC" 0 283 131076 10 1 0.010208
 "CD" "CT" 0 283 131076 11 6 -0.047841
 "HD2" "HC" 0 283 131076 12 1 0.070715
 "HD3" "HC" 0 283 131076 13 1 0.070715
 "CE" "CT" 0 283 131076 14 6 -0.069974
 "HE2" "HP" 0 283 131076 15 1 0.119522
 "HE3" "HP" 0 283 131076 16 1 0.119522
 "NZ" "N3" 0 283 131076 17 7 -0.250358
 "HZ1" "H" 0 283 131076 18 1 0.294561
 "HZ2" "H" 0 283 131076 19 1 0.294561
 "HZ3" "H" 0 283 131076 20 1 0.294561
 "C" "C" 0 283 131076 21 6 0.725129
 "O" "O" 0 283 131076 22 8 -0.563157
 "N" "N" 0 284 131076 1 7 -0.394918
 "H" "H" 0 284 131076 2 1 0.280537
 "CA" "CT" 0 284 131076 3 6 -0.087681
 "HA" "H1" 0 284 131076 4 1 0.123080
 "CB" "CT" 0 284 131076 5 6 0.019227
 "HB2" "HC" 0 284 131076 6 1 0.048840
 "HB3" "HC" 0 284 131076 7 1 0.048840
 "CG" "CT" 0 284 131076 8 6 -0.208167
 "HG2" "H1" 0 284 131076 9 1 0.124228
 "HG3" "H1" 0 284 131076 10 1 0.124228
 "SD" "S" 0 284 131076 11 16 -0.211958
 "CE" "CT" 0 284 131076 12 6 -0.284698
 "HE1" "H1" 0 284 131076 13 1 0.128394
 "HE2" "H1" 0 284 131076 14 1 0.128394
 "HE3" "H1" 0 284 131076 15 1 0.128394
 "C" "C" 0 284 131076 16 6 0.599684
 "O" "O" 0 284 131076 17 8 -0.566424
 "N" "N" 0 285 131076 1 7 -0.423392
 "H" "H" 0 285 131076 2 1 0.306811
 "CA" "CT" 0 285 131076 3 6 0.031633
 "HA" "H1" 0 285 131076 4 1 0.065100
 "CB" "CT" 0 285 131076 5 6 0.074772
 "HB2" "HC" 0 285 131076 6 1 -0.003535
 "HB3" "HC" 0 285 131076 7 1 -0.003535
 "CG" "CT" 0 285 131076 8 6 -0.033909
 "HG2" "HC" 0 285 131076 9 1 -0.004135
 "HG3" "HC" 0 285 131076 10 1 -0.004135
 "CD" "C" 0 285 131076 11 6 0.765188
 "OE1" "O2" 0 285 131076 12 8 -0.824035
 "OE2" "O2" 0 285 131076 13 8 -0.824035
 "C" "C" 0 285 131076 14 6 0.469735
 "O" "O" 0 285 131076 15 8 -0.592528
 "N" "N" 0 286 131076 1 7 -0.394918
 "H" "H" 0 286 131076 2 1 0.280537
 "CA" "CT" 0 286 131076 3 6 -0.087681
 "HA" "H1" 0 286 131076 4 1 0.123080
 "CB" "CT" 0 286 131076 5 6 0.019227
 "HB2" "HC" 0 286 131076 6 1 0.048840
 "HB3" "HC" 0 286 131076 7 1 0.048840
 "CG" "CT" 0 286 131076 8 6 -0.208167
 "HG2" "H1" 0 286 131076 9 1 0.124228
 "HG3" "H1" 0 286 131076 10 1 0.124228
 "SD" "S" 0 286 131076 11 16 -0.211958
 "CE" "CT" 0 286 131076 12 6 -0.284698
 "HE1" "H1" 0 286 131076 13 1 0.128394
 "HE2" "H1" 0 286 131076 14 1 0.128394
 "HE3" "H1" 0 286 131076 15 1 0.128394
 "C" "C" 0 286 131076 16 6 0.599684
 "O" "O" 0 286 131076 17 8 -0.566424
 "N" "N" 0 287 131076 1 7 -0.404773
 "H" "H" 0 287 131076 2 1 0.294276
 "CA" "CT" 0 287 131076 3 6 -0.027733
 "HA" "H1" 0 287 131076 4 1 0.120802
 "CB" "CT" 0 287 131076 5 6 -0.229951
 "HB1" "HC" 0 287 131076 6 1 0.077428
 "HB2" "HC" 0 287 131076 7 1 0.077428
 "HB3" "HC" 0 287 131076 8 1 0.077428
 "C" "C" 0 287 131076 9 6 0.570224
 "O" "O" 0 287 131076 10 8 -0.555129
 "N" "N" 0 288 131076 1 7 -0.382100
 "H" "H" 0 288 131076 2 1 0.268100
 "CA" "CT" 0 288 131076 3 6 -0.343800
 "HA" "H1" 0 288 131076 4 1 0.143800
 "CB" "CT" 0 288 131076 5 6 0.194000
 "HB" "HC" 0 288 131076 6 1 0.030800
 "CG1" "CT" 0 288 131076 7 6 -0.306400
 "HG11" "HC" 0 288 131076 8 1 0.083600
 "HG12" "HC" 0 288 131076 9 1 0.083600
 "HG13" "HC" 0 288 131076 10 1 0.083600
 "CG2" "CT" 0 288 131076 11 6 -0.306400
 "HG21" "HC" 0 288 131076 12 1 0.083600
 "HG22" "HC" 0 288 131076 13 1 0.083600
 "HG23" "HC" 0 288 131076 14 1 0.083600
 "C" "C" 0 288 131076 15 6 0.835000
 "O" "O2" 0 288 131076 16 8 -0.817300
 "OXT" "O2" 0 288 131076 17 8 -0.817300
 "P" "P" 0 289 196608 1 15 1.166200
 "O1P" "O2" 0 289 196609 2 8 -0.776000
 "O2P" "O2" 0 289 196608 3 8 -0.776000
 "O5'" "OS" 0 289 196608 4 8 -0.498900
 "C5'" "CT" 0 289 196608 5 6 0.055800
 "H5'1" "H1" 0 289 196608 6 1 0.067900
 "H5'2" "H1" 0 289 196608 7 1 0.067900
 "C4'" "CT" 0 289 196608 8 6 0.106500
 "H4'" "H1" 0 289 196608 9 1 0.117400
 "O4'" "OS" 0 289 196608 10 8 -0.354800
 "C1'" "CT" 0 289 196608 11 6 0.067400
 "H1'" "H2" 0 289 196608 12 1 0.182400
 "N1" "N*" 0 289 196608 13 7 0.041800
 "C6" "CT" 0 289 196608 14 6 -0.112600
 "H6" "H4" 0 289 196608 15 1 0.218800
 "C5" "CT" 0 289 196608 16 6 -0.363500
 "H5" "HA" 0 289 196608 17 1 0.181100
 "C4" "C" 0 289 196608 18 6 0.595200
 "O4" "O" 0 289 196608 19 8 -0.576100
 "N3" "NA" 0 289 196608 20 7 -0.354900
 "H3" "H" 0 289 196608 21 1 0.315400
 "C2" "C" 0 289 196608 22 6 0.468700
 "O2" "O" 0 289 196608 23 8 -0.547700
 "C3'" "CT" 0 289 196609 24 6 0.060220
 "H3'" "H1" 0 289 196609 25 1 0.061500
 "C2'" "CT" 0 289 196609 26 6 0.067000
 "H2'1" "HA" 0 289 196608 27 1 0.097200
 "O3'" "OS" 0 289 196609 30 8 -0.524600
 "O3P" "O" 0 289 196609 31 8 -0.560000
 "H32" "HA" 0 289 17956864 32 1 0.180000
 "H33" "HO" 0 289 17956865 33 1 0.418600
 "H34" "HA" 0 289 17956865 34 1 0.090000
!entry.complex2.unit.atomspertinfo table str pname str ptype int ptypex int pelmnt dbl pchg
 "N" "N3" 0 -1 0.0
 "H2" "H" 0 -1 0.0
 "H3" "H" 0 -1 0.0
 "CD" "CT" 0 -1 0.0
 "HD2" "HP" 0 -1 0.0
 "HD3" "HP" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "HP" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "CD" "CT" 0 -1 0.0
 "HD2" "H1" 0 -1 0.0
 "HD3" "H1" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CC" 0 -1 0.0
 "ND1" "NB" 0 -1 0.0
 "CE1" "CR" 0 -1 0.0
 "HE1" "H5" 0 -1 0.0
 "NE2" "NA" 0 -1 0.0
 "HE2" "H" 0 -1 0.0
 "CD2" "CW" 0 -1 0.0
 "HD2" "H4" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA2" "H0" 0 -1 0.0
 "HA3" "H0" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CD" "C" 0 -1 0.0
 "OE1" "O2" 0 -1 0.0
 "OE2" "O2" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG" "HC" 0 -1 0.0
 "CD1" "CT" 0 -1 0.0
 "HD11" "HC" 0 -1 0.0
 "HD12" "HC" 0 -1 0.0
 "HD13" "HC" 0 -1 0.0
 "CD2" "CT" 0 -1 0.0
 "HD21" "HC" 0 -1 0.0
 "HD22" "HC" 0 -1 0.0
 "HD23" "HC" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CD" "C" 0 -1 0.0
 "OE1" "O" 0 -1 0.0
 "NE2" "N" 0 -1 0.0
 "HE21" "H" 0 -1 0.0
 "HE22" "H" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CA" 0 -1 0.0
 "CD1" "CA" 0 -1 0.0
 "HD1" "HA" 0 -1 0.0
 "CE1" "CA" 0 -1 0.0
 "HE1" "HA" 0 -1 0.0
 "CZ" "C" 0 -1 0.0
 "OH" "OH" 0 -1 0.0
 "HH" "HO" 0 -1 0.0
 "CE2" "CA" 0 -1 0.0
 "HE2" "HA" 0 -1 0.0
 "CD2" "CA" 0 -1 0.0
 "HD2" "HA" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG" "HC" 0 -1 0.0
 "CD1" "CT" 0 -1 0.0
 "HD11" "HC" 0 -1 0.0
 "HD12" "HC" 0 -1 0.0
 "HD13" "HC" 0 -1 0.0
 "CD2" "CT" 0 -1 0.0
 "HD21" "HC" 0 -1 0.0
 "HD22" "HC" 0 -1 0.0
 "HD23" "HC" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA2" "H0" 0 -1 0.0
 "HA3" "H0" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CD" "C" 0 -1 0.0
 "OE1" "O" 0 -1 0.0
 "NE2" "N" 0 -1 0.0
 "HE21" "H" 0 -1 0.0
 "HE22" "H" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB" "HC" 0 -1 0.0
 "CG2" "CT" 0 -1 0.0
 "HG21" "HC" 0 -1 0.0
 "HG22" "HC" 0 -1 0.0
 "HG23" "HC" 0 -1 0.0
 "CG1" "CT" 0 -1 0.0
 "HG12" "HC" 0 -1 0.0
 "HG13" "HC" 0 -1 0.0
 "CD1" "CT" 0 -1 0.0
 "HD11" "HC" 0 -1 0.0
 "HD12" "HC" 0 -1 0.0
 "HD13" "HC" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CD" "C" 0 -1 0.0
 "OE1" "O" 0 -1 0.0
 "NE2" "N" 0 -1 0.0
 "HE21" "H" 0 -1 0.0
 "HE22" "H" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CC" 0 -1 0.0
 "ND1" "NB" 0 -1 0.0
 "CE1" "CR" 0 -1 0.0
 "HE1" "H5" 0 -1 0.0
 "NE2" "NA" 0 -1 0.0
 "HE2" "H" 0 -1 0.0
 "CD2" "CW" 0 -1 0.0
 "HD2" "H4" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB" "HC" 0 -1 0.0
 "CG2" "CT" 0 -1 0.0
 "HG21" "HC" 0 -1 0.0
 "HG22" "HC" 0 -1 0.0
 "HG23" "HC" 0 -1 0.0
 "CG1" "CT" 0 -1 0.0
 "HG12" "HC" 0 -1 0.0
 "HG13" "HC" 0 -1 0.0
 "CD1" "CT" 0 -1 0.0
 "HD11" "HC" 0 -1 0.0
 "HD12" "HC" 0 -1 0.0
 "HD13" "HC" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG" "HC" 0 -1 0.0
 "CD1" "CT" 0 -1 0.0
 "HD11" "HC" 0 -1 0.0
 "HD12" "HC" 0 -1 0.0
 "HD13" "HC" 0 -1 0.0
 "CD2" "CT" 0 -1 0.0
 "HD21" "HC" 0 -1 0.0
 "HD22" "HC" 0 -1 0.0
 "HD23" "HC" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "HC" 0 -1 0.0
 "HB3" "HC" 0 -1 0.0
 "CG" "CT" 0 -1 0.0
 "HG2" "HC" 0 -1 0.0
 "HG3" "HC" 0 -1 0.0
 "CD" "CT" 0 -1 0.0
 "HD2" "H1" 0 -1 0.0
 "HD3" "H1" 0 -1 0.0
 "NE" "N2" 0 -1 0.0
 "HE" "H" 0 -1 0.0
 "CZ" "CA" 0 -1 0.0
 "NH1" "N2" 0 -1 0.0
 "HH11" "H" 0 -1 0.0
 "HH12" "H" 0 -1 0.0
 "NH2" "N2" 0 -1 0.0
 "HH21" "H" 0 -1 0.0
 "HH22" "H" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB2" "H1" 0 -1 0.0
 "HB3" "H1" 0 -1 0.0
 "SG" "SH" 0 -1 0.0
 "HG" "HS" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA2" "H0" 0 -1 0.0
 "HA3" "H0" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
 "HA" "H1" 0 -1 0.0
 "CB" "CT" 0 -1 0.0
 "HB" "HC" 0 -1 0.0
 "CG1" "CT" 0 -1 0.0
 "HG11" "HC" 0 -1 0.0
 "HG12" "HC" 0 -1 0.0
 "HG13" "HC" 0 -1 0.0
 "CG2" "CT" 0 -1 0.0
 "HG21" "HC" 0 -1 0.0
 "HG22" "HC" 0 -1 0.0
 "HG23" "HC" 0 -1 0.0
 "C" "C" 0 -1 0.0
 "O" "O" 0 -1 0.0
 "N" "N" 0 -1 0.0
 "H" "H" 0 -1 0.0
 "CA" "CT" 0 -1 0.0
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 "O3P" "O" 0 -1 0.0
 "H32" "HA" 0 -1 0.0
 "H33" "HO" 0 -1 0.0
 "H34" "HA" 0 -1 0.0
!entry.complex2.unit.boundbox array dbl
 -1.000000
 0.0
 0.0
 0.0
 0.0
!entry.complex2.unit.childsequence single int
 318
!entry.complex2.unit.connect array int
 0
 0
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 900 898 1
 901 898 1
 902 901 1
 903 902 1
 904 902 1
 905 904 1
 906 904 1
 907 906 1
 908 907 1
 909 907 1
 910 909 1
 911 909 1
 912 911 1
 913 911 1
 914 913 1
 915 901 1
 915 906 1
 915 913 1
 916 896 1
 916 918 1
 917 916 1
 875 874 1
 876 874 1
 877 876 1
 878 876 1
 879 878 1
 880 878 1
 881 878 1
 882 881 1
 883 882 1
 884 882 1
 885 884 1
 886 884 1
 887 886 1
 888 886 1
 889 888 1
 890 881 1
 890 888 1
 891 890 1
 892 876 1
 892 894 1
 893 892 1
 859 858 1
 860 858 1
 861 860 1
 862 860 1
 863 862 1
 864 862 1
 865 864 1
 866 864 1
 867 864 1
 868 862 1
 869 868 1
 870 868 1
 871 868 1
 872 860 1
 872 874 1
 873 872 1
 835 834 1
 836 834 1
 837 836 1
 838 836 1
 839 838 1
 840 838 1
 841 838 1
 842 841 1
 843 841 1
 844 841 1
 845 844 1
 846 844 1
 847 844 1
 848 847 1
 849 847 1
 850 849 1
 851 850 1
 852 850 1
 853 849 1
 854 853 1
 855 853 1
 856 836 1
 856 858 1
 857 856 1
 813 812 1
 814 812 1
 815 814 1
 816 814 1
 817 816 1
 818 816 1
 819 816 1
 820 819 1
 821 819 1
 822 819 1
 823 822 1
 824 822 1
 825 822 1
 826 825 1
 827 825 1
 828 825 1
 829 828 1
 830 828 1
 831 828 1
 832 814 1
 832 834 1
 833 832 1
 799 798 1
 800 798 1
 801 800 1
 802 800 1
 803 802 1
 804 802 1
 805 804 1
 806 804 1
 807 804 1
 808 802 1
 809 808 1
 810 800 1
 810 812 1
 811 810 1
 785 784 1
 786 784 1
 787 786 1
 788 786 1
 789 788 1
 790 788 1
 791 790 1
 792 790 1
 793 790 1
 794 788 1
 795 794 1
 796 786 1
 796 798 1
 797 796 1
 766 765 1
 767 765 1
 768 767 1
 769 767 1
 770 769 1
 771 769 1
 772 769 1
 773 772 1
 774 772 1
 775 774 1
 776 774 1
 777 774 1
 778 772 1
 779 778 1
 780 778 1
 781 778 1
 782 767 1
 782 784 1
 783 782 1
 747 746 1
 748 746 1
 749 748 1
 750 748 1
 751 750 1
 752 750 1
 753 750 1
 754 753 1
 755 753 1
 756 755 1
 757 755 1
 758 755 1
 759 753 1
 760 759 1
 761 759 1
 762 759 1
 763 748 1
 763 765 1
 764 763 1
 733 732 1
 734 733 1
 735 733 1
 736 733 1
 737 736 1
 738 736 1
 739 736 1
 740 739 1
 741 739 1
 742 732 1
 742 739 1
 743 742 1
 744 742 1
 744 746 1
 745 744 1
 713 712 1
 714 712 1
 715 714 1
 716 714 1
 717 716 1
 718 716 1
 719 716 1
 720 719 1
 721 720 1
 722 720 1
 723 722 1
 724 722 1
 725 724 1
 726 724 1
 727 726 1
 728 719 1
 728 726 1
 729 728 1
 730 714 1
 730 732 1
 731 730 1
 698 697 1
 699 697 1
 700 699 1
 701 699 1
 702 701 1
 703 701 1
 704 701 1
 705 704 1
 706 704 1
 707 704 1
 708 707 1
 709 707 1
 710 699 1
 710 712 1
 711 710 1
 686 685 1
 687 685 1
 688 687 1
 689 687 1
 690 689 1
 691 689 1
 692 689 1
 693 692 1
 694 692 1
 695 687 1
 695 697 1
 696 695 1
 662 661 1
 663 661 1
 664 663 1
 665 663 1
 666 665 1
 667 665 1
 668 665 1
 669 668 1
 670 668 1
 671 668 1
 672 671 1
 673 671 1
 674 671 1
 675 674 1
 676 674 1
 677 676 1
 678 677 1
 679 677 1
 680 676 1
 681 680 1
 682 680 1
 683 663 1
 683 685 1
 684 683 1
 643 642 1
 644 642 1
 645 644 1
 646 644 1
 647 646 1
 648 646 1
 649 646 1
 650 649 1
 651 649 1
 652 651 1
 653 651 1
 654 651 1
 655 649 1
 656 655 1
 657 655 1
 658 655 1
 659 644 1
 659 661 1
 660 659 1
 632 631 1
 633 631 1
 634 633 1
 635 633 1
 636 635 1
 637 635 1
 638 635 1
 639 638 1
 640 633 1
 640 642 1
 641 640 1
 611 610 1
 612 610 1
 613 612 1
 614 612 1
 615 614 1
 616 614 1
 617 614 1
 618 617 1
 619 618 1
 620 618 1
 621 620 1
 622 620 1
 623 622 1
 624 623 1
 625 622 1
 626 625 1
 627 617 1
 627 625 1
 628 627 1
 629 612 1
 629 631 1
 630 629 1
 587 586 1
 588 586 1
 589 588 1
 590 588 1
 591 590 1
 592 590 1
 593 590 1
 594 593 1
 595 593 1
 596 593 1
 597 596 1
 598 596 1
 599 596 1
 600 599 1
 601 599 1
 602 601 1
 603 602 1
 604 602 1
 605 601 1
 606 605 1
 607 605 1
 608 588 1
 608 610 1
 609 608 1
 577 576 1
 578 576 1
 579 578 1
 580 578 1
 581 580 1
 582 580 1
 583 580 1
 584 578 1
 584 586 1
 585 584 1
 560 559 1
 561 559 1
 562 561 1
 563 561 1
 564 563 1
 565 563 1
 566 563 1
 567 566 1
 568 566 1
 569 566 1
 570 569 1
 571 569 1
 572 571 1
 573 571 1
 574 561 1
 574 576 1
 575 574 1
 543 542 1
 544 542 1
 545 544 1
 546 544 1
 547 546 1
 548 546 1
 549 546 1
 550 549 1
 551 549 1
 552 549 1
 553 552 1
 554 553 1
 555 553 1
 556 553 1
 557 544 1
 557 559 1
 558 557 1
 536 535 1
 537 535 1
 538 537 1
 539 537 1
 540 537 1
 540 542 1
 541 540 1
 516 515 1
 517 515 1
 518 517 1
 519 517 1
 520 519 1
 521 519 1
 522 519 1
 523 522 1
 524 523 1
 525 523 1
 526 525 1
 527 525 1
 528 527 1
 529 527 1
 530 529 1
 531 522 1
 531 529 1
 532 531 1
 533 517 1
 533 535 1
 534 533 1
 500 499 1
 501 499 1
 502 501 1
 503 501 1
 504 503 1
 505 503 1
 506 505 1
 507 505 1
 508 505 1
 509 503 1
 510 509 1
 511 509 1
 512 509 1
 513 501 1
 513 515 1
 514 513 1
 489 488 1
 490 488 1
 491 490 1
 492 490 1
 493 492 1
 494 492 1
 495 492 1
 496 495 1
 497 490 1
 497 499 1
 498 497 1
 470 469 1
 471 469 1
 472 471 1
 473 471 1
 474 473 1
 475 473 1
 476 473 1
 477 476 1
 478 476 1
 479 478 1
 480 478 1
 481 478 1
 482 476 1
 483 482 1
 484 482 1
 485 482 1
 486 471 1
 486 488 1
 487 486 1
 456 455 1
 457 455 1
 458 457 1
 459 457 1
 460 459 1
 461 459 1
 462 461 1
 463 461 1
 464 461 1
 465 459 1
 466 465 1
 467 457 1
 467 469 1
 468 467 1
 449 448 1
 450 448 1
 451 450 1
 452 450 1
 453 450 1
 453 455 1
 454 453 1
 435 434 1
 436 434 1
 437 436 1
 438 436 1
 439 438 1
 440 438 1
 441 440 1
 442 440 1
 443 440 1
 444 438 1
 445 444 1
 446 436 1
 446 448 1
 447 446 1
 428 427 1
 429 427 1
 430 429 1
 431 429 1
 432 429 1
 432 434 1
 433 432 1
 414 413 1
 415 413 1
 416 415 1
 417 415 1
 418 417 1
 419 417 1
 420 419 1
 421 419 1
 422 419 1
 423 417 1
 424 423 1
 425 415 1
 425 427 1
 426 425 1
 390 389 1
 391 389 1
 392 391 1
 393 391 1
 394 393 1
 395 393 1
 396 393 1
 397 396 1
 398 396 1
 399 396 1
 400 399 1
 401 399 1
 402 399 1
 403 402 1
 404 402 1
 405 404 1
 406 405 1
 407 405 1
 408 404 1
 409 408 1
 410 408 1
 411 391 1
 411 413 1
 412 411 1
 378 377 1
 379 377 1
 380 379 1
 381 379 1
 382 381 1
 383 381 1
 384 381 1
 385 384 1
 386 384 1
 387 379 1
 387 389 1
 388 387 1
 366 365 1
 367 365 1
 368 367 1
 369 367 1
 370 369 1
 371 369 1
 372 369 1
 373 372 1
 374 372 1
 375 367 1
 375 377 1
 376 375 1
 344 343 1
 345 343 1
 346 345 1
 347 345 1
 348 347 1
 349 347 1
 350 347 1
 351 350 1
 352 350 1
 353 350 1
 354 353 1
 355 353 1
 356 353 1
 357 356 1
 358 356 1
 359 356 1
 360 359 1
 361 359 1
 362 359 1
 363 345 1
 363 365 1
 364 363 1
 320 319 1
 321 319 1
 322 321 1
 323 321 1
 324 323 1
 325 323 1
 326 323 1
 327 326 1
 328 326 1
 329 326 1
 330 329 1
 331 329 1
 332 329 1
 333 332 1
 334 332 1
 335 334 1
 336 335 1
 337 335 1
 338 334 1
 339 338 1
 340 338 1
 341 321 1
 341 343 1
 342 341 1
 304 303 1
 305 303 1
 306 305 1
 307 305 1
 308 307 1
 309 307 1
 310 309 1
 311 309 1
 312 309 1
 313 307 1
 314 313 1
 315 313 1
 316 313 1
 317 305 1
 317 319 1
 318 317 1
 297 296 1
 298 296 1
 299 298 1
 300 298 1
 301 298 1
 301 303 1
 302 301 1
 286 285 1
 287 285 1
 288 287 1
 289 287 1
 290 289 1
 291 289 1
 292 289 1
 293 292 1
 294 287 1
 294 296 1
 295 294 1
 262 261 1
 263 261 1
 264 263 1
 265 263 1
 266 265 1
 267 265 1
 268 265 1
 269 268 1
 270 268 1
 271 268 1
 272 271 1
 273 271 1
 274 271 1
 275 274 1
 276 274 1
 277 276 1
 278 277 1
 279 277 1
 280 276 1
 281 280 1
 282 280 1
 283 263 1
 283 285 1
 284 283 1
 243 242 1
 244 242 1
 245 244 1
 246 244 1
 247 246 1
 248 246 1
 249 246 1
 250 249 1
 251 249 1
 252 251 1
 253 251 1
 254 251 1
 255 249 1
 256 255 1
 257 255 1
 258 255 1
 259 244 1
 259 261 1
 260 259 1
 224 223 1
 225 223 1
 226 225 1
 227 225 1
 228 227 1
 229 227 1
 230 229 1
 231 229 1
 232 229 1
 233 227 1
 234 233 1
 235 233 1
 236 233 1
 237 236 1
 238 236 1
 239 236 1
 240 225 1
 240 242 1
 241 240 1
 207 206 1
 208 206 1
 209 208 1
 210 208 1
 211 210 1
 212 210 1
 213 210 1
 214 213 1
 215 214 1
 216 215 1
 217 215 1
 218 217 1
 219 213 1
 219 217 1
 220 219 1
 221 208 1
 221 223 1
 222 221 1
 190 189 1
 191 189 1
 192 191 1
 193 191 1
 194 193 1
 195 193 1
 196 193 1
 197 196 1
 198 196 1
 199 196 1
 200 199 1
 201 199 1
 202 201 1
 203 201 1
 204 191 1
 204 206 1
 205 204 1
 171 170 1
 172 170 1
 173 172 1
 174 172 1
 175 174 1
 176 174 1
 177 176 1
 178 176 1
 179 176 1
 180 174 1
 181 180 1
 182 180 1
 183 180 1
 184 183 1
 185 183 1
 186 183 1
 187 172 1
 187 189 1
 188 187 1
 154 153 1
 155 153 1
 156 155 1
 157 155 1
 158 157 1
 159 157 1
 160 157 1
 161 160 1
 162 160 1
 163 160 1
 164 163 1
 165 163 1
 166 165 1
 167 165 1
 168 155 1
 168 170 1
 169 168 1
 147 146 1
 148 146 1
 149 148 1
 150 148 1
 151 148 1
 151 153 1
 152 151 1
 128 127 1
 129 127 1
 130 129 1
 131 129 1
 132 131 1
 133 131 1
 134 131 1
 135 134 1
 136 134 1
 137 136 1
 138 136 1
 139 136 1
 140 134 1
 141 140 1
 142 140 1
 143 140 1
 144 129 1
 144 146 1
 145 144 1
 107 106 1
 108 106 1
 109 108 1
 110 108 1
 111 110 1
 112 110 1
 113 110 1
 114 113 1
 115 114 1
 116 114 1
 117 116 1
 118 116 1
 119 118 1
 120 119 1
 121 118 1
 122 121 1
 123 113 1
 123 121 1
 124 123 1
 125 108 1
 125 127 1
 126 125 1
 90 89 1
 91 89 1
 92 91 1
 93 91 1
 94 93 1
 95 93 1
 96 93 1
 97 96 1
 98 96 1
 99 96 1
 100 99 1
 101 99 1
 102 101 1
 103 101 1
 104 91 1
 104 106 1
 105 104 1
 71 70 1
 72 70 1
 73 72 1
 74 72 1
 75 74 1
 76 74 1
 77 74 1
 78 77 1
 79 77 1
 80 79 1
 81 79 1
 82 79 1
 83 77 1
 84 83 1
 85 83 1
 86 83 1
 87 72 1
 87 89 1
 88 87 1
 56 55 1
 57 55 1
 58 57 1
 59 57 1
 60 59 1
 61 59 1
 62 59 1
 63 62 1
 64 62 1
 65 62 1
 66 65 1
 67 65 1
 68 57 1
 68 70 1
 69 68 1
 49 48 1
 50 48 1
 51 50 1
 52 50 1
 53 50 1
 53 55 1
 54 53 1
 32 31 1
 33 31 1
 34 33 1
 35 33 1
 36 35 1
 37 35 1
 38 35 1
 39 38 1
 40 39 1
 41 40 1
 42 40 1
 43 42 1
 44 38 1
 44 42 1
 45 44 1
 46 33 1
 46 48 1
 47 46 1
 18 17 1
 19 18 1
 20 18 1
 21 18 1
 22 21 1
 23 21 1
 24 21 1
 25 24 1
 26 24 1
 27 17 1
 27 24 1
 28 27 1
 29 27 1
 29 31 1
 30 29 1
 2 1 1
 3 1 1
 4 1 1
 5 4 1
 6 4 1
 7 4 1
 8 7 1
 9 7 1
 10 7 1
 11 10 1
 12 10 1
 13 1 1
 13 10 1
 14 13 1
 15 13 1
 15 17 1
 16 15 1
!entry.complex2.unit.hierarchy table str abovetype int abovex str belowtype int belowx
 "U" 0 "R" 289
 "R" 289 "A" 4655
 "R" 289 "A" 4654
 "R" 289 "A" 4653
 "R" 289 "A" 4652
 "R" 289 "A" 4624
 "R" 289 "A" 4625
 "R" 289 "A" 4626
 "R" 289 "A" 4627
 "R" 289 "A" 4628
 "R" 289 "A" 4629
 "R" 289 "A" 4630
 "R" 289 "A" 4631
 "R" 289 "A" 4632
 "R" 289 "A" 4633
 "R" 289 "A" 4634
 "R" 289 "A" 4635
 "R" 289 "A" 4636
 "R" 289 "A" 4637
 "R" 289 "A" 4638
 "R" 289 "A" 4639
 "R" 289 "A" 4640
 "R" 289 "A" 4641
 "R" 289 "A" 4642
 "R" 289 "A" 4643
 "R" 289 "A" 4644
 "R" 289 "A" 4645
 "R" 289 "A" 4646
 "R" 289 "A" 4647
 "R" 289 "A" 4648
 "R" 289 "A" 4649
 "R" 289 "A" 4650
 "R" 289 "A" 4651
 "U" 0 "R" 288
 "R" 288 "A" 4607
 "R" 288 "A" 4608
 "R" 288 "A" 4609
 "R" 288 "A" 4610
 "R" 288 "A" 4611
 "R" 288 "A" 4612
 "R" 288 "A" 4613
 "R" 288 "A" 4614
 "R" 288 "A" 4615
 "R" 288 "A" 4616
 "R" 288 "A" 4617
 "R" 288 "A" 4618
 "R" 288 "A" 4619
 "R" 288 "A" 4620
 "R" 288 "A" 4621
 "R" 288 "A" 4622
 "R" 288 "A" 4623
 "U" 0 "R" 287
 "R" 287 "A" 4597
 "R" 287 "A" 4598
 "R" 287 "A" 4599
 "R" 287 "A" 4600
 "R" 287 "A" 4601
 "R" 287 "A" 4602
 "R" 287 "A" 4603
 "R" 287 "A" 4604
 "R" 287 "A" 4605
 "R" 287 "A" 4606
 "U" 0 "R" 286
 "R" 286 "A" 4580
 "R" 286 "A" 4581
 "R" 286 "A" 4582
 "R" 286 "A" 4583
 "R" 286 "A" 4584
 "R" 286 "A" 4585
 "R" 286 "A" 4586
 "R" 286 "A" 4587
 "R" 286 "A" 4588
 "R" 286 "A" 4589
 "R" 286 "A" 4590
 "R" 286 "A" 4591
 "R" 286 "A" 4592
 "R" 286 "A" 4593
 "R" 286 "A" 4594
 "R" 286 "A" 4595
 "R" 286 "A" 4596
 "U" 0 "R" 285
 "R" 285 "A" 4565
 "R" 285 "A" 4566
 "R" 285 "A" 4567
 "R" 285 "A" 4568
 "R" 285 "A" 4569
 "R" 285 "A" 4570
 "R" 285 "A" 4571
 "R" 285 "A" 4572
 "R" 285 "A" 4573
 "R" 285 "A" 4574
 "R" 285 "A" 4575
 "R" 285 "A" 4576
 "R" 285 "A" 4577
 "R" 285 "A" 4578
 "R" 285 "A" 4579
 "U" 0 "R" 284
 "R" 284 "A" 4548
 "R" 284 "A" 4549
 "R" 284 "A" 4550
 "R" 284 "A" 4551
 "R" 284 "A" 4552
 "R" 284 "A" 4553
 "R" 284 "A" 4554
 "R" 284 "A" 4555
 "R" 284 "A" 4556
 "R" 284 "A" 4557
 "R" 284 "A" 4558
 "R" 284 "A" 4559
 "R" 284 "A" 4560
 "R" 284 "A" 4561
 "R" 284 "A" 4562
 "R" 284 "A" 4563
 "R" 284 "A" 4564
 "U" 0 "R" 283
 "R" 283 "A" 4526
 "R" 283 "A" 4527
 "R" 283 "A" 4528
 "R" 283 "A" 4529
 "R" 283 "A" 4530
 "R" 283 "A" 4531
 "R" 283 "A" 4532
 "R" 283 "A" 4533
 "R" 283 "A" 4534
 "R" 283 "A" 4535
 "R" 283 "A" 4536
 "R" 283 "A" 4537
 "R" 283 "A" 4538
 "R" 283 "A" 4539
 "R" 283 "A" 4540
 "R" 283 "A" 4541
 "R" 283 "A" 4542
 "R" 283 "A" 4543
 "R" 283 "A" 4544
 "R" 283 "A" 4545
 "R" 283 "A" 4546
 "R" 283 "A" 4547
 "U" 0 "R" 282
 "R" 282 "A" 4507
 "R" 282 "A" 4508
 "R" 282 "A" 4509
 "R" 282 "A" 4510
 "R" 282 "A" 4511
 "R" 282 "A" 4512
 "R" 282 "A" 4513
 "R" 282 "A" 4514
 "R" 282 "A" 4515
 "R" 282 "A" 4516
 "R" 282 "A" 4517
 "R" 282 "A" 4518
 "R" 282 "A" 4519
 "R" 282 "A" 4520
 "R" 282 "A" 4521
 "R" 282 "A" 4522
 "R" 282 "A" 4523
 "R" 282 "A" 4524
 "R" 282 "A" 4525
 "U" 0 "R" 281
 "R" 281 "A" 4493
 "R" 281 "A" 4494
 "R" 281 "A" 4495
 "R" 281 "A" 4496
 "R" 281 "A" 4497
 "R" 281 "A" 4498
 "R" 281 "A" 4499
 "R" 281 "A" 4500
 "R" 281 "A" 4501
 "R" 281 "A" 4502
 "R" 281 "A" 4503
 "R" 281 "A" 4504
 "R" 281 "A" 4505
 "R" 281 "A" 4506
 "U" 0 "R" 280
 "R" 280 "A" 4479
 "R" 280 "A" 4480
 "R" 280 "A" 4481
 "R" 280 "A" 4482
 "R" 280 "A" 4483
 "R" 280 "A" 4484
 "R" 280 "A" 4485
 "R" 280 "A" 4486
 "R" 280 "A" 4487
 "R" 280 "A" 4488
 "R" 280 "A" 4489
 "R" 280 "A" 4490
 "R" 280 "A" 4491
 "R" 280 "A" 4492
 "U" 0 "R" 279
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 "U" 0 "R" 159
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 "U" 0 "R" 154
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 "R" 154 "A" 2463
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 "U" 0 "R" 151
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 "U" 0 "R" 150
 "R" 150 "A" 2361
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 "R" 150 "A" 2363
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 "R" 150 "A" 2365
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 "R" 150 "A" 2384
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 "R" 149 "A" 2349
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 "R" 149 "A" 2360
 "U" 0 "R" 148
 "R" 148 "A" 2337
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 "R" 148 "A" 2340
 "R" 148 "A" 2341
 "R" 148 "A" 2342
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 "U" 0 "R" 147
 "R" 147 "A" 2323
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 "R" 147 "A" 2333
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 "U" 0 "R" 146
 "R" 146 "A" 2309
 "R" 146 "A" 2310
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 "U" 0 "R" 145
 "R" 145 "A" 2295
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 "R" 145 "A" 2299
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 "U" 0 "R" 144
 "R" 144 "A" 2273
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 "R" 144 "A" 2280
 "R" 144 "A" 2281
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 "R" 144 "A" 2284
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 "R" 144 "A" 2293
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 "U" 0 "R" 143
 "R" 143 "A" 2254
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 "R" 143 "A" 2260
 "R" 143 "A" 2261
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 "R" 143 "A" 2270
 "R" 143 "A" 2271
 "R" 143 "A" 2272
 "U" 0 "R" 142
 "R" 142 "A" 2240
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 "R" 142 "A" 2251
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 "U" 0 "R" 141
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 "U" 0 "R" 140
 "R" 140 "A" 2209
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 "U" 0 "R" 138
 "R" 138 "A" 2169
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 "U" 0 "R" 137
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 "U" 0 "R" 136
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 "U" 0 "R" 135
 "R" 135 "A" 2116
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 "U" 0 "R" 134
 "R" 134 "A" 2104
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 "U" 0 "R" 133
 "R" 133 "A" 2088
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 "U" 0 "R" 132
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 "U" 0 "R" 131
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 "U" 0 "R" 130
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 "U" 0 "R" 129
 "R" 129 "A" 2046
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 "U" 0 "R" 128
 "R" 128 "A" 2025
 "R" 128 "A" 2026
 "R" 128 "A" 2027
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 "U" 0 "R" 127
 "R" 127 "A" 2013
 "R" 127 "A" 2014
 "R" 127 "A" 2015
 "R" 127 "A" 2016
 "R" 127 "A" 2017
 "R" 127 "A" 2018
 "R" 127 "A" 2019
 "R" 127 "A" 2020
 "R" 127 "A" 2021
 "R" 127 "A" 2022
 "R" 127 "A" 2023
 "R" 127 "A" 2024
 "U" 0 "R" 126
 "R" 126 "A" 2002
 "R" 126 "A" 2003
 "R" 126 "A" 2004
 "R" 126 "A" 2005
 "R" 126 "A" 2006
 "R" 126 "A" 2007
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 "R" 126 "A" 2009
 "R" 126 "A" 2010
 "R" 126 "A" 2011
 "R" 126 "A" 2012
 "U" 0 "R" 125
 "R" 125 "A" 1987
 "R" 125 "A" 1988
 "R" 125 "A" 1989
 "R" 125 "A" 1990
 "R" 125 "A" 1991
 "R" 125 "A" 1992
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 "U" 0 "R" 124
 "R" 124 "A" 1970
 "R" 124 "A" 1971
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 "U" 0 "R" 123
 "R" 123 "A" 1958
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 "U" 0 "R" 121
 "R" 121 "A" 1913
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 "U" 0 "R" 120
 "R" 120 "A" 1898
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 "U" 0 "R" 119
 "R" 119 "A" 1888
 "R" 119 "A" 1889
 "R" 119 "A" 1890
 "R" 119 "A" 1891
 "R" 119 "A" 1892
 "R" 119 "A" 1893
 "R" 119 "A" 1894
 "R" 119 "A" 1895
 "R" 119 "A" 1896
 "R" 119 "A" 1897
 "U" 0 "R" 118
 "R" 118 "A" 1881
 "R" 118 "A" 1882
 "R" 118 "A" 1883
 "R" 118 "A" 1884
 "R" 118 "A" 1885
 "R" 118 "A" 1886
 "R" 118 "A" 1887
 "U" 0 "R" 117
 "R" 117 "A" 1861
 "R" 117 "A" 1862
 "R" 117 "A" 1863
 "R" 117 "A" 1864
 "R" 117 "A" 1865
 "R" 117 "A" 1866
 "R" 117 "A" 1867
 "R" 117 "A" 1868
 "R" 117 "A" 1869
 "R" 117 "A" 1870
 "R" 117 "A" 1871
 "R" 117 "A" 1872
 "R" 117 "A" 1873
 "R" 117 "A" 1874
 "R" 117 "A" 1875
 "R" 117 "A" 1876
 "R" 117 "A" 1877
 "R" 117 "A" 1878
 "R" 117 "A" 1879
 "R" 117 "A" 1880
 "U" 0 "R" 116
 "R" 116 "A" 1844
 "R" 116 "A" 1845
 "R" 116 "A" 1846
 "R" 116 "A" 1847
 "R" 116 "A" 1848
 "R" 116 "A" 1849
 "R" 116 "A" 1850
 "R" 116 "A" 1851
 "R" 116 "A" 1852
 "R" 116 "A" 1853
 "R" 116 "A" 1854
 "R" 116 "A" 1855
 "R" 116 "A" 1856
 "R" 116 "A" 1857
 "R" 116 "A" 1858
 "R" 116 "A" 1859
 "R" 116 "A" 1860
 "U" 0 "R" 115
 "R" 115 "A" 1820
 "R" 115 "A" 1821
 "R" 115 "A" 1822
 "R" 115 "A" 1823
 "R" 115 "A" 1824
 "R" 115 "A" 1825
 "R" 115 "A" 1826
 "R" 115 "A" 1827
 "R" 115 "A" 1828
 "R" 115 "A" 1829
 "R" 115 "A" 1830
 "R" 115 "A" 1831
 "R" 115 "A" 1832
 "R" 115 "A" 1833
 "R" 115 "A" 1834
 "R" 115 "A" 1835
 "R" 115 "A" 1836
 "R" 115 "A" 1837
 "R" 115 "A" 1838
 "R" 115 "A" 1839
 "R" 115 "A" 1840
 "R" 115 "A" 1841
 "R" 115 "A" 1842
 "R" 115 "A" 1843
 "U" 0 "R" 114
 "R" 114 "A" 1796
 "R" 114 "A" 1797
 "R" 114 "A" 1798
 "R" 114 "A" 1799
 "R" 114 "A" 1800
 "R" 114 "A" 1801
 "R" 114 "A" 1802
 "R" 114 "A" 1803
 "R" 114 "A" 1804
 "R" 114 "A" 1805
 "R" 114 "A" 1806
 "R" 114 "A" 1807
 "R" 114 "A" 1808
 "R" 114 "A" 1809
 "R" 114 "A" 1810
 "R" 114 "A" 1811
 "R" 114 "A" 1812
 "R" 114 "A" 1813
 "R" 114 "A" 1814
 "R" 114 "A" 1815
 "R" 114 "A" 1816
 "R" 114 "A" 1817
 "R" 114 "A" 1818
 "R" 114 "A" 1819
 "U" 0 "R" 113
 "R" 113 "A" 1779
 "R" 113 "A" 1780
 "R" 113 "A" 1781
 "R" 113 "A" 1782
 "R" 113 "A" 1783
 "R" 113 "A" 1784
 "R" 113 "A" 1785
 "R" 113 "A" 1786
 "R" 113 "A" 1787
 "R" 113 "A" 1788
 "R" 113 "A" 1789
 "R" 113 "A" 1790
 "R" 113 "A" 1791
 "R" 113 "A" 1792
 "R" 113 "A" 1793
 "R" 113 "A" 1794
 "R" 113 "A" 1795
 "U" 0 "R" 112
 "R" 112 "A" 1759
 "R" 112 "A" 1760
 "R" 112 "A" 1761
 "R" 112 "A" 1762
 "R" 112 "A" 1763
 "R" 112 "A" 1764
 "R" 112 "A" 1765
 "R" 112 "A" 1766
 "R" 112 "A" 1767
 "R" 112 "A" 1768
 "R" 112 "A" 1769
 "R" 112 "A" 1770
 "R" 112 "A" 1771
 "R" 112 "A" 1772
 "R" 112 "A" 1773
 "R" 112 "A" 1774
 "R" 112 "A" 1775
 "R" 112 "A" 1776
 "R" 112 "A" 1777
 "R" 112 "A" 1778
 "U" 0 "R" 111
 "R" 111 "A" 1752
 "R" 111 "A" 1753
 "R" 111 "A" 1754
 "R" 111 "A" 1755
 "R" 111 "A" 1756
 "R" 111 "A" 1757
 "R" 111 "A" 1758
 "U" 0 "R" 110
 "R" 110 "A" 1731
 "R" 110 "A" 1732
 "R" 110 "A" 1733
 "R" 110 "A" 1734
 "R" 110 "A" 1735
 "R" 110 "A" 1736
 "R" 110 "A" 1737
 "R" 110 "A" 1738
 "R" 110 "A" 1739
 "R" 110 "A" 1740
 "R" 110 "A" 1741
 "R" 110 "A" 1742
 "R" 110 "A" 1743
 "R" 110 "A" 1744
 "R" 110 "A" 1745
 "R" 110 "A" 1746
 "R" 110 "A" 1747
 "R" 110 "A" 1748
 "R" 110 "A" 1749
 "R" 110 "A" 1750
 "R" 110 "A" 1751
 "U" 0 "R" 109
 "R" 109 "A" 1715
 "R" 109 "A" 1716
 "R" 109 "A" 1717
 "R" 109 "A" 1718
 "R" 109 "A" 1719
 "R" 109 "A" 1720
 "R" 109 "A" 1721
 "R" 109 "A" 1722
 "R" 109 "A" 1723
 "R" 109 "A" 1724
 "R" 109 "A" 1725
 "R" 109 "A" 1726
 "R" 109 "A" 1727
 "R" 109 "A" 1728
 "R" 109 "A" 1729
 "R" 109 "A" 1730
 "U" 0 "R" 108
 "R" 108 "A" 1701
 "R" 108 "A" 1702
 "R" 108 "A" 1703
 "R" 108 "A" 1704
 "R" 108 "A" 1705
 "R" 108 "A" 1706
 "R" 108 "A" 1707
 "R" 108 "A" 1708
 "R" 108 "A" 1709
 "R" 108 "A" 1710
 "R" 108 "A" 1711
 "R" 108 "A" 1712
 "R" 108 "A" 1713
 "R" 108 "A" 1714
 "U" 0 "R" 107
 "R" 107 "A" 1694
 "R" 107 "A" 1695
 "R" 107 "A" 1696
 "R" 107 "A" 1697
 "R" 107 "A" 1698
 "R" 107 "A" 1699
 "R" 107 "A" 1700
 "U" 0 "R" 106
 "R" 106 "A" 1675
 "R" 106 "A" 1676
 "R" 106 "A" 1677
 "R" 106 "A" 1678
 "R" 106 "A" 1679
 "R" 106 "A" 1680
 "R" 106 "A" 1681
 "R" 106 "A" 1682
 "R" 106 "A" 1683
 "R" 106 "A" 1684
 "R" 106 "A" 1685
 "R" 106 "A" 1686
 "R" 106 "A" 1687
 "R" 106 "A" 1688
 "R" 106 "A" 1689
 "R" 106 "A" 1690
 "R" 106 "A" 1691
 "R" 106 "A" 1692
 "R" 106 "A" 1693
 "U" 0 "R" 105
 "R" 105 "A" 1663
 "R" 105 "A" 1664
 "R" 105 "A" 1665
 "R" 105 "A" 1666
 "R" 105 "A" 1667
 "R" 105 "A" 1668
 "R" 105 "A" 1669
 "R" 105 "A" 1670
 "R" 105 "A" 1671
 "R" 105 "A" 1672
 "R" 105 "A" 1673
 "R" 105 "A" 1674
 "U" 0 "R" 104
 "R" 104 "A" 1656
 "R" 104 "A" 1657
 "R" 104 "A" 1658
 "R" 104 "A" 1659
 "R" 104 "A" 1660
 "R" 104 "A" 1661
 "R" 104 "A" 1662
 "U" 0 "R" 103
 "R" 103 "A" 1641
 "R" 103 "A" 1642
 "R" 103 "A" 1643
 "R" 103 "A" 1644
 "R" 103 "A" 1645
 "R" 103 "A" 1646
 "R" 103 "A" 1647
 "R" 103 "A" 1648
 "R" 103 "A" 1649
 "R" 103 "A" 1650
 "R" 103 "A" 1651
 "R" 103 "A" 1652
 "R" 103 "A" 1653
 "R" 103 "A" 1654
 "R" 103 "A" 1655
 "U" 0 "R" 102
 "R" 102 "A" 1626
 "R" 102 "A" 1627
 "R" 102 "A" 1628
 "R" 102 "A" 1629
 "R" 102 "A" 1630
 "R" 102 "A" 1631
 "R" 102 "A" 1632
 "R" 102 "A" 1633
 "R" 102 "A" 1634
 "R" 102 "A" 1635
 "R" 102 "A" 1636
 "R" 102 "A" 1637
 "R" 102 "A" 1638
 "R" 102 "A" 1639
 "R" 102 "A" 1640
 "U" 0 "R" 101
 "R" 101 "A" 1602
 "R" 101 "A" 1603
 "R" 101 "A" 1604
 "R" 101 "A" 1605
 "R" 101 "A" 1606
 "R" 101 "A" 1607
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 "R" 101 "A" 1610
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 "R" 101 "A" 1621
 "R" 101 "A" 1622
 "R" 101 "A" 1623
 "R" 101 "A" 1624
 "R" 101 "A" 1625
 "U" 0 "R" 100
 "R" 100 "A" 1588
 "R" 100 "A" 1589
 "R" 100 "A" 1590
 "R" 100 "A" 1591
 "R" 100 "A" 1592
 "R" 100 "A" 1593
 "R" 100 "A" 1594
 "R" 100 "A" 1595
 "R" 100 "A" 1596
 "R" 100 "A" 1597
 "R" 100 "A" 1598
 "R" 100 "A" 1599
 "R" 100 "A" 1600
 "R" 100 "A" 1601
 "U" 0 "R" 99
 "R" 99 "A" 1577
 "R" 99 "A" 1578
 "R" 99 "A" 1579
 "R" 99 "A" 1580
 "R" 99 "A" 1581
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 "R" 99 "A" 1583
 "R" 99 "A" 1584
 "R" 99 "A" 1585
 "R" 99 "A" 1586
 "R" 99 "A" 1587
 "U" 0 "R" 98
 "R" 98 "A" 1557
 "R" 98 "A" 1558
 "R" 98 "A" 1559
 "R" 98 "A" 1560
 "R" 98 "A" 1561
 "R" 98 "A" 1562
 "R" 98 "A" 1563
 "R" 98 "A" 1564
 "R" 98 "A" 1565
 "R" 98 "A" 1566
 "R" 98 "A" 1567
 "R" 98 "A" 1568
 "R" 98 "A" 1569
 "R" 98 "A" 1570
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 "R" 98 "A" 1572
 "R" 98 "A" 1573
 "R" 98 "A" 1574
 "R" 98 "A" 1575
 "R" 98 "A" 1576
 "U" 0 "R" 97
 "R" 97 "A" 1550
 "R" 97 "A" 1551
 "R" 97 "A" 1552
 "R" 97 "A" 1553
 "R" 97 "A" 1554
 "R" 97 "A" 1555
 "R" 97 "A" 1556
 "U" 0 "R" 96
 "R" 96 "A" 1531
 "R" 96 "A" 1532
 "R" 96 "A" 1533
 "R" 96 "A" 1534
 "R" 96 "A" 1535
 "R" 96 "A" 1536
 "R" 96 "A" 1537
 "R" 96 "A" 1538
 "R" 96 "A" 1539
 "R" 96 "A" 1540
 "R" 96 "A" 1541
 "R" 96 "A" 1542
 "R" 96 "A" 1543
 "R" 96 "A" 1544
 "R" 96 "A" 1545
 "R" 96 "A" 1546
 "R" 96 "A" 1547
 "R" 96 "A" 1548
 "R" 96 "A" 1549
 "U" 0 "R" 95
 "R" 95 "A" 1520
 "R" 95 "A" 1521
 "R" 95 "A" 1522
 "R" 95 "A" 1523
 "R" 95 "A" 1524
 "R" 95 "A" 1525
 "R" 95 "A" 1526
 "R" 95 "A" 1527
 "R" 95 "A" 1528
 "R" 95 "A" 1529
 "R" 95 "A" 1530
 "U" 0 "R" 94
 "R" 94 "A" 1508
 "R" 94 "A" 1509
 "R" 94 "A" 1510
 "R" 94 "A" 1511
 "R" 94 "A" 1512
 "R" 94 "A" 1513
 "R" 94 "A" 1514
 "R" 94 "A" 1515
 "R" 94 "A" 1516
 "R" 94 "A" 1517
 "R" 94 "A" 1518
 "R" 94 "A" 1519
 "U" 0 "R" 93
 "R" 93 "A" 1489
 "R" 93 "A" 1490
 "R" 93 "A" 1491
 "R" 93 "A" 1492
 "R" 93 "A" 1493
 "R" 93 "A" 1494
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 "R" 93 "A" 1496
 "R" 93 "A" 1497
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 "R" 93 "A" 1500
 "R" 93 "A" 1501
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 "R" 93 "A" 1503
 "R" 93 "A" 1504
 "R" 93 "A" 1505
 "R" 93 "A" 1506
 "R" 93 "A" 1507
 "U" 0 "R" 92
 "R" 92 "A" 1469
 "R" 92 "A" 1470
 "R" 92 "A" 1471
 "R" 92 "A" 1472
 "R" 92 "A" 1473
 "R" 92 "A" 1474
 "R" 92 "A" 1475
 "R" 92 "A" 1476
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 "R" 92 "A" 1478
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 "R" 92 "A" 1481
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 "R" 92 "A" 1484
 "R" 92 "A" 1485
 "R" 92 "A" 1486
 "R" 92 "A" 1487
 "R" 92 "A" 1488
 "U" 0 "R" 91
 "R" 91 "A" 1457
 "R" 91 "A" 1458
 "R" 91 "A" 1459
 "R" 91 "A" 1460
 "R" 91 "A" 1461
 "R" 91 "A" 1462
 "R" 91 "A" 1463
 "R" 91 "A" 1464
 "R" 91 "A" 1465
 "R" 91 "A" 1466
 "R" 91 "A" 1467
 "R" 91 "A" 1468
 "U" 0 "R" 90
 "R" 90 "A" 1433
 "R" 90 "A" 1434
 "R" 90 "A" 1435
 "R" 90 "A" 1436
 "R" 90 "A" 1437
 "R" 90 "A" 1438
 "R" 90 "A" 1439
 "R" 90 "A" 1440
 "R" 90 "A" 1441
 "R" 90 "A" 1442
 "R" 90 "A" 1443
 "R" 90 "A" 1444
 "R" 90 "A" 1445
 "R" 90 "A" 1446
 "R" 90 "A" 1447
 "R" 90 "A" 1448
 "R" 90 "A" 1449
 "R" 90 "A" 1450
 "R" 90 "A" 1451
 "R" 90 "A" 1452
 "R" 90 "A" 1453
 "R" 90 "A" 1454
 "R" 90 "A" 1455
 "R" 90 "A" 1456
 "U" 0 "R" 89
 "R" 89 "A" 1422
 "R" 89 "A" 1423
 "R" 89 "A" 1424
 "R" 89 "A" 1425
 "R" 89 "A" 1426
 "R" 89 "A" 1427
 "R" 89 "A" 1428
 "R" 89 "A" 1429
 "R" 89 "A" 1430
 "R" 89 "A" 1431
 "R" 89 "A" 1432
 "U" 0 "R" 88
 "R" 88 "A" 1415
 "R" 88 "A" 1416
 "R" 88 "A" 1417
 "R" 88 "A" 1418
 "R" 88 "A" 1419
 "R" 88 "A" 1420
 "R" 88 "A" 1421
 "U" 0 "R" 87
 "R" 87 "A" 1401
 "R" 87 "A" 1402
 "R" 87 "A" 1403
 "R" 87 "A" 1404
 "R" 87 "A" 1405
 "R" 87 "A" 1406
 "R" 87 "A" 1407
 "R" 87 "A" 1408
 "R" 87 "A" 1409
 "R" 87 "A" 1410
 "R" 87 "A" 1411
 "R" 87 "A" 1412
 "R" 87 "A" 1413
 "R" 87 "A" 1414
 "U" 0 "R" 86
 "R" 86 "A" 1391
 "R" 86 "A" 1392
 "R" 86 "A" 1393
 "R" 86 "A" 1394
 "R" 86 "A" 1395
 "R" 86 "A" 1396
 "R" 86 "A" 1397
 "R" 86 "A" 1398
 "R" 86 "A" 1399
 "R" 86 "A" 1400
 "U" 0 "R" 85
 "R" 85 "A" 1379
 "R" 85 "A" 1380
 "R" 85 "A" 1381
 "R" 85 "A" 1382
 "R" 85 "A" 1383
 "R" 85 "A" 1384
 "R" 85 "A" 1385
 "R" 85 "A" 1386
 "R" 85 "A" 1387
 "R" 85 "A" 1388
 "R" 85 "A" 1389
 "R" 85 "A" 1390
 "U" 0 "R" 84
 "R" 84 "A" 1355
 "R" 84 "A" 1356
 "R" 84 "A" 1357
 "R" 84 "A" 1358
 "R" 84 "A" 1359
 "R" 84 "A" 1360
 "R" 84 "A" 1361
 "R" 84 "A" 1362
 "R" 84 "A" 1363
 "R" 84 "A" 1364
 "R" 84 "A" 1365
 "R" 84 "A" 1366
 "R" 84 "A" 1367
 "R" 84 "A" 1368
 "R" 84 "A" 1369
 "R" 84 "A" 1370
 "R" 84 "A" 1371
 "R" 84 "A" 1372
 "R" 84 "A" 1373
 "R" 84 "A" 1374
 "R" 84 "A" 1375
 "R" 84 "A" 1376
 "R" 84 "A" 1377
 "R" 84 "A" 1378
 "U" 0 "R" 83
 "R" 83 "A" 1336
 "R" 83 "A" 1337
 "R" 83 "A" 1338
 "R" 83 "A" 1339
 "R" 83 "A" 1340
 "R" 83 "A" 1341
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 "R" 83 "A" 1343
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 "R" 83 "A" 1346
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 "R" 83 "A" 1349
 "R" 83 "A" 1350
 "R" 83 "A" 1351
 "R" 83 "A" 1352
 "R" 83 "A" 1353
 "R" 83 "A" 1354
 "U" 0 "R" 82
 "R" 82 "A" 1314
 "R" 82 "A" 1315
 "R" 82 "A" 1316
 "R" 82 "A" 1317
 "R" 82 "A" 1318
 "R" 82 "A" 1319
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 "R" 82 "A" 1321
 "R" 82 "A" 1322
 "R" 82 "A" 1323
 "R" 82 "A" 1324
 "R" 82 "A" 1325
 "R" 82 "A" 1326
 "R" 82 "A" 1327
 "R" 82 "A" 1328
 "R" 82 "A" 1329
 "R" 82 "A" 1330
 "R" 82 "A" 1331
 "R" 82 "A" 1332
 "R" 82 "A" 1333
 "R" 82 "A" 1334
 "R" 82 "A" 1335
 "U" 0 "R" 81
 "R" 81 "A" 1298
 "R" 81 "A" 1299
 "R" 81 "A" 1300
 "R" 81 "A" 1301
 "R" 81 "A" 1302
 "R" 81 "A" 1303
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 "R" 81 "A" 1306
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 "R" 81 "A" 1309
 "R" 81 "A" 1310
 "R" 81 "A" 1311
 "R" 81 "A" 1312
 "R" 81 "A" 1313
 "U" 0 "R" 80
 "R" 80 "A" 1291
 "R" 80 "A" 1292
 "R" 80 "A" 1293
 "R" 80 "A" 1294
 "R" 80 "A" 1295
 "R" 80 "A" 1296
 "R" 80 "A" 1297
 "U" 0 "R" 79
 "R" 79 "A" 1269
 "R" 79 "A" 1270
 "R" 79 "A" 1271
 "R" 79 "A" 1272
 "R" 79 "A" 1273
 "R" 79 "A" 1274
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 "R" 79 "A" 1288
 "R" 79 "A" 1289
 "R" 79 "A" 1290
 "U" 0 "R" 78
 "R" 78 "A" 1258
 "R" 78 "A" 1259
 "R" 78 "A" 1260
 "R" 78 "A" 1261
 "R" 78 "A" 1262
 "R" 78 "A" 1263
 "R" 78 "A" 1264
 "R" 78 "A" 1265
 "R" 78 "A" 1266
 "R" 78 "A" 1267
 "R" 78 "A" 1268
 "U" 0 "R" 77
 "R" 77 "A" 1247
 "R" 77 "A" 1248
 "R" 77 "A" 1249
 "R" 77 "A" 1250
 "R" 77 "A" 1251
 "R" 77 "A" 1252
 "R" 77 "A" 1253
 "R" 77 "A" 1254
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 "R" 39 "A" 598
 "R" 39 "A" 599
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 "R" 39 "A" 601
 "R" 39 "A" 602
 "R" 39 "A" 603
 "R" 39 "A" 604
 "R" 39 "A" 605
 "R" 39 "A" 606
 "R" 39 "A" 607
 "R" 39 "A" 608
 "R" 39 "A" 609
 "U" 0 "R" 38
 "R" 38 "A" 576
 "R" 38 "A" 577
 "R" 38 "A" 578
 "R" 38 "A" 579
 "R" 38 "A" 580
 "R" 38 "A" 581
 "R" 38 "A" 582
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 "R" 38 "A" 584
 "R" 38 "A" 585
 "U" 0 "R" 37
 "R" 37 "A" 559
 "R" 37 "A" 560
 "R" 37 "A" 561
 "R" 37 "A" 562
 "R" 37 "A" 563
 "R" 37 "A" 564
 "R" 37 "A" 565
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 "R" 37 "A" 567
 "R" 37 "A" 568
 "R" 37 "A" 569
 "R" 37 "A" 570
 "R" 37 "A" 571
 "R" 37 "A" 572
 "R" 37 "A" 573
 "R" 37 "A" 574
 "R" 37 "A" 575
 "U" 0 "R" 36
 "R" 36 "A" 542
 "R" 36 "A" 543
 "R" 36 "A" 544
 "R" 36 "A" 545
 "R" 36 "A" 546
 "R" 36 "A" 547
 "R" 36 "A" 548
 "R" 36 "A" 549
 "R" 36 "A" 550
 "R" 36 "A" 551
 "R" 36 "A" 552
 "R" 36 "A" 553
 "R" 36 "A" 554
 "R" 36 "A" 555
 "R" 36 "A" 556
 "R" 36 "A" 557
 "R" 36 "A" 558
 "U" 0 "R" 35
 "R" 35 "A" 535
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 "R" 35 "A" 537
 "R" 35 "A" 538
 "R" 35 "A" 539
 "R" 35 "A" 540
 "R" 35 "A" 541
 "U" 0 "R" 34
 "R" 34 "A" 515
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 "R" 34 "A" 517
 "R" 34 "A" 518
 "R" 34 "A" 519
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 "R" 34 "A" 521
 "R" 34 "A" 522
 "R" 34 "A" 523
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 "R" 34 "A" 525
 "R" 34 "A" 526
 "R" 34 "A" 527
 "R" 34 "A" 528
 "R" 34 "A" 529
 "R" 34 "A" 530
 "R" 34 "A" 531
 "R" 34 "A" 532
 "R" 34 "A" 533
 "R" 34 "A" 534
 "U" 0 "R" 33
 "R" 33 "A" 499
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 "R" 33 "A" 501
 "R" 33 "A" 502
 "R" 33 "A" 503
 "R" 33 "A" 504
 "R" 33 "A" 505
 "R" 33 "A" 506
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 "R" 33 "A" 511
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 "U" 0 "R" 32
 "R" 32 "A" 488
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 "R" 32 "A" 498
 "U" 0 "R" 31
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 "R" 31 "A" 473
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 "R" 31 "A" 480
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 "U" 0 "R" 30
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 "U" 0 "R" 29
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 "U" 0 "R" 28
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 "U" 0 "R" 11
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 "U" 0 "R" 10
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 "R" 1 "A" 16
!entry.complex2.unit.name single str
 ""
!entry.complex2.unit.positions table dbl x dbl y dbl z
 -14.335000 21.198000 -9.125000
 -14.911144 20.853384 -8.370415
 -14.275855 20.682197 -9.991342
 -14.786000 22.541000 -9.531000
 -15.430509 22.966658 -8.761894
 -15.333641 22.482265 -10.471606
 -13.459000 23.298000 -9.673000
 -13.626348 24.370167 -9.570279
 -13.012545 23.092034 -10.645809
 -12.579000 22.759000 -8.543000
 -12.831348 23.245140 -7.600616
 -11.505751 22.838187 -8.716107
 -12.992000 21.290000 -8.496000
 -12.292771 20.679152 -9.067001
 -13.036000 20.795000 -7.047000
 -12.694000 21.537000 -6.124000
 -13.452000 19.533000 -6.833000
 -13.791000 18.546000 -7.873000
 -12.881793 18.176034 -8.346885
 -14.432557 19.003187 -8.626315
 -14.509000 17.475000 -7.075000
 -14.475605 16.512425 -7.585326
 -15.546855 17.750821 -6.888232
 -13.731000 17.445000 -5.807000
 -12.757474 16.971704 -5.934814
 -14.267259 16.957642 -4.992747
 -13.550000 18.928000 -5.497000
 -14.439952 19.338783 -5.020197
 -12.335000 19.186000 -4.612000
 -11.209000 18.827000 -4.962000
 -12.567000 19.800000 -3.457000
 -13.499912 20.092344 -3.203406
 -11.477000 20.099000 -2.540000
 -10.729007 20.718621 -3.034647
 -12.017000 20.860000 -1.324000
 -12.659557 21.683569 -1.635374
 -12.585134 20.174145 -0.695567
 -10.951000 21.453000 -0.456000
 -9.992000 20.689000 0.172000
 -9.204000 21.475000 0.885000
 -8.378953 21.057166 1.461897
 -9.616000 22.723000 0.739000
 -9.204703 23.539988 1.167328
 -10.705000 22.736000 -0.097000
 -11.190192 23.679937 -0.345340
 -10.811000 18.790000 -2.109000
 -11.495000 17.807000 -1.818000
 -9.480000 18.788000 -2.067000
 -8.958324 19.621101 -2.299155
 -8.740000 17.594000 -1.688000
 -8.985173 16.822787 -2.418219
 -7.680614 17.839721 -1.761633
 -9.028000 17.066000 -0.298000
 -8.971000 15.856000 -0.052000
 -9.334000 17.970000 0.624000
 -9.315231 18.955905 0.405509
 -9.623000 17.573000 1.991000
 -8.821558 16.943423 2.377551
 -9.738000 18.817000 2.876000
 -8.845020 19.416897 2.700474
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