*HEADER    TRANSFERASE                             28-FEB-14   4CRP
*TITLE     SOLUTION STRUCTURE OF A TRKAIG2 DOMAIN CONSTRUCT FOR USE IN DRUG
*TITLE    2 DISCOVERY
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: HIGH AFFINITY NERVE GROWTH FACTOR RECEPTOR;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: EXTRACELLULAR NGF BINDING DOMAIN, RESIDUES 270-383;
*COMPND   5 SYNONYM: NEUROTROPHIC TYROSINE KINASE RECEPTOR TYPE 1, TRK1-
*COMPND   6 TRANSFORMING TYROSINE KINASE PROTEIN, TROPOMYOSIN-RELATED KINASE A,
*COMPND   7 TYROSINE KINASE RECEPTOR, TYROSINE KINASE RECEPTOR A, TRK-A,
*COMPND   8 GP140TRK, P140-TRKA;
*COMPND   9 EC: 2.7.10.1;
*COMPND  10 ENGINEERED: YES;
*COMPND  11 MUTATION: YES;
*COMPND  12 OTHER_DETAILS: P285C, F367C INTRODUCED TO ADD A DISULPHIDE BOND TO
*COMPND  13 IMPROVE PROTEIN STABILITY
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   3 ORGANISM_COMMON: HUMAN;
*SOURCE   4 ORGANISM_TAXID: 9606;
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET SYSTEM;
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET24A
*KEYWDS    TRANSFERASE, TRKAIG2, NMR CONSTRUCT, PAIN, ALZHEIMERS
*EXPDTA    SOLUTION NMR
*AUTHOR    D.K.SHOEMARK,M.FAHEY,C.WILLIAMS,R.B.SESSIONS,M.P.CRUMP,S.J.ALLEN-BIRT
*REVDAT   1   28-FEB-14 4CRP    0




!UNAMBIG.tbl

assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name HD12) 2.461 0.757 0.757 weight 1.000 ! spec=13C, no=12, id=709, vol=2.450131e+07
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name HD22) 3.106 1.206 1.206 weight 1.000 ! spec=13C, no=13, id=710, vol=2.374878e+07
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name  HB2) 1.821 0.415 0.415 weight 1.000 ! spec=13C, no=16, id=712, vol=4.826957e+07
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name   HA) 3.155 1.244 1.244 weight 1.000 ! spec=13C, no=20, id=716, vol=2.016215e+07
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name   HA) 3.191 1.273 1.273 weight 1.000 ! spec=13C, no=21, id=717, vol=1.862266e+07
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name  HB2) 2.323 0.674 0.674 weight 1.000 ! spec=13C, no=27, id=722, vol=2.615663e+07
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HB2) 2.646 0.875 0.875 weight 1.000 ! spec=13C, no=28, id=723, vol=2.423977e+07
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   14 and name HD22) 3.160 1.248 1.248 weight 1.000 ! spec=13C, no=29, id=724, vol=2.670764e+07
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB2) 4.104 2.105 2.105 weight 1.000 ! spec=13C, no=31, id=726, vol=2.868440e+07
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HN) 3.209 1.287 1.287 weight 1.000 ! spec=13C, no=34, id=728, vol=8.089488e+06
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD22) 3.270 1.336 1.336 weight 1.000 ! spec=13C, no=39, id=730, vol=2.538426e+07
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   46 and name   HA) 2.163 0.585 0.585 weight 1.000 ! spec=13C, no=41, id=732, vol=6.979789e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   46 and name   HA)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   46 and name   HA)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   68 and name  HA2) 2.766 0.956 0.956 weight 1.000 ! spec=13C, no=42, id=733, vol=1.890931e+07
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   68 and name  HA2)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   68 and name  HA2)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   68 and name  HA1) 4.005 2.005 2.005 weight 1.000 ! spec=13C, no=43, id=734, vol=1.385293e+07
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   68 and name  HA1)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   68 and name  HA1)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   57 and name  HB2) 2.035 0.518 0.518 weight 1.000 ! spec=13C, no=45, id=735, vol=1.553481e+08
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   57 and name  HB2)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   57 and name  HB2)
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name   HA) 3.201 1.281 1.281 weight 1.000 ! spec=13C, no=90, id=737, vol=1.109792e+07
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   56 and name   HA) 3.674 1.688 1.688 weight 1.000 ! spec=13C, no=91, id=738, vol=1.538201e+07
assign (segid "   A" and resid  107 and name  HB1) (segid "   A" and resid  107 and name   HN) 3.599 1.619 1.619 weight 1.000 ! spec=13C, no=103, id=743, vol=1.592342e+07
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name   HN) 3.438 1.477 1.477 weight 1.000 ! spec=13C, no=108, id=746, vol=2.099108e+07
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name   HA) 2.780 0.966 0.966 weight 1.000 ! spec=13C, no=109, id=747, vol=4.242599e+07
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name   HA) 2.528 0.799 0.799 weight 1.000 ! spec=13C, no=110, id=748, vol=4.376630e+07
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name HD21) 3.704 1.715 1.715 weight 1.000 ! spec=13C, no=111, id=749, vol=1.132978e+07
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name HD21) 3.020 1.140 1.140 weight 1.000 ! spec=13C, no=112, id=750, vol=1.258264e+07
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name HD22) 4.206 2.211 2.211 weight 1.000 ! spec=13C, no=113, id=751, vol=2.192903e+07
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name HD22) 4.101 2.102 2.102 weight 1.000 ! spec=13C, no=114, id=752, vol=1.696053e+07
assign (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  105 and name   HN) 4.456 2.482 2.482 weight 1.000 ! spec=13C, no=117, id=753, vol=1.138051e+07
assign (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name   HN) 3.837 1.840 1.840 weight 1.000 ! spec=13C, no=119, id=754, vol=1.906485e+07
assign (segid "   A" and resid  104 and name  HB1) (segid "   A" and resid  105 and name   HN) 4.790 2.868 2.868 weight 1.000 ! spec=13C, no=121, id=756, vol=1.325771e+07
assign (segid "   A" and resid  104 and name  HB1) (segid "   A" and resid  104 and name   HA) 2.843 1.010 1.010 weight 1.000 ! spec=13C, no=125, id=757, vol=5.563195e+07
assign (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name   HA) 2.297 0.660 0.660 weight 1.000 ! spec=13C, no=129, id=758, vol=1.071173e+08
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name  HD1) 3.392 1.438 1.438 weight 1.000 ! spec=13C, no=134, id=759, vol=3.147121e+07
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name   HN) 2.938 1.079 1.079 weight 1.000 ! spec=13C, no=135, id=760, vol=1.660502e+07
assign (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid  102 and name  HD1) 3.682 1.695 1.695 weight 1.000 ! spec=13C, no=138, id=763, vol=1.394622e+07
assign (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   98 and name   HA) 2.751 0.946 0.946 weight 1.000 ! spec=13C, no=148, id=770, vol=1.337899e+07
assign (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   98 and name HG11) 2.616 0.856 0.856 weight 1.000 ! spec=13C, no=149, id=771, vol=2.263244e+07
assign (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   98 and name HG12) 1.570 0.308 0.308 weight 1.000 ! spec=13C, no=150, id=772, vol=7.789497e+07
assign (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   98 and name   HA) 2.632 0.866 0.866 weight 1.000 ! spec=13C, no=152, id=774, vol=1.989581e+07
assign (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   98 and name   HA) 3.619 1.637 1.637 weight 1.000 ! spec=13C, no=153, id=775, vol=2.449317e+07
assign (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   99 and name   HN) 3.967 1.967 1.967 weight 1.000 ! spec=13C, no=156, id=777, vol=2.479883e+07
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   98 and name   HA) 2.905 1.055 1.055 weight 1.000 ! spec=13C, no=157, id=778, vol=2.963723e+07
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   98 and name   HA)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   98 and name   HA)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   99 and name   HN) 2.591 0.839 0.839 weight 1.000 ! spec=13C, no=162, id=780, vol=4.192355e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   99 and name   HN)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   99 and name   HN)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   17 and name   HN) 2.735 0.935 0.935 weight 1.000 ! spec=13C, no=163, id=781, vol=2.927918e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   17 and name   HN)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   98 and name   HA) 2.643 0.873 0.873 weight 1.000 ! spec=13C, no=164, id=782, vol=5.248171e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   98 and name   HA)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   98 and name   HA)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   98 and name HG12) 1.724 0.372 0.372 weight 1.000 ! spec=13C, no=165, id=783, vol=1.100193e+08
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   98 and name HG12)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   98 and name HG12)
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   93 and name   HA) 3.553 1.578 1.578 weight 1.000 ! spec=13C, no=169, id=787, vol=1.679401e+07
assign (segid "   A" and resid   93 and name  HG1) (segid "   A" and resid   93 and name   HA) 2.888 1.043 1.043 weight 1.000 ! spec=13C, no=170, id=788, vol=1.974240e+07
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   94 and name   HN) 3.338 1.393 1.393 weight 1.000 ! spec=13C, no=173, id=790, vol=1.573716e+07
assign (segid "   A" and resid   93 and name  HG1) (segid "   A" and resid   88 and name  HB2) 2.864 1.025 1.025 weight 1.000 ! spec=13C, no=175, id=792, vol=2.081868e+07
    or (segid "   A" and resid   93 and name  HG1) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   93 and name  HG1) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   93 and name HE22) 3.144 1.235 1.235 weight 1.000 ! spec=13C, no=177, id=793, vol=8.869130e+06
assign (segid "   A" and resid   93 and name  HG1) (segid "   A" and resid   93 and name HE22) 3.445 1.484 1.484 weight 1.000 ! spec=13C, no=178, id=794, vol=1.100690e+07
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   93 and name HE21) 4.278 2.287 2.287 weight 1.000 ! spec=13C, no=179, id=795, vol=1.518141e+07
assign (segid "   A" and resid   93 and name  HG1) (segid "   A" and resid   93 and name HE21) 4.643 2.695 2.695 weight 1.000 ! spec=13C, no=180, id=796, vol=1.137263e+07
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   89 and name   HA) 3.222 1.298 1.298 weight 1.000 ! spec=13C, no=184, id=800, vol=9.545560e+06
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   89 and name   HA) 3.116 1.214 1.214 weight 1.000 ! spec=13C, no=185, id=801, vol=1.002562e+07
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name  HB1) 1.851 0.428 0.428 weight 1.000 ! spec=13C, no=187, id=803, vol=3.466366e+07
assign (segid "   A" and resid   86 and name   HG) (segid "   A" and resid   86 and name  HB1) 2.558 0.695 0.695 weight 1.000 ! spec=13C, no=188, id=804, vol=2.410351e+07
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   89 and name   HN) 3.373 1.422 1.422 weight 1.000 ! spec=13C, no=198, id=810, vol=8.999910e+06
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   47 and name   HA) 3.067 1.176 1.176 weight 1.000 ! spec=13C, no=199, id=811, vol=2.778490e+07
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name   HA) 2.987 1.115 1.115 weight 1.000 ! spec=13C, no=200, id=812, vol=2.852434e+07
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name HD22) 5.403 3.650 3.650 weight 1.000 ! spec=13C, no=202, id=814, vol=7.632895e+06
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name   HN) 3.345 1.399 1.399 weight 1.000 ! spec=13C, no=208, id=817, vol=2.041787e+07
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name   HA) 3.149 1.240 1.240 weight 1.000 ! spec=13C, no=209, id=818, vol=2.696662e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HB2) 4.137 2.140 2.140 weight 1.000 ! spec=13C, no=210, id=819, vol=1.755863e+07
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   14 and name   HN) 4.744 2.814 2.814 weight 1.000 ! spec=13C, no=211, id=820, vol=2.015133e+07
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   13 and name   HA) 2.895 1.048 1.048 weight 1.000 ! spec=13C, no=212, id=821, vol=4.665356e+07
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HB1) 2.734 0.935 0.935 weight 1.000 ! spec=13C, no=221, id=823, vol=3.348495e+07
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   32 and name   HA) 3.054 1.166 1.166 weight 1.000 ! spec=13C, no=222, id=824, vol=1.561291e+07
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   32 and name   HA) 3.091 1.194 1.194 weight 1.000 ! spec=13C, no=224, id=825, vol=2.077317e+07
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid    8 and name  HD1) 4.231 2.237 2.237 weight 1.000 ! spec=13C, no=226, id=826, vol=9.990761e+06
    or (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name HE21) 2.701 0.912 0.912 weight 1.000 ! spec=13C, no=234, id=831, vol=3.916393e+07
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name   HA) 2.668 0.890 0.890 weight 1.000 ! spec=13C, no=235, id=832, vol=2.871349e+07
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   32 and name  HB1) 2.978 1.109 1.109 weight 1.000 ! spec=13C, no=236, id=833, vol=4.233402e+07
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   32 and name  HG2) 2.413 0.728 0.728 weight 1.000 ! spec=13C, no=237, id=834, vol=5.190778e+07
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid    8 and name  HD1) 4.948 3.061 3.061 weight 1.000 ! spec=13C, no=239, id=835, vol=1.583981e+07
    or (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid   32 and name HE22) (segid "   A" and resid   32 and name  HG2) 4.389 2.408 2.408 weight 1.000 ! spec=13C, no=240, id=836, vol=1.526642e+07
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   33 and name  HD1) 3.670 1.684 1.684 weight 1.000 ! spec=13C, no=243, id=837, vol=1.350435e+07
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name  HD2) 4.160 2.163 2.163 weight 1.000 ! spec=13C, no=245, id=838, vol=1.391514e+07
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   33 and name  HD2) 3.613 1.632 1.632 weight 1.000 ! spec=13C, no=248, id=839, vol=1.479047e+07
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name  HD1) 4.045 2.045 2.045 weight 1.000 ! spec=13C, no=249, id=840, vol=1.652721e+07
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   33 and name  HG1) 2.557 0.817 0.817 weight 1.000 ! spec=13C, no=250, id=841, vol=3.719468e+07
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name  HG1) 2.517 0.792 0.792 weight 1.000 ! spec=13C, no=251, id=842, vol=3.656812e+07
assign (segid "   A" and resid   33 and name  HG2) (segid "   A" and resid   33 and name  HB2) 2.580 0.832 0.832 weight 1.000 ! spec=13C, no=254, id=843, vol=3.405763e+07
assign (segid "   A" and resid   33 and name  HG1) (segid "   A" and resid   33 and name  HD1) 2.350 0.690 0.690 weight 1.000 ! spec=13C, no=257, id=846, vol=2.373394e+07
assign (segid "   A" and resid   33 and name  HG2) (segid "   A" and resid   33 and name  HD2) 2.242 0.628 0.628 weight 1.000 ! spec=13C, no=258, id=847, vol=3.021130e+07
assign (segid "   A" and resid   33 and name  HG1) (segid "   A" and resid   33 and name  HD2) 2.829 1.000 1.000 weight 1.000 ! spec=13C, no=259, id=848, vol=3.151622e+07
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   33 and name  HD2) 1.830 0.418 0.418 weight 1.000 ! spec=13C, no=260, id=849, vol=4.251242e+07
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB2) 2.633 0.867 0.867 weight 1.000 ! spec=13C, no=265, id=853, vol=6.736488e+07
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB3)
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HB2) 1.996 0.498 0.498 weight 1.000 ! spec=13C, no=266, id=854, vol=1.112080e+08
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   60 and name  HB3)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   60 and name   HA) 1.805 0.407 0.407 weight 1.000 ! spec=13C, no=267, id=855, vol=1.479036e+08
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   60 and name   HA)
    or (segid "   A" and resid   60 and name  HB3) (segid "   A" and resid   60 and name   HA)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   36 and name   HA) 3.773 1.780 1.780 weight 1.000 ! spec=13C, no=268, id=856, vol=1.405224e+07
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   36 and name   HA) 4.603 2.649 2.649 weight 1.000 ! spec=13C, no=269, id=857, vol=1.383657e+07
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   38 and name   HA) 4.902 3.004 3.004 weight 1.000 ! spec=13C, no=277, id=860, vol=1.373790e+07
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name  HD2) 3.286 1.350 1.350 weight 1.000 ! spec=13C, no=278, id=861, vol=5.619249e+07
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   38 and name  HG2) 2.238 0.626 0.626 weight 1.000 ! spec=13C, no=279, id=862, vol=6.830252e+07
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name   HA) 2.492 0.776 0.776 weight 1.000 ! spec=13C, no=280, id=863, vol=8.194370e+07
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name HD21) 4.291 2.302 2.302 weight 1.000 ! spec=13C, no=282, id=865, vol=2.315469e+07
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name HD22) 3.142 1.234 1.234 weight 1.000 ! spec=13C, no=283, id=866, vol=3.230496e+07
assign (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   73 and name   HA) 4.155 2.158 2.158 weight 1.000 ! spec=13C, no=293, id=872, vol=8.419275e+06
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name  HB1) 2.310 0.667 0.667 weight 1.000 ! spec=13C, no=294, id=873, vol=2.535416e+07
assign (segid "   A" and resid   80 and name HD22) (segid "   A" and resid   80 and name  HB1) 4.220 2.226 2.226 weight 1.000 ! spec=13C, no=299, id=876, vol=1.193374e+07
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   80 and name HD22) 4.561 2.600 2.600 weight 1.000 ! spec=13C, no=300, id=877, vol=8.423121e+06
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   80 and name  HB1) 3.164 1.252 1.252 weight 1.000 ! spec=13C, no=304, id=879, vol=1.181386e+07
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name   HA) 2.829 1.000 1.000 weight 1.000 ! spec=13C, no=307, id=881, vol=2.026580e+07
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name   HA) 3.112 1.210 1.210 weight 1.000 ! spec=13C, no=308, id=882, vol=2.242516e+07
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HG2) 2.633 0.867 0.867 weight 1.000 ! spec=13C, no=309, id=883, vol=3.921898e+07
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HG2) 2.931 1.074 1.074 weight 1.000 ! spec=13C, no=310, id=884, vol=4.321352e+07
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HG1) 2.582 0.833 0.833 weight 1.000 ! spec=13C, no=312, id=885, vol=4.234683e+07
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HG1) 2.981 1.111 1.111 weight 1.000 ! spec=13C, no=313, id=886, vol=5.072604e+07
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name   HA) 3.532 1.559 1.559 weight 1.000 ! spec=13C, no=346, id=893, vol=9.596043e+06
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name   HA) 3.887 1.889 1.889 weight 1.000 ! spec=13C, no=351, id=896, vol=1.130485e+07
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name   HA) 3.570 1.593 1.593 weight 1.000 ! spec=13C, no=352, id=897, vol=7.363282e+06
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   52 and name   HB) 2.229 0.621 0.621 weight 1.000 ! spec=13C, no=358, id=898, vol=4.640181e+07
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   52 and name   HB)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   52 and name   HB)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   52 and name   HA) 3.678 1.691 1.691 weight 1.000 ! spec=13C, no=359, id=899, vol=1.901771e+07
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   52 and name   HA)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   52 and name   HA)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   48 and name   HA) 3.815 1.819 1.819 weight 1.000 ! spec=13C, no=366, id=901, vol=1.154745e+07
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   48 and name   HA)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   48 and name   HA)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   52 and name HG11) 1.924 0.463 0.463 weight 1.000 ! spec=13C, no=368, id=902, vol=5.858100e+07
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   52 and name HG11)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   52 and name HG11)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name   HA) 3.758 1.765 1.765 weight 1.000 ! spec=13C, no=384, id=904, vol=1.450871e+07
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name   HA) 2.710 0.918 0.918 weight 1.000 ! spec=13C, no=386, id=905, vol=3.972284e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HA) 2.173 0.590 0.590 weight 1.000 ! spec=13C, no=387, id=906, vol=6.722978e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   90 and name  HG1) (segid "   A" and resid   90 and name   HA) 4.867 2.961 2.961 weight 1.000 ! spec=13C, no=389, id=907, vol=9.171399e+06
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name   HA) 3.204 1.283 1.283 weight 1.000 ! spec=13C, no=393, id=909, vol=1.283378e+07
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name   HN) 4.501 2.533 2.533 weight 1.000 ! spec=13C, no=394, id=910, vol=1.237473e+07
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB2) 2.197 0.603 0.603 weight 1.000 ! spec=13C, no=395, id=911, vol=3.332357e+07
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB1)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB3)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   11 and name   HN) 2.761 0.953 0.953 weight 1.000 ! spec=13C, no=397, id=912, vol=3.752417e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   11 and name   HN)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   11 and name   HN)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   10 and name   HA) 2.035 0.518 0.518 weight 1.000 ! spec=13C, no=398, id=913, vol=5.077945e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   10 and name   HA)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   10 and name   HA)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   31 and name  HA2) 3.576 1.107 1.107 weight 1.000 ! spec=13C, no=400, id=914, vol=1.944066e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   31 and name  HA2)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   31 and name  HA2)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   11 and name   HA) 2.888 1.042 1.042 weight 1.000 ! spec=13C, no=401, id=915, vol=2.643492e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   11 and name   HA)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   11 and name   HA)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name   HN) 1.982 0.491 0.491 weight 1.000 ! spec=13C, no=404, id=916, vol=6.314065e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   17 and name   HN)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB2) 2.890 1.044 1.044 weight 1.000 ! spec=13C, no=405, id=917, vol=3.443543e+07
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB1)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name  HB3)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   16 and name   HA) 3.526 1.554 1.554 weight 1.000 ! spec=13C, no=410, id=918, vol=2.709954e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   16 and name   HA)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   18 and name   HA) 3.328 1.385 1.385 weight 1.000 ! spec=13C, no=412, id=919, vol=1.667974e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   18 and name   HA)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name   HA) 1.987 0.493 0.493 weight 1.000 ! spec=13C, no=413, id=920, vol=4.517740e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   17 and name   HA)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   79 and name   HA) 3.126 1.222 1.222 weight 1.000 ! spec=13C, no=415, id=921, vol=1.867803e+07
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   79 and name   HA)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   79 and name   HA)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   18 and name   HB) 3.860 1.862 1.862 weight 1.000 ! spec=13C, no=417, id=923, vol=1.531722e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   18 and name   HB)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   18 and name   HB)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name   HA) 1.759 0.387 0.387 weight 1.000 ! spec=13C, no=425, id=924, vol=8.726851e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   34 and name   HA)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   34 and name   HA)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   35 and name  HD1) 3.144 1.236 1.236 weight 1.000 ! spec=13C, no=426, id=925, vol=5.358887e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   35 and name  HD1)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   35 and name  HD1)
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB2) 1.956 0.478 0.478 weight 1.000 ! spec=13C, no=427, id=926, vol=1.118454e+08
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB1)
    or (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   34 and name  HB3)
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name   HN) 2.876 1.034 1.034 weight 1.000 ! spec=13C, no=429, id=928, vol=1.553460e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name  HD1) 2.053 0.527 0.527 weight 1.000 ! spec=13C, no=431, id=929, vol=6.038288e+07
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB2) 1.883 0.443 0.443 weight 1.000 ! spec=13C, no=432, id=930, vol=1.576582e+08
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name   HA) 2.528 0.799 0.799 weight 1.000 ! spec=13C, no=433, id=931, vol=6.297852e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HD22) 3.304 1.364 1.364 weight 1.000 ! spec=13C, no=435, id=932, vol=2.836921e+07
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HD22) 2.909 1.058 1.058 weight 1.000 ! spec=13C, no=436, id=933, vol=4.309171e+07
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   87 and name   HA) 2.256 0.636 0.636 weight 1.000 ! spec=13C, no=438, id=934, vol=4.825016e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   87 and name   HA)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   37 and name   HA) 2.021 0.511 0.511 weight 1.000 ! spec=13C, no=439, id=935, vol=6.320728e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   36 and name   HA) 4.300 2.311 2.311 weight 1.000 ! spec=13C, no=440, id=936, vol=1.865518e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   36 and name   HA)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   36 and name   HA)
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name HD22) 1.849 0.428 0.428 weight 1.000 ! spec=13C, no=444, id=937, vol=1.165367e+08
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   40 and name HD12) 3.819 0.858 0.858 weight 1.000 ! spec=13C, no=447, id=940, vol=2.294428e+07
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name  HB1) 2.345 0.687 0.687 weight 1.000 ! spec=13C, no=452, id=941, vol=2.467576e+07
assign (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   22 and name   HN) 4.065 2.065 2.065 weight 1.000 ! spec=13C, no=469, id=943, vol=1.287644e+07
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   67 and name  HB1) 2.991 1.118 1.118 weight 1.000 ! spec=13C, no=484, id=947, vol=1.724808e+07
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid  105 and name   HA) 3.882 1.884 1.884 weight 1.000 ! spec=13C, no=500, id=950, vol=1.294911e+07
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name  HB1) 2.117 0.560 0.560 weight 1.000 ! spec=13C, no=502, id=952, vol=2.957099e+07
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name  HB2) 2.028 0.514 0.514 weight 1.000 ! spec=13C, no=520, id=956, vol=3.667558e+07
assign (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   27 and name  HB2) 3.608 1.627 1.627 weight 1.000 ! spec=13C, no=527, id=958, vol=1.374505e+07
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name   HA) 4.719 2.784 2.784 weight 1.000 ! spec=13C, no=540, id=961, vol=1.035903e+07
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   53 and name   HA)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name   HA) 3.574 1.596 1.596 weight 1.000 ! spec=13C, no=544, id=963, vol=9.540659e+06
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name   HE) 3.633 1.649 1.649 weight 1.000 ! spec=13C, no=548, id=965, vol=1.199996e+07
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   66 and name   HA) 3.308 1.368 1.368 weight 1.000 ! spec=13C, no=556, id=969, vol=8.697029e+06
assign (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   66 and name   HA) 3.904 1.905 1.905 weight 1.000 ! spec=13C, no=557, id=970, vol=7.119049e+06
assign (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   66 and name   HE) 4.092 2.093 2.093 weight 1.000 ! spec=13C, no=559, id=971, vol=8.717567e+06
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   66 and name   HE) 3.385 1.433 1.433 weight 1.000 ! spec=13C, no=560, id=972, vol=9.689887e+06
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name   HN) 2.994 1.121 1.121 weight 1.000 ! spec=13C, no=562, id=973, vol=1.281449e+07
assign (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   66 and name  HB2) 2.606 0.849 0.849 weight 1.000 ! spec=13C, no=563, id=974, vol=2.138375e+07
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HD2) 2.632 0.866 0.866 weight 1.000 ! spec=13C, no=566, id=976, vol=1.303214e+07
assign (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   66 and name  HD2) 2.746 0.943 0.943 weight 1.000 ! spec=13C, no=567, id=977, vol=1.454690e+07
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   66 and name  HD2) 3.475 1.509 1.509 weight 1.000 ! spec=13C, no=569, id=978, vol=1.299331e+07
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HB2) 3.511 1.541 1.541 weight 1.000 ! spec=13C, no=572, id=979, vol=1.476857e+07
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HG2) 2.817 0.992 0.992 weight 1.000 ! spec=13C, no=573, id=980, vol=1.565454e+07
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HG1) 2.672 0.892 0.892 weight 1.000 ! spec=13C, no=574, id=981, vol=1.852184e+07
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   66 and name  HD1) 1.760 0.387 0.387 weight 1.000 ! spec=13C, no=575, id=982, vol=3.674059e+07
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name   HE) 3.302 1.363 1.363 weight 1.000 ! spec=13C, no=578, id=983, vol=8.481418e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name   HA) 4.851 2.942 2.942 weight 1.000 ! spec=13C, no=579, id=984, vol=9.504488e+06
assign (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   98 and name   HA) 4.273 2.282 2.282 weight 1.000 ! spec=13C, no=588, id=985, vol=2.049748e+07
assign (segid "   A" and resid   45 and name   HB) (segid "   A" and resid   45 and name   HA) 2.681 0.899 0.899 weight 1.000 ! spec=13C, no=597, id=990, vol=2.850439e+07
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   98 and name   HN) 3.871 1.873 1.873 weight 1.000 ! spec=13C, no=607, id=993, vol=8.654229e+06
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   98 and name   HN)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   98 and name   HN)
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name HG12) 3.895 1.896 1.896 weight 1.000 ! spec=13C, no=614, id=994, vol=1.127345e+07
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   13 and name HE22) 3.957 1.958 1.958 weight 1.000 ! spec=13C, no=619, id=997, vol=1.349407e+07
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   13 and name HE21) 5.214 3.399 3.399 weight 1.000 ! spec=13C, no=620, id=998, vol=7.727684e+06
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name   HA) 3.589 1.610 1.610 weight 1.000 ! spec=13C, no=639, id=1000, vol=5.894500e+06
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   14 and name HD22) 3.575 1.597 1.597 weight 1.000 ! spec=13C, no=641, id=1001, vol=1.228870e+07
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   89 and name HD22) 3.408 1.452 1.452 weight 1.000 ! spec=13C, no=661, id=1003, vol=8.624901e+06
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   89 and name HD22)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   89 and name HD22)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name  HB2) 2.765 0.955 0.955 weight 1.000 ! spec=13C, no=666, id=1005, vol=3.272449e+07
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name  HB1) 3.629 1.646 1.646 weight 1.000 ! spec=13C, no=668, id=1006, vol=1.755411e+07
assign (segid "   A" and resid   42 and name HD21) (segid "   A" and resid   42 and name  HB1) 2.713 0.920 0.920 weight 1.000 ! spec=13C, no=674, id=1007, vol=2.616483e+07
assign (segid "   A" and resid   42 and name HD21) (segid "   A" and resid   42 and name  HB2) 3.552 1.577 1.577 weight 1.000 ! spec=13C, no=675, id=1008, vol=2.264069e+07
assign (segid "   A" and resid   42 and name HD22) (segid "   A" and resid   42 and name  HB2) 4.585 2.627 2.627 weight 1.000 ! spec=13C, no=676, id=1009, vol=1.262459e+07
assign (segid "   A" and resid   42 and name HD22) (segid "   A" and resid   42 and name  HB1) 3.818 1.822 1.822 weight 1.000 ! spec=13C, no=677, id=1010, vol=1.622473e+07
assign (segid "   A" and resid   42 and name  HB1) (segid "   A" and resid   42 and name  HB2) 2.076 0.538 0.538 weight 1.000 ! spec=13C, no=681, id=1013, vol=5.619787e+07
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   43 and name  HA1) 2.090 0.546 0.546 weight 1.000 ! spec=13C, no=684, id=1016, vol=6.142047e+07
assign (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   43 and name   HN) 3.230 1.304 1.304 weight 1.000 ! spec=13C, no=686, id=1018, vol=1.212449e+07
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   43 and name   HN) 3.734 1.743 1.743 weight 1.000 ! spec=13C, no=688, id=1019, vol=1.214559e+07
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   40 and name HD22) 4.197 2.202 2.202 weight 1.000 ! spec=13C, no=691, id=1021, vol=1.782651e+07
    or (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   40 and name HD22) 3.638 1.079 1.079 weight 1.000 ! spec=13C, no=693, id=1022, vol=1.819875e+07
    or (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   44 and name   HN) 3.148 1.239 1.239 weight 1.000 ! spec=13C, no=695, id=1023, vol=2.649489e+07
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name   HN) 3.373 1.423 1.423 weight 1.000 ! spec=13C, no=697, id=1025, vol=2.729253e+07
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name   HN) 3.039 1.154 1.154 weight 1.000 ! spec=13C, no=698, id=1026, vol=3.156696e+07
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name   HA) 3.329 1.385 1.385 weight 1.000 ! spec=13C, no=700, id=1028, vol=2.750480e+07
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   44 and name   HA) 2.709 0.917 0.917 weight 1.000 ! spec=13C, no=701, id=1029, vol=3.488954e+07
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name  HB2) 1.599 0.320 0.320 weight 1.000 ! spec=13C, no=702, id=1030, vol=1.500468e+08
assign (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name HG22) 4.777 2.853 2.853 weight 1.000 ! spec=13C, no=708, id=1032, vol=8.698558e+06
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name HG21)
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name HG23)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name HG12) 2.581 0.594 0.594 weight 1.000 ! spec=13C, no=725, id=1038, vol=5.541005e+07
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name HG11)
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name HG13)
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   45 and name HG12) 3.467 0.824 0.824 weight 1.000 ! spec=13C, no=726, id=1039, vol=2.879905e+07
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   45 and name HG11)
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   45 and name HG13)
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name HG12) 2.838 0.805 0.805 weight 1.000 ! spec=13C, no=728, id=1040, vol=3.695284e+07
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name HG11)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name HG13)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name HG22) 2.064 0.532 0.532 weight 1.000 ! spec=13C, no=731, id=1041, vol=7.062041e+07
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name HG21)
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name HG23)
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   45 and name HG22) 3.309 0.917 0.917 weight 1.000 ! spec=13C, no=732, id=1042, vol=2.922440e+07
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   45 and name HG21)
    or (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   45 and name HG23)
assign (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   44 and name   HA) 3.856 1.408 1.408 weight 1.000 ! spec=13C, no=733, id=1043, vol=1.868911e+07
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   44 and name   HA)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   44 and name   HA)
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name HG22) 3.779 1.513 1.513 weight 1.000 ! spec=13C, no=734, id=1044, vol=3.012904e+07
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name HG21)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name HG23)
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name HG22) 2.856 0.528 0.528 weight 1.000 ! spec=13C, no=735, id=1045, vol=9.798048e+07
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name HG21)
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name HG23)
assign (segid "   A" and resid   45 and name HG22) (segid "   A" and resid   40 and name HD12) 2.827 0.573 0.573 weight 1.000 ! spec=13C, no=736, id=1046, vol=1.009285e+08
    or (segid "   A" and resid   45 and name HG22) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name HG22) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   45 and name HG21) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   45 and name HG21) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name HG21) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   45 and name HG23) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   45 and name HG23) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name HG23) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name  HB2) 2.210 0.611 0.611 weight 1.000 ! spec=13C, no=742, id=1050, vol=1.775068e+07
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name   HA) 3.267 1.334 1.334 weight 1.000 ! spec=13C, no=751, id=1055, vol=9.687078e+06
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name   HN) 3.519 1.548 1.548 weight 1.000 ! spec=13C, no=754, id=1057, vol=1.019684e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name HD12) 3.198 1.278 1.278 weight 1.000 ! spec=13C, no=755, id=1058, vol=4.566221e+07
    or (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name HD11)
    or (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name HD13)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name  HD1) 3.839 1.843 1.843 weight 1.000 ! spec=13C, no=756, id=1059, vol=2.191927e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name  HD1)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name  HD1)
    or (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name  HD2)
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name  HD2)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name  HD2)
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD12) 2.887 1.042 1.042 weight 1.000 ! spec=13C, no=759, id=1060, vol=4.172670e+07
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD11)
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD13)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name  HB2) 2.477 0.767 0.767 weight 1.000 ! spec=13C, no=761, id=1061, vol=3.928502e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name  HB2)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name  HB1) 2.534 0.802 0.802 weight 1.000 ! spec=13C, no=762, id=1062, vol=4.374756e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name  HB1)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name  HB1)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   39 and name  HB2) 3.345 1.398 1.398 weight 1.000 ! spec=13C, no=763, id=1063, vol=2.768845e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   39 and name  HB2)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD12) 2.127 0.565 0.565 weight 1.000 ! spec=13C, no=766, id=1064, vol=5.622541e+07
    or (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD11)
    or (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD13)
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD22) 2.342 0.685 0.685 weight 1.000 ! spec=13C, no=769, id=1065, vol=3.669716e+07
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   46 and name   HA) 4.000 2.000 2.000 weight 1.000 ! spec=13C, no=770, id=1066, vol=1.180409e+07
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name   HA)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   46 and name   HA)
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name  HG1) 3.513 1.542 1.542 weight 1.000 ! spec=13C, no=785, id=1067, vol=1.871461e+07
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name  HG2) 2.969 1.102 1.102 weight 1.000 ! spec=13C, no=793, id=1069, vol=2.275096e+07
assign (segid "   A" and resid   48 and name  HG2) (segid "   A" and resid   48 and name   HN) 4.581 2.623 2.623 weight 1.000 ! spec=13C, no=804, id=1075, vol=1.133579e+07
assign (segid "   A" and resid   48 and name  HG1) (segid "   A" and resid   49 and name   HN) 5.553 3.854 3.854 weight 1.000 ! spec=13C, no=805, id=1076, vol=8.753547e+06
assign (segid "   A" and resid   48 and name  HG1) (segid "   A" and resid   53 and name   HA) 4.604 2.650 2.650 weight 1.000 ! spec=13C, no=806, id=1077, vol=1.300163e+07
assign (segid "   A" and resid   48 and name  HG2) (segid "   A" and resid   53 and name   HA) 3.326 1.383 1.383 weight 1.000 ! spec=13C, no=807, id=1078, vol=1.106658e+07
assign (segid "   A" and resid   48 and name  HG2) (segid "   A" and resid   48 and name  HG1) 2.258 0.637 0.637 weight 1.000 ! spec=13C, no=808, id=1079, vol=2.659779e+07
assign (segid "   A" and resid   48 and name  HG2) (segid "   A" and resid   48 and name  HB1) 3.083 1.188 1.188 weight 1.000 ! spec=13C, no=809, id=1080, vol=1.571042e+07
assign (segid "   A" and resid   48 and name  HG1) (segid "   A" and resid   48 and name  HB1) 3.805 1.809 1.809 weight 1.000 ! spec=13C, no=810, id=1081, vol=1.617267e+07
assign (segid "   A" and resid   48 and name  HG1) (segid "   A" and resid   48 and name  HB2) 2.720 0.925 0.925 weight 1.000 ! spec=13C, no=812, id=1082, vol=3.693645e+07
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name  HB2) 2.281 0.650 0.650 weight 1.000 ! spec=13C, no=817, id=1085, vol=3.239333e+07
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name   HA) 3.431 1.471 1.471 weight 1.000 ! spec=13C, no=820, id=1086, vol=9.580573e+06
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name   HA) 3.125 1.221 1.221 weight 1.000 ! spec=13C, no=821, id=1087, vol=1.402025e+07
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD12) 2.761 0.953 0.953 weight 1.000 ! spec=13C, no=823, id=1088, vol=5.477802e+07
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD13)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD22)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name HD12) 2.171 0.589 0.589 weight 1.000 ! spec=13C, no=824, id=1089, vol=4.162067e+07
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name HD13)
    or (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   57 and name  HB2)
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   57 and name  HB2)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   57 and name  HB2)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name   HN) 2.983 1.112 1.112 weight 1.000 ! spec=13C, no=830, id=1093, vol=1.306399e+07
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD22) 1.981 0.490 0.490 weight 1.000 ! spec=13C, no=831, id=1094, vol=7.578016e+07
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   59 and name  HB1) (segid "   A" and resid   59 and name   HA) 2.490 0.775 0.775 weight 1.000 ! spec=13C, no=835, id=1097, vol=4.140184e+07
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name   HA) 3.106 1.206 1.206 weight 1.000 ! spec=13C, no=836, id=1098, vol=4.141003e+07
assign (segid "   A" and resid   59 and name  HB1) (segid "   A" and resid   59 and name  HD1) 4.315 2.328 2.328 weight 1.000 ! spec=13C, no=837, id=1099, vol=1.691211e+07
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name  HD1) 4.032 2.032 2.032 weight 1.000 ! spec=13C, no=838, id=1100, vol=2.685686e+07
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   59 and name  HB1) 1.609 0.323 0.323 weight 1.000 ! spec=13C, no=842, id=1102, vol=1.910340e+08
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name   HA) 4.273 2.283 2.283 weight 1.000 ! spec=13C, no=845, id=1103, vol=2.317377e+07
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   58 and name   HA) 4.584 2.626 2.626 weight 1.000 ! spec=13C, no=846, id=1104, vol=3.093023e+07
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name  HB1) 2.705 0.914 0.914 weight 1.000 ! spec=13C, no=849, id=1107, vol=7.398836e+07
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   60 and name   HN) 5.426 3.680 3.680 weight 1.000 ! spec=13C, no=851, id=1108, vol=9.427555e+06
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name  HD1) 2.525 0.797 0.797 weight 1.000 ! spec=13C, no=854, id=1110, vol=8.620438e+07
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB2) 1.968 0.484 0.484 weight 1.000 ! spec=13C, no=856, id=1112, vol=1.031011e+08
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   60 and name   HA) 3.684 1.697 1.697 weight 1.000 ! spec=13C, no=859, id=1113, vol=3.169161e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   60 and name   HA)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   60 and name   HA)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB2) 3.420 1.462 1.462 weight 1.000 ! spec=13C, no=861, id=1115, vol=2.121201e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB2)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name   HA) 3.586 1.607 1.607 weight 1.000 ! spec=13C, no=862, id=1116, vol=1.261169e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name   HA)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name   HA)
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name  HG2) 2.892 1.046 1.046 weight 1.000 ! spec=13C, no=863, id=1117, vol=6.579889e+07
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name  HB2) 1.947 0.474 0.474 weight 1.000 ! spec=13C, no=866, id=1120, vol=5.360583e+07
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name   HA) 3.376 1.424 1.424 weight 1.000 ! spec=13C, no=869, id=1122, vol=1.746882e+07
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name   HA) 2.973 1.105 1.105 weight 1.000 ! spec=13C, no=870, id=1123, vol=1.833741e+07
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name   HN) 4.373 2.390 2.390 weight 1.000 ! spec=13C, no=872, id=1124, vol=1.184791e+07
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   64 and name   HN) 4.456 2.481 2.481 weight 1.000 ! spec=13C, no=877, id=1128, vol=2.414002e+07
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   65 and name   HN) 4.835 2.922 2.922 weight 1.000 ! spec=13C, no=878, id=1129, vol=1.495182e+07
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   63 and name   HA) 3.206 1.284 1.284 weight 1.000 ! spec=13C, no=879, id=1130, vol=3.680497e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name HG21) 2.849 1.014 1.014 weight 1.000 ! spec=13C, no=880, id=1131, vol=3.076492e+07
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name HG21) 4.056 2.057 2.057 weight 1.000 ! spec=13C, no=883, id=1132, vol=1.450094e+07
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   64 and name   HA) 2.050 0.525 0.525 weight 1.000 ! spec=13C, no=884, id=1133, vol=1.535851e+08
    or (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   64 and name   HA)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   64 and name   HA)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name HG21) 3.156 1.245 1.245 weight 1.000 ! spec=13C, no=891, id=1135, vol=1.899261e+07
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name HG22)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name HG23)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   72 and name  HB2) 2.828 1.000 1.000 weight 1.000 ! spec=13C, no=894, id=1136, vol=1.898050e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name  HB2) 3.174 1.259 1.259 weight 1.000 ! spec=13C, no=907, id=1138, vol=3.284630e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name  HB1) 2.789 0.972 0.972 weight 1.000 ! spec=13C, no=908, id=1139, vol=3.047177e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name  HG1) 3.033 1.150 1.150 weight 1.000 ! spec=13C, no=912, id=1140, vol=1.869921e+07
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name  HG1) 3.001 1.126 1.126 weight 1.000 ! spec=13C, no=914, id=1141, vol=3.749805e+07
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name  HB1) 3.705 1.716 1.716 weight 1.000 ! spec=13C, no=916, id=1142, vol=1.260766e+07
assign (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   20 and name  HB1) 2.882 1.038 1.038 weight 1.000 ! spec=13C, no=917, id=1143, vol=2.022338e+07
assign (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   20 and name  HB2) 3.473 1.508 1.508 weight 1.000 ! spec=13C, no=918, id=1144, vol=1.825600e+07
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name  HB2) 2.585 0.835 0.835 weight 1.000 ! spec=13C, no=919, id=1145, vol=2.563680e+07
assign (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HG12) 3.107 1.207 1.207 weight 1.000 ! spec=13C, no=927, id=1148, vol=1.132268e+07
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HD1) 3.172 1.258 1.258 weight 1.000 ! spec=13C, no=929, id=1149, vol=1.960323e+07
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name  HD1) 2.526 0.798 0.798 weight 1.000 ! spec=13C, no=931, id=1150, vol=1.695210e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   84 and name   HB) 3.372 1.685 1.685 weight 1.000 ! spec=13C, no=941, id=1155, vol=1.190432e+07
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   84 and name   HB) 3.058 1.169 1.169 weight 1.000 ! spec=13C, no=945, id=1156, vol=7.338617e+06
assign (segid "   A" and resid   41 and name  HD1) (segid "   A" and resid   41 and name  HB1) 3.701 1.712 1.712 weight 1.000 ! spec=13C, no=952, id=1159, vol=1.471280e+07
    or (segid "   A" and resid   41 and name  HD2) (segid "   A" and resid   41 and name  HB1)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HB2) 4.476 2.505 2.505 weight 1.000 ! spec=13C, no=953, id=1160, vol=7.993655e+06
assign (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   41 and name   HN) 3.215 1.292 1.292 weight 1.000 ! spec=13C, no=957, id=1162, vol=6.825251e+06
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   46 and name   HN) 3.247 1.317 1.317 weight 1.000 ! spec=13C, no=967, id=1165, vol=1.872547e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   46 and name   HN)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   46 and name   HN)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   47 and name   HA) 4.322 2.335 2.335 weight 1.000 ! spec=13C, no=968, id=1166, vol=1.274136e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   47 and name   HA)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   47 and name   HA)
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name   HA) 3.923 1.924 1.924 weight 1.000 ! spec=13C, no=969, id=1167, vol=1.723628e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name   HA)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD22) 2.432 0.739 0.739 weight 1.000 ! spec=13C, no=970, id=1168, vol=3.478133e+07
    or (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   41 and name  HB1) 3.314 1.373 1.373 weight 1.000 ! spec=13C, no=971, id=1169, vol=2.548063e+07
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   41 and name  HB1)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   41 and name  HB1)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   39 and name  HB2) 2.334 0.681 0.681 weight 1.000 ! spec=13C, no=972, id=1170, vol=4.735045e+07
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   39 and name  HB2)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name   HA) 3.371 1.421 1.421 weight 1.000 ! spec=13C, no=973, id=1171, vol=1.050419e+07
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name  HD1) 3.685 1.698 1.698 weight 1.000 ! spec=13C, no=974, id=1172, vol=1.896084e+07
    or (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name  HD2)
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name  HB2) 2.072 0.537 0.537 weight 1.000 ! spec=13C, no=976, id=1174, vol=3.975933e+07
assign (segid "   A" and resid   52 and name   HB) (segid "   A" and resid   52 and name   HA) 3.419 1.461 1.461 weight 1.000 ! spec=13C, no=981, id=1176, vol=8.126738e+06
assign (segid "   A" and resid   52 and name   HB) (segid "   A" and resid   52 and name HG11) 3.298 1.360 1.360 weight 1.000 ! spec=13C, no=982, id=1177, vol=1.144344e+07
assign (segid "   A" and resid   52 and name   HB) (segid "   A" and resid   52 and name HG12) 2.759 0.951 0.951 weight 1.000 ! spec=13C, no=983, id=1178, vol=1.304175e+07
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   52 and name   HA) 2.536 0.804 0.804 weight 1.000 ! spec=13C, no=985, id=1179, vol=2.541543e+07
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   52 and name   HA)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   52 and name   HA)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   53 and name   HN) 3.102 1.203 1.203 weight 1.000 ! spec=13C, no=987, id=1181, vol=2.186331e+07
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   53 and name   HN)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   53 and name   HN)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   52 and name   HB) 1.959 0.480 0.480 weight 1.000 ! spec=13C, no=988, id=1182, vol=5.094168e+07
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   52 and name   HB)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   52 and name   HB)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   48 and name   HA) 3.462 1.498 1.498 weight 1.000 ! spec=13C, no=990, id=1183, vol=1.262528e+07
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   48 and name   HA)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   48 and name   HA)
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name   HA) 2.914 1.061 1.061 weight 1.000 ! spec=13C, no=999, id=1186, vol=5.163826e+07
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   59 and name  HD2) 4.654 2.708 2.708 weight 1.000 ! spec=13C, no=1000, id=1187, vol=2.365586e+07
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   59 and name  HD1) 4.801 2.881 2.881 weight 1.000 ! spec=13C, no=1001, id=1188, vol=1.831022e+07
assign (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   59 and name  HD1) 4.555 2.593 2.593 weight 1.000 ! spec=13C, no=1004, id=1191, vol=1.911193e+07
assign (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   59 and name  HD2) 3.883 1.885 1.885 weight 1.000 ! spec=13C, no=1005, id=1192, vol=3.160911e+07
assign (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   58 and name   HA) 2.752 0.947 0.947 weight 1.000 ! spec=13C, no=1006, id=1193, vol=5.049039e+07
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name  HG2) 2.116 0.560 0.560 weight 1.000 ! spec=13C, no=1009, id=1194, vol=2.038951e+08
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name  HG2) 3.392 0.974 0.974 weight 1.000 ! spec=13C, no=1010, id=1195, vol=4.270470e+07
assign (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   81 and name  HA1) 2.174 0.591 0.591 weight 1.000 ! spec=13C, no=1014, id=1196, vol=4.007200e+07
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   59 and name   HA) 3.466 1.502 1.502 weight 1.000 ! spec=13C, no=1026, id=1200, vol=3.856387e+07
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   59 and name   HA)
    or (segid "   A" and resid   60 and name  HB3) (segid "   A" and resid   59 and name   HA)
assign (segid "   A" and resid   59 and name  HD1) (segid "   A" and resid   59 and name  HD2) 1.879 0.441 0.441 weight 1.000 ! spec=13C, no=1027, id=1201, vol=7.366537e+07
assign (segid "   A" and resid   59 and name  HD1) (segid "   A" and resid   58 and name   HA) 1.993 0.496 0.496 weight 1.000 ! spec=13C, no=1032, id=1202, vol=6.188322e+07
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   58 and name   HA) 2.820 0.994 0.994 weight 1.000 ! spec=13C, no=1033, id=1203, vol=6.447159e+07
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   60 and name   HA) 3.843 1.846 1.846 weight 1.000 ! spec=13C, no=1034, id=1204, vol=7.667296e+06
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name   HA) 2.844 1.011 1.011 weight 1.000 ! spec=13C, no=1054, id=1207, vol=1.008117e+07
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name   HA) 3.303 1.363 1.363 weight 1.000 ! spec=13C, no=1055, id=1208, vol=1.092972e+07
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name   HG) 2.590 0.775 0.775 weight 1.000 ! spec=13C, no=1061, id=1212, vol=2.409246e+07
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   93 and name HE21) 3.594 1.615 1.615 weight 1.000 ! spec=13C, no=1067, id=1216, vol=1.780174e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   93 and name HE21)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   93 and name HE21)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   86 and name   HA) 2.016 0.508 0.508 weight 1.000 ! spec=13C, no=1069, id=1217, vol=5.142612e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   86 and name   HA)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   95 and name  HB2) 2.304 0.664 0.664 weight 1.000 ! spec=13C, no=1074, id=1221, vol=4.645127e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   95 and name  HB2)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   95 and name  HB2)
assign (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name HD12) 2.291 0.656 0.656 weight 1.000 ! spec=13C, no=1075, id=1222, vol=4.353499e+07
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name HD11)
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name HD13)
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name HD12) 2.635 0.868 0.868 weight 1.000 ! spec=13C, no=1077, id=1223, vol=5.313761e+07
    or (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name HD11)
    or (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name HD13)
assign (segid "   A" and resid   86 and name   HG) (segid "   A" and resid   86 and name   HN) 3.310 1.721 1.721 weight 1.000 ! spec=13C, no=1080, id=1224, vol=1.357700e+07
assign (segid "   A" and resid   86 and name   HG) (segid "   A" and resid   87 and name   HN) 4.843 2.932 2.932 weight 1.000 ! spec=13C, no=1082, id=1225, vol=8.336653e+06
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   95 and name   HN) 4.420 2.442 2.442 weight 1.000 ! spec=13C, no=1086, id=1227, vol=9.512765e+06
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   95 and name   HN)
assign (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   90 and name  HG2) 3.540 1.567 1.567 weight 1.000 ! spec=13C, no=1092, id=1230, vol=2.001974e+07
assign (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   90 and name  HG1) 2.706 0.915 0.915 weight 1.000 ! spec=13C, no=1093, id=1231, vol=2.460049e+07
assign (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   90 and name  HB2) 2.130 0.567 0.567 weight 1.000 ! spec=13C, no=1094, id=1232, vol=4.016040e+07
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name  HG2) 2.782 0.968 0.968 weight 1.000 ! spec=13C, no=1097, id=1233, vol=2.085095e+07
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   88 and name  HB2) 3.140 1.233 1.233 weight 1.000 ! spec=13C, no=1101, id=1236, vol=1.301558e+07
    or (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   93 and name   HA) 2.635 0.868 0.868 weight 1.000 ! spec=13C, no=1103, id=1238, vol=2.605715e+07
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   93 and name   HN) 3.697 1.709 1.709 weight 1.000 ! spec=13C, no=1105, id=1240, vol=1.367023e+07
assign (segid "   A" and resid   93 and name  HB1) (segid "   A" and resid   94 and name   HN) 4.692 2.752 2.752 weight 1.000 ! spec=13C, no=1106, id=1241, vol=1.046315e+07
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   94 and name   HN) 4.666 2.722 2.722 weight 1.000 ! spec=13C, no=1108, id=1242, vol=1.140165e+07
assign (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   98 and name HG22) 2.093 0.548 0.548 weight 1.000 ! spec=13C, no=1109, id=1243, vol=5.864450e+07
    or (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   98 and name HG23)
assign (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   14 and name HD22) 3.118 1.215 1.215 weight 1.000 ! spec=13C, no=1111, id=1245, vol=1.360617e+07
    or (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   98 and name HG12) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   14 and name HD22) 3.818 1.822 1.822 weight 1.000 ! spec=13C, no=1112, id=1246, vol=1.815981e+07
    or (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   83 and name  HD1) 4.504 2.536 2.536 weight 1.000 ! spec=13C, no=1113, id=1247, vol=8.543710e+06
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   98 and name HG22) 2.885 0.652 0.652 weight 1.000 ! spec=13C, no=1114, id=1248, vol=6.970455e+07
    or (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   98 and name HG11) (segid "   A" and resid   98 and name HG23)
assign (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   98 and name HG22) 1.732 0.375 0.375 weight 1.000 ! spec=13C, no=1115, id=1249, vol=7.084307e+07
    or (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   98 and name HG23)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   14 and name HD22) 1.900 0.451 0.451 weight 1.000 ! spec=13C, no=1116, id=1250, vol=7.131628e+07
    or (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   14 and name HD23)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   14 and name HD22)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   14 and name HD23)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   14 and name HD22)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HA) 2.425 0.735 0.735 weight 1.000 ! spec=13C, no=1121, id=1253, vol=6.579060e+07
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name   HA) 2.911 1.060 1.060 weight 1.000 ! spec=13C, no=1123, id=1255, vol=3.582202e+07
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name  HB1) 2.107 0.555 0.555 weight 1.000 ! spec=13C, no=1129, id=1258, vol=3.888560e+07
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   65 and name HG22) 2.844 1.011 1.011 weight 1.000 ! spec=13C, no=1131, id=1260, vol=1.217930e+07
    or (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   65 and name HG22) 3.371 1.421 1.421 weight 1.000 ! spec=13C, no=1132, id=1261, vol=1.515585e+07
    or (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG12) 2.977 1.108 1.108 weight 1.000 ! spec=13C, no=1171, id=1267, vol=3.606277e+07
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name  HG2) 2.061 0.531 0.531 weight 1.000 ! spec=13C, no=1179, id=1268, vol=1.589735e+08
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   15 and name   HN) 3.145 1.236 1.236 weight 1.000 ! spec=13C, no=1181, id=1270, vol=8.322338e+06
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name   HA) 3.144 1.236 1.236 weight 1.000 ! spec=13C, no=1185, id=1273, vol=6.711719e+06
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name  HB2) 1.692 0.358 0.358 weight 1.000 ! spec=13C, no=1187, id=1274, vol=4.473806e+07
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   14 and name   HN) 3.652 1.667 1.667 weight 1.000 ! spec=13C, no=1191, id=1277, vol=9.464273e+06
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   14 and name   HN)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   14 and name   HN) 3.899 1.900 1.900 weight 1.000 ! spec=13C, no=1194, id=1278, vol=1.497213e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   14 and name   HN)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   15 and name   HN) 4.086 2.086 2.086 weight 1.000 ! spec=13C, no=1195, id=1279, vol=1.493451e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   15 and name   HN)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   15 and name   HN)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   27 and name  HD1) 4.154 2.157 2.157 weight 1.000 ! spec=13C, no=1202, id=1281, vol=1.488333e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   27 and name  HD1)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   14 and name  HB2) 1.865 0.435 0.435 weight 1.000 ! spec=13C, no=1210, id=1283, vol=6.631147e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name HD12) 2.090 0.546 0.546 weight 1.000 ! spec=13C, no=1211, id=1284, vol=6.902852e+07
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name HD13)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   14 and name  HB2) 2.418 0.731 0.731 weight 1.000 ! spec=13C, no=1212, id=1285, vol=7.000926e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   14 and name  HB1) 1.933 0.467 0.467 weight 1.000 ! spec=13C, no=1213, id=1286, vol=5.070589e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   14 and name  HB1)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   85 and name  HB1) 2.371 0.702 0.702 weight 1.000 ! spec=13C, no=1218, id=1287, vol=2.036367e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   85 and name  HB1)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   85 and name HD22) 2.428 0.737 0.737 weight 1.000 ! spec=13C, no=1219, id=1288, vol=1.851080e+07
    or (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   85 and name HD22) 2.329 0.678 0.678 weight 1.000 ! spec=13C, no=1221, id=1290, vol=3.735730e+07
    or (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   26 and name  HG1) 3.675 1.688 1.688 weight 1.000 ! spec=13C, no=1232, id=1291, vol=9.451864e+06
assign (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   15 and name  HB2) 3.301 1.362 1.362 weight 1.000 ! spec=13C, no=1237, id=1294, vol=1.288276e+07
assign (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   26 and name  HB2) 3.751 1.758 1.758 weight 1.000 ! spec=13C, no=1240, id=1296, vol=1.098733e+07
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG21) 3.586 1.607 1.607 weight 1.000 ! spec=13C, no=1243, id=1297, vol=3.050241e+07
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG22)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HG23)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   17 and name   HA) 3.762 1.769 1.769 weight 1.000 ! spec=13C, no=1245, id=1299, vol=9.197603e+06
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   17 and name   HA)
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   17 and name   HA)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   16 and name   HB) 1.920 0.461 0.461 weight 1.000 ! spec=13C, no=1246, id=1300, vol=1.103579e+08
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   16 and name   HB)
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   16 and name   HB)
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name   HA) 2.936 1.078 1.078 weight 1.000 ! spec=13C, no=1254, id=1302, vol=1.579523e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   29 and name   HB) 4.072 2.072 2.072 weight 1.000 ! spec=13C, no=1261, id=1305, vol=1.781447e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name  HB2) 3.624 1.642 1.642 weight 1.000 ! spec=13C, no=1275, id=1307, vol=3.950653e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name  HB2) 3.316 1.375 1.375 weight 1.000 ! spec=13C, no=1276, id=1308, vol=5.751567e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   88 and name   HN) 4.512 2.545 2.545 weight 1.000 ! spec=13C, no=1277, id=1309, vol=1.328934e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name   HA) 2.349 0.690 0.690 weight 1.000 ! spec=13C, no=1279, id=1310, vol=9.766598e+07
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name   HA) 2.822 0.996 0.996 weight 1.000 ! spec=13C, no=1283, id=1311, vol=1.365253e+07
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   87 and name  HB2) 2.098 0.444 0.444 weight 1.000 ! spec=13C, no=1287, id=1314, vol=8.697732e+07
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   85 and name HD22) 2.053 0.429 0.429 weight 1.000 ! spec=13C, no=1290, id=1315, vol=3.415257e+07
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name  HG2) 2.003 0.501 0.501 weight 1.000 ! spec=13C, no=1294, id=1317, vol=1.253439e+08
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name  HB2) 4.312 2.324 2.324 weight 1.000 ! spec=13C, no=1299, id=1318, vol=7.376028e+06
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name   HG) 3.031 1.148 1.148 weight 1.000 ! spec=13C, no=1304, id=1320, vol=3.116356e+07
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name   HG)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name   HG)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   52 and name HG11) 2.216 0.614 0.614 weight 1.000 ! spec=13C, no=1305, id=1321, vol=3.217579e+07
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   52 and name HG11)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   52 and name HG11)
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG21) 2.385 0.711 0.711 weight 1.000 ! spec=13C, no=1314, id=1323, vol=3.363375e+07
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG22)
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name HG23)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name HG21) 3.988 1.988 1.988 weight 1.000 ! spec=13C, no=1315, id=1324, vol=1.342873e+07
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name HG22)
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name HG23)
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   56 and name  HD1) 2.903 1.053 1.053 weight 1.000 ! spec=13C, no=1316, id=1325, vol=4.785572e+07
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   56 and name  HD1)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   56 and name  HD1)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   56 and name  HD2)
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   56 and name  HD2)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   56 and name   HZ) 2.373 0.704 0.704 weight 1.000 ! spec=13C, no=1317, id=1326, vol=5.247898e+07
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   56 and name   HZ)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   56 and name   HZ)
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   56 and name  HE1) 3.051 1.163 1.163 weight 1.000 ! spec=13C, no=1318, id=1327, vol=3.299097e+07
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   56 and name  HE1)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   56 and name  HE1)
    or (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   56 and name  HE2)
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   56 and name  HE2)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   56 and name  HE2)
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   54 and name   HA) 2.498 0.780 0.780 weight 1.000 ! spec=13C, no=1319, id=1328, vol=3.962934e+07
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   54 and name   HA)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   54 and name   HA)
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HG21) 2.173 0.590 0.590 weight 1.000 ! spec=13C, no=1320, id=1329, vol=4.287332e+07
    or (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HG22)
    or (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name HG23)
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   38 and name   HE) 2.706 0.915 0.915 weight 1.000 ! spec=13C, no=1335, id=1331, vol=2.073570e+07
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name  HB1) 2.244 0.629 0.629 weight 1.000 ! spec=13C, no=1359, id=1334, vol=2.612864e+07
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name   HA) 3.979 1.979 1.979 weight 1.000 ! spec=13C, no=1360, id=1335, vol=8.786247e+06
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HG21) 2.582 0.833 0.833 weight 1.000 ! spec=13C, no=1384, id=1339, vol=3.625784e+07
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HG22)
    or (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name HG23)
assign (segid "   A" and resid   76 and name HG21) (segid "   A" and resid   76 and name   HA) 2.235 0.624 0.624 weight 1.000 ! spec=13C, no=1385, id=1340, vol=6.734145e+07
    or (segid "   A" and resid   76 and name HG22) (segid "   A" and resid   76 and name   HA)
    or (segid "   A" and resid   76 and name HG23) (segid "   A" and resid   76 and name   HA)
assign (segid "   A" and resid   76 and name HG21) (segid "   A" and resid   76 and name   HB) 1.926 0.463 0.463 weight 1.000 ! spec=13C, no=1386, id=1341, vol=6.048090e+07
    or (segid "   A" and resid   76 and name HG22) (segid "   A" and resid   76 and name   HB)
    or (segid "   A" and resid   76 and name HG23) (segid "   A" and resid   76 and name   HB)
assign (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG22) 2.770 0.959 0.959 weight 1.000 ! spec=13C, no=1393, id=1345, vol=2.255372e+07
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG22) 2.982 1.111 1.111 weight 1.000 ! spec=13C, no=1394, id=1346, vol=1.620619e+07
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG22) 2.680 0.898 0.898 weight 1.000 ! spec=13C, no=1395, id=1347, vol=2.861853e+07
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   76 and name   HA) 4.514 2.547 2.547 weight 1.000 ! spec=13C, no=1397, id=1349, vol=9.510133e+06
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   76 and name   HA)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   76 and name   HA)
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   76 and name HG21) 3.069 1.177 1.177 weight 1.000 ! spec=13C, no=1399, id=1350, vol=1.500736e+07
    or (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   76 and name HG22)
    or (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   76 and name HG23)
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   76 and name HG21)
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   76 and name HG22)
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   76 and name HG23)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   76 and name HG21)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   76 and name HG22)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   76 and name HG23)
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG12) 3.815 1.819 1.819 weight 1.000 ! spec=13C, no=1400, id=1351, vol=1.185868e+07
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG13)
assign (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG12) 3.944 1.945 1.945 weight 1.000 ! spec=13C, no=1403, id=1353, vol=9.441048e+06
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG13)
assign (segid "   A" and resid   78 and name HG12) (segid "   A" and resid   77 and name   HA) 3.973 1.973 1.973 weight 1.000 ! spec=13C, no=1405, id=1355, vol=1.127131e+07
    or (segid "   A" and resid   78 and name HG11) (segid "   A" and resid   77 and name   HA)
    or (segid "   A" and resid   78 and name HG13) (segid "   A" and resid   77 and name   HA)
assign (segid "   A" and resid   78 and name HG12) (segid "   A" and resid   78 and name   HA) 2.233 0.623 0.623 weight 1.000 ! spec=13C, no=1406, id=1356, vol=8.551207e+07
    or (segid "   A" and resid   78 and name HG11) (segid "   A" and resid   78 and name   HA)
    or (segid "   A" and resid   78 and name HG13) (segid "   A" and resid   78 and name   HA)
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   79 and name  HB2) 2.400 0.720 0.720 weight 1.000 ! spec=13C, no=1417, id=1360, vol=1.201961e+07
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name   HA) 3.441 1.480 1.480 weight 1.000 ! spec=13C, no=1419, id=1361, vol=8.775383e+06
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   80 and name   HA) 3.308 1.368 1.368 weight 1.000 ! spec=13C, no=1421, id=1362, vol=8.258151e+06
assign (segid "   A" and resid   82 and name  HB1) (segid "   A" and resid   83 and name   HN) 4.010 2.010 2.010 weight 1.000 ! spec=13C, no=1439, id=1364, vol=1.056910e+07
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   36 and name   HN) 4.121 2.123 2.123 weight 1.000 ! spec=13C, no=1440, id=1365, vol=1.101392e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   27 and name  HE1) 3.281 1.111 1.111 weight 1.000 ! spec=13C, no=1443, id=1366, vol=1.000806e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   27 and name  HE1)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   27 and name  HE1)
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   27 and name  HE2) 
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   27 and name  HE2)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   27 and name  HE2)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   38 and name  HD2) 3.613 1.631 1.631 weight 1.000 ! spec=13C, no=1451, id=1367, vol=2.442321e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   38 and name  HD2)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   38 and name  HD2)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   85 and name   HA) 2.890 1.044 1.044 weight 1.000 ! spec=13C, no=1452, id=1368, vol=2.314982e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   85 and name   HA)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   85 and name   HA)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   84 and name   HB) 3.383 0.996 0.996 weight 1.000 ! spec=13C, no=1454, id=1369, vol=3.362948e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   84 and name   HB)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   84 and name   HB)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   86 and name   HA) 2.979 1.109 1.109 weight 1.000 ! spec=13C, no=1456, id=1370, vol=1.562747e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   86 and name   HA)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   86 and name   HN) 2.511 0.788 0.788 weight 1.000 ! spec=13C, no=1460, id=1371, vol=1.570908e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   86 and name   HN)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   93 and name HE21) 4.678 2.736 2.736 weight 1.000 ! spec=13C, no=1463, id=1372, vol=1.033527e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   93 and name HE21)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   93 and name HE21)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   86 and name  HB1) 2.541 0.807 0.807 weight 1.000 ! spec=13C, no=1465, id=1373, vol=7.174916e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   86 and name  HB1)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   14 and name   HA) 3.092 1.195 1.195 weight 1.000 ! spec=13C, no=1466, id=1374, vol=1.664765e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   14 and name   HA) 2.375 0.705 0.705 weight 1.000 ! spec=13C, no=1467, id=1375, vol=3.264470e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   18 and name   HA) 4.813 2.895 2.895 weight 1.000 ! spec=13C, no=1477, id=1377, vol=1.024772e+07
assign (segid "   A" and resid   85 and name  HB2) (segid "   A" and resid   85 and name  HB1) 1.896 0.449 0.449 weight 1.000 ! spec=13C, no=1483, id=1381, vol=1.853422e+07
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   70 and name  HB1) 2.161 0.584 0.584 weight 1.000 ! spec=13C, no=1487, id=1384, vol=1.272270e+07
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name  HB1) 2.292 0.657 0.657 weight 1.000 ! spec=13C, no=1492, id=1385, vol=2.259824e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name  HB1)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name HD12) 2.888 0.903 0.903 weight 1.000 ! spec=13C, no=1494, id=1386, vol=5.309862e+07
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name HD13)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name HD12)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name HD13)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name HD12)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name HD13)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name HD22) 2.888 0.773 0.673 weight 1.000 ! spec=13C, no=1495, id=1387, vol=4.702183e+07
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name HD23)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name HD22)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name HD23)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name HD22)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name   HA) 2.133 0.569 0.569 weight 1.000 ! spec=13C, no=1497, id=1388, vol=4.340192e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name   HA)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name   HA)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   14 and name   HA) 6.104 4.657 4.657 weight 1.000 ! spec=13C, no=1498, id=1389, vol=7.769855e+05
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   37 and name   HA) 3.232 1.306 1.306 weight 1.000 ! spec=13C, no=1499, id=1390, vol=2.004330e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   39 and name   HA) 3.182 1.266 1.266 weight 1.000 ! spec=13C, no=1501, id=1391, vol=1.134913e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   39 and name   HA)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   39 and name   HA)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   39 and name  HH2) 2.865 1.026 1.026 weight 1.000 ! spec=13C, no=1503, id=1392, vol=1.914711e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name HD12) 2.589 0.838 0.838 weight 1.000 ! spec=13C, no=1504, id=1393, vol=4.812223e+07
    or (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   85 and name HD12) 2.309 0.666 0.666 weight 1.000 ! spec=13C, no=1505, id=1394, vol=3.041458e+07
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name   HN) 3.813 1.817 1.817 weight 1.000 ! spec=13C, no=1506, id=1395, vol=1.320360e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name   HN)
assign (segid "   A" and resid   85 and name  HB2) (segid "   A" and resid   85 and name HD22) 1.859 0.432 0.432 weight 1.000 ! spec=13C, no=1510, id=1396, vol=6.656822e+07
    or (segid "   A" and resid   85 and name  HB2) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   85 and name  HB2) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   85 and name   HA) 3.708 1.718 1.718 weight 1.000 ! spec=13C, no=1511, id=1397, vol=9.824654e+06
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   85 and name   HA)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   85 and name   HA)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   85 and name   HN) 3.911 1.912 1.912 weight 1.000 ! spec=13C, no=1517, id=1398, vol=1.219458e+07
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   85 and name   HN)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   86 and name   HN) 4.073 2.074 2.074 weight 1.000 ! spec=13C, no=1518, id=1399, vol=1.175690e+07
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   86 and name   HN)
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HG1) 1.717 0.369 0.369 weight 1.000 ! spec=13C, no=1520, id=1400, vol=5.573529e+07
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   33 and name  HB1) 3.918 1.919 1.919 weight 1.000 ! spec=13C, no=1522, id=1402, vol=1.519086e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   33 and name  HB1)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   33 and name  HB1)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   35 and name  HB1) 4.123 2.125 2.125 weight 1.000 ! spec=13C, no=1523, id=1403, vol=1.455412e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   35 and name  HB1)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   14 and name  HB2) 2.844 1.011 1.011 weight 1.000 ! spec=13C, no=1530, id=1404, vol=3.809223e+07
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   16 and name   HA) 4.202 2.207 2.207 weight 1.000 ! spec=13C, no=1532, id=1405, vol=8.908677e+06
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   16 and name   HA)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   83 and name  HB1) 3.441 1.480 1.480 weight 1.000 ! spec=13C, no=1533, id=1406, vol=8.589527e+06
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   83 and name  HB1)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   83 and name  HB1)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   83 and name  HB2) 2.724 0.928 0.928 weight 1.000 ! spec=13C, no=1534, id=1407, vol=8.824249e+06
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   83 and name  HB2)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   83 and name  HB2)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   29 and name   HN) 2.162 0.584 0.584 weight 1.000 ! spec=13C, no=1552, id=1408, vol=3.423342e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   29 and name   HN)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   30 and name   HN) 3.292 1.355 1.355 weight 1.000 ! spec=13C, no=1553, id=1409, vol=3.783705e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   30 and name   HN)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   30 and name   HN)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  102 and name   HN) 2.862 0.640 0.640 weight 1.000 ! spec=13C, no=1554, id=1410, vol=4.833116e+07
    or (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid  102 and name   HN)
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name  HB2) 2.031 0.515 0.515 weight 1.000 ! spec=13C, no=1555, id=1411, vol=7.682482e+07
    or (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name  HB1)
    or (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name  HB3)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid   80 and name   HA) 3.350 1.403 1.403 weight 1.000 ! spec=13C, no=1561, id=1412, vol=1.869068e+07
    or (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid   80 and name   HA)
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid   80 and name   HA)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  100 and name   HA) 3.377 1.425 1.425 weight 1.000 ! spec=13C, no=1562, id=1413, vol=3.766837e+07
    or (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  100 and name   HA)
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid  100 and name   HA)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  101 and name   HA) 1.743 0.380 0.380 weight 1.000 ! spec=13C, no=1563, id=1414, vol=1.061899e+08
    or (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  101 and name   HA)
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid  101 and name   HA)
assign (segid "   A" and resid  101 and name  HB2) (segid "   A" and resid  102 and name   HA) 3.224 1.299 1.299 weight 1.000 ! spec=13C, no=1564, id=1415, vol=2.264474e+07
    or (segid "   A" and resid  101 and name  HB1) (segid "   A" and resid  102 and name   HA)
    or (segid "   A" and resid  101 and name  HB3) (segid "   A" and resid  102 and name   HA)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   66 and name  HD2) 2.080 0.541 0.541 weight 1.000 ! spec=13C, no=1565, id=1416, vol=2.422120e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   66 and name  HD2)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   66 and name  HD2)
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  100 and name   HA) 1.903 0.453 0.453 weight 1.000 ! spec=13C, no=1579, id=1420, vol=7.048452e+07
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name   HA)
    or (segid "   A" and resid  100 and name  HB3) (segid "   A" and resid  100 and name   HA)
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  101 and name   HN) 2.765 0.956 0.956 weight 1.000 ! spec=13C, no=1584, id=1421, vol=4.704556e+07
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  101 and name   HN)
    or (segid "   A" and resid  100 and name  HB3) (segid "   A" and resid  101 and name   HN)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  100 and name  HB2) 2.350 0.690 0.690 weight 1.000 ! spec=13C, no=1585, id=1422, vol=3.773614e+07
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid   83 and name  HE1) (segid "   A" and resid   83 and name  HD1) 4.246 2.253 2.253 weight 1.000 ! spec=13C, no=1591, id=1423, vol=1.724439e+07
    or (segid "   A" and resid   83 and name  HE1) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   83 and name  HE2) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   83 and name  HE2) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   97 and name  HB2) 1.939 0.470 0.470 weight 1.000 ! spec=13C, no=1597, id=1425, vol=8.077176e+07
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name   HA) 3.448 1.486 1.486 weight 1.000 ! spec=13C, no=1604, id=1426, vol=1.682542e+07
assign (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   97 and name   HA) 2.933 1.076 1.076 weight 1.000 ! spec=13C, no=1605, id=1427, vol=2.084154e+07
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   97 and name  HB2) 4.411 2.433 2.433 weight 1.000 ! spec=13C, no=1610, id=1431, vol=1.845090e+07
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   96 and name  HB2) 3.581 1.603 1.603 weight 1.000 ! spec=13C, no=1617, id=1437, vol=1.161317e+07
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   96 and name  HB2) 2.388 0.713 0.713 weight 1.000 ! spec=13C, no=1620, id=1439, vol=3.319194e+07
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name  HB2) 2.520 0.794 0.794 weight 1.000 ! spec=13C, no=1624, id=1440, vol=5.671211e+07
    or (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   95 and name   HA) 3.798 1.803 1.803 weight 1.000 ! spec=13C, no=1626, id=1441, vol=9.785039e+06
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   96 and name  HB3) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HA) 2.066 0.534 0.534 weight 1.000 ! spec=13C, no=1627, id=1442, vol=6.482810e+07
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   96 and name   HA)
    or (segid "   A" and resid   96 and name  HB3) (segid "   A" and resid   96 and name   HA)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   98 and name   HB) 3.654 1.669 1.669 weight 1.000 ! spec=13C, no=1630, id=1443, vol=2.111081e+07
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   98 and name   HB)
    or (segid "   A" and resid   96 and name  HB3) (segid "   A" and resid   98 and name   HB)
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   86 and name   HA) 3.688 1.700 1.700 weight 1.000 ! spec=13C, no=1636, id=1444, vol=1.587195e+07
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HN) 4.287 2.297 2.297 weight 1.000 ! spec=13C, no=1641, id=1447, vol=8.874099e+06
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   95 and name   HA) 2.564 0.822 0.822 weight 1.000 ! spec=13C, no=1645, id=1449, vol=4.101005e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   94 and name  HB1) 4.128 2.130 2.130 weight 1.000 ! spec=13C, no=1648, id=1450, vol=1.025370e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   94 and name  HB3)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB1) 2.680 0.898 0.898 weight 1.000 ! spec=13C, no=1650, id=1451, vol=2.378379e+07
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HA) 2.606 0.849 0.849 weight 1.000 ! spec=13C, no=1651, id=1452, vol=2.787240e+07
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   86 and name   HA) 2.770 0.959 0.959 weight 1.000 ! spec=13C, no=1652, id=1453, vol=1.657356e+07
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   10 and name  HB2) 2.866 0.535 0.535 weight 1.000 ! spec=13C, no=1659, id=1457, vol=6.463934e+07
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   10 and name  HB1)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   10 and name  HB3)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   10 and name  HB2)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   10 and name  HB1)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   10 and name  HB3)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   10 and name  HB2)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   10 and name  HB1)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   10 and name  HB3)
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name  HB2) 2.174 0.591 0.591 weight 1.000 ! spec=13C, no=1660, id=1458, vol=4.834589e+07
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name  HB3)
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   12 and name   HN) 2.617 0.856 0.856 weight 1.000 ! spec=13C, no=1662, id=1459, vol=3.551026e+07
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name   HN)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name   HN)
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name  HB2) 2.524 0.796 0.796 weight 1.000 ! spec=13C, no=1663, id=1460, vol=6.186509e+07
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name  HB3)
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   11 and name   HN) 3.459 1.496 1.496 weight 1.000 ! spec=13C, no=1664, id=1461, vol=1.268997e+07
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   11 and name   HN)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   11 and name   HN)
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   95 and name   HA) 3.484 1.517 1.517 weight 1.000 ! spec=13C, no=1665, id=1462, vol=1.050598e+07
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   93 and name   HA) 3.648 1.664 1.664 weight 1.000 ! spec=13C, no=1666, id=1463, vol=2.075804e+07
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   93 and name   HA)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   93 and name   HA)
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   94 and name   HA) 1.991 0.495 0.495 weight 1.000 ! spec=13C, no=1667, id=1464, vol=8.582558e+07
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   94 and name   HA)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   94 and name   HA)
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   93 and name   HN) 4.611 2.658 2.658 weight 1.000 ! spec=13C, no=1674, id=1465, vol=8.528587e+06
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   96 and name   HN) 4.946 3.057 3.057 weight 1.000 ! spec=13C, no=1677, id=1466, vol=6.594976e+06
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   91 and name  HB2) 2.099 0.551 0.551 weight 1.000 ! spec=13C, no=1681, id=1470, vol=2.262556e+07
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   89 and name  HB2) 2.198 0.604 0.604 weight 1.000 ! spec=13C, no=1687, id=1472, vol=1.010199e+07
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   87 and name  HB2) 2.190 0.600 0.600 weight 1.000 ! spec=13C, no=1691, id=1474, vol=4.001858e+07
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name  HB2) 3.034 1.150 1.150 weight 1.000 ! spec=13C, no=1693, id=1475, vol=3.486415e+07
    or (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   87 and name   HA) 1.911 0.456 0.456 weight 1.000 ! spec=13C, no=1695, id=1476, vol=5.685895e+07
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   87 and name   HA)
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   37 and name   HA) 3.378 1.108 1.108 weight 1.000 ! spec=13C, no=1696, id=1477, vol=2.653439e+07
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   86 and name   HA) 3.571 1.338 1.338 weight 1.000 ! spec=13C, no=1697, id=1478, vol=1.950116e+07
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   86 and name   HA)
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   29 and name   HB) 2.917 1.063 1.063 weight 1.000 ! spec=13C, no=1700, id=1479, vol=1.377137e+07
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   29 and name   HB)
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   87 and name  HB2) 2.203 0.607 0.607 weight 1.000 ! spec=13C, no=1701, id=1480, vol=6.658746e+07
    or (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   87 and name  HB2) 2.224 0.618 0.618 weight 1.000 ! spec=13C, no=1702, id=1481, vol=4.396888e+07
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   27 and name  HD1) 3.806 1.810 1.810 weight 1.000 ! spec=13C, no=1709, id=1483, vol=1.163725e+07
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   27 and name  HD2)
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   27 and name  HD2)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   39 and name  HH2) 2.794 0.975 0.975 weight 1.000 ! spec=13C, no=1710, id=1484, vol=1.986425e+07
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name HD21) 3.485 1.518 1.518 weight 1.000 ! spec=13C, no=1722, id=1488, vol=7.918545e+06
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   27 and name  HD1) 2.450 0.750 0.750 weight 1.000 ! spec=13C, no=1730, id=1489, vol=4.661460e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   27 and name  HD2)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   27 and name  HD2)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   55 and name   HA) 3.592 1.613 1.613 weight 1.000 ! spec=13C, no=1744, id=1492, vol=1.273540e+07
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   55 and name   HA)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   55 and name   HA)
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name   HA) 2.449 0.750 0.750 weight 1.000 ! spec=13C, no=1751, id=1495, vol=3.361010e+07
assign (segid "   A" and resid   65 and name   HA) (segid "   A" and resid   64 and name   HN) 3.931 1.932 1.932 weight 1.000 ! spec=13C, no=1770, id=1499, vol=1.558862e+07
assign (segid "   A" and resid   65 and name   HB) (segid "   A" and resid   65 and name   HA) 2.595 0.842 0.842 weight 1.000 ! spec=13C, no=1772, id=1500, vol=2.888211e+07
assign (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG21) 2.016 0.508 0.508 weight 1.000 ! spec=13C, no=1777, id=1501, vol=7.290637e+07
    or (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   64 and name   HB) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   61 and name  HB2) 4.334 2.348 2.348 weight 1.000 ! spec=13C, no=1784, id=1502, vol=1.040894e+07
    or (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   61 and name  HB2) 4.768 2.842 2.842 weight 1.000 ! spec=13C, no=1785, id=1503, vol=1.156571e+07
    or (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   60 and name  HB2) 2.248 0.632 0.632 weight 1.000 ! spec=13C, no=1786, id=1504, vol=4.497378e+07
    or (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   60 and name  HB3)
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   63 and name  HG2) 4.890 2.989 2.989 weight 1.000 ! spec=13C, no=1791, id=1507, vol=7.569750e+06
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   61 and name  HB2) 3.948 1.948 1.948 weight 1.000 ! spec=13C, no=1797, id=1508, vol=1.155821e+07
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   61 and name   HA) 3.904 1.906 1.906 weight 1.000 ! spec=13C, no=1798, id=1509, vol=1.318415e+07
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   61 and name   HA)
    or (segid "   A" and resid   60 and name  HB3) (segid "   A" and resid   61 and name   HA)
assign (segid "   A" and resid   59 and name  HD1) (segid "   A" and resid   59 and name   HA) 4.138 2.140 2.140 weight 1.000 ! spec=13C, no=1802, id=1512, vol=1.018052e+07
assign (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   57 and name HD12) 4.306 2.317 2.317 weight 1.000 ! spec=13C, no=1803, id=1513, vol=9.879788e+06
    or (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   67 and name   HA) 4.330 2.344 2.344 weight 1.000 ! spec=13C, no=1805, id=1514, vol=1.010823e+07
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   67 and name   HA)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   67 and name   HA)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   58 and name   HN) 2.584 0.834 0.834 weight 1.000 ! spec=13C, no=1813, id=1515, vol=3.676220e+07
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   58 and name   HN)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   58 and name   HN)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD12) 3.534 1.561 1.561 weight 1.000 ! spec=13C, no=1814, id=1516, vol=2.470229e+07
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name HD12) 1.786 0.399 0.399 weight 1.000 ! spec=13C, no=1818, id=1517, vol=1.345039e+08
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   54 and name   HA) 3.077 1.183 1.183 weight 1.000 ! spec=13C, no=1834, id=1518, vol=2.211883e+07
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB1) 2.830 1.001 1.001 weight 1.000 ! spec=13C, no=1845, id=1520, vol=4.201371e+07
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB2) 2.938 1.079 1.079 weight 1.000 ! spec=13C, no=1849, id=1523, vol=3.856778e+07
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   52 and name   HN) 4.437 2.461 2.461 weight 1.000 ! spec=13C, no=1853, id=1525, vol=9.799326e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   52 and name   HN)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   52 and name   HN)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   49 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=13C, no=1854, id=1526, vol=5.682324e+07
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   49 and name   HA)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   49 and name   HA)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   49 and name   HB) 2.196 0.603 0.603 weight 1.000 ! spec=13C, no=1855, id=1527, vol=3.066833e+07
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   49 and name   HB)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   49 and name   HB)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   48 and name   HA) 3.314 1.373 1.373 weight 1.000 ! spec=13C, no=1856, id=1528, vol=1.417800e+07
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   48 and name   HA)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   48 and name   HA)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   48 and name  HB2) 4.375 2.393 2.393 weight 1.000 ! spec=13C, no=1858, id=1529, vol=7.971457e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   48 and name  HB2)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   48 and name  HB2)
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   39 and name  HB1) 3.810 1.815 1.815 weight 1.000 ! spec=13C, no=1863, id=1530, vol=9.137983e+06
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   40 and name   HA) 3.317 1.046 1.046 weight 1.000 ! spec=13C, no=1865, id=1532, vol=1.255432e+07
assign (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   39 and name   HN) 4.529 1.832 1.832 weight 1.000 ! spec=13C, no=1866, id=1533, vol=8.528549e+06
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   39 and name   HN)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   39 and name   HN)
assign (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name   HA) 4.045 1.571 1.571 weight 1.000 ! spec=13C, no=1867, id=1534, vol=1.099841e+07
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name   HA)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   46 and name   HA) 3.874 1.259 1.259 weight 1.000 ! spec=13C, no=1869, id=1535, vol=1.585440e+07
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   46 and name   HA)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   46 and name   HA)
assign (segid "   A" and resid   45 and name HG22) (segid "   A" and resid   47 and name   HA) 4.072 2.073 2.073 weight 1.000 ! spec=13C, no=1870, id=1536, vol=2.034756e+07
    or (segid "   A" and resid   45 and name HG21) (segid "   A" and resid   47 and name   HA)
    or (segid "   A" and resid   45 and name HG23) (segid "   A" and resid   47 and name   HA)
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   60 and name   HA) 3.733 1.742 1.742 weight 1.000 ! spec=13C, no=1877, id=1538, vol=2.837200e+07
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name   HA) 2.074 0.538 0.538 weight 1.000 ! spec=13C, no=1881, id=1539, vol=5.454025e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name   HA)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   38 and name  HG1) 2.965 1.099 1.099 weight 1.000 ! spec=13C, no=1884, id=1540, vol=1.751904e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   38 and name  HG1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   38 and name  HG1)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   38 and name  HG2) 3.485 1.519 1.519 weight 1.000 ! spec=13C, no=1885, id=1541, vol=1.800055e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   38 and name  HG2)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   38 and name  HG2)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name  HB1) 2.913 1.061 1.061 weight 1.000 ! spec=13C, no=1886, id=1542, vol=3.310001e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name  HB1)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name  HB2) 1.796 0.403 0.403 weight 1.000 ! spec=13C, no=1887, id=1543, vol=1.317032e+08
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name  HB2)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name  HB2)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   40 and name HD12) 2.248 0.525 0.525 weight 1.000 ! spec=13C, no=1890, id=1545, vol=7.986619e+07
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD12) 4.024 1.081 1.081 weight 1.000 ! spec=13C, no=1891, id=1546, vol=1.177857e+07
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD12) 3.168 1.254 1.254 weight 1.000 ! spec=13C, no=1892, id=1547, vol=2.305022e+07
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD12) 3.006 0.823 0.823 weight 1.000 ! spec=13C, no=1893, id=1548, vol=3.561774e+07
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD12) 3.306 1.284 1.284 weight 1.000 ! spec=13C, no=1894, id=1549, vol=2.376936e+07
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HA) 3.358 1.409 1.409 weight 1.000 ! spec=13C, no=1895, id=1550, vol=2.128195e+07
assign (segid "   A" and resid   38 and name  HG2) (segid "   A" and resid   38 and name   HN) 4.601 2.646 2.646 weight 1.000 ! spec=13C, no=1904, id=1551, vol=9.621140e+06
assign (segid "   A" and resid   38 and name  HG2) (segid "   A" and resid   38 and name   HE) 3.901 1.902 1.902 weight 1.000 ! spec=13C, no=1907, id=1553, vol=8.919060e+06
assign (segid "   A" and resid   38 and name  HG2) (segid "   A" and resid   38 and name   HA) 3.140 1.232 1.232 weight 1.000 ! spec=13C, no=1908, id=1554, vol=1.566455e+07
assign (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   38 and name   HA) 3.624 1.642 1.642 weight 1.000 ! spec=13C, no=1909, id=1555, vol=1.442781e+07
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   37 and name   HA) 3.528 1.556 1.556 weight 1.000 ! spec=13C, no=1913, id=1558, vol=1.084499e+07
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name  HD1) 4.295 2.306 2.306 weight 1.000 ! spec=13C, no=1921, id=1561, vol=1.000900e+07
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name  HD1) 3.493 1.525 1.525 weight 1.000 ! spec=13C, no=1923, id=1562, vol=8.388730e+06
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   87 and name  HB2) 2.550 0.813 0.813 weight 1.000 ! spec=13C, no=1925, id=1563, vol=1.428354e+07
    or (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   87 and name  HB2) 3.191 1.273 1.273 weight 1.000 ! spec=13C, no=1926, id=1564, vol=1.775369e+07
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name  HB1) 1.854 0.430 0.430 weight 1.000 ! spec=13C, no=1931, id=1565, vol=3.986159e+07
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   88 and name   HN) 3.166 1.253 1.253 weight 1.000 ! spec=13C, no=1932, id=1566, vol=8.388730e+06
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   36 and name   HA) 4.018 2.018 2.018 weight 1.000 ! spec=13C, no=1938, id=1567, vol=8.323366e+06
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   35 and name  HG1) 4.615 2.663 2.663 weight 1.000 ! spec=13C, no=1940, id=1569, vol=1.636980e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   35 and name  HG1)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   35 and name  HG1)
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name  HB2) 1.703 0.362 0.362 weight 1.000 ! spec=13C, no=1942, id=1570, vol=1.240286e+08
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   33 and name  HB2) 4.728 2.795 2.795 weight 1.000 ! spec=13C, no=1943, id=1571, vol=1.431301e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   33 and name  HB2)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   33 and name  HB2)
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   32 and name   HA) 4.768 2.842 2.842 weight 1.000 ! spec=13C, no=1946, id=1573, vol=1.248039e+07
assign (segid "   A" and resid   33 and name  HG2) (segid "   A" and resid   33 and name   HA) 4.439 2.463 2.463 weight 1.000 ! spec=13C, no=1947, id=1574, vol=9.563286e+06
assign (segid "   A" and resid   33 and name  HG1) (segid "   A" and resid   33 and name   HA) 4.582 2.625 2.625 weight 1.000 ! spec=13C, no=1950, id=1575, vol=8.166954e+06
assign (segid "   A" and resid   33 and name  HG2) (segid "   A" and resid   34 and name   HN) 4.931 3.039 3.039 weight 1.000 ! spec=13C, no=1953, id=1577, vol=1.008817e+07
assign (segid "   A" and resid   33 and name  HG2) (segid "   A" and resid   33 and name  HD1) 2.887 1.042 1.042 weight 1.000 ! spec=13C, no=1955, id=1579, vol=2.683729e+07
assign (segid "   A" and resid   31 and name  HA1) (segid "   A" and resid   31 and name  HA2) 2.294 0.658 0.658 weight 1.000 ! spec=13C, no=1960, id=1581, vol=2.281407e+07
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   30 and name   HN) 2.746 0.943 0.943 weight 1.000 ! spec=13C, no=1968, id=1586, vol=3.103208e+07
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   30 and name   HA) 2.824 0.997 0.997 weight 1.000 ! spec=13C, no=1970, id=1588, vol=2.492255e+07
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   27 and name  HD1) 3.851 1.854 1.854 weight 1.000 ! spec=13C, no=1971, id=1589, vol=1.123578e+07
    or (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   26 and name   HA) 4.050 2.050 2.050 weight 1.000 ! spec=13C, no=1977, id=1591, vol=1.562734e+07
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   15 and name  HD2) 3.672 1.685 1.685 weight 1.000 ! spec=13C, no=1978, id=1592, vol=1.077432e+07
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HD1) 4.546 2.583 2.583 weight 1.000 ! spec=13C, no=1979, id=1593, vol=1.224712e+07
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name  HB1) 1.994 0.497 0.497 weight 1.000 ! spec=13C, no=1985, id=1595, vol=4.672356e+07
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name  HG2) 3.397 1.443 1.443 weight 1.000 ! spec=13C, no=1987, id=1597, vol=2.408968e+07
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name   HA) 3.687 1.700 1.700 weight 1.000 ! spec=13C, no=1988, id=1598, vol=1.326848e+07
assign (segid "   A" and resid   26 and name  HG1) (segid "   A" and resid   26 and name  HB2) 2.764 0.955 0.955 weight 1.000 ! spec=13C, no=1991, id=1600, vol=1.810619e+07
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   18 and name HG22) 2.772 0.960 0.960 weight 1.000 ! spec=13C, no=2000, id=1603, vol=8.086796e+06
    or (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   18 and name HG22) 3.933 1.933 1.933 weight 1.000 ! spec=13C, no=2001, id=1604, vol=1.190675e+07
    or (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name   HN) 3.549 1.575 1.575 weight 1.000 ! spec=13C, no=2003, id=1606, vol=9.779060e+06
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name   HA) 4.321 2.334 2.334 weight 1.000 ! spec=13C, no=2005, id=1607, vol=6.670441e+06
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name   HA) 3.221 1.297 1.297 weight 1.000 ! spec=13C, no=2006, id=1608, vol=2.541514e+07
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name   HA) 3.497 1.528 1.528 weight 1.000 ! spec=13C, no=2007, id=1609, vol=1.852768e+07
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HA) 3.366 1.416 1.416 weight 1.000 ! spec=13C, no=2008, id=1610, vol=1.610551e+07
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   18 and name   HB) 4.563 2.602 2.602 weight 1.000 ! spec=13C, no=2013, id=1611, vol=8.348518e+06
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name  HG1) 3.148 1.239 1.239 weight 1.000 ! spec=13C, no=2015, id=1613, vol=2.490824e+07
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HB2) 3.285 1.349 1.349 weight 1.000 ! spec=13C, no=2016, id=1614, vol=2.284320e+07
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   24 and name  HB2) 4.765 2.838 2.838 weight 1.000 ! spec=13C, no=2018, id=1615, vol=1.060411e+07
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name   HA) 2.544 0.809 0.809 weight 1.000 ! spec=13C, no=2019, id=1616, vol=4.024187e+07
assign (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   17 and name   HN) 3.231 1.305 1.305 weight 1.000 ! spec=13C, no=2026, id=1620, vol=2.416268e+07
assign (segid "   A" and resid   74 and name  HG2) (segid "   A" and resid   74 and name   HN) 4.458 2.485 2.485 weight 1.000 ! spec=13C, no=2042, id=1624, vol=9.710699e+06
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   28 and name  HB2) 1.904 0.453 0.453 weight 1.000 ! spec=13C, no=2079, id=1625, vol=5.796429e+07
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   28 and name  HB1) 4.872 2.967 2.967 weight 1.000 ! spec=13C, no=2080, id=1626, vol=9.764867e+06
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   12 and name   HA) 2.615 0.855 0.855 weight 1.000 ! spec=13C, no=2082, id=1627, vol=2.498542e+07
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   30 and name   HN) 2.348 0.689 0.689 weight 1.000 ! spec=13C, no=2083, id=1628, vol=4.092659e+07
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HB) 2.458 0.755 0.755 weight 1.000 ! spec=13C, no=2084, id=1629, vol=2.388247e+07
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   33 and name  HD2) 5.605 3.927 3.927 weight 1.000 ! spec=13C, no=2092, id=1631, vol=9.082252e+06
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   31 and name   HN) 4.659 2.713 2.713 weight 1.000 ! spec=13C, no=2093, id=1632, vol=1.068226e+07
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    6 and name   HN) 2.663 0.887 0.887 weight 1.000 ! spec=13C, no=2131, id=1634, vol=3.483211e+07
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    6 and name   HN)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    6 and name   HN)
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    8 and name  HD1) 3.327 1.383 1.383 weight 1.000 ! spec=13C, no=2132, id=1635, vol=1.730977e+07
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    8 and name  HD1)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    8 and name  HD1)
    or (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    8 and name  HD2)
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    8 and name  HD2)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   56 and name   HA) 4.851 2.941 2.941 weight 1.000 ! spec=13C, no=2138, id=1637, vol=1.040935e+07
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   56 and name   HA)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   56 and name   HA)
assign (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   77 and name  HB2) 3.588 1.609 1.609 weight 1.000 ! spec=13C, no=2151, id=1638, vol=1.573774e+07
assign (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   77 and name  HB1) 3.319 1.377 1.377 weight 1.000 ! spec=13C, no=2156, id=1639, vol=1.001592e+07
assign (segid "   A" and resid   78 and name   HB) (segid "   A" and resid   78 and name   HA) 2.319 0.672 0.672 weight 1.000 ! spec=13C, no=2172, id=1644, vol=7.455324e+07
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   78 and name   HA) 2.508 0.787 0.787 weight 1.000 ! spec=13C, no=2173, id=1645, vol=1.062588e+08
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   78 and name   HA)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   78 and name   HA)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   39 and name  HB2) 4.030 2.030 2.030 weight 1.000 ! spec=13C, no=2187, id=1648, vol=8.502213e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name  HE3) 4.264 2.272 2.272 weight 1.000 ! spec=13C, no=2190, id=1649, vol=1.472347e+07
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name  HG1) 3.927 1.928 1.928 weight 1.000 ! spec=13C, no=2196, id=1650, vol=1.014062e+07
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   25 and name HG22) 3.094 0.716 0.716 weight 1.000 ! spec=13C, no=2215, id=1656, vol=6.533077e+07
    or (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   25 and name HG21)
    or (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   25 and name HG23)
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   25 and name HG22)
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   25 and name HG21)
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   25 and name HG23)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   25 and name HG22)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   25 and name HG21)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   25 and name HG23)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   98 and name HG11) 2.056 0.385 0.585 weight 1.000 ! spec=13C, no=2216, id=1657, vol=1.041926e+08
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   98 and name HG11)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   98 and name HG11)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   99 and name  HB2) 3.583 1.605 1.605 weight 1.000 ! spec=13C, no=2218, id=1659, vol=1.831502e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   99 and name  HB2)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   99 and name  HB2)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   82 and name   HA) 3.878 1.880 1.880 weight 1.000 ! spec=13C, no=2222, id=1660, vol=1.084401e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   82 and name   HA)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   82 and name   HA)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name  HB2) 2.503 0.783 0.783 weight 1.000 ! spec=13C, no=2235, id=1663, vol=2.295001e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name  HB2)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name  HB2)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name   HA) 2.234 0.624 0.624 weight 1.000 ! spec=13C, no=2236, id=1664, vol=4.125019e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name   HA)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name   HA)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   54 and name   HA) 2.819 0.994 0.994 weight 1.000 ! spec=13C, no=2237, id=1665, vol=2.062872e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   54 and name   HA)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   54 and name   HA)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   39 and name  HH2) 3.863 1.499 1.499 weight 1.000 ! spec=13C, no=2239, id=1666, vol=1.919812e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name HD12) 3.495 1.527 1.527 weight 1.000 ! spec=13C, no=2241, id=1667, vol=2.242343e+07
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name HD12) 3.917 1.918 1.918 weight 1.000 ! spec=13C, no=2242, id=1668, vol=1.460218e+07
    or (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name  HB1) 3.067 1.176 1.176 weight 1.000 ! spec=13C, no=2243, id=1669, vol=2.020670e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name  HB1)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   35 and name  HD1) 3.153 1.243 1.243 weight 1.000 ! spec=13C, no=2249, id=1670, vol=3.036877e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   35 and name  HD1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   35 and name  HD1)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name   HA) 3.124 1.220 1.220 weight 1.000 ! spec=13C, no=2251, id=1671, vol=2.166172e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   10 and name   HA) 3.978 1.978 1.978 weight 1.000 ! spec=13C, no=2252, id=1672, vol=2.273165e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   10 and name   HA)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   10 and name   HA)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   27 and name  HD1) 3.371 1.257 1.257 weight 1.000 ! spec=13C, no=2253, id=1673, vol=2.995111e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   27 and name  HD2)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   27 and name  HD2)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   30 and name   HN) 2.369 0.701 0.701 weight 1.000 ! spec=13C, no=2256, id=1674, vol=6.472529e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   30 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   30 and name   HN)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name HG22) 2.912 1.060 1.060 weight 1.000 ! spec=13C, no=2257, id=1675, vol=2.402927e+07
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name HG23)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   36 and name   HA) 5.111 3.265 3.265 weight 1.000 ! spec=13C, no=2267, id=1678, vol=9.248182e+06
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   36 and name   HA)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   36 and name   HA)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name   HA) 3.797 1.802 1.802 weight 1.000 ! spec=13C, no=2268, id=1679, vol=1.193628e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   56 and name  HE1) 3.807 1.812 1.812 weight 1.000 ! spec=13C, no=2269, id=1680, vol=9.486744e+06
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   56 and name  HE1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   56 and name  HE1)
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   56 and name  HE2)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   56 and name  HE2)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   56 and name  HE2)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   56 and name   HZ) 2.664 0.887 0.887 weight 1.000 ! spec=13C, no=2270, id=1681, vol=2.097995e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   56 and name   HZ)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   56 and name   HZ)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   56 and name  HD1) 2.881 1.038 1.038 weight 1.000 ! spec=13C, no=2271, id=1682, vol=5.917902e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   56 and name  HD1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   56 and name  HD1)
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   56 and name  HD2)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   56 and name  HD2)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HD12) 3.669 1.683 1.683 weight 1.000 ! spec=13C, no=2272, id=1683, vol=1.831291e+07
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name  HG2) 2.203 0.607 0.607 weight 1.000 ! spec=13C, no=2274, id=1684, vol=1.052109e+08
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   35 and name  HD2) 3.315 1.374 1.374 weight 1.000 ! spec=13C, no=2275, id=1685, vol=9.576202e+06
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name HG22) 2.030 0.515 0.515 weight 1.000 ! spec=13C, no=2276, id=1686, vol=7.650672e+07
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   65 and name   HA) 2.362 0.697 0.697 weight 1.000 ! spec=13C, no=2279, id=1687, vol=3.164518e+07
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   65 and name   HA)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   65 and name   HA)
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   65 and name HG22) 3.649 1.664 1.664 weight 1.000 ! spec=13C, no=2280, id=1688, vol=5.580734e+07
    or (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   28 and name  HB2) 4.027 2.027 2.027 weight 1.000 ! spec=13C, no=2283, id=1689, vol=1.165197e+07
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   66 and name   HA) 4.097 2.098 2.098 weight 1.000 ! spec=13C, no=2284, id=1690, vol=9.483553e+06
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   66 and name   HA)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   66 and name   HA)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   63 and name   HA) 4.306 2.318 2.318 weight 1.000 ! spec=13C, no=2285, id=1691, vol=1.070896e+07
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   63 and name   HA)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   63 and name   HA)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   30 and name  HB1) 2.585 0.835 0.835 weight 1.000 ! spec=13C, no=2291, id=1692, vol=3.211306e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   30 and name  HB1)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   30 and name  HB1)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   28 and name  HB1) 2.308 0.666 0.666 weight 1.000 ! spec=13C, no=2293, id=1693, vol=2.121317e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   28 and name  HB2) 3.496 1.528 1.528 weight 1.000 ! spec=13C, no=2294, id=1694, vol=2.441005e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   28 and name  HB2)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   28 and name  HB2)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   65 and name   HA) 2.182 0.595 0.595 weight 1.000 ! spec=13C, no=2295, id=1695, vol=5.211671e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   65 and name   HA)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   65 and name   HA)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   28 and name   HA) 3.091 1.194 1.194 weight 1.000 ! spec=13C, no=2296, id=1696, vol=1.670564e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   28 and name   HA)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   30 and name   HA) 3.215 1.292 1.292 weight 1.000 ! spec=13C, no=2297, id=1697, vol=2.250152e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   30 and name   HA)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   30 and name   HA)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   65 and name   HN) 3.068 1.176 1.176 weight 1.000 ! spec=13C, no=2298, id=1698, vol=3.374462e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   65 and name   HN)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   65 and name   HN)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   67 and name  HE1) 3.568 1.592 1.592 weight 1.000 ! spec=13C, no=2300, id=1700, vol=1.124571e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   67 and name  HE1)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   67 and name  HE1)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG12) 2.965 1.099 1.099 weight 1.000 ! spec=13C, no=2301, id=1701, vol=1.834830e+07
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG11)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG13)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    6 and name   HB) 2.212 0.612 0.612 weight 1.000 ! spec=13C, no=2304, id=1702, vol=8.134887e+07
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    6 and name   HA) 1.999 0.500 0.500 weight 1.000 ! spec=13C, no=2305, id=1703, vol=1.393429e+08
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid    6 and name   HA) (segid "   A" and resid    7 and name  HB2) 4.484 2.513 2.513 weight 1.000 ! spec=13C, no=2306, id=1704, vol=1.759196e+07
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name   HA) 2.494 0.777 0.777 weight 1.000 ! spec=13C, no=2307, id=1705, vol=5.083180e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HA) 2.089 0.546 0.546 weight 1.000 ! spec=13C, no=2308, id=1706, vol=1.288456e+08
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   18 and name   HA) 2.747 0.943 0.943 weight 1.000 ! spec=13C, no=2312, id=1707, vol=5.689957e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   18 and name   HA)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   18 and name   HN) 2.352 0.692 0.692 weight 1.000 ! spec=13C, no=2313, id=1708, vol=2.477398e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   18 and name   HN)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG22) 2.965 1.099 1.099 weight 1.000 ! spec=13C, no=2314, id=1709, vol=4.612591e+07
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   24 and name  HB2) 3.781 1.787 1.787 weight 1.000 ! spec=13C, no=2315, id=1710, vol=1.509783e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   24 and name  HB2)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   25 and name   HA) 2.313 0.669 0.669 weight 1.000 ! spec=13C, no=2339, id=1712, vol=2.640877e+07
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   25 and name   HA)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name   HA) 2.522 0.795 0.795 weight 1.000 ! spec=13C, no=2351, id=1713, vol=5.972172e+07
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name   HA)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name   HA)
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name HG12) 1.974 0.487 0.487 weight 1.000 ! spec=13C, no=2353, id=1714, vol=7.936957e+07
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name HG13)
assign (segid "   A" and resid   88 and name  HB2) (segid "   A" and resid   87 and name   HA) 3.390 1.436 1.436 weight 1.000 ! spec=13C, no=2373, id=1715, vol=2.851190e+07
    or (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   88 and name  HB3) (segid "   A" and resid   87 and name   HA)
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   88 and name  HB2) 2.087 0.544 0.544 weight 1.000 ! spec=13C, no=2376, id=1716, vol=5.764311e+07
    or (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   88 and name  HB2) 2.613 0.853 0.853 weight 1.000 ! spec=13C, no=2377, id=1717, vol=6.840291e+07
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   93 and name  HB1) (segid "   A" and resid   88 and name  HB2) 3.529 1.557 1.557 weight 1.000 ! spec=13C, no=2379, id=1718, vol=5.010169e+07
    or (segid "   A" and resid   93 and name  HB1) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   93 and name  HB1) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   88 and name  HB2) 3.845 1.848 1.848 weight 1.000 ! spec=13C, no=2380, id=1719, vol=2.676383e+07
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name HD12) 2.582 0.834 0.834 weight 1.000 ! spec=13C, no=2383, id=1720, vol=1.965295e+07
    or (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name HD11)
    or (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name HD13)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   72 and name  HB2) 2.020 0.510 0.510 weight 1.000 ! spec=13C, no=2385, id=1721, vol=5.712771e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   72 and name  HB2)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   72 and name  HB2)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   72 and name  HB1) 2.821 0.995 0.995 weight 1.000 ! spec=13C, no=2386, id=1722, vol=4.098923e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   72 and name  HB1)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   72 and name  HB1)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   70 and name  HB2) 2.386 0.712 0.712 weight 1.000 ! spec=13C, no=2388, id=1723, vol=2.193558e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   70 and name  HB2)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   70 and name  HB2)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   25 and name HD12) 1.634 0.334 0.334 weight 1.000 ! spec=13C, no=2389, id=1724, vol=5.350769e+07
    or (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   70 and name  HB1) 2.350 0.690 0.690 weight 1.000 ! spec=13C, no=2395, id=1725, vol=3.006579e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   70 and name  HB1)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   70 and name   HA) 3.719 1.729 1.729 weight 1.000 ! spec=13C, no=2396, id=1726, vol=1.323218e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   70 and name   HA)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   70 and name   HA)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   98 and name HD12) 3.367 1.089 1.089 weight 1.000 ! spec=13C, no=2406, id=1727, vol=4.519717e+07
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name HG21) 2.094 0.548 0.548 weight 1.000 ! spec=13C, no=2407, id=1728, vol=7.627483e+07
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name HG22)
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name HG23)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name   HN) 2.776 0.963 0.963 weight 1.000 ! spec=13C, no=2409, id=1730, vol=2.476901e+07
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HB2) 2.463 0.758 0.758 weight 1.000 ! spec=13C, no=2411, id=1731, vol=7.812922e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HB2) 4.122 2.124 2.124 weight 1.000 ! spec=13C, no=2412, id=1732, vol=2.921163e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HB2) 2.731 0.932 0.932 weight 1.000 ! spec=13C, no=2413, id=1733, vol=5.850855e+07
assign (segid "   A" and resid   90 and name  HB1) (segid "   A" and resid   90 and name   HA) 2.642 0.872 0.872 weight 1.000 ! spec=13C, no=2422, id=1734, vol=5.784330e+07
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name   HA) 2.727 0.930 0.930 weight 1.000 ! spec=13C, no=2423, id=1735, vol=4.929562e+07
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HB2) 2.031 0.516 0.516 weight 1.000 ! spec=13C, no=2492, id=1736, vol=4.762199e+07
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HE1) 5.062 3.203 3.203 weight 1.000 ! spec=13C, no=2506, id=1739, vol=5.553144e+06
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HE2)
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   15 and name   HA) 3.790 1.796 1.796 weight 1.000 ! spec=13C, no=2512, id=1740, vol=5.147366e+06
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name   HA) 3.907 1.908 1.908 weight 1.000 ! spec=13C, no=2516, id=1742, vol=9.597853e+06
assign (segid "   A" and resid  107 and name  HD1) (segid "   A" and resid  107 and name  HE1) 3.275 1.340 1.340 weight 1.000 ! spec=13C, no=2533, id=1743, vol=9.223478e+07
    or (segid "   A" and resid  107 and name  HD1) (segid "   A" and resid  107 and name  HE2)
    or (segid "   A" and resid  107 and name  HD2) (segid "   A" and resid  107 and name  HE1)
    or (segid "   A" and resid  107 and name  HD2) (segid "   A" and resid  107 and name  HE2)
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   67 and name   HA) 5.580 3.892 3.892 weight 1.000 ! spec=13C, no=2556, id=1747, vol=2.038180e+06
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   66 and name   HN) 4.355 2.371 2.371 weight 1.000 ! spec=13C, no=2558, id=1748, vol=5.597975e+06
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   77 and name   HA) 2.357 0.694 0.694 weight 1.000 ! spec=13C, no=2583, id=1749, vol=6.437039e+07
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name   HA) 2.752 0.947 0.947 weight 1.000 ! spec=13C, no=2584, id=1750, vol=2.999038e+07
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   94 and name  HB2) 4.238 2.245 2.245 weight 1.000 ! spec=13C, no=2620, id=1754, vol=1.244236e+07
    or (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   94 and name  HB3)
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   28 and name  HB2) 3.623 1.640 1.640 weight 1.000 ! spec=13C, no=2624, id=1755, vol=7.991434e+06
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name  HB1) 1.730 0.374 0.374 weight 1.000 ! spec=13C, no=2634, id=1757, vol=7.252047e+07
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name   HA) 2.881 1.038 1.038 weight 1.000 ! spec=13C, no=2645, id=1759, vol=1.474775e+07
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   24 and name   HA) 3.256 1.325 1.325 weight 1.000 ! spec=13C, no=2647, id=1760, vol=1.753970e+07
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HB2) 4.106 2.107 2.107 weight 1.000 ! spec=13C, no=2664, id=1762, vol=8.013473e+06
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name  HB1) 3.139 1.231 1.231 weight 1.000 ! spec=13C, no=2665, id=1763, vol=1.208511e+07
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   91 and name   HA) 3.056 1.167 1.167 weight 1.000 ! spec=13C, no=2672, id=1764, vol=4.051165e+07
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name  HB2) 3.014 1.135 1.135 weight 1.000 ! spec=13C, no=2673, id=1765, vol=1.790923e+07
assign (segid "   A" and resid   76 and name   HB) (segid "   A" and resid   76 and name   HA) 2.781 0.967 0.967 weight 1.000 ! spec=13C, no=2713, id=1774, vol=2.188957e+07
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG21) 2.501 0.782 0.782 weight 1.000 ! spec=13C, no=2726, id=1776, vol=2.735639e+07
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name  HG2) 2.601 0.846 0.846 weight 1.000 ! spec=13C, no=2729, id=1777, vol=2.507780e+07
assign (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   99 and name   HA) 2.857 1.020 1.020 weight 1.000 ! spec=13C, no=2730, id=1778, vol=5.224333e+07
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB2) 2.655 0.881 0.881 weight 1.000 ! spec=13C, no=2755, id=1779, vol=3.339908e+07
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name   HN) 3.888 1.890 1.890 weight 1.000 ! spec=13C, no=2760, id=1783, vol=1.089033e+07
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name  HG2) 2.681 0.898 0.898 weight 1.000 ! spec=13C, no=2764, id=1785, vol=5.550896e+07
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name  HB1) 1.515 0.287 0.287 weight 1.000 ! spec=13C, no=2768, id=1787, vol=1.883954e+08
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name  HG2) 2.201 0.605 0.605 weight 1.000 ! spec=13C, no=2771, id=1789, vol=8.111140e+07
assign (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  103 and name   HA) 3.221 1.297 1.297 weight 1.000 ! spec=13C, no=2773, id=1790, vol=3.359812e+07
assign (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  103 and name  HE2) 3.012 1.134 1.134 weight 1.000 ! spec=13C, no=2777, id=1792, vol=1.074337e+07
    or (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  103 and name  HE1)
    or (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  103 and name  HE3)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   86 and name HD22) 1.825 0.417 0.417 weight 1.000 ! spec=13C, no=2780, id=1793, vol=4.108702e+07
    or (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   86 and name HD21)
    or (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   86 and name HD23)
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   86 and name HD22)
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   86 and name HD21)
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   86 and name HD23)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   86 and name HD22)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   86 and name HD21)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   86 and name HD23)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   40 and name  HB1) 3.562 1.498 1.498 weight 1.000 ! spec=13C, no=2782, id=1794, vol=1.380746e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   40 and name  HB1)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   93 and name  HG1) 3.373 1.422 1.422 weight 1.000 ! spec=13C, no=2783, id=1795, vol=2.091692e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   93 and name  HG1)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   93 and name  HG1)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   93 and name  HG2) 2.885 1.040 1.040 weight 1.000 ! spec=13C, no=2784, id=1796, vol=1.958532e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   93 and name  HG2)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   93 and name  HG2)
assign (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    8 and name   HZ) 3.354 1.406 1.406 weight 1.000 ! spec=13C, no=2804, id=1798, vol=6.208336e+07
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    8 and name   HZ)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name  HB2) 3.147 1.238 1.238 weight 1.000 ! spec=13C, no=2809, id=1800, vol=1.224405e+07
assign (segid "   A" and resid   41 and name  HE1) (segid "   A" and resid   41 and name  HB2) 4.805 2.886 2.886 weight 1.000 ! spec=13C, no=2817, id=1801, vol=6.704352e+06
    or (segid "   A" and resid   41 and name  HE2) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid  107 and name  HB1) (segid "   A" and resid  107 and name   HA) 2.981 1.111 1.111 weight 1.000 ! spec=13C, no=2829, id=1802, vol=6.528190e+07
assign (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  107 and name   HA) 2.658 0.883 0.883 weight 1.000 ! spec=13C, no=2830, id=1803, vol=5.480188e+07
assign (segid "   A" and resid  107 and name  HD1) (segid "   A" and resid  107 and name   HA) 3.953 1.953 1.953 weight 1.000 ! spec=13C, no=2832, id=1805, vol=2.016424e+07
    or (segid "   A" and resid  107 and name  HD2) (segid "   A" and resid  107 and name   HA)
assign (segid "   A" and resid  107 and name  HB1) (segid "   A" and resid  107 and name  HB2) 1.530 0.293 0.293 weight 1.000 ! spec=13C, no=2836, id=1807, vol=4.472439e+08
assign (segid "   A" and resid   23 and name  HZ3) (segid "   A" and resid   23 and name  HB2) 6.621 5.479 5.479 weight 1.000 ! spec=13C, no=2850, id=1809, vol=3.333563e+06
assign (segid "   A" and resid   23 and name  HZ3) (segid "   A" and resid   23 and name  HB1) 5.242 3.435 3.435 weight 1.000 ! spec=13C, no=2852, id=1810, vol=5.698167e+06
assign (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HG22) 1.823 0.416 0.416 weight 1.000 ! spec=13C, no=2878, id=1812, vol=4.102381e+07
    or (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HG21)
    or (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HG23)
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   25 and name HG11) 2.734 0.934 0.934 weight 1.000 ! spec=13C, no=2882, id=1813, vol=3.324165e+07
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   25 and name HG11)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   25 and name HG11)
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   70 and name   HG) 4.213 2.219 2.219 weight 1.000 ! spec=13C, no=2884, id=1814, vol=1.431593e+07
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   70 and name   HG)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   70 and name   HG)
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   26 and name  HD1) 3.454 1.491 1.491 weight 1.000 ! spec=13C, no=2887, id=1815, vol=1.132785e+07
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   26 and name  HD1)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   26 and name  HD1)
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name   HA) 2.850 1.015 1.015 weight 1.000 ! spec=13C, no=2892, id=1816, vol=2.985757e+07
assign (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid  102 and name   HA) 2.783 0.968 0.968 weight 1.000 ! spec=13C, no=2893, id=1817, vol=2.265096e+07
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name  HB2) 2.276 0.647 0.647 weight 1.000 ! spec=13C, no=2894, id=1818, vol=1.458372e+07
assign (segid "   A" and resid  102 and name  HD1) (segid "   A" and resid  102 and name   HZ) 4.404 2.425 2.425 weight 1.000 ! spec=13C, no=2899, id=1819, vol=8.858270e+06
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   72 and name HD22) 2.886 1.041 1.041 weight 1.000 ! spec=13C, no=2989, id=1820, vol=1.679073e+07
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   72 and name HD23)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HG1) 3.317 1.375 1.375 weight 1.000 ! spec=13C, no=3028, id=1824, vol=1.733709e+07
assign (segid "   A" and resid   66 and name  HG2) (segid "   A" and resid   66 and name  HG1) 2.090 0.546 0.546 weight 1.000 ! spec=13C, no=3031, id=1826, vol=2.558680e+07
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   66 and name   HA) 5.083 3.230 3.230 weight 1.000 ! spec=13C, no=3040, id=1827, vol=7.030517e+06
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   66 and name   HE) 3.203 1.282 1.282 weight 1.000 ! spec=13C, no=3045, id=1828, vol=7.415302e+06
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   38 and name   HN) 6.033 4.550 4.550 weight 1.000 ! spec=13C, no=3751, id=1829, vol=4.080231e+06
assign (segid "   A" and resid   38 and name  HD2) (segid "   A" and resid   38 and name   HE) 3.863 1.865 1.865 weight 1.000 ! spec=13C, no=3754, id=1830, vol=5.527929e+06
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   92 and name  HA1) 5.008 3.134 3.134 weight 1.000 ! spec=13C, no=3781, id=1832, vol=7.239237e+06
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   41 and name  HB1) 2.403 0.722 0.722 weight 1.000 ! spec=13C, no=3794, id=1833, vol=1.422352e+07
assign (segid "   A" and resid   23 and name  HZ2) (segid "   A" and resid   23 and name  HB2) 5.609 3.933 3.933 weight 1.000 ! spec=13C, no=3811, id=1835, vol=2.568878e+06
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name   HN) 3.018 1.138 1.138 weight 1.000 ! spec=13C, no=3817, id=1836, vol=2.765770e+07
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   35 and name  HD2) 2.868 1.028 1.028 weight 1.000 ! spec=13C, no=3818, id=1837, vol=6.709630e+06
assign (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   16 and name   HA) 4.028 2.028 2.028 weight 1.000 ! spec=13C, no=3819, id=1838, vol=4.213364e+06
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   27 and name  HB2) 2.980 1.110 1.110 weight 1.000 ! spec=13C, no=4134, id=1840, vol=9.275534e+06
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid    8 and name   HN) 3.417 1.460 1.460 weight 1.000 ! spec=13C, no=4135, id=1841, vol=1.376859e+07
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name   HA) 3.643 1.659 1.659 weight 1.000 ! spec=13C, no=4145, id=1842, vol=1.489200e+07
!assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid  105 and name   HA) 4.404 2.425 2.425 weight 1.000 ! spec=13C, no=4146, id=1843, vol=8.880920e+06
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name  HB2) 2.259 0.638 0.638 weight 1.000 ! spec=13C, no=4156, id=1845, vol=2.001704e+07
assign (segid "   A" and resid   82 and name  HB2) (segid "   A" and resid   99 and name  HE2) 3.905 1.906 1.906 weight 1.000 ! spec=13C, no=4158, id=1846, vol=1.517450e+07
    or (segid "   A" and resid   82 and name  HB2) (segid "   A" and resid   99 and name  HE1)
    or (segid "   A" and resid   82 and name  HB2) (segid "   A" and resid   99 and name  HE3)
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  106 and name  HD2) 4.648 2.701 2.701 weight 1.000 ! spec=13C, no=4165, id=1850, vol=1.954879e+07
assign (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  106 and name  HD2) 3.996 1.996 1.996 weight 1.000 ! spec=13C, no=4166, id=1851, vol=2.396352e+07
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   65 and name HG12) 3.843 1.846 1.846 weight 1.000 ! spec=13C, no=4181, id=1853, vol=1.143892e+07
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   65 and name HG11)
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   65 and name HG13)
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   65 and name HG22)
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   41 and name  HE1) (segid "   A" and resid   41 and name   HA) 5.280 3.485 3.485 weight 1.000 ! spec=13C, no=4185, id=1854, vol=5.266211e+06
    or (segid "   A" and resid   41 and name  HE2) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   83 and name  HD1) 4.227 2.233 2.233 weight 1.000 ! spec=13C, no=4197, id=1857, vol=6.337901e+06
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   83 and name  HB1) 2.485 0.772 0.772 weight 1.000 ! spec=13C, no=4199, id=1858, vol=9.539349e+06
assign (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   82 and name   HA) 5.459 3.726 3.726 weight 1.000 ! spec=13C, no=4202, id=1859, vol=6.627067e+06
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   39 and name  HH2) 5.329 3.550 3.550 weight 1.000 ! spec=13C, no=4205, id=1860, vol=5.717001e+06
assign (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   84 and name HG21) 4.665 2.720 2.720 weight 1.000 ! spec=13C, no=4210, id=1861, vol=6.243796e+06
    or (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   84 and name HG21) 5.034 3.168 3.168 weight 1.000 ! spec=13C, no=4211, id=1862, vol=5.607252e+06
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   39 and name  HH2) 4.778 2.853 2.853 weight 1.000 ! spec=13C, no=4220, id=1864, vol=6.996975e+06
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   23 and name   HN) 3.219 1.296 1.296 weight 1.000 ! spec=13C, no=4231, id=1866, vol=8.804604e+06
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   23 and name   HN) 4.669 2.725 2.725 weight 1.000 ! spec=13C, no=4232, id=1867, vol=5.756676e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name  HZ2) 4.945 3.056 3.056 weight 1.000 ! spec=13C, no=4256, id=1869, vol=5.259149e+06
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   32 and name  HG2) 4.240 2.247 2.247 weight 1.000 ! spec=13C, no=4266, id=1873, vol=1.745039e+07
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   32 and name  HB2) 3.640 1.547 1.547 weight 1.000 ! spec=13C, no=4267, id=1874, vol=1.745039e+07
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid   32 and name  HB1) 3.510 1.540 1.540 weight 1.000 ! spec=13C, no=4269, id=1875, vol=1.564121e+07
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG12) 3.709 1.720 1.720 weight 1.000 ! spec=13C, no=4281, id=1878, vol=2.182309e+07
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   29 and name   HB) (segid "   A" and resid   12 and name   HA) 3.309 1.369 1.369 weight 1.000 ! spec=13C, no=4291, id=1879, vol=9.297679e+06
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   98 and name HD12) 4.271 2.280 2.280 weight 1.000 ! spec=13C, no=4301, id=1881, vol=1.179085e+07
    or (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   98 and name HD12) 5.021 3.151 3.151 weight 1.000 ! spec=13C, no=4302, id=1882, vol=4.941550e+06
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   25 and name HD12) 2.672 0.892 0.892 weight 1.000 ! spec=13C, no=4305, id=1883, vol=2.917715e+07
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HG1) 1.979 0.490 0.490 weight 1.000 ! spec=13C, no=4308, id=1884, vol=8.597156e+07
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name   HN) 4.797 2.876 2.876 weight 1.000 ! spec=13C, no=4310, id=1886, vol=1.697671e+07
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name   HN) 3.963 1.964 1.964 weight 1.000 ! spec=13C, no=4311, id=1887, vol=1.044444e+07
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   72 and name  HB2) 4.251 2.259 2.259 weight 1.000 ! spec=13C, no=4321, id=1889, vol=7.711686e+06
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   72 and name  HB2) 3.698 1.709 1.709 weight 1.000 ! spec=13C, no=4322, id=1890, vol=4.966115e+06
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name   HA) 4.054 2.054 2.054 weight 1.000 ! spec=13C, no=4324, id=1891, vol=5.741191e+06
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name   HA) 3.663 1.677 1.677 weight 1.000 ! spec=13C, no=4327, id=1892, vol=4.817409e+06
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name   HA) 3.342 1.396 1.396 weight 1.000 ! spec=13C, no=4341, id=1896, vol=6.310815e+06
assign (segid "   A" and resid   28 and name   HA) (segid "   A" and resid   29 and name   HB) 4.416 2.437 2.437 weight 1.000 ! spec=13C, no=4346, id=1897, vol=8.487823e+06
assign (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   28 and name   HA) 4.132 2.134 2.134 weight 1.000 ! spec=13C, no=4350, id=1898, vol=1.183417e+07
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   28 and name   HA)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HN) 2.872 1.031 1.031 weight 1.000 ! spec=13C, no=4363, id=1899, vol=1.572522e+07
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name   HA) 2.994 1.120 1.120 weight 1.000 ! spec=13C, no=4366, id=1900, vol=2.379194e+07
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   65 and name HG22) 3.547 1.573 1.573 weight 1.000 ! spec=13C, no=4367, id=1901, vol=1.108825e+07
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   30 and name  HB1) (segid "   A" and resid   65 and name   HA) 4.177 2.181 2.181 weight 1.000 ! spec=13C, no=4373, id=1902, vol=6.667206e+06
assign (segid "   A" and resid   31 and name  HA1) (segid "   A" and resid   30 and name  HB1) 5.090 1.497 1.497 weight 1.000 ! spec=13C, no=4379, id=1903, vol=6.798800e+06
assign (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   64 and name HG21) 4.276 2.285 2.285 weight 1.000 ! spec=13C, no=4380, id=1904, vol=5.691236e+06
    or (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   32 and name  HB2) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   64 and name HG21) 4.629 2.679 2.679 weight 1.000 ! spec=13C, no=4381, id=1905, vol=6.799402e+06
    or (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   31 and name  HA2) 6.323 4.997 4.997 weight 1.000 ! spec=13C, no=4392, id=1907, vol=6.976208e+06
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   31 and name  HA1) 5.346 3.573 3.573 weight 1.000 ! spec=13C, no=4393, id=1908, vol=1.077362e+07
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   34 and name   HA) 5.072 3.216 3.216 weight 1.000 ! spec=13C, no=4395, id=1910, vol=7.336032e+06
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   34 and name   HA) 4.189 2.193 2.193 weight 1.000 ! spec=13C, no=4396, id=1911, vol=6.958626e+06
assign (segid "   A" and resid   33 and name  HB1) (segid "   A" and resid   33 and name   HA) 3.138 1.231 1.231 weight 1.000 ! spec=13C, no=4398, id=1912, vol=2.227707e+07
assign (segid "   A" and resid   33 and name  HB2) (segid "   A" and resid   33 and name   HA) 2.545 0.810 0.810 weight 1.000 ! spec=13C, no=4399, id=1913, vol=3.797045e+07
assign (segid "   A" and resid   33 and name  HG2) (segid "   A" and resid   33 and name  HG1) 1.513 0.286 0.286 weight 1.000 ! spec=13C, no=4401, id=1915, vol=1.123166e+08
assign (segid "   A" and resid   33 and name  HD2) (segid "   A" and resid   33 and name   HA) 5.308 3.522 3.522 weight 1.000 ! spec=13C, no=4407, id=1917, vol=1.670686e+06
assign (segid "   A" and resid   33 and name  HD1) (segid "   A" and resid   33 and name   HA) 4.557 2.596 2.596 weight 1.000 ! spec=13C, no=4408, id=1918, vol=4.141552e+06
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   33 and name   HA) 3.771 1.778 1.778 weight 1.000 ! spec=13C, no=4424, id=1919, vol=3.429246e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   33 and name   HA)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   33 and name   HA)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   32 and name HE21) 4.661 2.715 2.715 weight 1.000 ! spec=13C, no=4425, id=1920, vol=7.442484e+06
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   32 and name HE21)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   32 and name HE21)
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name  HG1) 4.421 2.443 2.443 weight 1.000 ! spec=13C, no=4429, id=1921, vol=1.472605e+07
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   34 and name  HB2) 4.982 3.103 3.103 weight 1.000 ! spec=13C, no=4436, id=1922, vol=7.270492e+06
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   34 and name  HB1)
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   34 and name  HB3)
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   31 and name  HA2) 4.401 2.421 2.421 weight 1.000 ! spec=13C, no=4439, id=1924, vol=7.662404e+06
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   31 and name  HA2) 3.801 1.362 1.362 weight 1.000 ! spec=13C, no=4440, id=1925, vol=6.363810e+06
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   36 and name   HA) 4.714 2.778 2.778 weight 1.000 ! spec=13C, no=4441, id=1926, vol=1.168598e+07
assign (segid "   A" and resid   37 and name   HG) (segid "   A" and resid   37 and name   HA) 3.273 1.339 1.339 weight 1.000 ! spec=13C, no=4464, id=1927, vol=9.516253e+06
assign (segid "   A" and resid   37 and name   HG) (segid "   A" and resid   37 and name   HN) 2.608 0.850 0.850 weight 1.000 ! spec=13C, no=4465, id=1928, vol=2.174198e+07
assign (segid "   A" and resid   37 and name   HG) (segid "   A" and resid   38 and name   HN) 4.765 2.839 2.839 weight 1.000 ! spec=13C, no=4466, id=1929, vol=8.104360e+06
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name   HA) 2.303 0.663 0.663 weight 1.000 ! spec=13C, no=4469, id=1931, vol=5.732408e+07
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name  HZ3) 5.958 4.437 4.437 weight 1.000 ! spec=13C, no=4471, id=1933, vol=5.424386e+06
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name  HB2) 2.199 0.605 0.605 weight 1.000 ! spec=13C, no=4472, id=1934, vol=1.777087e+07
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name  HB1) 3.106 1.206 1.206 weight 1.000 ! spec=13C, no=4474, id=1936, vol=2.254936e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name  HB2) 2.322 0.674 0.674 weight 1.000 ! spec=13C, no=4476, id=1937, vol=2.823441e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name  HB2)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name  HB2)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name   HG) 2.778 0.965 0.965 weight 1.000 ! spec=13C, no=4478, id=1938, vol=1.046600e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name   HG) 3.317 1.375 1.375 weight 1.000 ! spec=13C, no=4480, id=1939, vol=9.865109e+06
assign (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name HD12) 4.892 2.991 2.991 weight 1.000 ! spec=13C, no=4493, id=1940, vol=6.931000e+06
    or (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   40 and name HD12) 5.210 3.392 3.392 weight 1.000 ! spec=13C, no=4494, id=1941, vol=7.647052e+06
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   41 and name  HB1) (segid "   A" and resid   41 and name   HA) 4.213 2.219 2.219 weight 1.000 ! spec=13C, no=4495, id=1942, vol=5.568601e+06
assign (segid "   A" and resid   41 and name  HD1) (segid "   A" and resid   41 and name   HA) 4.658 2.712 2.712 weight 1.000 ! spec=13C, no=4496, id=1943, vol=6.665832e+06
    or (segid "   A" and resid   41 and name  HD2) (segid "   A" and resid   41 and name   HA)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   82 and name  HB2) 3.232 1.306 1.306 weight 1.000 ! spec=13C, no=4497, id=1944, vol=2.008100e+07
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HD21) 5.111 3.265 3.265 weight 1.000 ! spec=13C, no=4498, id=1945, vol=7.780089e+06
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name HD22) 4.897 2.997 2.997 weight 1.000 ! spec=13C, no=4503, id=1946, vol=1.012388e+07
assign (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name HD12) 3.368 0.962 0.962 weight 1.000 ! spec=13C, no=4510, id=1947, vol=4.411905e+07
    or (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   40 and name HD23)
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   40 and name HD23)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   45 and name HG22) (segid "   A" and resid   40 and name   HA) 3.881 1.883 1.883 weight 1.000 ! spec=13C, no=4511, id=1948, vol=1.021440e+07
    or (segid "   A" and resid   45 and name HG21) (segid "   A" and resid   40 and name   HA)
    or (segid "   A" and resid   45 and name HG23) (segid "   A" and resid   40 and name   HA)
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name   HA) 3.562 1.586 1.586 weight 1.000 ! spec=13C, no=4512, id=1949, vol=7.685620e+06
assign (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name  HE1) 4.221 1.825 1.825 weight 1.000 ! spec=13C, no=4513, id=1950, vol=1.048332e+07
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name  HE1)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name  HE1)
    or (segid "   A" and resid   46 and name HD12) (segid "   A" and resid   41 and name  HE2) 
    or (segid "   A" and resid   46 and name HD11) (segid "   A" and resid   41 and name  HE2)
    or (segid "   A" and resid   46 and name HD13) (segid "   A" and resid   41 and name  HE2)
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name HD21) 4.019 2.019 2.019 weight 1.000 ! spec=13C, no=4515, id=1951, vol=1.068861e+07
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name  HB1) 2.256 0.636 0.636 weight 1.000 ! spec=13C, no=4519, id=1953, vol=2.852928e+07
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name   HA) 3.597 1.617 1.617 weight 1.000 ! spec=13C, no=4520, id=1954, vol=1.800470e+07
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   52 and name HD12) 2.964 1.098 1.098 weight 1.000 ! spec=13C, no=4523, id=1957, vol=1.175670e+07
    or (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   52 and name HD11)
    or (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   52 and name HD13)
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   52 and name HD12)
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   52 and name HD11)
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   52 and name HD13)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   52 and name HD12)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   52 and name HD11)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   52 and name HD13)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   52 and name   HB) 3.778 1.785 1.785 weight 1.000 ! spec=13C, no=4524, id=1958, vol=5.379725e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   52 and name   HB)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   52 and name   HB)
assign (segid "   A" and resid   49 and name HG21) (segid "   A" and resid   48 and name  HB1) 4.326 2.339 2.339 weight 1.000 ! spec=13C, no=4525, id=1959, vol=7.324187e+06
    or (segid "   A" and resid   49 and name HG22) (segid "   A" and resid   48 and name  HB1)
    or (segid "   A" and resid   49 and name HG23) (segid "   A" and resid   48 and name  HB1)
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HB1) 1.845 0.425 0.425 weight 1.000 ! spec=13C, no=4527, id=1961, vol=1.158919e+08
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   51 and name   HN) 4.590 2.634 2.634 weight 1.000 ! spec=13C, no=4531, id=1963, vol=5.360752e+06
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   52 and name HG11) 4.541 2.577 2.577 weight 1.000 ! spec=13C, no=4536, id=1964, vol=7.585724e+06
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   52 and name HG11) 4.832 2.918 2.918 weight 1.000 ! spec=13C, no=4537, id=1965, vol=4.704961e+06
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   51 and name  HB1) 4.492 2.522 2.522 weight 1.000 ! spec=13C, no=4539, id=1966, vol=8.285746e+06
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   51 and name  HB1)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   51 and name  HB1)
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name  HB1) 2.632 0.866 0.866 weight 1.000 ! spec=13C, no=4544, id=1968, vol=1.479841e+07
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   48 and name  HB1) 3.888 1.270 1.270 weight 1.000 ! spec=13C, no=4547, id=1969, vol=6.223132e+06
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   48 and name  HB2) 5.230 3.419 3.419 weight 1.000 ! spec=13C, no=4548, id=1970, vol=5.707070e+06
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   53 and name  HB1) 4.876 2.971 2.971 weight 1.000 ! spec=13C, no=4557, id=1973, vol=6.767447e+06
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name   HA) 3.388 1.435 1.435 weight 1.000 ! spec=13C, no=4558, id=1974, vol=8.970769e+06
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name  HB1) 2.040 0.520 0.520 weight 1.000 ! spec=13C, no=4559, id=1975, vol=5.314850e+07
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name   HN) 3.525 1.553 1.553 weight 1.000 ! spec=13C, no=4561, id=1977, vol=7.590448e+06
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name   HN) 4.158 2.161 2.161 weight 1.000 ! spec=13C, no=4562, id=1978, vol=5.501999e+06
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name  HG2) 3.158 1.247 1.247 weight 1.000 ! spec=13C, no=4563, id=1979, vol=2.028959e+07
assign (segid "   A" and resid   55 and name  HB1) (segid "   A" and resid   55 and name  HG2) 3.428 1.469 1.469 weight 1.000 ! spec=13C, no=4565, id=1980, vol=1.733888e+07
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name   HA) 3.449 1.487 1.487 weight 1.000 ! spec=13C, no=4567, id=1981, vol=1.562791e+07
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name   HN) 4.745 2.815 2.815 weight 1.000 ! spec=13C, no=4571, id=1983, vol=5.076174e+06
assign (segid "   A" and resid   56 and name   HZ) (segid "   A" and resid   56 and name  HB1) 4.957 3.071 3.071 weight 1.000 ! spec=13C, no=4579, id=1987, vol=4.493853e+06
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD12) 2.751 0.946 0.946 weight 1.000 ! spec=13C, no=4587, id=1991, vol=7.082553e+07
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD13)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD22)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name   HA) 3.580 1.602 1.602 weight 1.000 ! spec=13C, no=4589, id=1992, vol=1.497882e+07
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   56 and name   HA) 5.308 3.522 3.522 weight 1.000 ! spec=13C, no=4590, id=1993, vol=5.383464e+06
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   58 and name   HN) 4.196 2.201 2.201 weight 1.000 ! spec=13C, no=4592, id=1994, vol=9.094202e+06
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name   HN) 2.595 0.841 0.841 weight 1.000 ! spec=13C, no=4593, id=1995, vol=1.743994e+07
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD22) 3.745 1.754 1.754 weight 1.000 ! spec=13C, no=4595, id=1996, vol=3.389467e+07
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   68 and name  HA1) 4.840 2.928 2.928 weight 1.000 ! spec=13C, no=4596, id=1997, vol=9.851490e+06
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   68 and name  HA1)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   68 and name  HA1)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   56 and name   HA) 5.425 3.679 3.679 weight 1.000 ! spec=13C, no=4599, id=1998, vol=8.063207e+06
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   56 and name   HA)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   56 and name   HA)
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   57 and name  HB2) 4.559 2.598 2.598 weight 1.000 ! spec=13C, no=4603, id=1999, vol=7.155224e+06
assign (segid "   A" and resid   59 and name  HD2) (segid "   A" and resid   59 and name  HB1) 4.116 2.118 2.118 weight 1.000 ! spec=13C, no=4607, id=2001, vol=2.220691e+07
assign (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name  HD2) 2.123 0.563 0.563 weight 1.000 ! spec=13C, no=4609, id=2002, vol=1.088172e+08
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   61 and name   HA) 4.695 2.756 2.756 weight 1.000 ! spec=13C, no=4612, id=2004, vol=1.058726e+07
assign (segid "   A" and resid   64 and name HG21) (segid "   A" and resid   63 and name   HA) 3.880 1.882 1.882 weight 1.000 ! spec=13C, no=4615, id=2006, vol=9.250348e+06
    or (segid "   A" and resid   64 and name HG22) (segid "   A" and resid   63 and name   HA)
    or (segid "   A" and resid   64 and name HG23) (segid "   A" and resid   63 and name   HA)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   64 and name HG21) 4.169 2.173 2.173 weight 1.000 ! spec=13C, no=4620, id=2007, vol=6.466609e+06
    or (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   64 and name HG23)
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   64 and name HG23)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name   HA) 2.312 0.668 0.668 weight 1.000 ! spec=13C, no=4621, id=2008, vol=6.264053e+07
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   18 and name   HA)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   24 and name  HB2) 3.967 1.968 1.968 weight 1.000 ! spec=13C, no=4623, id=2009, vol=2.229297e+07
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   24 and name  HB2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   18 and name HG12) 3.112 1.211 1.211 weight 1.000 ! spec=13C, no=4631, id=2013, vol=1.867537e+07
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   18 and name HG13)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG12) 3.291 1.354 1.354 weight 1.000 ! spec=13C, no=4634, id=2015, vol=5.021202e+07
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG13)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HA) 2.446 0.748 0.748 weight 1.000 ! spec=13C, no=4636, id=2016, vol=6.777421e+07
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   20 and name  HG1) 1.845 0.426 0.426 weight 1.000 ! spec=13C, no=4638, id=2018, vol=7.492899e+07
assign (segid "   A" and resid   20 and name  HG2) (segid "   A" and resid   19 and name   HA) 5.115 3.270 3.270 weight 1.000 ! spec=13C, no=4640, id=2020, vol=4.124469e+06
assign (segid "   A" and resid   20 and name  HG1) (segid "   A" and resid   19 and name   HA) 5.950 4.426 4.426 weight 1.000 ! spec=13C, no=4641, id=2021, vol=4.587435e+06
assign (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   20 and name   HA) 4.266 2.275 2.275 weight 1.000 ! spec=13C, no=4649, id=2024, vol=1.715133e+07
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   20 and name   HA)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   20 and name   HA)
assign (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   20 and name   HN) 4.266 2.275 2.275 weight 1.000 ! spec=13C, no=4650, id=2025, vol=9.349152e+06
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   20 and name   HN)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   20 and name   HN)
assign (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   24 and name   HN) 4.123 2.124 2.124 weight 1.000 ! spec=13C, no=4651, id=2026, vol=1.042772e+07
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   24 and name   HN)
assign (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   24 and name  HB2) 2.510 0.787 0.787 weight 1.000 ! spec=13C, no=4652, id=2027, vol=2.862844e+07
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   24 and name  HB2)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   24 and name  HB2)
assign (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   25 and name HG22) 2.355 0.693 0.693 weight 1.000 ! spec=13C, no=4666, id=2033, vol=1.828034e+07
    or (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   25 and name HG21)
    or (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   25 and name HG23)
assign (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   25 and name   HA) 3.386 1.433 1.433 weight 1.000 ! spec=13C, no=4669, id=2035, vol=8.617408e+06
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   25 and name HD12) 1.661 0.345 0.345 weight 1.000 ! spec=13C, no=4670, id=2036, vol=1.024236e+08
    or (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HD12) 2.217 0.614 0.614 weight 1.000 ! spec=13C, no=4671, id=2037, vol=3.430988e+07
    or (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   25 and name   HN) 3.763 1.770 1.770 weight 1.000 ! spec=13C, no=4672, id=2038, vol=1.514516e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   25 and name   HN)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   25 and name   HN)
assign (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   25 and name HD12) 1.895 0.449 0.449 weight 1.000 ! spec=13C, no=4675, id=2039, vol=5.689009e+07
    or (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   25 and name HD12) 2.042 0.521 0.521 weight 1.000 ! spec=13C, no=4676, id=2040, vol=3.927959e+07
    or (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   27 and name  HD1) 4.423 2.446 2.446 weight 1.000 ! spec=13C, no=4679, id=2041, vol=6.627774e+06
    or (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name  HB1) 2.512 0.789 0.789 weight 1.000 ! spec=13C, no=4682, id=2043, vol=1.785882e+07
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   69 and name   HN) 4.081 2.082 2.082 weight 1.000 ! spec=13C, no=4695, id=2047, vol=8.849878e+06
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   69 and name  HB2) 5.257 3.455 3.455 weight 1.000 ! spec=13C, no=4699, id=2048, vol=2.522976e+06
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name  HB1) 3.658 1.672 1.672 weight 1.000 ! spec=13C, no=4701, id=2049, vol=7.911092e+06
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   25 and name   HB) 3.242 1.314 1.314 weight 1.000 ! spec=13C, no=4706, id=2051, vol=1.255225e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   25 and name   HB)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   25 and name   HB)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   23 and name  HB1) 2.922 1.067 1.067 weight 1.000 ! spec=13C, no=4710, id=2052, vol=1.537805e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   23 and name  HB2) 3.027 1.145 1.145 weight 1.000 ! spec=13C, no=4711, id=2053, vol=1.246622e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   23 and name  HB2)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   72 and name   HA) 3.635 1.652 1.652 weight 1.000 ! spec=13C, no=4712, id=2054, vol=1.371984e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   72 and name   HA)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   72 and name   HA)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name   HN) 4.476 2.505 2.505 weight 1.000 ! spec=13C, no=4715, id=2055, vol=5.031174e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name   HN)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name   HN)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name   HA) 3.583 1.605 1.605 weight 1.000 ! spec=13C, no=4716, id=2056, vol=8.455944e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name   HA)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name   HA)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   23 and name  HB1) 4.373 2.390 2.390 weight 1.000 ! spec=13C, no=4717, id=2057, vol=6.355592e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name HD12) 2.065 0.533 0.533 weight 1.000 ! spec=13C, no=4719, id=2058, vol=2.393065e+07
    or (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name HD11)
    or (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name HD13)
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name HD12)
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name HD11)
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name HD13)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name HD12)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name HD11)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name HD13)
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name  HB2) 1.697 0.360 0.360 weight 1.000 ! spec=13C, no=4723, id=2061, vol=1.057289e+08
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name   HA) 3.845 1.848 1.848 weight 1.000 ! spec=13C, no=4730, id=2062, vol=6.786532e+06
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   79 and name   HA) 3.498 1.529 1.529 weight 1.000 ! spec=13C, no=4731, id=2063, vol=5.706488e+06
assign (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   80 and name   HA) 4.747 2.817 2.817 weight 1.000 ! spec=13C, no=4735, id=2064, vol=8.348207e+06
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   81 and name  HA1) 4.646 2.699 2.699 weight 1.000 ! spec=13C, no=4737, id=2065, vol=5.844665e+06
assign (segid "   A" and resid   82 and name  HB2) (segid "   A" and resid   82 and name   HA) 3.122 1.218 1.218 weight 1.000 ! spec=13C, no=4738, id=2066, vol=2.797845e+07
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   82 and name  HB2) 3.880 1.882 1.882 weight 1.000 ! spec=13C, no=4749, id=2068, vol=9.550106e+06
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HD1) 4.133 2.135 2.135 weight 1.000 ! spec=13C, no=4750, id=2069, vol=9.302794e+06
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   83 and name  HD1) 3.920 1.921 1.921 weight 1.000 ! spec=13C, no=4754, id=2072, vol=9.275166e+06
    or (segid "   A" and resid   83 and name  HB1) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   85 and name HD22) 2.234 0.624 0.624 weight 1.000 ! spec=13C, no=4758, id=2074, vol=2.639994e+07
    or (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   85 and name   HA) 4.197 2.202 2.202 weight 1.000 ! spec=13C, no=4760, id=2076, vol=6.630715e+06
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   85 and name   HA)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   85 and name   HA)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   86 and name  HB2) 2.050 0.525 0.525 weight 1.000 ! spec=13C, no=4761, id=2077, vol=5.377697e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   86 and name  HB2)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   86 and name  HB2)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   84 and name HG21) 1.841 0.259 0.459 weight 1.000 ! spec=13C, no=4762, id=2078, vol=1.187580e+08
    or (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   84 and name HG23)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   38 and name  HB1) 2.668 0.890 0.890 weight 1.000 ! spec=13C, no=4763, id=2079, vol=5.230380e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   38 and name  HB1)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   38 and name  HB1)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   93 and name  HG1) 4.286 2.297 2.297 weight 1.000 ! spec=13C, no=4764, id=2080, vol=1.308887e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   93 and name  HG1)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   93 and name  HG1)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   93 and name  HG2) 4.366 2.382 2.382 weight 1.000 ! spec=13C, no=4765, id=2081, vol=1.041877e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   93 and name  HG2)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   93 and name  HG2)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   85 and name   HN) 3.624 1.642 1.642 weight 1.000 ! spec=13C, no=4768, id=2082, vol=1.124081e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   85 and name   HN)
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   86 and name   HA) 4.021 2.021 2.021 weight 1.000 ! spec=13C, no=4775, id=2083, vol=9.608969e+06
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   37 and name   HG) 3.335 1.390 1.390 weight 1.000 ! spec=13C, no=4776, id=2084, vol=1.541586e+07
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   86 and name  HB1) 3.581 1.603 1.603 weight 1.000 ! spec=13C, no=4778, id=2085, vol=1.013483e+07
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   93 and name  HB2) 3.235 1.308 1.308 weight 1.000 ! spec=13C, no=4798, id=2090, vol=1.572023e+07
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HB2) 2.011 0.506 0.506 weight 1.000 ! spec=13C, no=4799, id=2091, vol=4.407945e+07
    or (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   90 and name  HG2) (segid "   A" and resid   90 and name   HA) 4.544 2.581 2.581 weight 1.000 ! spec=13C, no=4824, id=2092, vol=6.038925e+06
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   92 and name   HN) 3.941 1.941 1.941 weight 1.000 ! spec=13C, no=4830, id=2095, vol=1.207330e+07
assign (segid "   A" and resid   92 and name  HA1) (segid "   A" and resid   92 and name  HA2) 2.089 0.546 0.546 weight 1.000 ! spec=13C, no=4835, id=2098, vol=6.632518e+07
assign (segid "   A" and resid   92 and name  HA1) (segid "   A" and resid   91 and name   HN) 5.262 3.461 3.461 weight 1.000 ! spec=13C, no=4838, id=2100, vol=5.979042e+06
assign (segid "   A" and resid   92 and name  HA2) (segid "   A" and resid   91 and name   HN) 4.515 2.548 2.548 weight 1.000 ! spec=13C, no=4842, id=2101, vol=1.255568e+07
assign (segid "   A" and resid   92 and name  HA1) (segid "   A" and resid   93 and name   HA) 4.524 2.558 2.558 weight 1.000 ! spec=13C, no=4844, id=2102, vol=7.892679e+06
assign (segid "   A" and resid   93 and name  HB1) (segid "   A" and resid   93 and name   HA) 3.145 1.237 1.237 weight 1.000 ! spec=13C, no=4847, id=2105, vol=3.158296e+07
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   87 and name   HN) 2.789 0.972 0.972 weight 1.000 ! spec=13C, no=4854, id=2107, vol=1.862774e+07
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   86 and name  HB2) 4.462 2.488 2.488 weight 1.000 ! spec=13C, no=4855, id=2108, vol=1.062655e+07
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   95 and name  HB1) 1.953 0.477 0.477 weight 1.000 ! spec=13C, no=4858, id=2109, vol=5.203841e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   95 and name  HB1)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   95 and name  HB1)
assign (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   96 and name   HN) 4.115 2.117 2.117 weight 1.000 ! spec=13C, no=4862, id=2112, vol=1.816968e+07
assign (segid "   A" and resid   97 and name  HB1) (segid "   A" and resid   96 and name   HA) 5.816 4.228 4.228 weight 1.000 ! spec=13C, no=4870, id=2114, vol=5.272572e+06
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   25 and name HD12) 2.109 0.556 0.556 weight 1.000 ! spec=13C, no=4874, id=2115, vol=1.866460e+07
    or (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   45 and name   HB) (segid "   A" and resid   44 and name   HA) 4.654 2.707 2.707 weight 1.000 ! spec=13C, no=4879, id=2117, vol=1.126036e+07
assign (segid "   A" and resid   45 and name   HB) (segid "   A" and resid   45 and name   HN) 2.400 0.720 0.720 weight 1.000 ! spec=13C, no=4881, id=2118, vol=4.648419e+07
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid  100 and name   HN) 3.749 1.757 1.757 weight 1.000 ! spec=13C, no=4882, id=2119, vol=1.713674e+07
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   98 and name   HA) 4.253 2.261 2.261 weight 1.000 ! spec=13C, no=4890, id=2120, vol=1.774903e+07
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   99 and name   HA) 2.572 0.827 0.827 weight 1.000 ! spec=13C, no=4892, id=2121, vol=3.086989e+07
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   99 and name   HN) 2.784 0.969 0.969 weight 1.000 ! spec=13C, no=4893, id=2122, vol=4.626356e+07
assign (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   99 and name  HB1) 1.512 0.286 0.286 weight 1.000 ! spec=13C, no=4894, id=2123, vol=2.452111e+08
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   99 and name  HG2) 2.259 0.432 0.432 weight 1.000 ! spec=13C, no=4897, id=2124, vol=1.157671e+08
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   99 and name  HG2)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   99 and name  HG2)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   99 and name   HA) 3.127 1.222 1.222 weight 1.000 ! spec=13C, no=4899, id=2125, vol=2.914271e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   99 and name   HA)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   99 and name   HA)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   82 and name HD21) 4.074 2.075 2.075 weight 1.000 ! spec=13C, no=4900, id=2126, vol=1.436127e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   82 and name HD21)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   82 and name HD21)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   82 and name HD22) 3.198 1.278 1.278 weight 1.000 ! spec=13C, no=4901, id=2127, vol=1.809670e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   82 and name HD22)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   82 and name HD22)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   99 and name   HN) 4.199 2.204 2.204 weight 1.000 ! spec=13C, no=4902, id=2128, vol=1.783421e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   99 and name   HN)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   99 and name   HN)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   81 and name   HN) 3.507 1.537 1.537 weight 1.000 ! spec=13C, no=4908, id=2129, vol=1.302769e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   81 and name   HN)
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid   99 and name   HN) 4.217 2.223 2.223 weight 1.000 ! spec=13C, no=4910, id=2130, vol=4.564098e+06
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid   99 and name   HN)
    or (segid "   A" and resid  100 and name  HB3) (segid "   A" and resid   99 and name   HN)
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid   99 and name  HB2) 4.407 2.427 2.427 weight 1.000 ! spec=13C, no=4913, id=2131, vol=7.500362e+06
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid   99 and name  HB2)
    or (segid "   A" and resid  100 and name  HB3) (segid "   A" and resid   99 and name  HB2)
assign (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid  102 and name   HN) 4.145 2.148 2.148 weight 1.000 ! spec=13C, no=4923, id=2132, vol=5.205643e+06
assign (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name   HA) 2.598 0.844 0.844 weight 1.000 ! spec=13C, no=4927, id=2133, vol=4.304492e+07
assign (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name  HB1) 1.738 0.377 0.377 weight 1.000 ! spec=13C, no=4931, id=2136, vol=2.108085e+08
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   61 and name   HN) 2.288 0.654 0.654 weight 1.000 ! spec=13C, no=4932, id=2137, vol=7.272324e+07
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  107 and name   HN) 2.174 0.591 0.591 weight 1.000 ! spec=13C, no=4940, id=2139, vol=1.154485e+08
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name   HN) 3.713 1.723 1.723 weight 1.000 ! spec=13C, no=4958, id=2140, vol=8.591997e+06
assign (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  107 and name  HB1) 3.597 1.618 1.618 weight 1.000 ! spec=13C, no=4964, id=2143, vol=2.174428e+07
assign (segid "   A" and resid  106 and name  HB1) (segid "   A" and resid  107 and name  HB1) 3.133 1.227 1.227 weight 1.000 ! spec=13C, no=4966, id=2144, vol=2.002408e+07
assign (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name  HB1) 1.563 0.306 0.306 weight 1.000 ! spec=13C, no=4968, id=2145, vol=2.626102e+08
assign (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name  HG1) 2.777 0.964 0.964 weight 1.000 ! spec=13C, no=4969, id=2146, vol=5.177603e+07
assign (segid "   A" and resid  106 and name  HB1) (segid "   A" and resid  106 and name  HG1) 2.305 0.664 0.664 weight 1.000 ! spec=13C, no=4970, id=2147, vol=8.210359e+07
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  107 and name  HB1) 3.988 1.988 1.988 weight 1.000 ! spec=13C, no=4972, id=2148, vol=2.471239e+07
assign (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name   HA) 2.139 0.572 0.572 weight 1.000 ! spec=13C, no=4973, id=2149, vol=1.174317e+08
assign (segid "   A" and resid  106 and name  HB1) (segid "   A" and resid  106 and name   HA) 2.721 0.925 0.925 weight 1.000 ! spec=13C, no=4974, id=2150, vol=7.683938e+07
assign (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  106 and name  HB2) 4.450 2.476 2.476 weight 1.000 ! spec=13C, no=4976, id=2151, vol=1.594337e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  106 and name  HB2) 4.105 2.107 2.107 weight 1.000 ! spec=13C, no=4977, id=2152, vol=1.738701e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  106 and name  HB1) 3.254 1.324 1.324 weight 1.000 ! spec=13C, no=4978, id=2153, vol=2.075699e+07
assign (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  106 and name  HB1) 4.103 2.104 2.104 weight 1.000 ! spec=13C, no=4979, id=2154, vol=2.242744e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  106 and name  HG2) 3.106 1.206 1.206 weight 1.000 ! spec=13C, no=4980, id=2155, vol=4.619599e+07
assign (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  106 and name  HG2) 2.359 0.696 0.696 weight 1.000 ! spec=13C, no=4981, id=2156, vol=5.070164e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  106 and name   HA) 4.031 2.032 2.032 weight 1.000 ! spec=13C, no=4984, id=2157, vol=1.192885e+07
assign (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  106 and name   HA) 3.958 1.958 1.958 weight 1.000 ! spec=13C, no=4985, id=2158, vol=1.157146e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  105 and name   HA) 2.463 0.758 0.758 weight 1.000 ! spec=13C, no=4986, id=2159, vol=7.482714e+07
assign (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  105 and name   HA) 1.940 0.471 0.471 weight 1.000 ! spec=13C, no=4987, id=2160, vol=8.734105e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  107 and name   HN) 4.914 3.018 3.018 weight 1.000 ! spec=13C, no=4988, id=2161, vol=1.008274e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  105 and name  HB2) 4.842 2.931 2.931 weight 1.000 ! spec=13C, no=4992, id=2163, vol=1.626017e+07
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  105 and name  HB1) 4.363 2.379 2.379 weight 1.000 ! spec=13C, no=4993, id=2164, vol=1.386246e+07
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    7 and name  HB2) 4.131 2.134 2.134 weight 1.000 ! spec=13C, no=4995, id=2166, vol=1.387029e+07
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    7 and name  HB2)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    7 and name  HB2)
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    7 and name   HN) 2.887 1.042 1.042 weight 1.000 ! spec=13C, no=4998, id=2167, vol=3.108251e+07
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    7 and name   HN)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    7 and name   HN)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   24 and name  HB1) 5.221 3.407 3.407 weight 1.000 ! spec=13C, no=5013, id=2169, vol=1.343985e+06
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   19 and name   HA) 4.018 2.018 2.018 weight 1.000 ! spec=13C, no=5015, id=2170, vol=8.204245e+06
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   19 and name   HA)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   19 and name   HA)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   24 and name  HB1) 2.524 0.796 0.796 weight 1.000 ! spec=13C, no=5017, id=2171, vol=1.033922e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   65 and name HG22) 2.631 0.865 0.865 weight 1.000 ! spec=13C, no=5020, id=2172, vol=3.524972e+07
    or (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   64 and name   HA) 4.745 2.814 2.814 weight 1.000 ! spec=13C, no=5025, id=2173, vol=6.118042e+06
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   64 and name   HA)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   64 and name   HA)
assign (segid "   A" and resid   26 and name  HG1) (segid "   A" and resid   26 and name  HG2) 1.957 0.479 0.479 weight 1.000 ! spec=13C, no=5035, id=2175, vol=3.922169e+07
assign (segid "   A" and resid   26 and name  HD2) (segid "   A" and resid   26 and name  HD1) 2.289 0.655 0.655 weight 1.000 ! spec=13C, no=5037, id=2176, vol=1.608033e+07
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name   HA) 4.360 2.376 2.376 weight 1.000 ! spec=13C, no=5051, id=2181, vol=5.317940e+06
assign (segid "   A" and resid   78 and name HG12) (segid "   A" and resid   77 and name  HE1) 5.444 3.704 3.704 weight 1.000 ! spec=13C, no=5066, id=2182, vol=1.418826e+06
    or (segid "   A" and resid   78 and name HG11) (segid "   A" and resid   77 and name  HE1)
    or (segid "   A" and resid   78 and name HG13) (segid "   A" and resid   77 and name  HE1)
    or (segid "   A" and resid   77 and name  HE1) (segid "   A" and resid   78 and name HG22)
    or (segid "   A" and resid   77 and name  HE1) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   77 and name  HE1) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   67 and name  HE1) (segid "   A" and resid   67 and name  HB1) 5.785 4.183 4.183 weight 1.000 ! spec=13C, no=5086, id=2184, vol=3.230533e+06
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   79 and name  HB2) 5.137 3.299 3.299 weight 1.000 ! spec=13C, no=5108, id=2185, vol=7.766863e+06
assign (segid "   A" and resid   83 and name  HE1) (segid "   A" and resid   83 and name  HB1) 4.666 2.721 2.721 weight 1.000 ! spec=13C, no=5113, id=2187, vol=6.866758e+06
    or (segid "   A" and resid   83 and name  HE2) (segid "   A" and resid   83 and name  HB1)
assign (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG12) 3.043 1.157 1.157 weight 1.000 ! spec=13C, no=5131, id=2189, vol=8.507617e+06
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG13)
    or (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    8 and name  HD1)
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    8 and name  HD1)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    8 and name  HD1)
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   52 and name   HA) 5.226 3.414 3.414 weight 1.000 ! spec=13C, no=5134, id=2190, vol=6.984781e+06
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   52 and name   HA)
assign (segid "   A" and resid   41 and name  HE1) (segid "   A" and resid   41 and name  HB1) 4.703 2.764 2.764 weight 1.000 ! spec=13C, no=5142, id=2193, vol=7.022942e+06
    or (segid "   A" and resid   41 and name  HE2) (segid "   A" and resid   41 and name  HB1)
assign (segid "   A" and resid   56 and name  HD1) (segid "   A" and resid   55 and name   HA) 5.377 3.614 3.614 weight 1.000 ! spec=13C, no=5158, id=2196, vol=8.012364e+06
    or (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   55 and name   HA)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   41 and name  HB2) 2.990 1.117 1.117 weight 1.000 ! spec=13C, no=5166, id=2198, vol=1.516729e+07
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   41 and name  HB2)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   25 and name   HB) 4.419 2.441 2.441 weight 1.000 ! spec=13C, no=5169, id=2199, vol=1.110188e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   25 and name   HB)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   25 and name   HB)
assign (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   70 and name   HG) 2.801 0.981 0.981 weight 1.000 ! spec=13C, no=5170, id=2200, vol=8.018611e+06
assign (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   25 and name   HB) 2.666 0.888 0.888 weight 1.000 ! spec=13C, no=5172, id=2201, vol=5.693132e+06
assign (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   85 and name   HG) 3.105 1.205 1.205 weight 1.000 ! spec=13C, no=5183, id=2203, vol=1.058733e+07
assign (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   86 and name HD12) 4.245 2.253 2.253 weight 1.000 ! spec=13C, no=5185, id=2204, vol=7.756972e+06
    or (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   86 and name HD11)
    or (segid "   A" and resid   85 and name  HB1) (segid "   A" and resid   86 and name HD13)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   84 and name   HA) 2.768 0.958 0.958 weight 1.000 ! spec=13C, no=5189, id=2205, vol=2.428826e+07
assign (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG21) 2.085 0.543 0.543 weight 1.000 ! spec=13C, no=5191, id=2206, vol=4.058096e+07
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid  100 and name   HN) 3.648 1.663 1.663 weight 1.000 ! spec=13C, no=5194, id=2207, vol=1.879161e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid  100 and name   HN)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   81 and name  HA2) 2.346 0.688 0.688 weight 1.000 ! spec=13C, no=5195, id=2208, vol=3.346235e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   81 and name  HA2)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   81 and name  HA2)
assign (segid "   A" and resid  103 and name  HG2) (segid "   A" and resid  104 and name   HN) 4.999 3.124 3.124 weight 1.000 ! spec=13C, no=5197, id=2209, vol=1.051734e+07
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   46 and name  HB1) 4.417 2.439 2.439 weight 1.000 ! spec=13C, no=5211, id=2210, vol=6.280948e+06
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name   HA) 3.412 1.455 1.455 weight 1.000 ! spec=13C, no=5212, id=2211, vol=7.232662e+06
assign (segid "   A" and resid   39 and name  HB1) (segid "   A" and resid   39 and name  HD1) 4.728 2.794 2.794 weight 1.000 ! spec=13C, no=5214, id=2213, vol=7.560743e+06
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HE1) 5.238 3.430 3.430 weight 1.000 ! spec=13C, no=5215, id=2214, vol=6.913394e+06
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name   HN) 3.856 1.858 1.858 weight 1.000 ! spec=13C, no=5217, id=2215, vol=5.039994e+06
assign (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   77 and name   HA) 4.578 2.619 2.619 weight 1.000 ! spec=13C, no=5228, id=2216, vol=7.969001e+06
assign (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   78 and name   HA) 3.588 1.610 1.610 weight 1.000 ! spec=13C, no=5234, id=2219, vol=1.092470e+07
assign (segid "   A" and resid   74 and name  HG2) (segid "   A" and resid   74 and name HE22) 3.685 2.744 2.744 weight 1.000 ! spec=13C, no=5263, id=2224, vol=1.252077e+07
assign (segid "   A" and resid   74 and name  HG2) (segid "   A" and resid   74 and name HE21) 3.342 2.357 2.357 weight 1.000 ! spec=13C, no=5266, id=2226, vol=7.339424e+06
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name HE22) 3.693 2.753 2.753 weight 1.000 ! spec=13C, no=5269, id=2228, vol=8.998483e+06
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name HE21) 3.639 1.656 1.656 weight 1.000 ! spec=13C, no=5271, id=2229, vol=5.816345e+06
assign (segid "   A" and resid   74 and name  HG1) (segid "   A" and resid   74 and name   HA) 3.627 1.645 1.645 weight 1.000 ! spec=13C, no=5273, id=2230, vol=1.590340e+07
assign (segid "   A" and resid  106 and name  HG1) (segid "   A" and resid  106 and name   HA) 4.491 2.521 2.521 weight 1.000 ! spec=13C, no=5414, id=2235, vol=1.580659e+07
assign (segid "   A" and resid   63 and name  HG1) (segid "   A" and resid   63 and name  HB2) 2.186 0.597 0.597 weight 1.000 ! spec=13C, no=5446, id=2236, vol=1.070309e+08
assign (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   64 and name HG21) 5.112 3.266 3.266 weight 1.000 ! spec=13C, no=5447, id=2237, vol=5.982532e+06
    or (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   63 and name  HG2) (segid "   A" and resid   64 and name HG23)
!assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   39 and name   HA) 5.196 3.374 3.374 weight 1.000 ! spec=13C, no=5449, id=2238, vol=7.387027e+06
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   45 and name HG12) 5.036 3.170 3.170 weight 1.000 ! spec=13C, no=5452, id=2239, vol=7.544815e+06
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   45 and name HG11)
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   45 and name HG13)
!assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   45 and name HG12) 4.419 2.441 2.441 weight 1.000 ! spec=13C, no=5454, id=2240, vol=6.922192e+06
!    or (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   45 and name HG11)
!    or (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   45 and name HG13)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   75 and name   HA) 3.602 1.622 1.622 weight 1.000 ! spec=13C, no=5465, id=2241, vol=1.085982e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   75 and name   HA)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   75 and name   HA)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name  HB1) 2.217 0.615 0.615 weight 1.000 ! spec=13C, no=5468, id=2242, vol=3.199655e+07
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name  HB1)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name  HB1)
assign (segid "   A" and resid   86 and name HD22) (segid "   A" and resid   95 and name   HA) 3.591 1.612 1.612 weight 1.000 ! spec=13C, no=5475, id=2243, vol=1.007283e+07
    or (segid "   A" and resid   86 and name HD21) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   86 and name HD23) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   85 and name  HB2) (segid "   A" and resid   85 and name   HG) 2.397 0.718 0.718 weight 1.000 ! spec=13C, no=5480, id=2245, vol=1.470114e+07
assign (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   64 and name HG21) 2.582 0.834 0.834 weight 1.000 ! spec=13C, no=5486, id=2246, vol=3.332013e+07
    or (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   64 and name HG22)
    or (segid "   A" and resid   32 and name  HG2) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   37 and name   HA) 2.546 0.810 0.810 weight 1.000 ! spec=13C, no=5487, id=2247, vol=2.427439e+07
assign (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  107 and name   HN) 4.529 2.563 2.563 weight 1.000 ! spec=13C, no=5488, id=2248, vol=1.134698e+07
assign (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   70 and name   HG) 4.520 2.554 2.554 weight 1.000 ! spec=13C, no=5494, id=2251, vol=1.090561e+07
assign (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   70 and name   HG) 3.949 1.950 1.950 weight 1.000 ! spec=13C, no=5495, id=2252, vol=7.117583e+06
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   35 and name  HG2) 3.263 0.640 0.640 weight 1.000 ! spec=13C, no=5508, id=2253, vol=2.921864e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   35 and name  HG2)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   35 and name  HG2)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   46 and name   HG) 3.104 1.205 1.205 weight 1.000 ! spec=13C, no=5510, id=2254, vol=1.991421e+07
assign (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   14 and name HD22) 3.506 1.537 1.537 weight 1.000 ! spec=13C, no=5517, id=2255, vol=1.284219e+07
    or (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   98 and name   HB) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   39 and name  HH2) 2.883 1.039 1.039 weight 1.000 ! spec=13C, no=5518, id=2256, vol=2.944090e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   39 and name  HH2) 2.058 0.529 0.529 weight 1.000 ! spec=13C, no=5519, id=2257, vol=4.476008e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   13 and name  HG1) (segid "   A" and resid   28 and name  HB2) 4.689 2.749 2.749 weight 1.000 ! spec=13C, no=5524, id=2258, vol=1.032983e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   88 and name  HB2) 4.166 2.170 2.170 weight 1.000 ! spec=13C, no=5525, id=2259, vol=1.276655e+07
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   17 and name  HB2) 3.586 1.115 1.115 weight 1.000 ! spec=13C, no=5529, id=2260, vol=3.602020e+07
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   17 and name  HB1)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   17 and name  HB3)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   17 and name  HB1)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   17 and name  HB3)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   17 and name  HB1)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   17 and name  HB3)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   70 and name  HB2) 3.265 1.333 1.333 weight 1.000 ! spec=13C, no=5538, id=2262, vol=2.227022e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   70 and name  HB2)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   70 and name  HB2)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   70 and name   HG) 3.390 0.775 0.775 weight 1.000 ! spec=13C, no=5539, id=2263, vol=4.161739e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   70 and name   HG)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   70 and name   HG)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid  100 and name  HB1) 2.890 0.775 0.775 weight 1.000 ! spec=13C, no=5540, id=2264, vol=4.161739e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   25 and name HD12) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   25 and name HD12) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   30 and name  HB2) 4.471 2.499 2.499 weight 1.000 ! spec=13C, no=5546, id=2265, vol=7.078854e+06
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   28 and name  HB1) 3.274 1.340 1.340 weight 1.000 ! spec=13C, no=5551, id=2267, vol=9.885797e+06
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   28 and name  HB1)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   28 and name  HB1)
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   57 and name HD12) 2.865 1.026 1.026 weight 1.000 ! spec=13C, no=5554, id=2268, vol=1.394728e+07
    or (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name  HB2) 4.285 2.296 2.296 weight 1.000 ! spec=13C, no=5558, id=2269, vol=1.002306e+07
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid   55 and name  HB2) 3.385 1.432 1.432 weight 1.000 ! spec=13C, no=5562, id=2272, vol=1.931337e+07
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   35 and name  HG1) 4.101 2.102 2.102 weight 1.000 ! spec=13C, no=5568, id=2274, vol=9.719773e+06
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   35 and name  HG1) 5.206 3.388 3.388 weight 1.000 ! spec=13C, no=5569, id=2275, vol=6.553097e+06
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name  HB2) 2.534 0.803 0.803 weight 1.000 ! spec=13C, no=5576, id=2276, vol=1.131612e+07
assign (segid "   A" and resid   25 and name   HB) (segid "   A" and resid   25 and name HG11) 2.854 1.018 1.018 weight 1.000 ! spec=13C, no=5588, id=2280, vol=7.105917e+06
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   69 and name  HB1) 4.893 2.992 2.992 weight 1.000 ! spec=13C, no=5590, id=2281, vol=8.493501e+06
assign (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   69 and name  HB1) 4.264 2.272 2.272 weight 1.000 ! spec=13C, no=5591, id=2282, vol=6.400757e+06
assign (segid "   A" and resid   26 and name  HD2) (segid "   A" and resid   26 and name  HB2) 4.239 2.246 2.246 weight 1.000 ! spec=13C, no=5601, id=2284, vol=1.343505e+07
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   65 and name   HA) 2.631 0.865 0.865 weight 1.000 ! spec=13C, no=5618, id=2286, vol=2.302607e+07
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   65 and name HG22) 4.609 2.655 2.655 weight 1.000 ! spec=13C, no=5619, id=2287, vol=6.597074e+06
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   29 and name HG22) 3.526 1.554 1.554 weight 1.000 ! spec=13C, no=5620, id=2288, vol=7.048679e+06
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   29 and name HG23)
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   57 and name   HG) 3.086 1.190 1.190 weight 1.000 ! spec=13C, no=5627, id=2289, vol=6.989582e+06
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   68 and name  HA1) 2.131 0.568 0.568 weight 1.000 ! spec=13C, no=5632, id=2291, vol=3.855197e+07
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   36 and name   HA) 5.050 3.187 3.187 weight 1.000 ! spec=13C, no=5640, id=2293, vol=8.383473e+06
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   36 and name   HA) 6.024 4.536 4.536 weight 1.000 ! spec=13C, no=5641, id=2294, vol=7.256336e+06
assign (segid "   A" and resid   37 and name   HG) (segid "   A" and resid   37 and name  HB1) 2.777 0.964 0.964 weight 1.000 ! spec=13C, no=5643, id=2295, vol=3.381473e+07
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   38 and name   HN) 4.345 2.360 2.360 weight 1.000 ! spec=13C, no=5645, id=2296, vol=1.027021e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   38 and name   HN)
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name HD12) 2.062 0.532 0.532 weight 1.000 ! spec=13C, no=5646, id=2297, vol=7.504795e+07
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name HD22) 4.121 2.123 2.123 weight 1.000 ! spec=13C, no=5648, id=2298, vol=9.544362e+06
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   38 and name   HE) 4.176 2.180 2.180 weight 1.000 ! spec=13C, no=5649, id=2299, vol=5.283207e+06
assign (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   38 and name   HN) 4.645 2.697 2.697 weight 1.000 ! spec=13C, no=5650, id=2300, vol=4.895587e+06
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name   HA) 3.619 1.637 1.637 weight 1.000 ! spec=13C, no=5653, id=2302, vol=6.384629e+06
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name   HA) 3.147 1.238 1.238 weight 1.000 ! spec=13C, no=5654, id=2303, vol=7.137970e+06
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   84 and name   HB) 3.960 1.960 1.960 weight 1.000 ! spec=13C, no=5656, id=2304, vol=1.835170e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   84 and name   HB)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   84 and name   HB)
assign (segid "   A" and resid   82 and name  HB2) (segid "   A" and resid   81 and name  HA2) 4.981 3.101 3.101 weight 1.000 ! spec=13C, no=5665, id=2305, vol=1.297296e+07
assign (segid "   A" and resid   81 and name  HA1) (segid "   A" and resid   82 and name  HB2) 4.405 2.426 2.426 weight 1.000 ! spec=13C, no=5667, id=2306, vol=2.326346e+07
assign (segid "   A" and resid   82 and name  HB1) (segid "   A" and resid   42 and name   HA) 4.350 2.366 2.366 weight 1.000 ! spec=13C, no=5672, id=2307, vol=1.333999e+07
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   32 and name  HG1) 2.665 0.888 0.888 weight 1.000 ! spec=13C, no=5679, id=2309, vol=2.695553e+07
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid   32 and name  HB2) 1.713 0.367 0.367 weight 1.000 ! spec=13C, no=5681, id=2310, vol=5.094404e+07
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   47 and name  HB2) 1.840 0.423 0.423 weight 1.000 ! spec=13C, no=5690, id=2312, vol=1.255678e+08
assign (segid "   A" and resid   47 and name  HB2) (segid "   A" and resid   46 and name   HA) 4.802 2.882 2.882 weight 1.000 ! spec=13C, no=5692, id=2313, vol=8.994972e+06
assign (segid "   A" and resid   47 and name  HB1) (segid "   A" and resid   46 and name   HA) 5.144 3.308 3.308 weight 1.000 ! spec=13C, no=5693, id=2314, vol=6.981028e+06
assign (segid "   A" and resid   52 and name   HB) (segid "   A" and resid   72 and name HD22) 3.924 1.925 1.925 weight 1.000 ! spec=13C, no=5695, id=2315, vol=7.614999e+06
    or (segid "   A" and resid   52 and name   HB) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name   HB) (segid "   A" and resid   72 and name HD23)
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name   HG) 2.705 0.915 0.915 weight 1.000 ! spec=13C, no=5696, id=2316, vol=1.723092e+07
assign (segid "   A" and resid   46 and name   HG) (segid "   A" and resid   48 and name  HG1) 3.367 1.417 1.417 weight 1.000 ! spec=13C, no=5697, id=2317, vol=1.151969e+07
assign (segid "   A" and resid   46 and name   HG) (segid "   A" and resid   39 and name  HB1) 3.927 1.928 1.928 weight 1.000 ! spec=13C, no=5698, id=2318, vol=9.873758e+06
assign (segid "   A" and resid   46 and name   HG) (segid "   A" and resid   46 and name   HA) 2.984 1.113 1.113 weight 1.000 ! spec=13C, no=5699, id=2319, vol=1.345762e+07
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name   HA) 3.285 1.349 1.349 weight 1.000 ! spec=13C, no=5706, id=2321, vol=1.230680e+07
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name   HA)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name   HA)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   53 and name   HA) 3.334 1.390 1.390 weight 1.000 ! spec=13C, no=5707, id=2322, vol=9.200444e+06
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   53 and name   HA)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   53 and name   HA)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   14 and name   HA) 3.916 1.917 1.917 weight 1.000 ! spec=13C, no=5718, id=2324, vol=7.890378e+06
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   96 and name  HB3) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   25 and name HG11) 3.202 1.281 1.281 weight 1.000 ! spec=13C, no=5736, id=2325, vol=1.531519e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   25 and name HG11)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   25 and name HG11)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   25 and name HG12) 3.791 1.797 1.797 weight 1.000 ! spec=13C, no=5737, id=2326, vol=9.868651e+06
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   25 and name HG12)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   25 and name HG12)
assign (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   99 and name  HB2) 4.428 2.451 2.451 weight 1.000 ! spec=13C, no=5743, id=2327, vol=1.849666e+07
assign (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid   42 and name HD22) 4.008 2.008 2.008 weight 1.000 ! spec=13C, no=5744, id=2328, vol=1.009425e+07
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   80 and name HD22) 3.516 1.546 1.546 weight 1.000 ! spec=13C, no=5745, id=2329, vol=9.357883e+06
assign (segid "   A" and resid   77 and name  HB2) (segid "   A" and resid   80 and name HD22) 4.276 2.285 2.285 weight 1.000 ! spec=13C, no=5746, id=2330, vol=1.094729e+07
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   77 and name  HD2) 4.390 2.409 2.409 weight 1.000 ! spec=13C, no=5749, id=2332, vol=7.029553e+06
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   77 and name  HD2)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   77 and name  HD2)
assign (segid "   A" and resid   78 and name HG12) (segid "   A" and resid   77 and name  HD2) 5.010 1.288 1.288 weight 1.000 ! spec=13C, no=5754, id=2333, vol=1.232868e+07
    or (segid "   A" and resid   78 and name HG11) (segid "   A" and resid   77 and name  HD2)
    or (segid "   A" and resid   78 and name HG13) (segid "   A" and resid   77 and name  HD2)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   83 and name  HE1) 6.436 5.177 5.177 weight 1.000 ! spec=13C, no=5758, id=2334, vol=4.324231e+06
    or (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   83 and name  HE2)
assign (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   83 and name  HE1) 4.903 3.004 3.004 weight 1.000 ! spec=13C, no=5759, id=2335, vol=5.800871e+06
    or (segid "   A" and resid   79 and name  HB1) (segid "   A" and resid   83 and name  HE2)
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   98 and name   HB) 5.156 3.323 3.323 weight 1.000 ! spec=13C, no=5762, id=2336, vol=9.289977e+06
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid   99 and name   HA) 3.477 1.511 1.511 weight 1.000 ! spec=13C, no=5768, id=2337, vol=1.818390e+07
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid   99 and name   HA)
    or (segid "   A" and resid  100 and name  HB3) (segid "   A" and resid   99 and name   HA)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   81 and name  HA1) 3.657 1.672 1.672 weight 1.000 ! spec=13C, no=5771, id=2338, vol=2.142452e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   81 and name  HA1)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   81 and name  HA1)
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   84 and name HG21) 2.273 0.646 0.646 weight 1.000 ! spec=13C, no=5783, id=2340, vol=2.118975e+07
    or (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   39 and name  HB1) 4.008 2.008 2.008 weight 1.000 ! spec=13C, no=5788, id=2342, vol=8.313891e+06
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   39 and name  HB1)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   38 and name   HA) 3.885 1.886 1.886 weight 1.000 ! spec=13C, no=5790, id=2343, vol=6.380349e+06
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   38 and name   HA)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   38 and name   HA)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   86 and name   HA) 4.185 2.189 2.189 weight 1.000 ! spec=13C, no=5792, id=2344, vol=5.697752e+06
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   86 and name   HA)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   46 and name HD22) 3.821 1.825 1.825 weight 1.000 ! spec=13C, no=5795, id=2345, vol=1.636648e+07
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   40 and name HD22) 2.780 0.966 0.966 weight 1.000 ! spec=13C, no=5801, id=2346, vol=3.427566e+07
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   84 and name   HB) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name  HE3) 3.625 1.643 1.643 weight 1.000 ! spec=13C, no=5807, id=2349, vol=6.348993e+06
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   23 and name   HA) 4.629 2.678 2.678 weight 1.000 ! spec=13C, no=5809, id=2351, vol=6.748461e+06
assign (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   23 and name   HA) 5.002 3.128 3.128 weight 1.000 ! spec=13C, no=5813, id=2352, vol=5.431719e+06
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   23 and name   HA) 4.511 2.544 2.544 weight 1.000 ! spec=13C, no=5814, id=2353, vol=7.530332e+06
assign (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   25 and name HG12) 1.954 0.477 0.477 weight 1.000 ! spec=13C, no=5824, id=2355, vol=2.252348e+07
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   70 and name   HN) 4.143 2.145 2.145 weight 1.000 ! spec=13C, no=5826, id=2357, vol=8.127733e+06
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   70 and name   HN)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   70 and name   HN)
assign (segid "   A" and resid   25 and name HG22) (segid "   A" and resid   39 and name  HH2) 2.306 0.665 0.665 weight 1.000 ! spec=13C, no=5832, id=2358, vol=3.198504e+07
    or (segid "   A" and resid   25 and name HG21) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   25 and name HG23) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   70 and name   HN) 4.519 2.552 2.552 weight 1.000 ! spec=13C, no=5839, id=2359, vol=7.974006e+06
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   70 and name   HN)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   70 and name   HN)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   25 and name   HA) 3.974 1.974 1.974 weight 1.000 ! spec=13C, no=5845, id=2360, vol=9.236296e+06
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   25 and name   HA)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   28 and name   HA) 4.402 2.422 2.422 weight 1.000 ! spec=13C, no=5861, id=2361, vol=6.090478e+06
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   28 and name   HA)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   28 and name   HA)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   64 and name   HA) 4.357 2.373 2.373 weight 1.000 ! spec=13C, no=5862, id=2362, vol=8.207884e+06
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   64 and name   HA)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   64 and name   HA)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   27 and name  HE1) 4.024 2.024 2.024 weight 1.000 ! spec=13C, no=5865, id=2364, vol=1.144860e+07
    or (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   27 and name  HE2)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   26 and name   HA) 3.267 1.334 1.334 weight 1.000 ! spec=13C, no=5868, id=2365, vol=1.046076e+07
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   26 and name  HG1) 5.196 3.374 3.374 weight 1.000 ! spec=13C, no=5870, id=2366, vol=8.013076e+06
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   25 and name HG12) 3.587 1.115 1.115 weight 1.000 ! spec=13C, no=5883, id=2369, vol=2.880852e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   25 and name HG12)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   25 and name HG12)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   71 and name   HA) 3.632 1.649 1.649 weight 1.000 ! spec=13C, no=5887, id=2370, vol=6.017138e+06
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   71 and name   HA)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   71 and name   HA)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   73 and name   HN) 4.890 2.989 2.989 weight 1.000 ! spec=13C, no=5892, id=2371, vol=7.219187e+06
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   73 and name   HN)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   73 and name   HN)
assign (segid "   A" and resid   54 and name HG21) (segid "   A" and resid   55 and name  HB2) 4.459 2.485 2.485 weight 1.000 ! spec=13C, no=5902, id=2372, vol=8.038064e+06
    or (segid "   A" and resid   54 and name HG22) (segid "   A" and resid   55 and name  HB2)
    or (segid "   A" and resid   54 and name HG23) (segid "   A" and resid   55 and name  HB2)
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   70 and name   HG) 3.717 1.727 1.727 weight 1.000 ! spec=13C, no=5917, id=2373, vol=5.432072e+06
assign (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   25 and name HG12) 4.531 2.567 2.567 weight 1.000 ! spec=13C, no=5918, id=2374, vol=6.259376e+06
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   91 and name  HB1) 4.838 2.926 2.926 weight 1.000 ! spec=13C, no=5922, id=2375, vol=8.776382e+06
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   91 and name  HB1) 4.325 2.338 2.338 weight 1.000 ! spec=13C, no=5923, id=2376, vol=8.232578e+06
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   48 and name  HG1) 4.511 1.544 2.544 weight 1.000 ! spec=13C, no=5932, id=2378, vol=1.511065e+07
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   70 and name   HA) 6.478 5.246 5.246 weight 1.000 ! spec=13C, no=5941, id=2379, vol=1.450019e+06
assign (segid "   A" and resid   25 and name HG11) (segid "   A" and resid   70 and name  HB1) 3.458 1.495 1.495 weight 1.000 ! spec=13C, no=5956, id=2380, vol=5.357739e+06
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   70 and name   HN) 4.165 2.168 2.168 weight 1.000 ! spec=13C, no=5966, id=2381, vol=1.345259e+07
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   23 and name  HB2) 4.628 2.678 2.678 weight 1.000 ! spec=13C, no=5983, id=2382, vol=3.866666e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   23 and name  HB2)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   73 and name   HA) 5.770 4.162 4.162 weight 1.000 ! spec=13C, no=5988, id=2383, vol=4.183224e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   73 and name   HA)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   73 and name   HA)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   79 and name HD21) 3.289 1.352 1.352 weight 1.000 ! spec=13C, no=5992, id=2384, vol=1.169578e+07
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   79 and name HD21)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   79 and name HD21)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   23 and name  HD1) 3.677 1.690 1.690 weight 1.000 ! spec=13C, no=5994, id=2385, vol=5.897464e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   23 and name  HD1)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   23 and name  HD1)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   73 and name   HN) 4.336 2.350 2.350 weight 1.000 ! spec=13C, no=5995, id=2386, vol=8.321620e+06
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   73 and name   HN)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   73 and name   HN)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   24 and name   HN) 4.227 2.233 2.233 weight 1.000 ! spec=13C, no=5998, id=2387, vol=8.673741e+06
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   24 and name   HN)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   71 and name   HN) 4.187 2.191 2.191 weight 1.000 ! spec=13C, no=5999, id=2388, vol=6.987781e+06
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   71 and name   HN)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   71 and name   HN)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   23 and name  HE3) 4.461 2.488 2.488 weight 1.000 ! spec=13C, no=6002, id=2389, vol=5.549799e+06
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   23 and name  HE3)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   23 and name  HE3)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   83 and name  HD1) 3.648 1.161 1.161 weight 1.000 ! spec=13C, no=6003, id=2390, vol=6.427730e+06
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   72 and name HD12) (segid "   A" and resid   79 and name HD21) 4.524 1.558 1.558 weight 1.000 ! spec=13C, no=6004, id=2391, vol=2.113994e+07
    or (segid "   A" and resid   72 and name HD11) (segid "   A" and resid   79 and name HD21)
    or (segid "   A" and resid   72 and name HD13) (segid "   A" and resid   79 and name HD21)
assign (segid "   A" and resid   81 and name  HA2) (segid "   A" and resid  100 and name   HN) 4.819 2.903 2.903 weight 1.000 ! spec=13C, no=6019, id=2392, vol=3.783623e+06
assign (segid "   A" and resid   81 and name  HA1) (segid "   A" and resid  100 and name   HN) 4.245 2.252 2.252 weight 1.000 ! spec=13C, no=6021, id=2393, vol=1.154163e+07
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HB2) 3.579 1.601 1.601 weight 1.000 ! spec=13C, no=6028, id=2394, vol=1.043168e+07
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   40 and name   HG) 4.608 2.654 2.654 weight 1.000 ! spec=13C, no=6030, id=2395, vol=6.846376e+06
!assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   83 and name  HB1) 5.148 3.313 3.313 weight 1.000 ! spec=13C, no=6043, id=2396, vol=5.791127e+06
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   41 and name  HD1) 6.209 4.819 4.819 weight 1.000 ! spec=13C, no=6047, id=2397, vol=4.032871e+06
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   41 and name  HD1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   41 and name  HD1)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   41 and name  HD2)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   41 and name  HD2)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   41 and name  HD2)
assign (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   98 and name   HN) 5.762 4.149 4.149 weight 1.000 ! spec=13C, no=6057, id=2398, vol=5.365452e+06
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   81 and name   HN) 5.266 3.466 3.466 weight 1.000 ! spec=13C, no=6059, id=2399, vol=3.699383e+06
assign (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid   82 and name   HA) 3.709 1.720 1.720 weight 1.000 ! spec=13C, no=6063, id=2400, vol=1.263146e+07
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   56 and name  HE1) 5.765 4.155 4.155 weight 1.000 ! spec=13C, no=6082, id=2401, vol=6.074805e+06
    or (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   56 and name  HE2)
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   56 and name   HA) 3.843 1.846 1.846 weight 1.000 ! spec=13C, no=6083, id=2402, vol=1.097386e+07
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   56 and name  HB2) 6.229 4.851 4.851 weight 1.000 ! spec=13C, no=6086, id=2403, vol=4.825083e+06
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   56 and name  HB1) 5.150 3.315 3.315 weight 1.000 ! spec=13C, no=6087, id=2404, vol=8.134366e+06
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   25 and name   HN) 4.830 2.916 2.916 weight 1.000 ! spec=13C, no=6099, id=2405, vol=9.017213e+06
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   25 and name   HN)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   25 and name   HN)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   98 and name   HA) 4.618 2.666 2.666 weight 1.000 ! spec=13C, no=6120, id=2408, vol=6.444851e+06
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   83 and name  HB1) 3.709 1.720 1.720 weight 1.000 ! spec=13C, no=6126, id=2409, vol=9.847583e+06
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   83 and name  HB1)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   83 and name  HB1)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   83 and name  HB2) 2.909 1.058 1.058 weight 1.000 ! spec=13C, no=6127, id=2410, vol=9.497052e+06
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   83 and name  HB2)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   83 and name  HB2)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   98 and name HD12) 3.515 1.544 1.544 weight 1.000 ! spec=13C, no=6129, id=2411, vol=1.847730e+07
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG12) 2.962 1.097 1.097 weight 1.000 ! spec=13C, no=6135, id=2412, vol=9.996167e+06
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG13)
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name HG12)
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name HG13)
assign (segid "   A" and resid    7 and name  HB2) (segid "   A" and resid    8 and name  HB2) 5.766 4.155 4.155 weight 1.000 ! spec=13C, no=6139, id=2413, vol=6.925926e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   91 and name  HB2) 4.640 2.691 2.691 weight 1.000 ! spec=13C, no=6140, id=2414, vol=9.216093e+06
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   89 and name HD21) 3.039 1.154 1.154 weight 1.000 ! spec=13C, no=6145, id=2415, vol=1.377514e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   89 and name HD21)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   89 and name HD21)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   89 and name  HB2) 2.584 0.835 0.835 weight 1.000 ! spec=13C, no=6147, id=2416, vol=1.067286e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   89 and name  HB2)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   89 and name  HB2)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   89 and name  HB1) 3.430 1.470 1.470 weight 1.000 ! spec=13C, no=6150, id=2417, vol=1.039135e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   89 and name  HB1)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   89 and name  HB1)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HB) 2.715 0.921 0.921 weight 1.000 ! spec=13C, no=6173, id=2422, vol=1.883672e+07
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HA) 2.296 0.659 0.659 weight 1.000 ! spec=13C, no=6187, id=2423, vol=3.468353e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG22) 2.812 0.988 0.988 weight 1.000 ! spec=13C, no=6206, id=2424, vol=2.418641e+07
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   94 and name   HA) 3.284 1.348 1.348 weight 1.000 ! spec=13C, no=6207, id=2425, vol=1.713354e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   94 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   94 and name   HA)
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   27 and name   HA) 4.212 2.218 2.218 weight 1.000 ! spec=13C, no=6209, id=2426, vol=8.647227e+06
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   28 and name  HB1) 5.799 4.204 4.204 weight 1.000 ! spec=13C, no=6211, id=2427, vol=1.318252e+07
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   14 and name  HB1) 4.773 2.847 2.847 weight 1.000 ! spec=13C, no=6212, id=2428, vol=1.109586e+07
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   96 and name  HB2) 4.016 2.016 2.016 weight 1.000 ! spec=13C, no=6213, id=2429, vol=1.249077e+07
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   12 and name   HA) 3.926 1.927 1.927 weight 1.000 ! spec=13C, no=6214, id=2430, vol=7.051304e+06
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   28 and name   HN) 4.592 2.636 2.636 weight 1.000 ! spec=13C, no=6217, id=2431, vol=8.660398e+06
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   27 and name  HB2) 2.046 0.523 0.523 weight 1.000 ! spec=13C, no=6222, id=2433, vol=3.372564e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   27 and name   HA) 4.332 2.346 2.346 weight 1.000 ! spec=13C, no=6225, id=2435, vol=5.704974e+06
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   27 and name   HA)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   27 and name   HA)
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   26 and name  HB1) 5.769 4.161 4.161 weight 1.000 ! spec=13C, no=6231, id=2436, vol=9.812393e+06
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   26 and name  HB2) 4.804 2.885 2.885 weight 1.000 ! spec=13C, no=6232, id=2437, vol=6.772039e+06
assign (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   26 and name  HB1) 4.567 2.607 2.607 weight 1.000 ! spec=13C, no=6239, id=2438, vol=1.738345e+07
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   98 and name HG12) 3.138 1.231 1.231 weight 1.000 ! spec=13C, no=6241, id=2439, vol=1.187109e+07
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   23 and name  HE3) 2.407 0.724 0.724 weight 1.000 ! spec=13C, no=6253, id=2441, vol=3.475004e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   23 and name  HE3)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   23 and name  HE3)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   23 and name  HB2) 4.743 2.812 2.812 weight 1.000 ! spec=13C, no=6256, id=2443, vol=7.101146e+06
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   23 and name  HB2)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   23 and name  HB1) 3.819 1.823 1.823 weight 1.000 ! spec=13C, no=6257, id=2444, vol=7.076232e+06
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid  100 and name  HB2) 2.870 0.549 0.549 weight 1.000 ! spec=13C, no=6259, id=2445, vol=4.467090e+07
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   25 and name HG11) 2.974 0.894 0.894 weight 1.000 ! spec=13C, no=6263, id=2446, vol=2.653752e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   25 and name HG11)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   25 and name HG11)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   17 and name   HA) 4.628 2.677 2.677 weight 1.000 ! spec=13C, no=6269, id=2447, vol=5.188925e+06
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   24 and name   HN) 4.105 2.106 2.106 weight 1.000 ! spec=13C, no=6290, id=2449, vol=8.579119e+06
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   18 and name HG13) (segid "   A" and resid   24 and name   HN)
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   18 and name   HA) 4.508 2.540 2.540 weight 1.000 ! spec=13C, no=6291, id=2450, vol=7.994212e+06
assign (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   18 and name HG22) 1.800 0.405 0.405 weight 1.000 ! spec=13C, no=6302, id=2451, vol=8.471118e+07
    or (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   18 and name HG23)
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   18 and name HG22)
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   18 and name HG23)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   18 and name HG22)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   23 and name  HZ2) (segid "   A" and resid  102 and name  HD1) 5.766 4.156 4.156 weight 1.000 ! spec=13C, no=6312, id=2452, vol=4.626342e+06
    or (segid "   A" and resid   23 and name  HZ2) (segid "   A" and resid  102 and name  HD2)
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   69 and name  HB1) 4.110 2.112 2.112 weight 1.000 ! spec=13C, no=6320, id=2453, vol=1.084798e+07
assign (segid "   A" and resid   25 and name HG12) (segid "   A" and resid   70 and name   HN) 5.581 3.893 3.893 weight 1.000 ! spec=13C, no=6334, id=2454, vol=4.656023e+06
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   48 and name  HB1) 4.607 2.654 2.654 weight 1.000 ! spec=13C, no=6352, id=2455, vol=8.234840e+06
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   55 and name  HB1) 4.001 1.052 1.052 weight 1.000 ! spec=13C, no=6356, id=2456, vol=6.033103e+06
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   55 and name  HB1)
assign (segid "   A" and resid   54 and name   HB) (segid "   A" and resid   55 and name   HN) 3.900 1.901 1.901 weight 1.000 ! spec=13C, no=6362, id=2457, vol=9.778564e+06
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   67 and name  HB1) 4.558 2.597 2.597 weight 1.000 ! spec=13C, no=6412, id=2462, vol=9.212164e+06
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   68 and name  HA1) 4.610 2.657 2.657 weight 1.000 ! spec=13C, no=6417, id=2463, vol=7.152525e+06
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   67 and name  HB2) 2.363 0.698 0.698 weight 1.000 ! spec=13C, no=6420, id=2465, vol=4.022789e+07
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   67 and name  HB2)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   67 and name  HB2)
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   57 and name HD22) 2.616 0.855 0.855 weight 1.000 ! spec=13C, no=6421, id=2466, vol=3.202426e+07
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   67 and name  HD2) 4.422 2.444 2.444 weight 1.000 ! spec=13C, no=6423, id=2467, vol=7.810985e+06
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   67 and name  HD2)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   67 and name  HD2)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   67 and name   HN) 4.190 2.195 2.195 weight 1.000 ! spec=13C, no=6426, id=2468, vol=8.792201e+06
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   67 and name   HN)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   67 and name   HN)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   68 and name   HN) 5.102 3.254 3.254 weight 1.000 ! spec=13C, no=6428, id=2469, vol=5.425711e+06
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   68 and name   HN)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   67 and name   HA) 5.044 3.180 3.180 weight 1.000 ! spec=13C, no=6429, id=2470, vol=5.662496e+06
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   67 and name   HA)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   67 and name   HA)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   68 and name  HA2) 4.367 2.384 2.384 weight 1.000 ! spec=13C, no=6431, id=2471, vol=7.245616e+06
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   68 and name  HA2)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   68 and name  HA2)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   67 and name  HB1) 4.287 2.297 2.297 weight 1.000 ! spec=13C, no=6434, id=2472, vol=7.681163e+06
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   67 and name  HB1)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   67 and name  HB1)
assign (segid "   A" and resid   66 and name  HG1) (segid "   A" and resid   67 and name   HN) 5.041 3.176 3.176 weight 1.000 ! spec=13C, no=6440, id=2474, vol=5.524819e+06
assign (segid "   A" and resid   66 and name  HD2) (segid "   A" and resid   67 and name   HN) 5.590 3.906 3.906 weight 1.000 ! spec=13C, no=6443, id=2475, vol=6.995190e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   67 and name   HN) 5.758 4.145 4.145 weight 1.000 ! spec=13C, no=6444, id=2476, vol=5.903677e+06
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   57 and name  HB2) 4.852 2.943 2.943 weight 1.000 ! spec=13C, no=6458, id=2478, vol=6.574989e+06
assign (segid "   A" and resid   67 and name  HE1) (segid "   A" and resid   67 and name  HB2) 6.198 4.802 4.802 weight 1.000 ! spec=13C, no=6461, id=2479, vol=2.691133e+06
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   28 and name   HA) 5.124 3.282 3.282 weight 1.000 ! spec=13C, no=6467, id=2480, vol=5.377770e+06
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   70 and name  HB2) 4.470 2.498 2.498 weight 1.000 ! spec=13C, no=6471, id=2481, vol=9.799034e+06
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   55 and name   HA) 5.995 4.493 4.493 weight 1.000 ! spec=13C, no=6491, id=2482, vol=5.563002e+06
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   26 and name  HG2) 3.583 1.605 1.605 weight 1.000 ! spec=13C, no=6495, id=2483, vol=6.400558e+06
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   26 and name  HG2) 4.612 2.658 2.658 weight 1.000 ! spec=13C, no=6496, id=2484, vol=7.912139e+06
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   25 and name HD12) 5.083 3.229 3.229 weight 1.000 ! spec=13C, no=6498, id=2486, vol=5.327901e+06
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   69 and name   HA) 4.821 2.905 2.905 weight 1.000 ! spec=13C, no=6508, id=2488, vol=5.025497e+06
assign (segid "   A" and resid   68 and name  HA2) (segid "   A" and resid   67 and name   HN) 4.177 2.181 2.181 weight 1.000 ! spec=13C, no=6525, id=2491, vol=9.758816e+06
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   68 and name  HA2) 3.714 1.725 1.725 weight 1.000 ! spec=13C, no=6553, id=2492, vol=5.804031e+06
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   68 and name  HA2) 5.024 3.155 3.155 weight 1.000 ! spec=13C, no=6554, id=2493, vol=5.744117e+06
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   27 and name   HA) 2.962 1.097 1.097 weight 1.000 ! spec=13C, no=6561, id=2495, vol=1.441796e+07
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   14 and name   HA) 3.772 1.779 1.779 weight 1.000 ! spec=13C, no=6571, id=2498, vol=4.760166e+06
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   28 and name   HN) 4.165 2.168 2.168 weight 1.000 ! spec=13C, no=6583, id=2499, vol=1.635385e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   28 and name   HN)
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name HE21) 5.293 3.502 3.502 weight 1.000 ! spec=13C, no=6589, id=2500, vol=7.786684e+06
assign (segid "   A" and resid   28 and name  HB1) (segid "   A" and resid   27 and name   HA) 5.995 4.493 4.493 weight 1.000 ! spec=13C, no=6634, id=2505, vol=4.151024e+06
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   66 and name   HE) 3.736 1.745 1.745 weight 1.000 ! spec=13C, no=6642, id=2506, vol=1.721875e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   66 and name   HE)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   66 and name   HE)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   66 and name  HD1) 3.715 1.725 1.725 weight 1.000 ! spec=13C, no=6648, id=2507, vol=1.152479e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   66 and name  HD2) 3.250 0.878 0.878 weight 1.000 ! spec=13C, no=6649, id=2508, vol=1.426165e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   66 and name  HD2)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   66 and name  HD2)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   66 and name   HE) 3.255 1.324 1.324 weight 1.000 ! spec=13C, no=6654, id=2509, vol=3.636126e+07
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   66 and name   HE)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   66 and name   HE)
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name HD22) 3.351 1.404 1.404 weight 1.000 ! spec=13C, no=6669, id=2513, vol=8.168970e+06
    or (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name HD23)
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   68 and name  HA2) 3.364 1.415 1.415 weight 1.000 ! spec=13C, no=6704, id=2514, vol=1.088908e+07
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   87 and name   HN) 2.332 0.680 0.680 weight 1.000 ! spec=13C, no=6710, id=2516, vol=2.545511e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   39 and name  HH2) 3.141 1.233 1.233 weight 1.000 ! spec=13C, no=6730, id=2518, vol=1.400991e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   26 and name  HG1) (segid "   A" and resid   26 and name  HD2) 3.481 1.515 1.515 weight 1.000 ! spec=13C, no=6742, id=2519, vol=8.858624e+06
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   93 and name   HA) 3.693 0.975 1.075 weight 1.000 ! spec=13C, no=6746, id=2520, vol=2.451655e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   93 and name   HA)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   93 and name   HA)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG12) 2.364 0.699 0.699 weight 1.000 ! spec=13C, no=6752, id=2521, vol=3.964507e+07
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   29 and name   HA) 3.454 1.491 1.491 weight 1.000 ! spec=13C, no=6755, id=2522, vol=1.771316e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   29 and name   HA) 4.401 2.421 2.421 weight 1.000 ! spec=13C, no=6758, id=2523, vol=8.944753e+06
assign (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   12 and name   HA) 2.692 0.906 0.906 weight 1.000 ! spec=13C, no=6759, id=2524, vol=2.223881e+07
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG12) 3.696 1.708 1.708 weight 1.000 ! spec=13C, no=6769, id=2525, vol=2.229411e+07
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HA) 2.356 0.694 0.694 weight 1.000 ! spec=13C, no=6779, id=2526, vol=2.359659e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   29 and name   HA) 3.123 1.219 1.219 weight 1.000 ! spec=13C, no=6780, id=2527, vol=1.743103e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   29 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   29 and name   HA)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   95 and name   HA) 2.719 0.924 0.924 weight 1.000 ! spec=13C, no=6791, id=2528, vol=1.906734e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   86 and name   HA) 3.990 1.990 1.990 weight 1.000 ! spec=13C, no=6796, id=2529, vol=1.517262e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   86 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   86 and name   HA)
assign (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   11 and name   HA) 3.951 1.951 1.951 weight 1.000 ! spec=13C, no=6798, id=2530, vol=1.140404e+07
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   12 and name HG12) 3.382 0.851 0.851 weight 1.000 ! spec=13C, no=6799, id=2531, vol=7.659900e+07
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG22) 3.368 0.869 0.869 weight 1.000 ! spec=13C, no=6800, id=2532, vol=1.875974e+08
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG22) 3.222 1.297 1.297 weight 1.000 ! spec=13C, no=6807, id=2533, vol=2.155044e+07
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   37 and name HD12) 1.876 0.272 0.572 weight 1.000 ! spec=13C, no=6808, id=2534, vol=7.779427e+07
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   37 and name HD12)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   37 and name HD12)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   37 and name HD22) 2.039 0.296 0.596 weight 1.000 ! spec=13C, no=6809, id=2535, vol=8.460475e+07
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   37 and name HD23)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   37 and name HD22)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   37 and name HD23)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   37 and name HD22)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   37 and name HD22) 2.032 0.333 0.533 weight 1.000 ! spec=13C, no=6810, id=2536, vol=7.018756e+07
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   37 and name HD23)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   37 and name HD22)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   37 and name HD23)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   37 and name HD22)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   37 and name HD23)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   29 and name HG12) 2.876 0.539 0.539 weight 1.000 ! spec=13C, no=6812, id=2538, vol=3.097217e+07
    or (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   29 and name HG11)
    or (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   29 and name HG13)
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   29 and name HG11)
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   29 and name HG13)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   29 and name HG11)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   29 and name HG13)
assign (segid "   A" and resid   20 and name  HE2) (segid "   A" and resid   24 and name  HB1) 2.520 0.794 0.794 weight 1.000 ! spec=13C, no=6814, id=2539, vol=2.455739e+07
    or (segid "   A" and resid   20 and name  HE1) (segid "   A" and resid   24 and name  HB1)
    or (segid "   A" and resid   20 and name  HE3) (segid "   A" and resid   24 and name  HB1)
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid   55 and name   HA) 3.480 1.513 1.513 weight 1.000 ! spec=13C, no=6816, id=2540, vol=1.297628e+07
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   53 and name  HE1) 2.881 0.842 0.842 weight 1.000 ! spec=13C, no=6817, id=2541, vol=6.691875e+06
    or (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   53 and name  HE2)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   66 and name   HE) 3.736 1.745 1.745 weight 1.000 ! spec=13C, no=6819, id=2542, vol=1.782396e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   66 and name   HE)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   66 and name   HE)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   85 and name HD12) 1.924 0.463 0.463 weight 1.000 ! spec=13C, no=6821, id=2543, vol=7.240491e+07
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   56 and name   HZ) 4.105 1.106 1.106 weight 1.000 ! spec=13C, no=6822, id=2544, vol=1.000854e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   56 and name   HZ)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   56 and name   HZ)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   37 and name   HG) 2.003 0.321 0.321 weight 1.000 ! spec=13C, no=6823, id=2545, vol=1.176164e+08
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   37 and name   HG)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   37 and name   HG)
assign (segid "   A" and resid   45 and name HG22) (segid "   A" and resid   45 and name   HB) 1.676 0.351 0.351 weight 1.000 ! spec=13C, no=6826, id=2547, vol=1.440094e+08
    or (segid "   A" and resid   45 and name HG21) (segid "   A" and resid   45 and name   HB)
    or (segid "   A" and resid   45 and name HG23) (segid "   A" and resid   45 and name   HB)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   65 and name   HB) 1.707 0.364 0.364 weight 1.000 ! spec=13C, no=6828, id=2549, vol=9.966343e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   65 and name   HB)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   65 and name   HB)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HB) 1.759 0.387 0.387 weight 1.000 ! spec=13C, no=6830, id=2550, vol=7.266562e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   94 and name  HB2) 2.825 0.676 0.876 weight 1.000 ! spec=13C, no=6831, id=2551, vol=7.727195e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   94 and name  HB3)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   94 and name  HB3)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   94 and name  HB3)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD22) 1.601 0.321 0.321 weight 1.000 ! spec=13C, no=6832, id=2552, vol=6.950264e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   87 and name  HB2) 2.898 0.450 1.050 weight 1.000 ! spec=13C, no=6833, id=2553, vol=8.387505e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name HD12) 2.503 0.363 0.563 weight 1.000 ! spec=13C, no=6834, id=2554, vol=7.981186e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name HD13)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name HD12)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name HD13)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name HD12)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name HD13)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   95 and name   HA) 3.002 1.127 1.127 weight 1.000 ! spec=13C, no=6835, id=2555, vol=1.949896e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   95 and name   HA)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   95 and name   HA)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD12) 2.897 1.049 1.049 weight 1.000 ! spec=13C, no=6836, id=2556, vol=2.389942e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   14 and name   HN) 3.370 1.420 1.420 weight 1.000 ! spec=13C, no=6838, id=2558, vol=1.317399e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   14 and name   HN)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG12) 2.944 1.084 1.084 weight 1.000 ! spec=13C, no=6839, id=2559, vol=1.443195e+07
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   63 and name  HB1) 2.700 0.912 0.912 weight 1.000 ! spec=13C, no=6840, id=2560, vol=4.160078e+07
    or (segid "   A" and resid   60 and name  HB1) (segid "   A" and resid   63 and name  HB1)
    or (segid "   A" and resid   60 and name  HB3) (segid "   A" and resid   63 and name  HB1)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   35 and name  HG1) 2.340 0.685 0.685 weight 1.000 ! spec=13C, no=6842, id=2562, vol=4.445052e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   35 and name  HG1)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   35 and name  HG1)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   35 and name  HB1) 2.350 0.690 0.690 weight 1.000 ! spec=13C, no=6843, id=2563, vol=3.639242e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   35 and name  HB1)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   12 and name HG11) 4.250 1.090 1.090 weight 1.000 ! spec=13C, no=6845, id=2563, vol=3.639242e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   87 and name  HB1) 2.850 0.690 0.690 weight 1.000 ! spec=13C, no=6845, id=2566, vol=3.639242e+07
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   10 and name  HB3) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid    6 and name HG12) (segid "   A" and resid    6 and name   HB) 1.695 0.359 0.359 weight 1.000 ! spec=13C, no=6847, id=2567, vol=1.378442e+08
    or (segid "   A" and resid    6 and name HG11) (segid "   A" and resid    6 and name   HB)
    or (segid "   A" and resid    6 and name HG13) (segid "   A" and resid    6 and name   HB)
assign (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   65 and name   HB) 1.701 0.361 0.361 weight 1.000 ! spec=13C, no=6848, id=2568, vol=1.042676e+08
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   65 and name   HB)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   65 and name   HB)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   29 and name   HB) 2.085 0.355 0.355 weight 1.000 ! spec=13C, no=6851, id=2569, vol=8.040247e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   29 and name   HB)
assign (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   29 and name HG22) 1.979 0.490 0.490 weight 1.000 ! spec=13C, no=6852, id=2570, vol=5.737812e+07
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   35 and name  HG2) (segid "   A" and resid   29 and name HG23)
assign (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   29 and name HG22) 1.843 0.425 0.425 weight 1.000 ! spec=13C, no=6854, id=2571, vol=7.007568e+07
    or (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   29 and name HG21)
    or (segid "   A" and resid   35 and name  HG1) (segid "   A" and resid   29 and name HG23)
assign (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   25 and name HD12) 3.227 1.302 1.302 weight 1.000 ! spec=13C, no=6855, id=2572, vol=1.932625e+07
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   83 and name  HB1) 3.209 1.287 1.287 weight 1.000 ! spec=13C, no=6856, id=2573, vol=1.063780e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   83 and name  HB1)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   83 and name  HB1)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid   83 and name  HB2) 2.616 0.856 0.856 weight 1.000 ! spec=13C, no=6857, id=2574, vol=1.395001e+07
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid   83 and name  HB2)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid   83 and name  HB2)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   79 and name HD21) 2.671 0.892 0.892 weight 1.000 ! spec=13C, no=6859, id=2575, vol=3.262187e+07
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   79 and name HD21)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   79 and name HD21)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   79 and name HD22) 2.229 0.621 0.621 weight 1.000 ! spec=13C, no=6860, id=2576, vol=2.166592e+07
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   79 and name HD22)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   79 and name HD22)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   72 and name HD22) 2.885 0.444 0.444 weight 1.000 ! spec=13C, no=6862, id=2577, vol=5.226941e+07
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   72 and name HD23)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   70 and name HD22) 3.624 0.735 0.735 weight 1.000 ! spec=13C, no=6863, id=2578, vol=1.718377e+07
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   70 and name HD23)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   70 and name HD22)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   70 and name HD23)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   70 and name HD22)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   70 and name HD12) 4.226 0.862 1.062 weight 1.000 ! spec=13C, no=6864, id=2579, vol=1.212112e+07
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   70 and name HD13)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   70 and name HD12)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   70 and name HD13)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   70 and name HD12)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   70 and name HD22) 3.361 0.681 1.081 weight 1.000 ! spec=13C, no=6867, id=2580, vol=3.947034e+07
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   70 and name HD23)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   70 and name HD22)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   70 and name HD23)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   70 and name HD22)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   70 and name HD12) 2.405 0.247 0.547 weight 1.000 ! spec=13C, no=6868, id=2581, vol=6.397685e+07
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   70 and name HD13)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   70 and name HD12)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   70 and name HD13)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   70 and name HD12)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name HD22) 1.860 0.433 0.433 weight 1.000 ! spec=13C, no=6869, id=2582, vol=3.601635e+07
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name HD23)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   82 and name   HA) 2.935 1.077 1.077 weight 1.000 ! spec=13C, no=6870, id=2583, vol=2.075726e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   82 and name   HA)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   82 and name   HA)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   99 and name  HE2) 3.065 1.174 1.174 weight 1.000 ! spec=13C, no=6871, id=2584, vol=2.228543e+07
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   99 and name  HE1)
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   99 and name  HE3)
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   78 and name   HB) 1.738 0.377 0.377 weight 1.000 ! spec=13C, no=6874, id=2587, vol=1.155204e+08
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   78 and name   HB)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   78 and name   HB)
assign (segid "   A" and resid   45 and name HG12) (segid "   A" and resid   45 and name   HN) 2.780 0.966 0.966 weight 1.000 ! spec=13C, no=6875, id=2588, vol=4.402825e+07
    or (segid "   A" and resid   45 and name HG11) (segid "   A" and resid   45 and name   HN)
    or (segid "   A" and resid   45 and name HG13) (segid "   A" and resid   45 and name   HN)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   14 and name   HN) 2.417 0.730 0.730 weight 1.000 ! spec=13C, no=6877, id=2589, vol=3.011399e+07
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   96 and name  HB3) (segid "   A" and resid   14 and name   HN)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   93 and name HE22) 2.938 1.079 1.079 weight 1.000 ! spec=13C, no=6883, id=2590, vol=2.033739e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   93 and name HE22)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   93 and name HE22)
assign (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   85 and name HD12) 2.313 0.669 0.669 weight 1.000 ! spec=13C, no=6887, id=2592, vol=1.567596e+07
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   37 and name  HB1) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   13 and name   HA) 2.607 0.849 0.849 weight 1.000 ! spec=13C, no=6889, id=2593, vol=3.236044e+07
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   13 and name   HA)
    or (segid "   A" and resid   96 and name  HB3) (segid "   A" and resid   13 and name   HA)
assign (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid  100 and name  HB2) 2.995 1.121 1.121 weight 1.000 ! spec=13C, no=6890, id=2594, vol=2.947701e+07
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid   83 and name  HE1) (segid "   A" and resid  100 and name  HB2) 3.406 0.823 0.823 weight 1.000 ! spec=13C, no=6892, id=2595, vol=2.800596e+07
    or (segid "   A" and resid   83 and name  HE1) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   83 and name  HE1) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   83 and name  HE2) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   83 and name  HE2) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   83 and name  HE2) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid   25 and name HG12) 2.803 0.453 0.853 weight 1.000 ! spec=13C, no=6894, id=2596, vol=4.928423e+07
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid   25 and name HG12)
    or (segid "   A" and resid  100 and name  HB3) (segid "   A" and resid   25 and name HG12)
assign (segid "   A" and resid   25 and name HD12) (segid "   A" and resid  100 and name  HB2) 2.269 0.270 0.570 weight 1.000 ! spec=13C, no=6895, id=2597, vol=5.428054e+07
    or (segid "   A" and resid   25 and name HD12) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   25 and name HD12) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   25 and name HD11) (segid "   A" and resid  100 and name  HB3)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   25 and name HD13) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name   HG) 1.715 0.368 0.368 weight 1.000 ! spec=13C, no=6896, id=2598, vol=7.457019e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name   HG)
assign (segid "   A" and resid   57 and name HD12) (segid "   A" and resid   58 and name  HB2) 2.904 1.054 1.054 weight 1.000 ! spec=13C, no=6898, id=2599, vol=2.691703e+07
    or (segid "   A" and resid   57 and name HD11) (segid "   A" and resid   58 and name  HB2)
    or (segid "   A" and resid   57 and name HD13) (segid "   A" and resid   58 and name  HB2)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   44 and name   HA) 3.803 1.808 1.808 weight 1.000 ! spec=13C, no=6899, id=2600, vol=1.542802e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   44 and name   HA)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   44 and name   HA)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD12) 2.622 0.859 0.859 weight 1.000 ! spec=13C, no=6904, id=2602, vol=7.469826e+07
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   94 and name  HB2) 2.241 0.628 0.628 weight 1.000 ! spec=13C, no=6905, id=2603, vol=9.636585e+07
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   94 and name  HB2) 2.504 0.502 0.502 weight 1.000 ! spec=13C, no=6906, id=2604, vol=4.190006e+07
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   94 and name  HB3)
assign (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   87 and name  HB2) 2.092 0.401 0.401 weight 1.000 ! spec=13C, no=6908, id=2605, vol=4.675809e+07
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   87 and name  HB3)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   87 and name  HB1)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   87 and name  HB3)
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   85 and name HD12) 3.160 1.248 1.248 weight 1.000 ! spec=13C, no=6909, id=2606, vol=1.186285e+07
    or (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   87 and name  HB1) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   87 and name  HB3) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   98 and name HD12) 2.599 0.844 0.844 weight 1.000 ! spec=13C, no=6910, id=2607, vol=5.803698e+07
    or (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   16 and name HG21) (segid "   A" and resid   98 and name HD13)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   98 and name HD12)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   16 and name HG22) (segid "   A" and resid   98 and name HD13)
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   98 and name HD12)
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   16 and name HG23) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    6 and name   HB) 1.681 0.353 0.353 weight 1.000 ! spec=13C, no=6911, id=2608, vol=1.462571e+08
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    6 and name   HB)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    6 and name   HB)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD22) 1.722 0.371 0.371 weight 1.000 ! spec=13C, no=6913, id=2610, vol=4.494456e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   12 and name   HB) 1.798 0.404 0.404 weight 1.000 ! spec=13C, no=6915, id=2612, vol=6.373941e+07
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   12 and name   HB)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   12 and name   HB)
assign (segid "   A" and resid   78 and name HG12) (segid "   A" and resid   78 and name   HB) 2.032 0.375 0.375 weight 1.000 ! spec=13C, no=6916, id=2613, vol=1.334943e+08
    or (segid "   A" and resid   78 and name HG11) (segid "   A" and resid   78 and name   HB)
    or (segid "   A" and resid   78 and name HG13) (segid "   A" and resid   78 and name   HB)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   46 and name HD22) 3.038 0.619 0.619 weight 1.000 ! spec=13C, no=6917, id=2614, vol=4.500847e+07
    or (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   46 and name HD23)
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   46 and name HD22)
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   46 and name HD23)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   46 and name HD22)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name   HG) 1.916 0.459 0.459 weight 1.000 ! spec=13C, no=6919, id=2616, vol=4.865216e+07
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name   HG)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name   HG)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name HD22) 2.079 0.312 0.312 weight 1.000 ! spec=13C, no=6920, id=2617, vol=8.036428e+07
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name HD23)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name HD22)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name HD21)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name HD23)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name   HG) 2.023 0.329 0.329 weight 1.000 ! spec=13C, no=6921, id=2618, vol=9.487460e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name   HG)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name   HG)
assign (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   85 and name HD12) 3.166 1.253 1.253 weight 1.000 ! spec=13C, no=6922, id=2619, vol=4.002313e+07
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   37 and name  HB2) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD12) 2.597 0.843 0.843 weight 1.000 ! spec=13C, no=6923, id=2620, vol=4.601791e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name HD22) 1.665 0.347 0.347 weight 1.000 ! spec=13C, no=6924, id=2621, vol=7.658518e+07
    or (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   70 and name HD12) (segid "   A" and resid   70 and name HD23)
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name HD22)
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   70 and name HD11) (segid "   A" and resid   70 and name HD23)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name HD22)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   70 and name HD13) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   65 and name HG22) 3.014 1.135 1.135 weight 1.000 ! spec=13C, no=6926, id=2623, vol=2.151505e+07
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   32 and name   HA) 4.233 1.473 1.473 weight 1.000 ! spec=13C, no=6928, id=2624, vol=2.056240e+07
    or (segid "   A" and resid   34 and name  HB1) (segid "   A" and resid   32 and name   HA)
    or (segid "   A" and resid   34 and name  HB3) (segid "   A" and resid   32 and name   HA)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   83 and name  HD1) 3.183 1.266 1.266 weight 1.000 ! spec=13C, no=6930, id=2626, vol=1.938324e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   39 and name  HH2) 3.041 1.156 1.156 weight 1.000 ! spec=13C, no=6931, id=2627, vol=1.331207e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   39 and name  HH2)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   83 and name  HE1) 3.300 1.362 1.362 weight 1.000 ! spec=13C, no=6932, id=2628, vol=1.704035e+07
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   83 and name  HE1)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   83 and name  HE1)
    or (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   83 and name  HE2)
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   83 and name  HE2)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   83 and name  HE2)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   83 and name  HD1) 3.585 1.349 1.349 weight 1.000 ! spec=13C, no=6934, id=2629, vol=2.152435e+07
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   83 and name  HD1)
    or (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   83 and name  HD2)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   83 and name  HE1) 3.359 1.038 1.038 weight 1.000 ! spec=13C, no=6935, id=2630, vol=1.562831e+07
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   83 and name  HE1)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   83 and name  HE1)
    or (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   83 and name  HE2)
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   83 and name  HE2)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   83 and name  HE2)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   97 and name   HA) 2.996 1.122 1.122 weight 1.000 ! spec=13C, no=6936, id=2631, vol=1.454799e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   97 and name   HA)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   97 and name   HA)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   97 and name   HA) 3.850 1.853 1.853 weight 1.000 ! spec=13C, no=6937, id=2632, vol=1.178654e+07
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   97 and name   HA)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   97 and name   HA)
assign (segid "   A" and resid  106 and name  HD1) (segid "   A" and resid  106 and name  HG1) 2.410 0.726 0.726 weight 1.000 ! spec=13C, no=6945, id=2634, vol=4.628157e+07
assign (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  106 and name  HG1) 2.725 0.928 0.928 weight 1.000 ! spec=13C, no=6946, id=2635, vol=5.483435e+07
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   72 and name  HB1) 2.880 1.037 1.037 weight 1.000 ! spec=13C, no=6948, id=2636, vol=2.988056e+07
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   84 and name HG21) 3.466 1.502 1.502 weight 1.000 ! spec=13C, no=6952, id=2638, vol=1.179954e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   99 and name   HA) 2.699 0.911 0.911 weight 1.000 ! spec=13C, no=6955, id=2640, vol=2.691528e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   99 and name   HA)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   99 and name   HA)
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   88 and name  HB2) 3.173 1.258 1.258 weight 1.000 ! spec=13C, no=6956, id=2641, vol=3.978870e+07
    or (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   72 and name HD22) (segid "   A" and resid   72 and name   HG) 2.028 0.514 0.514 weight 1.000 ! spec=13C, no=6959, id=2642, vol=3.334062e+07
    or (segid "   A" and resid   72 and name HD21) (segid "   A" and resid   72 and name   HG)
    or (segid "   A" and resid   72 and name HD23) (segid "   A" and resid   72 and name   HG)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   85 and name   HG) 1.698 0.361 0.361 weight 1.000 ! spec=13C, no=6962, id=2644, vol=6.784585e+07
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   85 and name   HG)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   85 and name   HG)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   27 and name  HB1) 2.577 0.830 0.830 weight 1.000 ! spec=13C, no=6963, id=2645, vol=9.000765e+06
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   27 and name  HB1)
assign (segid "   A" and resid   85 and name HD22) (segid "   A" and resid   27 and name  HB2) 2.898 1.050 1.050 weight 1.000 ! spec=13C, no=6964, id=2646, vol=1.726706e+07
    or (segid "   A" and resid   85 and name HD21) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   85 and name HD23) (segid "   A" and resid   27 and name  HB2)
assign (segid "   A" and resid   46 and name HD22) (segid "   A" and resid   46 and name   HN) 4.382 2.400 2.400 weight 1.000 ! spec=13C, no=6966, id=2647, vol=9.753271e+06
    or (segid "   A" and resid   46 and name HD21) (segid "   A" and resid   46 and name   HN)
    or (segid "   A" and resid   46 and name HD23) (segid "   A" and resid   46 and name   HN)
assign (segid "   A" and resid   70 and name HD22) (segid "   A" and resid   39 and name  HB1) 3.155 1.245 1.245 weight 1.000 ! spec=13C, no=6972, id=2650, vol=7.275496e+06
    or (segid "   A" and resid   70 and name HD21) (segid "   A" and resid   39 and name  HB1)
    or (segid "   A" and resid   70 and name HD23) (segid "   A" and resid   39 and name  HB1)
assign (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   68 and name   HN) 3.730 1.739 1.739 weight 1.000 ! spec=13C, no=6974, id=2651, vol=1.225787e+07
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   68 and name   HN)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   86 and name HD12) 3.578 1.600 1.600 weight 1.000 ! spec=13C, no=6978, id=2652, vol=1.945714e+07
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   86 and name HD11)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   86 and name HD13)
assign (segid "   A" and resid   37 and name HD22) (segid "   A" and resid   29 and name   HB) 2.126 0.565 0.565 weight 1.000 ! spec=13C, no=6979, id=2653, vol=1.943517e+07
    or (segid "   A" and resid   37 and name HD21) (segid "   A" and resid   29 and name   HB)
    or (segid "   A" and resid   37 and name HD23) (segid "   A" and resid   29 and name   HB)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   96 and name  HB2) 2.042 0.525 0.525 weight 1.000 ! spec=13C, no=6980, id=2654, vol=1.110613e+08
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   45 and name   HB) 3.592 1.119 1.119 weight 1.000 ! spec=13C, no=6981, id=2655, vol=2.587529e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   45 and name   HB)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   45 and name   HB)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   16 and name   HA) 2.810 0.556 0.556 weight 1.000 ! spec=13C, no=6985, id=2657, vol=5.298509e+07
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   16 and name   HA)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   16 and name   HA)
assign (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   25 and name HD12) 2.831 0.515 0.515 weight 1.000 ! spec=13C, no=6986, id=2658, vol=2.478289e+07
    or (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   98 and name HD12) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   98 and name HD11) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   98 and name HD13) (segid "   A" and resid   25 and name HD13)
assign (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   96 and name  HB1) 3.392 1.119 1.119 weight 1.000 ! spec=13C, no=6995
    or (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name   HB) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   46 and name  HB1) (segid "   A" and resid   40 and name   HA) 3.992 1.009 1.009 weight 1.000 ! spec=13C, no=6996
assign (segid "   A" and resid   23 and name  HZ2) (segid "   A" and resid   23 and name  HZ3) 4.054 2.055 2.055 weight 1.000 ! spec=13C_aro, no=11, id=2659, vol=6.008581e+05
assign (segid "   A" and resid   23 and name  HZ3) (segid "   A" and resid   23 and name  HE3) 2.936 1.077 1.077 weight 1.000 ! spec=13C_aro, no=74, id=2663, vol=5.878994e+05
assign (segid "   A" and resid   23 and name  HZ2) (segid "   A" and resid   23 and name  HH2) 2.137 0.571 0.571 weight 1.000 ! spec=13C_aro, no=78, id=2664, vol=3.519464e+06
assign (segid "   A" and resid   23 and name  HZ3) (segid "   A" and resid   23 and name  HH2) 2.324 0.675 0.675 weight 1.000 ! spec=13C_aro, no=82, id=2665, vol=2.583868e+06
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name  HE1) 3.035 1.152 1.152 weight 1.000 ! spec=13C_aro, no=101, id=2666, vol=3.369219e+06
    or (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name  HE2)
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   53 and name  HE2)
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   53 and name  HE1)
assign (segid "   A" and resid  102 and name  HD1) (segid "   A" and resid  102 and name  HE1) 3.688 1.700 1.700 weight 1.000 ! spec=13C_aro, no=104, id=2667, vol=8.698159e+05
    or (segid "   A" and resid  102 and name  HD1) (segid "   A" and resid  102 and name  HE2)
    or (segid "   A" and resid  102 and name  HD2) (segid "   A" and resid  102 and name  HE1)
    or (segid "   A" and resid  102 and name  HD2) (segid "   A" and resid  102 and name  HE2)
assign (segid "   A" and resid   41 and name  HE1) (segid "   A" and resid   41 and name  HD1) 3.358 1.410 1.410 weight 1.000 ! spec=13C_aro, no=106, id=2668, vol=1.694695e+06
    or (segid "   A" and resid   41 and name  HE1) (segid "   A" and resid   41 and name  HD2)
    or (segid "   A" and resid   41 and name  HE2) (segid "   A" and resid   41 and name  HD1)
    or (segid "   A" and resid   41 and name  HE2) (segid "   A" and resid   41 and name  HD2)
assign (segid "   A" and resid   41 and name  HD1) (segid "   A" and resid   41 and name   HZ) 4.037 2.037 2.037 weight 1.000 ! spec=13C_aro, no=108, id=2669, vol=4.908609e+05
    or (segid "   A" and resid   41 and name  HD2) (segid "   A" and resid   41 and name   HZ)
assign (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   41 and name  HD1) 3.100 1.201 1.201 weight 1.000 ! spec=13C_aro, no=113, id=2671, vol=1.106445e+06
    or (segid "   A" and resid   41 and name  HB2) (segid "   A" and resid   41 and name  HD2) 
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name  HD1) 3.020 1.140 1.140 weight 1.000 ! spec=13C_aro, no=115, id=2672, vol=9.983334e+05
    or (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name  HD2)
assign (segid "   A" and resid   56 and name  HE1) (segid "   A" and resid   56 and name   HZ) 3.177 1.262 1.262 weight 1.000 ! spec=13C_aro, no=124, id=2674, vol=7.471038e+05
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   56 and name   HZ)
assign (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HD1) 3.415 1.458 1.458 weight 1.000 ! spec=13C_aro, no=126, id=2675, vol=6.503638e+05
    or (segid "   A" and resid    8 and name  HB1) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name  HD1) 3.129 1.224 1.224 weight 1.000 ! spec=13C_aro, no=127, id=2676, vol=1.137593e+06
    or (segid "   A" and resid    8 and name  HB2) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name  HD1) 3.345 1.398 1.398 weight 1.000 ! spec=13C_aro, no=130, id=2677, vol=5.560771e+05
    or (segid "   A" and resid   27 and name  HB1) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name  HB2) 3.599 1.619 1.619 weight 1.000 ! spec=13C_aro, no=131, id=2678, vol=5.893865e+05
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   53 and name  HB2)
assign (segid "   A" and resid   29 and name HG12) (segid "   A" and resid   27 and name  HD1) 2.375 0.705 0.705 weight 1.000 ! spec=13C_aro, no=133, id=2679, vol=1.323449e+06
    or (segid "   A" and resid   29 and name HG11) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG13) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   27 and name  HD1)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   27 and name  HD1)
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name  HD1) 3.392 1.438 1.438 weight 1.000 ! spec=13C_aro, no=135, id=2680, vol=8.225806e+05
    or (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid    8 and name  HD1) 4.020 2.020 2.020 weight 1.000 ! spec=13C_aro, no=140, id=2682, vol=3.935425e+05
    or (segid "   A" and resid   32 and name  HB1) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid  107 and name  HD1) (segid "   A" and resid  106 and name  HB1) 4.420 2.442 2.442 weight 1.000 ! spec=13C_aro, no=141, id=2683, vol=3.771473e+05
    or (segid "   A" and resid  107 and name  HD2) (segid "   A" and resid  106 and name  HB1)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   56 and name  HD1) 3.511 1.541 1.541 weight 1.000 ! spec=13C_aro, no=144, id=2684, vol=6.140248e+05
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name  HD1) 2.852 1.017 1.017 weight 1.000 ! spec=13C_aro, no=153, id=2685, vol=5.683413e+05
assign (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   46 and name HD22) 3.752 1.760 1.760 weight 1.000 ! spec=13C_aro, no=154, id=2686, vol=5.530163e+05
    or (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   23 and name  HD1) (segid "   A" and resid   23 and name  HB1) 3.730 1.739 1.739 weight 1.000 ! spec=13C_aro, no=155, id=2687, vol=4.698032e+05
assign (segid "   A" and resid   23 and name  HE1) (segid "   A" and resid   23 and name  HZ2) 2.972 1.104 1.104 weight 1.000 ! spec=13C_aro, no=178, id=2689, vol=5.731337e+05
assign (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   15 and name  HE1) 3.826 1.829 1.829 weight 1.000 ! spec=13C_aro, no=183, id=2690, vol=7.725190e+05
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HD2) 3.261 1.330 1.330 weight 1.000 ! spec=13C_aro, no=185, id=2691, vol=5.235358e+05
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HD1) 3.438 1.478 1.478 weight 1.000 ! spec=13C_aro, no=188, id=2692, vol=5.319854e+05
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HD1) 2.953 1.090 1.090 weight 1.000 ! spec=13C_aro, no=189, id=2693, vol=7.713311e+05
assign (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   39 and name  HD1) 2.433 0.740 0.740 weight 1.000 ! spec=13C_aro, no=190, id=2694, vol=1.862117e+06
assign (segid "   A" and resid   23 and name  HE1) (segid "   A" and resid   23 and name  HD1) 2.184 0.596 0.596 weight 1.000 ! spec=13C_aro, no=191, id=2695, vol=2.353028e+06
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HD1) 3.404 1.448 1.448 weight 1.000 ! spec=13C_aro, no=210, id=2696, vol=8.382432e+05
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HD1) 4.140 2.143 2.143 weight 1.000 ! spec=13C_aro, no=214, id=2697, vol=5.415145e+05
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HD2)
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name   HN) 3.906 1.907 1.907 weight 1.000 ! spec=13C_aro, no=215, id=2698, vol=3.798840e+05
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   53 and name   HN)
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HD1) 3.554 1.579 1.579 weight 1.000 ! spec=13C_aro, no=220, id=2699, vol=7.874544e+05
    or (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HD1) 4.715 2.779 2.779 weight 1.000 ! spec=13C_aro, no=221, id=2700, vol=4.505242e+05
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   23 and name  HH2) (segid "   A" and resid   23 and name  HE1) 4.504 2.535 2.535 weight 1.000 ! spec=13C_aro, no=246, id=2701, vol=3.434958e+05
assign (segid "   A" and resid   78 and name HG12) (segid "   A" and resid   77 and name  HE1) 3.481 1.515 1.515 weight 1.000 ! spec=13C_aro, no=257, id=2702, vol=4.886187e+05
    or (segid "   A" and resid   78 and name HG11) (segid "   A" and resid   77 and name  HE1)
    or (segid "   A" and resid   78 and name HG13) (segid "   A" and resid   77 and name  HE1)
assign (segid "   A" and resid   77 and name  HE1) (segid "   A" and resid   77 and name  HD2) 5.408 3.656 3.656 weight 1.000 ! spec=13C_aro, no=258, id=2703, vol=1.032875e+05
assign (segid "   A" and resid   77 and name  HE1) (segid "   A" and resid  106 and name  HG1) 5.075 1.781 1.781 weight 1.000 ! spec=13C_aro, no=260, id=2704, vol=2.621102e+05
assign (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   15 and name  HB1) 4.172 2.176 2.176 weight 1.000 ! spec=13C_aro, no=264, id=2705, vol=3.992764e+05
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name  HD2) 3.031 1.148 1.148 weight 1.000 ! spec=13C_aro, no=268, id=2707, vol=4.873818e+05
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   67 and name  HB1) 3.847 1.850 1.850 weight 1.000 ! spec=13C_aro, no=270, id=2708, vol=3.614637e+05
assign (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   57 and name HD12) 3.135 1.228 1.228 weight 1.000 ! spec=13C_aro, no=271, id=2709, vol=5.215915e+05
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   67 and name  HD2) (segid "   A" and resid   57 and name HD13)
    or (segid "   A" and resid   57 and name HD22) (segid "   A" and resid   67 and name  HD2)
    or (segid "   A" and resid   57 and name HD21) (segid "   A" and resid   67 and name  HD2)
    or (segid "   A" and resid   57 and name HD23) (segid "   A" and resid   67 and name  HD2)
assign (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   78 and name HG12) 2.911 1.059 1.059 weight 1.000 ! spec=13C_aro, no=274, id=2710, vol=4.671586e+05
    or (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   78 and name HG13)
assign (segid "   A" and resid   77 and name  HD2) (segid "   A" and resid   77 and name  HB2) 3.811 1.816 1.816 weight 1.000 ! spec=13C_aro, no=278, id=2712, vol=4.914615e+05
assign (segid "   A" and resid    8 and name   HZ) (segid "   A" and resid    8 and name   HN) 4.523 1.641 1.641 weight 1.000 ! spec=13C_aro, no=281, id=2715, vol=5.793585e+05
assign (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   37 and name HD12) 2.598 0.844 0.844 weight 1.000 ! spec=13C_aro, no=287, id=2716, vol=2.866505e+05
    or (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   37 and name HD12)
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   41 and name  HE1) (segid "   A" and resid   41 and name   HZ) 2.924 1.069 1.069 weight 1.000 ! spec=13C_aro, no=292, id=2718, vol=1.644624e+06
    or (segid "   A" and resid   41 and name  HE2) (segid "   A" and resid   41 and name   HZ)
assign (segid "   A" and resid   53 and name  HD1) (segid "   A" and resid   53 and name  HB1) 3.851 1.854 1.854 weight 1.000 ! spec=13C_aro, no=296, id=2719, vol=3.938584e+05
    or (segid "   A" and resid   53 and name  HD2) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   21 and name   HN) 4.397 2.417 2.417 weight 1.000 ! spec=13C_aro, no=305, id=2720, vol=1.726141e+05
assign (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   21 and name  HB1) 3.509 1.539 1.539 weight 1.000 ! spec=13C_aro, no=307, id=2721, vol=3.428869e+05
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name  HD1) 2.779 0.965 0.965 weight 1.000 ! spec=13C_aro, no=325, id=2722, vol=3.681699e+05
assign (segid "   A" and resid   23 and name  HD1) (segid "   A" and resid   72 and name  HB2) 3.468 1.504 1.504 weight 1.000 ! spec=13C_aro, no=329, id=2723, vol=3.603917e+05
assign (segid "   A" and resid   23 and name  HD1) (segid "   A" and resid   23 and name  HZ2) 4.255 2.263 2.263 weight 1.000 ! spec=13C_aro, no=330, id=2724, vol=2.765999e+05
assign (segid "   A" and resid   51 and name  HD1) (segid "   A" and resid   49 and name   HN) 5.792 4.194 4.194 weight 1.000 ! spec=13C_aro, no=333, id=2725, vol=1.998049e+05
    or (segid "   A" and resid   51 and name  HD2) (segid "   A" and resid   49 and name   HN)
assign (segid "   A" and resid   51 and name  HD1) (segid "   A" and resid   51 and name   HN) 3.456 1.493 1.493 weight 1.000 ! spec=13C_aro, no=335, id=2726, vol=8.398493e+05
    or (segid "   A" and resid   51 and name  HD2) (segid "   A" and resid   51 and name   HN)
assign (segid "   A" and resid  107 and name  HD1) (segid "   A" and resid  107 and name  HB1) 3.353 1.405 1.405 weight 1.000 ! spec=13C_aro, no=336, id=2727, vol=1.016867e+06
    or (segid "   A" and resid  107 and name  HD2) (segid "   A" and resid  107 and name  HB1)
assign (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  107 and name  HD1) 3.589 1.610 1.610 weight 1.000 ! spec=13C_aro, no=338, id=2728, vol=6.678924e+05
    or (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  107 and name  HD2)
assign (segid "   A" and resid   51 and name  HD1) (segid "   A" and resid   49 and name HG21) 4.861 2.953 2.953 weight 1.000 ! spec=13C_aro, no=340, id=2729, vol=2.403486e+05
    or (segid "   A" and resid   51 and name  HD1) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   51 and name  HD1) (segid "   A" and resid   49 and name HG23)
    or (segid "   A" and resid   51 and name  HD2) (segid "   A" and resid   49 and name HG21)
    or (segid "   A" and resid   51 and name  HD2) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   51 and name  HD2) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name  HD1) 3.461 1.497 1.497 weight 1.000 ! spec=13C_aro, no=342, id=2731, vol=5.672744e+05
    or (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name  HD2)
assign (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name   HB) 3.542 0.940 0.940 weight 1.000 ! spec=13C_aro, no=345, id=2732, vol=6.184350e+05
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name   HB)
assign (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   46 and name HD22) 4.167 2.171 2.171 weight 1.000 ! spec=13C_aro, no=350, id=2733, vol=1.606277e+05
    or (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   39 and name  HE3) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name  HE3) 4.630 2.680 2.680 weight 1.000 ! spec=13C_aro, no=354, id=2734, vol=2.495682e+05
assign (segid "   A" and resid   39 and name  HH2) (segid "   A" and resid   39 and name  HE3) 4.079 2.079 2.079 weight 1.000 ! spec=13C_aro, no=359, id=2735, vol=2.769180e+05
assign (segid "   A" and resid   56 and name  HE1) (segid "   A" and resid   56 and name  HD1) 4.317 2.330 2.330 weight 1.000 ! spec=13C_aro, no=377, id=2738, vol=3.417716e+05
    or (segid "   A" and resid   56 and name  HE1) (segid "   A" and resid   56 and name  HD2)
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   56 and name  HD1)
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   56 and name   HZ) (segid "   A" and resid   56 and name  HD1) 3.438 1.478 1.478 weight 1.000 ! spec=13C_aro, no=380, id=2741, vol=1.028896e+06
    or (segid "   A" and resid   56 and name   HZ) (segid "   A" and resid   56 and name  HD2)
assign (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   54 and name HG21) 4.727 2.793 2.793 weight 1.000 ! spec=13C_aro, no=406, id=2742, vol=1.784333e+05
    or (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   54 and name HG22)
    or (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   54 and name HG23)
assign (segid "   A" and resid   23 and name  HZ2) (segid "   A" and resid   72 and name  HB2) 5.534 3.828 3.828 weight 1.000 ! spec=13C_aro, no=430, id=2743, vol=9.220736e+04
assign (segid "   A" and resid    8 and name   HZ) (segid "   A" and resid   64 and name HG22) 4.034 1.228 1.228 weight 1.000 ! spec=13C_aro, no=432, id=2745, vol=9.220736e+04
    or (segid "   A" and resid    8 and name   HZ) (segid "   A" and resid   64 and name HG21)
    or (segid "   A" and resid    8 and name   HZ) (segid "   A" and resid   64 and name HG23)
assign (segid "   A" and resid   56 and name   HZ) (segid "   A" and resid   37 and name  HB1) 3.155 1.245 1.245 weight 1.000 ! spec=13C_aro, no=433, id=2746, vol=9.429533e+05
assign (segid "   A" and resid  102 and name  HE1) (segid "   A" and resid   72 and name HD12) 3.738 1.747 1.747 weight 1.000 ! spec=13C_aro, no=437, id=2748, vol=3.838750e+05
    or (segid "   A" and resid  102 and name  HE1) (segid "   A" and resid   72 and name HD11)
    or (segid "   A" and resid  102 and name  HE1) (segid "   A" and resid   72 and name HD13)
    or (segid "   A" and resid  102 and name  HE2) (segid "   A" and resid   72 and name HD12)
    or (segid "   A" and resid  102 and name  HE2) (segid "   A" and resid   72 and name HD11)
    or (segid "   A" and resid  102 and name  HE2) (segid "   A" and resid   72 and name HD13)
assign (segid "   A" and resid   23 and name  HE3) (segid "   A" and resid   17 and name  HB3) 3.316 1.063 1.363 weight 1.000 ! spec=13C_aro, no=438, id=2749, vol=8.575475e+05
    or (segid "   A" and resid   23 and name  HE3) (segid "   A" and resid   17 and name  HB2)
    or (segid "   A" and resid   23 and name  HE3) (segid "   A" and resid   17 and name  HB1)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   23 and name  HZ3) 2.646 0.875 0.875 weight 1.000 ! spec=13C_aro, no=442, id=2751, vol=8.877350e+05
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   23 and name  HZ3)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   23 and name  HZ3)
assign (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   29 and name HG13) 3.346 0.875 0.875 weight 1.000 ! spec=13C_aro, no=447,
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   27 and name  HD2) (segid "   A" and resid   29 and name HG11)
    or (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   29 and name HG12)
    or (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   29 and name HG11)
    or (segid "   A" and resid   27 and name  HD1) (segid "   A" and resid   29 and name HG13)
assign (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   70 and name HD12) 3.138 1.231 1.231 weight 1.000 ! spec=13C_aro, no=449, id=2755, vol=3.519819e+05
    or (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   39 and name  HD1) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   73 and name HD22) (segid "   A" and resid   73 and name HD21) 1.975 0.488 0.488 weight 1.000 ! spec=15N, no=3, id=1, vol=1.016526e+08
assign (segid "   A" and resid   82 and name HD22) (segid "   A" and resid   82 and name HD21) 1.485 0.275 0.275 weight 1.000 ! spec=15N, no=6, id=2, vol=2.840799e+08
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD12) 3.822 1.826 1.826 weight 1.000 ! spec=15N, no=7, id=3, vol=2.873166e+07
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD13)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD22)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name  HB2) 3.250 1.320 1.320 weight 1.000 ! spec=15N, no=8, id=4, vol=9.054075e+07
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name  HG2) 3.943 1.943 1.943 weight 1.000 ! spec=15N, no=9, id=5, vol=3.206582e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name   HB) 2.889 1.043 1.043 weight 1.000 ! spec=15N, no=11, id=7, vol=6.160092e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   29 and name   HB) 2.933 1.075 1.075 weight 1.000 ! spec=15N, no=17, id=9, vol=2.713123e+07
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name   HB) 2.253 0.634 0.634 weight 1.000 ! spec=15N, no=19, id=11, vol=1.040852e+08
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name HG12) 2.066 0.534 0.534 weight 1.000 ! spec=15N, no=22, id=13, vol=1.213965e+08
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name HG13)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name HG22) 2.036 0.518 0.518 weight 1.000 ! spec=15N, no=23, id=14, vol=1.209480e+08
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name   HB) 2.981 1.111 1.111 weight 1.000 ! spec=15N, no=24, id=15, vol=4.237748e+07
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  103 and name   HA) 2.622 0.617 0.617 weight 1.000 ! spec=15N, no=27, id=16, vol=1.770768e+08
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD12) 3.269 0.891 0.891 weight 1.000 ! spec=15N, no=28, id=17, vol=3.551306e+07
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name   HB) 2.724 0.927 0.927 weight 1.000 ! spec=15N, no=29, id=18, vol=3.089782e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name HG22) 3.701 1.712 1.712 weight 1.000 ! spec=15N, no=30, id=19, vol=2.181627e+07
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name HG21)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name HG23)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name   HB) 2.742 0.939 0.939 weight 1.000 ! spec=15N, no=31, id=20, vol=3.857798e+07
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HB) 2.663 0.886 0.886 weight 1.000 ! spec=15N, no=32, id=21, vol=5.362510e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HA) 2.422 0.733 0.733 weight 1.000 ! spec=15N, no=33, id=22, vol=1.079099e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB2) 3.298 1.359 1.359 weight 1.000 ! spec=15N, no=34, id=23, vol=2.415884e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   52 and name   HN) 2.090 0.546 0.546 weight 1.000 ! spec=15N, no=35, id=24, vol=9.821191e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HB1) 3.791 1.796 1.796 weight 1.000 ! spec=15N, no=37, id=25, vol=3.133719e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HB2) 2.843 1.011 1.011 weight 1.000 ! spec=15N, no=38, id=26, vol=2.628173e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HD1) 4.009 2.009 2.009 weight 1.000 ! spec=15N, no=39, id=27, vol=3.256990e+07
    or (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB1) 3.592 1.613 1.613 weight 1.000 ! spec=15N, no=42, id=28, vol=3.661963e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  102 and name  HD1) 4.427 2.450 2.450 weight 1.000 ! spec=15N, no=44, id=29, vol=3.079862e+07
    or (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  102 and name  HD2) 
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  101 and name  HB2) 3.968 1.681 1.681 weight 1.000 ! spec=15N, no=46, id=30, vol=3.064234e+07
    or (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  101 and name  HB1)
    or (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  101 and name  HB3)
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name   HA) 2.252 0.634 0.634 weight 1.000 ! spec=15N, no=47, id=31, vol=9.840021e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name   HA) 2.519 0.793 0.793 weight 1.000 ! spec=15N, no=53, id=35, vol=7.523922e+07
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid  107 and name   HA) 2.398 0.719 0.719 weight 1.000 ! spec=15N, no=54, id=36, vol=1.587795e+08
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid  106 and name  HD2) 3.971 1.971 1.971 weight 1.000 ! spec=15N, no=56, id=37, vol=7.612113e+07
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid  107 and name  HB2) 3.502 1.533 1.533 weight 1.000 ! spec=15N, no=57, id=38, vol=6.839051e+07
assign (segid "   A" and resid  107 and name   HN) (segid "   A" and resid  106 and name  HB1) 3.973 1.973 1.973 weight 1.000 ! spec=15N, no=58, id=39, vol=5.163279e+07
assign (segid "   A" and resid   47 and name HD22) (segid "   A" and resid   47 and name  HB2) 4.015 2.015 2.015 weight 1.000 ! spec=15N, no=72, id=44, vol=5.161449e+07
assign (segid "   A" and resid   47 and name HD21) (segid "   A" and resid   47 and name  HB2) 2.708 0.917 0.917 weight 1.000 ! spec=15N, no=76, id=45, vol=5.092151e+07
assign (segid "   A" and resid   82 and name HD21) (segid "   A" and resid   83 and name   HA) 4.575 2.617 2.617 weight 1.000 ! spec=15N, no=84, id=46, vol=2.111598e+07
assign (segid "   A" and resid   82 and name HD22) (segid "   A" and resid   82 and name  HB2) 3.735 1.744 1.744 weight 1.000 ! spec=15N, no=85, id=47, vol=4.587148e+07
assign (segid "   A" and resid   82 and name HD21) (segid "   A" and resid   82 and name  HB2) 3.992 1.992 1.992 weight 1.000 ! spec=15N, no=86, id=48, vol=3.442428e+07
assign (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   79 and name   HA) 4.705 2.767 2.767 weight 1.000 ! spec=15N, no=90, id=49, vol=1.946147e+07
assign (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   79 and name   HA) 2.646 0.875 0.875 weight 1.000 ! spec=15N, no=91, id=50, vol=2.070146e+07
assign (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG12) 4.119 2.121 2.121 weight 1.000 ! spec=15N, no=93, id=51, vol=1.674458e+07
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG13)
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG22)
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG12) 3.735 1.743 1.743 weight 1.000 ! spec=15N, no=94, id=52, vol=2.438678e+07
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG13)
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG22)
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   79 and name  HB2) 3.853 1.856 1.856 weight 1.000 ! spec=15N, no=95, id=53, vol=1.130974e+07
assign (segid "   A" and resid   74 and name HE22) (segid "   A" and resid   74 and name HE21) 1.499 0.281 0.281 weight 1.000 ! spec=15N, no=97, id=55, vol=3.570668e+08
assign (segid "   A" and resid  105 and name HD22) (segid "   A" and resid  105 and name HD21) 1.824 0.353 0.353 weight 1.000 ! spec=15N, no=98, id=56, vol=5.951041e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HA) 2.412 0.727 0.727 weight 1.000 ! spec=15N, no=101, id=57, vol=1.160211e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name   HB) 2.665 0.888 0.888 weight 1.000 ! spec=15N, no=102, id=58, vol=1.032745e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB2) 3.702 1.713 1.713 weight 1.000 ! spec=15N, no=103, id=59, vol=7.238887e+07
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HB1) 2.893 1.047 1.047 weight 1.000 ! spec=15N, no=104, id=60, vol=4.540097e+07
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   80 and name HD22) 1.785 0.398 0.398 weight 1.000 ! spec=15N, no=106, id=61, vol=6.533134e+07
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   80 and name  HB2) 3.357 1.409 1.409 weight 1.000 ! spec=15N, no=109, id=64, vol=2.504448e+07
assign (segid "   A" and resid   73 and name HD22) (segid "   A" and resid   73 and name  HB1) 4.265 2.274 2.274 weight 1.000 ! spec=15N, no=111, id=65, vol=2.966992e+07
assign (segid "   A" and resid   80 and name HD21) (segid "   A" and resid   77 and name   HA) 4.033 2.033 2.033 weight 1.000 ! spec=15N, no=112, id=66, vol=1.015101e+07
assign (segid "   A" and resid   80 and name HD22) (segid "   A" and resid   77 and name   HA) 3.864 1.098 1.098 weight 1.000 ! spec=15N, no=113, id=67, vol=2.390742e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name  HA2) 3.157 1.581 1.581 weight 1.000 ! spec=15N, no=114, id=68, vol=4.923164e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   31 and name  HA1) 2.413 0.669 0.669 weight 1.000 ! spec=15N, no=115, id=69, vol=6.597356e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HB1) 3.267 1.334 1.334 weight 1.000 ! spec=15N, no=117, id=70, vol=2.727343e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HG2) 4.189 2.194 2.194 weight 1.000 ! spec=15N, no=118, id=71, vol=2.220810e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name  HB2) 2.507 0.785 0.785 weight 1.000 ! spec=15N, no=119, id=72, vol=3.370807e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   87 and name   HA) 4.168 2.172 2.172 weight 1.000 ! spec=15N, no=121, id=74, vol=2.210656e+07
assign (segid "   A" and resid   89 and name   HN) (segid "   A" and resid   88 and name   HA) 2.145 0.575 0.575 weight 1.000 ! spec=15N, no=137, id=75, vol=1.537927e+08
assign (segid "   A" and resid   79 and name HD21) (segid "   A" and resid   79 and name  HB1) 3.665 1.679 1.679 weight 1.000 ! spec=15N, no=147, id=76, vol=1.380013e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG12) 3.428 1.469 1.469 weight 1.000 ! spec=15N, no=148, id=77, vol=4.193474e+07
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG13)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG22)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG21)
    or (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name HG23)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name   HA) 2.335 0.682 0.682 weight 1.000 ! spec=15N, no=149, id=78, vol=9.459756e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HD1) 3.661 1.676 1.676 weight 1.000 ! spec=15N, no=151, id=80, vol=3.464854e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name   HA) 3.212 1.290 1.290 weight 1.000 ! spec=15N, no=154, id=82, vol=2.439634e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name   HA) 2.748 0.944 0.944 weight 1.000 ! spec=15N, no=155, id=83, vol=7.794928e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name   HA) 2.692 0.906 0.906 weight 1.000 ! spec=15N, no=156, id=84, vol=7.332135e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HD1) 3.844 1.847 1.847 weight 1.000 ! spec=15N, no=157, id=85, vol=2.859957e+07
    or (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HD2)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   43 and name   HN) 4.270 2.280 2.280 weight 1.000 ! spec=15N, no=158, id=86, vol=2.760050e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name  HB1) 3.298 1.360 1.360 weight 1.000 ! spec=15N, no=160, id=87, vol=2.152153e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HE1) 4.313 2.326 2.326 weight 1.000 ! spec=15N, no=161, id=88, vol=1.780811e+07
    or (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HE2)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   82 and name  HB2) 3.278 1.035 1.035 weight 1.000 ! spec=15N, no=163, id=89, vol=4.446304e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name   HA) 3.417 1.460 1.460 weight 1.000 ! spec=15N, no=166, id=91, vol=4.029516e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name   HA) 2.796 0.977 0.977 weight 1.000 ! spec=15N, no=167, id=92, vol=3.770529e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   48 and name   HA) 4.630 2.679 2.679 weight 1.000 ! spec=15N, no=168, id=93, vol=2.135323e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HG11) 3.718 1.728 1.728 weight 1.000 ! spec=15N, no=170, id=94, vol=3.225637e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   53 and name  HD1) 4.039 1.655 1.655 weight 1.000 ! spec=15N, no=172, id=95, vol=3.923252e+07
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   53 and name  HD2)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HD1) 4.820 2.904 2.904 weight 1.000 ! spec=15N, no=175, id=96, vol=2.294056e+07
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HD2)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name   HA) 2.442 0.746 0.746 weight 1.000 ! spec=15N, no=176, id=97, vol=7.080323e+07
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HB1) 3.976 1.976 1.976 weight 1.000 ! spec=15N, no=178, id=99, vol=3.741115e+07
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name  HB2) 2.875 1.033 1.033 weight 1.000 ! spec=15N, no=179, id=100, vol=3.768168e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HA) 2.605 0.848 0.848 weight 1.000 ! spec=15N, no=180, id=101, vol=6.595709e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name  HB2) 3.246 1.317 1.317 weight 1.000 ! spec=15N, no=181, id=102, vol=3.706592e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HA) 3.271 1.338 1.338 weight 1.000 ! spec=15N, no=183, id=103, vol=1.949402e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HN) 4.210 2.215 2.215 weight 1.000 ! spec=15N, no=185, id=104, vol=1.882775e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HA) 3.297 1.359 1.359 weight 1.000 ! spec=15N, no=187, id=106, vol=6.836769e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name  HB1) 4.152 2.154 2.154 weight 1.000 ! spec=15N, no=190, id=107, vol=3.641305e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name  HB2) 3.603 1.622 1.622 weight 1.000 ! spec=15N, no=193, id=109, vol=2.211803e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name  HB2) 3.035 1.151 1.151 weight 1.000 ! spec=15N, no=194, id=110, vol=3.852117e+07
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name   HA) 2.339 0.684 0.684 weight 1.000 ! spec=15N, no=197, id=112, vol=1.098076e+08
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   97 and name   HA) 3.805 1.810 1.810 weight 1.000 ! spec=15N, no=198, id=113, vol=2.380073e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB2) 3.327 1.384 1.384 weight 1.000 ! spec=15N, no=199, id=114, vol=2.870658e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   30 and name  HB1) 3.335 1.390 1.390 weight 1.000 ! spec=15N, no=200, id=115, vol=2.416851e+07
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name  HB1) 2.423 0.734 0.734 weight 1.000 ! spec=15N, no=201, id=116, vol=8.485709e+07
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name  HB2) 2.791 0.974 0.974 weight 1.000 ! spec=15N, no=202, id=117, vol=7.274520e+07
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   94 and name   HA) 2.903 1.053 1.053 weight 1.000 ! spec=15N, no=205, id=119, vol=3.947752e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB2) 2.657 0.883 0.883 weight 1.000 ! spec=15N, no=212, id=120, vol=8.091427e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   93 and name   HA) 3.613 1.632 1.632 weight 1.000 ! spec=15N, no=213, id=121, vol=2.976331e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   92 and name  HA2) 2.779 0.966 0.966 weight 1.000 ! spec=15N, no=214, id=122, vol=8.867704e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   92 and name  HA1) 2.898 1.050 1.050 weight 1.000 ! spec=15N, no=215, id=123, vol=6.954861e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   91 and name  HB2) 4.198 2.203 2.203 weight 1.000 ! spec=15N, no=216, id=124, vol=3.456927e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   91 and name  HB1) 2.711 0.918 0.918 weight 1.000 ! spec=15N, no=217, id=125, vol=4.000913e+07
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   92 and name   HN) 2.527 0.798 0.798 weight 1.000 ! spec=15N, no=218, id=126, vol=8.888449e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   89 and name   HN) 2.963 1.097 1.097 weight 1.000 ! spec=15N, no=219, id=127, vol=4.333058e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   32 and name   HN) 3.909 1.813 1.813 weight 1.000 ! spec=15N, no=222, id=128, vol=2.586446e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name   HA) 2.377 0.706 0.706 weight 1.000 ! spec=15N, no=224, id=129, vol=1.226445e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name  HA2) 3.164 1.251 1.251 weight 1.000 ! spec=15N, no=225, id=130, vol=4.119575e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name  HB1) 3.720 1.730 1.730 weight 1.000 ! spec=15N, no=226, id=131, vol=2.752571e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   31 and name  HA1) 2.678 0.897 0.897 weight 1.000 ! spec=15N, no=227, id=132, vol=5.628069e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   88 and name  HB2) 4.181 2.185 2.185 weight 1.000 ! spec=15N, no=231, id=133, vol=2.321217e+07
    or (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name   HA) 2.486 0.772 0.772 weight 1.000 ! spec=15N, no=233, id=134, vol=6.917785e+07
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   32 and name   HA) 3.042 1.156 1.156 weight 1.000 ! spec=15N, no=235, id=135, vol=2.816400e+07
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB2) 4.191 2.195 2.195 weight 1.000 ! spec=15N, no=238, id=137, vol=2.650174e+07
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name   HA) 2.241 0.628 0.628 weight 1.000 ! spec=15N, no=240, id=138, vol=8.026504e+07
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HB2) 4.538 2.574 2.574 weight 1.000 ! spec=15N, no=241, id=139, vol=3.465905e+07
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name   HA) 2.619 0.857 0.857 weight 1.000 ! spec=15N, no=242, id=140, vol=5.889338e+07
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name   HB) 2.645 0.875 0.875 weight 1.000 ! spec=15N, no=244, id=141, vol=7.097879e+07
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name  HB1) 3.572 1.595 1.595 weight 1.000 ! spec=15N, no=245, id=142, vol=3.378250e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name  HB1) 3.268 1.335 1.335 weight 1.000 ! spec=15N, no=252, id=144, vol=2.372795e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HG) 3.964 1.965 1.965 weight 1.000 ! spec=15N, no=253, id=145, vol=2.998884e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name  HB2) 3.113 1.211 1.211 weight 1.000 ! spec=15N, no=254, id=146, vol=2.387216e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HD12) 3.764 1.771 1.771 weight 1.000 ! spec=15N, no=255, id=147, vol=2.864506e+07
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   84 and name   HB) 3.688 1.700 1.700 weight 1.000 ! spec=15N, no=257, id=148, vol=2.156065e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name  HB2) 4.076 2.076 2.076 weight 1.000 ! spec=15N, no=258, id=149, vol=3.459801e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   40 and name   HA) 3.136 1.229 1.229 weight 1.000 ! spec=15N, no=260, id=150, vol=1.696274e+07
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name  HB2) 2.460 0.757 0.757 weight 1.000 ! spec=15N, no=261, id=151, vol=9.416318e+07
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name  HA1) 2.557 0.817 0.817 weight 1.000 ! spec=15N, no=262, id=152, vol=7.457634e+07
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   42 and name   HA) 4.412 2.433 2.433 weight 1.000 ! spec=15N, no=263, id=153, vol=2.299557e+07
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name  HA2) 3.120 1.216 1.216 weight 1.000 ! spec=15N, no=264, id=154, vol=6.192032e+07
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   82 and name   HA) 3.003 1.127 1.127 weight 1.000 ! spec=15N, no=265, id=155, vol=3.225154e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name   HA) 2.993 1.120 1.120 weight 1.000 ! spec=15N, no=268, id=157, vol=5.669919e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HB) 3.871 1.873 1.873 weight 1.000 ! spec=15N, no=271, id=160, vol=4.222690e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name HG12) 3.712 1.723 1.723 weight 1.000 ! spec=15N, no=272, id=161, vol=4.421354e+07
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name HG13)
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   57 and name HD12) 4.516 2.549 2.549 weight 1.000 ! spec=15N, no=275, id=162, vol=1.701276e+07
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   78 and name   HA) 2.773 0.961 0.961 weight 1.000 ! spec=15N, no=276, id=163, vol=5.516243e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   13 and name  HB2) 3.350 1.403 1.403 weight 1.000 ! spec=15N, no=279, id=165, vol=2.834239e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name   HA) 3.124 1.220 1.220 weight 1.000 ! spec=15N, no=280, id=166, vol=2.886252e+07
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name  HB2) 3.404 1.448 1.448 weight 1.000 ! spec=15N, no=282, id=167, vol=4.832157e+07
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name  HB1) 2.774 0.962 0.962 weight 1.000 ! spec=15N, no=283, id=168, vol=3.814068e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name  HB2) 4.079 2.079 2.079 weight 1.000 ! spec=15N, no=288, id=170, vol=3.769031e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  100 and name   HA) 2.977 1.108 1.108 weight 1.000 ! spec=15N, no=290, id=172, vol=2.799132e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name   HN) 4.443 2.468 2.468 weight 1.000 ! spec=15N, no=291, id=173, vol=1.906461e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  101 and name   HN) 3.949 1.949 1.949 weight 1.000 ! spec=15N, no=292, id=174, vol=2.217463e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   81 and name   HN) 3.123 1.219 1.219 weight 1.000 ! spec=15N, no=294, id=175, vol=2.995786e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name  HG2) 3.353 1.405 1.405 weight 1.000 ! spec=15N, no=297, id=176, vol=2.063160e+07
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name   HA) 2.254 0.635 0.635 weight 1.000 ! spec=15N, no=298, id=177, vol=1.208909e+08
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name   HA) 2.929 1.072 1.072 weight 1.000 ! spec=15N, no=300, id=178, vol=3.699461e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name   HA) 2.228 0.621 0.621 weight 1.000 ! spec=15N, no=301, id=179, vol=1.197633e+08
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   97 and name   HA) 2.337 0.683 0.683 weight 1.000 ! spec=15N, no=302, id=180, vol=8.844031e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name HG12) 4.015 2.015 2.015 weight 1.000 ! spec=15N, no=310, id=181, vol=1.838517e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HB2) 3.244 1.315 1.315 weight 1.000 ! spec=15N, no=312, id=182, vol=2.234005e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   28 and name  HB1) 4.057 2.057 2.057 weight 1.000 ! spec=15N, no=313, id=183, vol=2.792675e+07
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name   HA) 2.872 1.031 1.031 weight 1.000 ! spec=15N, no=314, id=184, vol=5.695216e+07
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name  HB2) 3.950 1.950 1.950 weight 1.000 ! spec=15N, no=316, id=185, vol=3.404620e+07
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   84 and name   HB) 2.640 0.871 0.871 weight 1.000 ! spec=15N, no=317, id=186, vol=5.020510e+07
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name  HG1) 3.480 1.186 1.186 weight 1.000 ! spec=15N, no=318, id=187, vol=4.354462e+07
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name  HB2) 4.132 2.135 2.135 weight 1.000 ! spec=15N, no=319, id=188, vol=3.557998e+07
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   40 and name  HB2) 3.740 1.749 1.749 weight 1.000 ! spec=15N, no=320, id=189, vol=4.099294e+07
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   92 and name  HA1) 2.641 0.872 0.872 weight 1.000 ! spec=15N, no=324, id=190, vol=6.815183e+07
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   92 and name  HA2) 3.614 1.633 1.633 weight 1.000 ! spec=15N, no=325, id=191, vol=8.170373e+07
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   88 and name   HA) 4.184 2.188 2.188 weight 1.000 ! spec=15N, no=326, id=192, vol=3.373293e+07
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name   HA) 2.975 1.107 1.107 weight 1.000 ! spec=15N, no=330, id=193, vol=3.346972e+07
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   76 and name   HB) 3.861 1.863 1.863 weight 1.000 ! spec=15N, no=331, id=194, vol=1.562572e+07
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   79 and name  HB1) 3.921 1.922 1.922 weight 1.000 ! spec=15N, no=332, id=195, vol=2.853687e+07
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   75 and name   HA) 2.307 0.665 0.665 weight 1.000 ! spec=15N, no=333, id=196, vol=1.117545e+08
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   79 and name   HN) 3.391 1.437 1.437 weight 1.000 ! spec=15N, no=336, id=197, vol=3.479125e+07
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid  102 and name  HB2) 4.307 2.319 2.319 weight 1.000 ! spec=15N, no=340, id=198, vol=1.495918e+07
assign (segid "   A" and resid   76 and name   HN) (segid "   A" and resid   79 and name  HB2) 3.116 1.213 1.213 weight 1.000 ! spec=15N, no=342, id=200, vol=1.799607e+07
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HA) 3.266 1.334 1.334 weight 1.000 ! spec=15N, no=343, id=201, vol=1.556072e+07
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   76 and name   HA) 3.999 1.999 1.999 weight 1.000 ! spec=15N, no=344, id=202, vol=3.280764e+07
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name   HN) 2.773 0.961 0.961 weight 1.000 ! spec=15N, no=346, id=203, vol=3.189712e+07
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   79 and name   HN) 2.394 0.717 0.717 weight 1.000 ! spec=15N, no=347, id=204, vol=7.785999e+07
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   76 and name   HB) 2.670 0.891 0.891 weight 1.000 ! spec=15N, no=349, id=205, vol=4.545834e+07
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name  HB2) 3.888 1.889 1.889 weight 1.000 ! spec=15N, no=350, id=206, vol=2.511186e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name   HA) 2.853 1.017 1.017 weight 1.000 ! spec=15N, no=353, id=209, vol=4.506341e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name   HA) 3.291 1.354 1.354 weight 1.000 ! spec=15N, no=354, id=210, vol=3.046205e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name  HB2) 2.709 0.918 0.918 weight 1.000 ! spec=15N, no=356, id=211, vol=3.344706e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   79 and name  HB1) 3.534 1.561 1.561 weight 1.000 ! spec=15N, no=357, id=212, vol=4.533957e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid  102 and name  HB2) 4.266 2.275 2.275 weight 1.000 ! spec=15N, no=358, id=213, vol=1.692918e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   78 and name   HN) 3.746 1.754 1.754 weight 1.000 ! spec=15N, no=361, id=214, vol=3.055038e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name   HA) 3.107 1.207 1.207 weight 1.000 ! spec=15N, no=362, id=215, vol=4.559331e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   79 and name   HA) 2.854 1.018 1.018 weight 1.000 ! spec=15N, no=363, id=216, vol=4.988891e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   78 and name   HA) 3.197 1.277 1.277 weight 1.000 ! spec=15N, no=364, id=217, vol=2.597893e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name  HB1) 2.517 0.792 0.792 weight 1.000 ! spec=15N, no=365, id=218, vol=6.362799e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name  HB2) 3.813 1.818 1.818 weight 1.000 ! spec=15N, no=366, id=219, vol=4.450214e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   79 and name  HB2) 3.630 1.647 1.647 weight 1.000 ! spec=15N, no=367, id=220, vol=2.385166e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   79 and name  HB1) 3.944 1.945 1.945 weight 1.000 ! spec=15N, no=368, id=221, vol=2.813499e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name  HB1) 4.636 2.687 2.687 weight 1.000 ! spec=15N, no=369, id=222, vol=2.374980e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name  HB2) 3.536 1.563 1.563 weight 1.000 ! spec=15N, no=370, id=223, vol=3.671431e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  101 and name   HA) 3.743 1.751 1.751 weight 1.000 ! spec=15N, no=371, id=224, vol=1.867194e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name  HA1) 3.120 1.216 1.216 weight 1.000 ! spec=15N, no=372, id=225, vol=4.134663e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   81 and name  HA2) 3.038 1.153 1.153 weight 1.000 ! spec=15N, no=373, id=226, vol=3.927463e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name   HN) 4.760 2.832 2.832 weight 1.000 ! spec=15N, no=374, id=227, vol=2.219599e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   41 and name  HE1) 4.221 2.028 2.028 weight 1.000 ! spec=15N, no=375, id=228, vol=2.162695e+07
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   41 and name  HE2)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   83 and name  HE1) 3.565 1.174 1.174 weight 1.000 ! spec=15N, no=376, id=229, vol=3.329990e+07
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   83 and name  HE2)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  100 and name  HB2) 3.199 1.279 1.279 weight 1.000 ! spec=15N, no=379, id=231, vol=3.203117e+07
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  100 and name  HB1)
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid  100 and name  HB3)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   41 and name  HE1) 4.252 2.260 2.260 weight 1.000 ! spec=15N, no=380, id=232, vol=2.435389e+07
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   41 and name  HE2)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   42 and name HD22) 3.840 1.566 1.566 weight 1.000 ! spec=15N, no=381, id=233, vol=2.295894e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   98 and name   HN) 3.125 1.220 1.220 weight 1.000 ! spec=15N, no=382, id=234, vol=2.803992e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   82 and name  HB2) 4.211 2.216 2.216 weight 1.000 ! spec=15N, no=384, id=235, vol=2.164857e+07
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   41 and name   HA) 3.649 1.665 1.665 weight 1.000 ! spec=15N, no=386, id=236, vol=2.592637e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   84 and name   HN) 3.021 1.141 1.141 weight 1.000 ! spec=15N, no=387, id=237, vol=2.882560e+07
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   84 and name   HA) 2.158 0.582 0.582 weight 1.000 ! spec=15N, no=393, id=238, vol=1.146584e+08
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB2) 2.075 0.538 0.538 weight 1.000 ! spec=15N, no=395, id=239, vol=9.076867e+07
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name   HA) 2.167 0.587 0.587 weight 1.000 ! spec=15N, no=396, id=240, vol=1.167307e+08
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   86 and name   HA) 2.278 0.649 0.649 weight 1.000 ! spec=15N, no=397, id=241, vol=8.269548e+07
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name   HN) 3.671 1.684 1.684 weight 1.000 ! spec=15N, no=398, id=242, vol=3.845487e+07
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name   HA) 2.111 0.557 0.557 weight 1.000 ! spec=15N, no=399, id=243, vol=1.332964e+08
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   35 and name  HG1) 4.315 2.327 2.327 weight 1.000 ! spec=15N, no=405, id=247, vol=3.883524e+07
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   35 and name  HB1) 3.856 1.858 1.858 weight 1.000 ! spec=15N, no=406, id=248, vol=3.432689e+07
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   90 and name  HB2) 3.317 1.376 1.376 weight 1.000 ! spec=15N, no=411, id=251, vol=4.048092e+07
assign (segid "   A" and resid   91 and name   HN) (segid "   A" and resid   91 and name   HA) 2.888 1.042 1.042 weight 1.000 ! spec=15N, no=412, id=252, vol=7.115314e+07
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   93 and name   HA) 2.230 0.622 0.622 weight 1.000 ! spec=15N, no=413, id=253, vol=1.044685e+08
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   93 and name  HG1) 3.112 1.210 1.210 weight 1.000 ! spec=15N, no=415, id=254, vol=4.361503e+07
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   87 and name   HN) 2.837 1.006 1.006 weight 1.000 ! spec=15N, no=417, id=256, vol=3.762342e+07
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   95 and name   HA) 2.953 1.090 1.090 weight 1.000 ! spec=15N, no=418, id=257, vol=3.910452e+07
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   95 and name  HB1) 3.297 1.359 1.359 weight 1.000 ! spec=15N, no=419, id=258, vol=3.154402e+07
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   94 and name   HA) 2.400 0.720 0.720 weight 1.000 ! spec=15N, no=420, id=259, vol=1.457528e+08
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   93 and name  HG2) 4.063 2.064 2.064 weight 1.000 ! spec=15N, no=421, id=260, vol=1.546005e+07
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   86 and name  HB2) 5.263 3.462 3.462 weight 1.000 ! spec=15N, no=424, id=262, vol=1.214305e+07
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG12) 3.670 1.684 1.684 weight 1.000 ! spec=15N, no=425, id=263, vol=2.849112e+07
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   84 and name HG21) 2.537 0.804 0.804 weight 1.000 ! spec=15N, no=428, id=266, vol=4.909087e+07
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   95 and name  HB2) 2.768 0.958 0.958 weight 1.000 ! spec=15N, no=429, id=267, vol=5.140499e+07
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   96 and name   HA) 2.863 1.025 1.025 weight 1.000 ! spec=15N, no=430, id=268, vol=4.111495e+07
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   95 and name   HA) 2.254 0.635 0.635 weight 1.000 ! spec=15N, no=432, id=269, vol=1.124765e+08
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   85 and name   HN) 2.680 0.897 0.897 weight 1.000 ! spec=15N, no=435, id=270, vol=4.213890e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   98 and name HG22) 3.617 1.635 1.635 weight 1.000 ! spec=15N, no=437, id=271, vol=3.052435e+07
    or (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   98 and name HG23)
!assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   98 and name HG12) 4.698 2.758 2.758 weight 1.000 ! spec=15N, no=439, id=273, vol=1.457510e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name  HB1) 4.091 2.093 2.093 weight 1.000 ! spec=15N, no=441, id=274, vol=3.487588e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name  HB2) 2.899 1.051 1.051 weight 1.000 ! spec=15N, no=442, id=275, vol=5.025543e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name   HA) 2.306 0.665 0.665 weight 1.000 ! spec=15N, no=443, id=276, vol=1.726518e+08
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   97 and name   HA) 3.154 1.244 1.244 weight 1.000 ! spec=15N, no=444, id=277, vol=3.475850e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   96 and name   HN) 4.005 2.005 2.005 weight 1.000 ! spec=15N, no=445, id=278, vol=2.364598e+07
assign (segid "   A" and resid   97 and name   HN) (segid "   A" and resid   98 and name   HN) 4.689 2.749 2.749 weight 1.000 ! spec=15N, no=446, id=279, vol=1.566928e+07
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name   HA) 2.929 1.073 1.073 weight 1.000 ! spec=15N, no=453, id=282, vol=2.817892e+07
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   97 and name  HB1) 3.525 1.553 1.553 weight 1.000 ! spec=15N, no=454, id=283, vol=3.059261e+07
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name   HB) 2.900 1.052 1.052 weight 1.000 ! spec=15N, no=457, id=285, vol=2.865252e+07
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name HG22) 2.278 0.649 0.649 weight 1.000 ! spec=15N, no=458, id=286, vol=6.379682e+07
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name HG23)
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   98 and name HG11) 4.209 2.214 2.214 weight 1.000 ! spec=15N, no=460, id=287, vol=1.440211e+07
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name   HB) 3.469 1.504 1.504 weight 1.000 ! spec=15N, no=461, id=288, vol=7.554536e+07
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name HG11) 2.656 0.882 0.882 weight 1.000 ! spec=15N, no=462, id=289, vol=3.868351e+07
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name HG22) 3.345 1.399 1.399 weight 1.000 ! spec=15N, no=463, id=290, vol=4.844178e+07
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   98 and name HG23)
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  100 and name   HA) 2.117 0.560 0.560 weight 1.000 ! spec=15N, no=466, id=292, vol=1.718203e+08
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  101 and name   HA) 2.771 0.960 0.960 weight 1.000 ! spec=15N, no=467, id=293, vol=3.957408e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  101 and name   HA) 4.246 2.149 2.149 weight 1.000 ! spec=15N, no=469, id=294, vol=3.664613e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name   HA) 2.575 0.829 0.829 weight 1.000 ! spec=15N, no=470, id=295, vol=5.934264e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  102 and name   HA) 2.737 0.936 0.936 weight 1.000 ! spec=15N, no=471, id=296, vol=4.124513e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name  HG2) 2.842 1.010 1.010 weight 1.000 ! spec=15N, no=472, id=297, vol=3.248860e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid  103 and name  HB1) 2.447 0.749 0.749 weight 1.000 ! spec=15N, no=474, id=298, vol=7.084930e+07
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  104 and name  HB1) 2.546 0.810 0.810 weight 1.000 ! spec=15N, no=476, id=299, vol=1.107088e+08
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  103 and name  HB1) 4.394 2.413 2.413 weight 1.000 ! spec=15N, no=477, id=300, vol=3.423776e+07
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  103 and name  HB2) 3.552 1.577 1.577 weight 1.000 ! spec=15N, no=478, id=301, vol=3.306188e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB2) 2.308 0.666 0.666 weight 1.000 ! spec=15N, no=479, id=302, vol=9.430149e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name  HB1) 3.697 1.708 1.708 weight 1.000 ! spec=15N, no=480, id=303, vol=4.195155e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   36 and name   HA) 2.150 0.578 0.578 weight 1.000 ! spec=15N, no=483, id=305, vol=1.720148e+08
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  103 and name   HN) 3.997 1.997 1.997 weight 1.000 ! spec=15N, no=484, id=306, vol=2.282725e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name   HA) 3.027 1.146 1.146 weight 1.000 ! spec=15N, no=485, id=307, vol=2.984211e+07
assign (segid "   A" and resid  105 and name   HN) (segid "   A" and resid  105 and name  HB2) 2.339 0.684 0.684 weight 1.000 ! spec=15N, no=489, id=309, vol=1.488976e+08
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    7 and name  HB2) 3.647 1.850 1.850 weight 1.000 ! spec=15N, no=491, id=310, vol=3.610251e+07
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name   HB) 2.842 0.745 0.745 weight 1.000 ! spec=15N, no=492, id=311, vol=8.573447e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HB2) 2.553 0.815 0.815 weight 1.000 ! spec=15N, no=496, id=314, vol=6.782542e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name   HA) 2.405 0.723 0.723 weight 1.000 ! spec=15N, no=497, id=315, vol=1.106529e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HA) 2.340 0.684 0.684 weight 1.000 ! spec=15N, no=498, id=316, vol=6.706859e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name   HA) 2.715 0.921 0.921 weight 1.000 ! spec=15N, no=500, id=317, vol=5.641284e+07
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name   HA) 2.861 1.023 1.023 weight 1.000 ! spec=15N, no=506, id=318, vol=5.733181e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   30 and name   HA) 3.963 1.963 1.963 weight 1.000 ! spec=15N, no=508, id=320, vol=2.674688e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name   HA) 2.958 1.094 1.094 weight 1.000 ! spec=15N, no=509, id=321, vol=3.513149e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.081 1.187 1.187 weight 1.000 ! spec=15N, no=510, id=322, vol=3.662743e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name HG12) 3.845 1.848 1.848 weight 1.000 ! spec=15N, no=514, id=323, vol=2.793593e+07
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   29 and name HG12) 4.719 2.784 2.784 weight 1.000 ! spec=15N, no=516, id=324, vol=1.310833e+07
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   29 and name HG11)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   29 and name HG13)
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB2) 3.609 1.628 1.628 weight 1.000 ! spec=15N, no=519, id=327, vol=8.038920e+07
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HA) 2.178 0.593 0.593 weight 1.000 ! spec=15N, no=520, id=328, vol=1.548065e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA) 2.903 1.054 1.054 weight 1.000 ! spec=15N, no=521, id=329, vol=3.035161e+07
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HN) 4.290 2.301 2.301 weight 1.000 ! spec=15N, no=522, id=330, vol=2.964850e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HA) 2.293 0.657 0.657 weight 1.000 ! spec=15N, no=523, id=331, vol=1.070501e+08
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HA) 2.319 0.672 0.672 weight 1.000 ! spec=15N, no=528, id=333, vol=1.065373e+08
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name   HA) 3.264 1.332 1.332 weight 1.000 ! spec=15N, no=529, id=334, vol=2.588738e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB1) 3.817 1.821 1.821 weight 1.000 ! spec=15N, no=530, id=335, vol=4.483610e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name  HB2) 3.634 1.651 1.651 weight 1.000 ! spec=15N, no=531, id=336, vol=5.052263e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HD22) 2.777 0.964 0.964 weight 1.000 ! spec=15N, no=532, id=337, vol=5.612381e+07
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HD21)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HD23)
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HD2) 3.491 1.524 1.524 weight 1.000 ! spec=15N, no=537, id=338, vol=2.508005e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   27 and name   HA) 3.840 1.844 1.844 weight 1.000 ! spec=15N, no=539, id=339, vol=2.190690e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HA) 2.074 0.538 0.538 weight 1.000 ! spec=15N, no=542, id=340, vol=1.551343e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG21) 2.024 0.512 0.512 weight 1.000 ! spec=15N, no=544, id=341, vol=1.238783e+08
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG22)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name HG23)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB2) 2.816 0.991 0.991 weight 1.000 ! spec=15N, no=552, id=343, vol=5.817604e+07
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB1) 3.097 1.199 1.199 weight 1.000 ! spec=15N, no=554, id=344, vol=4.488902e+07
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HG2) 4.819 2.903 2.903 weight 1.000 ! spec=15N, no=555, id=345, vol=2.131244e+07
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HB1) 4.299 2.310 2.310 weight 1.000 ! spec=15N, no=556, id=346, vol=1.962751e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HA) 2.968 1.101 1.101 weight 1.000 ! spec=15N, no=558, id=347, vol=4.420834e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HB2) 2.645 0.523 0.523 weight 1.000 ! spec=15N, no=559, id=348, vol=8.709742e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name  HB1) 2.880 1.037 1.037 weight 1.000 ! spec=15N, no=560, id=349, vol=4.227123e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name  HB1) 2.950 1.088 1.088 weight 1.000 ! spec=15N, no=565, id=350, vol=3.470846e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HN) 4.168 2.171 2.171 weight 1.000 ! spec=15N, no=574, id=351, vol=1.711218e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.438 0.743 0.743 weight 1.000 ! spec=15N, no=577, id=352, vol=5.611147e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name  HB1) 4.073 2.074 2.074 weight 1.000 ! spec=15N, no=578, id=353, vol=2.160610e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name  HB2) 4.187 2.192 2.192 weight 1.000 ! spec=15N, no=579, id=354, vol=2.570642e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name  HB1) 3.832 1.836 1.836 weight 1.000 ! spec=15N, no=581, id=355, vol=3.297702e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   13 and name   HN) 2.864 1.025 1.025 weight 1.000 ! spec=15N, no=584, id=356, vol=3.953359e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HN) 4.459 2.485 2.485 weight 1.000 ! spec=15N, no=588, id=357, vol=1.561718e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name   HA) 2.463 0.758 0.758 weight 1.000 ! spec=15N, no=591, id=358, vol=8.402233e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   27 and name  HB1) 2.648 0.876 0.876 weight 1.000 ! spec=15N, no=593, id=359, vol=6.422685e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HB2) 4.421 2.443 2.443 weight 1.000 ! spec=15N, no=595, id=360, vol=2.830181e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name  HB1) 3.856 1.859 1.859 weight 1.000 ! spec=15N, no=596, id=361, vol=2.605070e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HA) 2.203 0.607 0.607 weight 1.000 ! spec=15N, no=597, id=362, vol=1.192062e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name   HA) 4.299 2.310 2.310 weight 1.000 ! spec=15N, no=599, id=363, vol=1.650783e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   30 and name   HN) 2.792 0.974 0.974 weight 1.000 ! spec=15N, no=604, id=364, vol=4.860482e+07
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   36 and name   HN) 2.612 0.853 0.853 weight 1.000 ! spec=15N, no=616, id=366, vol=5.340021e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name   HN) 4.250 2.258 2.258 weight 1.000 ! spec=15N, no=617, id=367, vol=2.037574e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   36 and name   HA) 2.490 0.775 0.775 weight 1.000 ! spec=15N, no=618, id=368, vol=1.411652e+08
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   89 and name  HB2) 4.281 2.291 2.291 weight 1.000 ! spec=15N, no=620, id=369, vol=2.393281e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   89 and name  HB1) 4.856 2.947 2.947 weight 1.000 ! spec=15N, no=621, id=370, vol=2.313991e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HB2) 2.707 0.916 0.916 weight 1.000 ! spec=15N, no=623, id=371, vol=4.587560e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   88 and name  HB2) 3.163 1.250 1.250 weight 1.000 ! spec=15N, no=625, id=372, vol=3.037515e+07
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   88 and name  HB1)
    or (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   88 and name  HB3)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HA) 2.135 0.570 0.570 weight 1.000 ! spec=15N, no=628, id=374, vol=1.451415e+08
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name   HA) 2.758 0.951 0.951 weight 1.000 ! spec=15N, no=629, id=375, vol=4.817756e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   85 and name   HA) 3.507 1.537 1.537 weight 1.000 ! spec=15N, no=630, id=376, vol=2.467818e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   38 and name  HB2) 3.075 1.182 1.182 weight 1.000 ! spec=15N, no=633, id=377, vol=5.352058e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name  HB2) 3.342 1.396 1.396 weight 1.000 ! spec=15N, no=634, id=378, vol=7.632552e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name  HB1) 2.520 0.794 0.794 weight 1.000 ! spec=15N, no=635, id=379, vol=5.620588e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   46 and name HD22) 3.840 1.844 1.844 weight 1.000 ! spec=15N, no=647, id=382, vol=2.378417e+07
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   46 and name HD21)
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   46 and name HD23)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name  HB1) 3.916 1.916 1.916 weight 1.000 ! spec=15N, no=648, id=383, vol=4.556097e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name  HG2) 3.246 1.317 1.317 weight 1.000 ! spec=15N, no=649, id=384, vol=2.937368e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name  HD2) 3.756 1.764 1.764 weight 1.000 ! spec=15N, no=650, id=385, vol=8.816553e+07
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HA) 2.312 0.668 0.668 weight 1.000 ! spec=15N, no=651, id=386, vol=1.177736e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name   HA) 3.220 1.296 1.296 weight 1.000 ! spec=15N, no=652, id=387, vol=2.531422e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HD1) 4.589 2.633 2.633 weight 1.000 ! spec=15N, no=657, id=388, vol=2.523835e+07
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   41 and name  HD2)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   45 and name   HA) 3.324 0.796 0.796 weight 1.000 ! spec=15N, no=658, id=389, vol=4.969681e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name   HN) 3.387 1.987 1.987 weight 1.000 ! spec=15N, no=659, id=390, vol=4.374470e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   41 and name   HN) 2.887 0.987 0.987 weight 1.000 ! spec=15N, no=660,
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name   HA) 2.880 1.037 1.037 weight 1.000 ! spec=15N, no=662, id=391, vol=5.711969e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   44 and name  HB1) 2.489 0.775 0.775 weight 1.000 ! spec=15N, no=663, id=392, vol=9.847976e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HA1) 3.366 0.956 0.956 weight 1.000 ! spec=15N, no=664, id=393, vol=4.599789e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   43 and name  HA2) 3.540 1.066 1.066 weight 1.000 ! spec=15N, no=665, id=394, vol=4.572230e+07
!assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   45 and name   HB) 4.532 2.568 2.568 weight 1.000 ! spec=15N, no=668, id=395, vol=2.423376e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name  HB1) 4.021 2.021 2.021 weight 1.000 ! spec=15N, no=669, id=396, vol=3.083797e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD12) 4.032 1.149 1.149 weight 1.000 ! spec=15N, no=671, id=397, vol=3.807882e+07
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HB2) 2.521 0.794 0.794 weight 1.000 ! spec=15N, no=675, id=398, vol=9.383500e+07
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   45 and name   HA) 2.373 0.704 0.704 weight 1.000 ! spec=15N, no=676, id=399, vol=1.156831e+08
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   40 and name   HA) 2.982 1.111 1.111 weight 1.000 ! spec=15N, no=681, id=400, vol=2.839640e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name   HA) 3.265 1.333 1.333 weight 1.000 ! spec=15N, no=682, id=401, vol=2.108827e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name   HA) 2.324 0.675 0.675 weight 1.000 ! spec=15N, no=683, id=402, vol=9.279532e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   45 and name   HB) 3.171 1.257 1.257 weight 1.000 ! spec=15N, no=685, id=403, vol=4.403067e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   46 and name  HB1) 2.736 0.935 0.935 weight 1.000 ! spec=15N, no=686, id=404, vol=3.262525e+07
assign (segid "   A" and resid   46 and name   HN) (segid "   A" and resid   41 and name   HN) 4.095 1.096 1.096 weight 1.000 ! spec=15N, no=690, id=407, vol=1.818039e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name   HG) 3.395 1.441 1.441 weight 1.000 ! spec=15N, no=692, id=409, vol=3.123959e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name  HB1) 4.093 2.095 2.095 weight 1.000 ! spec=15N, no=693, id=410, vol=1.931465e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name  HB2) 2.734 0.934 0.934 weight 1.000 ! spec=15N, no=698, id=411, vol=8.819957e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   46 and name   HA) 2.320 0.673 0.673 weight 1.000 ! spec=15N, no=704, id=412, vol=1.296022e+08
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name   HA) 3.305 1.366 1.366 weight 1.000 ! spec=15N, no=707, id=413, vol=2.752236e+07
assign (segid "   A" and resid   47 and name   HN) (segid "   A" and resid   47 and name HD22) 5.331 3.553 3.553 weight 1.000 ! spec=15N, no=711, id=414, vol=1.743453e+07
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name  HG1) 2.331 0.679 0.679 weight 1.000 ! spec=15N, no=715, id=415, vol=1.098581e+08
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   48 and name   HA) 2.960 1.095 1.095 weight 1.000 ! spec=15N, no=716, id=416, vol=4.271681e+07
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name   HA) 2.272 0.645 0.645 weight 1.000 ! spec=15N, no=717, id=417, vol=1.420273e+08
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   52 and name HG22) 3.661 1.675 1.675 weight 1.000 ! spec=15N, no=719, id=418, vol=2.745305e+07
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   52 and name HG21)
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   52 and name HG23)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG21) 2.787 0.971 0.971 weight 1.000 ! spec=15N, no=720, id=419, vol=3.711299e+07
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   52 and name   HB) 3.019 1.139 1.139 weight 1.000 ! spec=15N, no=721, id=420, vol=2.503756e+07
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name  HB1) 2.998 1.123 1.123 weight 1.000 ! spec=15N, no=722, id=421, vol=4.852374e+07
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name  HB2) 4.065 2.065 2.065 weight 1.000 ! spec=15N, no=723, id=422, vol=4.561910e+07
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name   HA) 2.421 0.733 0.733 weight 1.000 ! spec=15N, no=725, id=423, vol=9.452739e+07
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   49 and name   HA) 3.127 1.222 1.222 weight 1.000 ! spec=15N, no=726, id=424, vol=3.194535e+07
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   52 and name   HN) 2.981 1.111 1.111 weight 1.000 ! spec=15N, no=730, id=425, vol=3.826981e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   57 and name   HA) 3.109 1.208 1.208 weight 1.000 ! spec=15N, no=733, id=426, vol=3.451504e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   68 and name  HA2) 3.063 1.173 1.173 weight 1.000 ! spec=15N, no=734, id=427, vol=3.542723e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   68 and name  HA1) 3.698 1.710 1.710 weight 1.000 ! spec=15N, no=735, id=428, vol=2.689999e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HB2) 4.132 2.134 2.134 weight 1.000 ! spec=15N, no=736, id=429, vol=4.039577e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name  HB1) 3.761 1.768 1.768 weight 1.000 ! spec=15N, no=737, id=430, vol=2.246857e+07
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name  HB1) 3.797 1.802 1.802 weight 1.000 ! spec=15N, no=741, id=432, vol=6.134121e+07
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name   HA) 2.369 0.702 0.702 weight 1.000 ! spec=15N, no=742, id=433, vol=1.365040e+08
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name  HB2) 2.357 0.694 0.694 weight 1.000 ! spec=15N, no=745, id=434, vol=7.641747e+07
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name  HB1) 3.255 1.325 1.325 weight 1.000 ! spec=15N, no=746, id=435, vol=5.992988e+07
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name  HB2) 2.980 1.110 1.110 weight 1.000 ! spec=15N, no=747, id=436, vol=7.284400e+07
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   59 and name   HA) 2.178 0.593 0.593 weight 1.000 ! spec=15N, no=748, id=437, vol=2.413524e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HA) 2.163 0.585 0.585 weight 1.000 ! spec=15N, no=754, id=438, vol=1.341632e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HA) 2.255 0.635 0.635 weight 1.000 ! spec=15N, no=756, id=439, vol=1.890590e+08
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   11 and name  HB2) 4.184 2.188 2.188 weight 1.000 ! spec=15N, no=758, id=441, vol=3.285965e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   29 and name   HA) 3.549 1.574 1.574 weight 1.000 ! spec=15N, no=759, id=442, vol=3.119581e+07
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   63 and name   HN) 3.727 1.737 1.737 weight 1.000 ! spec=15N, no=760, id=443, vol=3.979199e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HG2) 3.055 1.167 1.167 weight 1.000 ! spec=15N, no=762, id=444, vol=3.354068e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HB) 3.569 1.592 1.592 weight 1.000 ! spec=15N, no=766, id=445, vol=2.857784e+07
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG12) 2.518 0.793 0.793 weight 1.000 ! spec=15N, no=769, id=447, vol=5.051883e+07
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG13)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name   HA) 2.838 1.007 1.007 weight 1.000 ! spec=15N, no=774, id=448, vol=7.253531e+07
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name   HA) 3.073 1.180 1.180 weight 1.000 ! spec=15N, no=775, id=449, vol=6.993611e+07
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   62 and name  HB2) 3.142 1.234 1.234 weight 1.000 ! spec=15N, no=776, id=450, vol=3.631125e+07
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HB2) 2.759 0.952 0.952 weight 1.000 ! spec=15N, no=777, id=451, vol=4.854510e+07
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   62 and name   HN) (segid "   A" and resid   63 and name   HN) 2.550 0.813 0.813 weight 1.000 ! spec=15N, no=779, id=453, vol=7.661240e+07
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name   HA) 2.705 0.915 0.915 weight 1.000 ! spec=15N, no=781, id=454, vol=9.295861e+07
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   62 and name   HA) 2.867 1.028 1.028 weight 1.000 ! spec=15N, no=782, id=455, vol=9.711135e+07
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   61 and name   HA) 3.124 1.220 1.220 weight 1.000 ! spec=15N, no=783, id=456, vol=4.388817e+07
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name  HG2) 2.529 0.799 0.799 weight 1.000 ! spec=15N, no=784, id=457, vol=1.028901e+08
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   63 and name  HB1) 2.587 0.837 0.837 weight 1.000 ! spec=15N, no=785, id=458, vol=1.011411e+08
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   60 and name  HB2) 3.042 1.156 1.156 weight 1.000 ! spec=15N, no=787, id=459, vol=5.341786e+07
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   60 and name  HB3)
assign (segid "   A" and resid   63 and name   HN) (segid "   A" and resid   62 and name  HB2) 4.175 2.179 2.179 weight 1.000 ! spec=15N, no=788, id=460, vol=3.644918e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name   HA) 2.399 0.719 0.719 weight 1.000 ! spec=15N, no=790, id=462, vol=9.525589e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   64 and name   HA) 3.013 1.135 1.135 weight 1.000 ! spec=15N, no=791, id=463, vol=4.438836e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name  HB2) 2.856 1.019 1.019 weight 1.000 ! spec=15N, no=793, id=464, vol=4.391677e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name  HB1) 3.895 1.896 1.896 weight 1.000 ! spec=15N, no=794, id=465, vol=4.707880e+07
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   65 and name   HA) 2.663 0.887 0.887 weight 1.000 ! spec=15N, no=799, id=469, vol=4.643186e+07
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name   HA) 3.241 1.313 1.313 weight 1.000 ! spec=15N, no=800, id=470, vol=3.357189e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   65 and name   HN) 2.219 0.616 0.616 weight 1.000 ! spec=15N, no=802, id=471, vol=1.141442e+08
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   66 and name  HB2) 2.218 0.615 0.615 weight 1.000 ! spec=15N, no=803, id=472, vol=8.435886e+07
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name HG12) 2.019 0.510 0.510 weight 1.000 ! spec=15N, no=806, id=474, vol=1.150685e+08
    or (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name HG11)
    or (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name HG13)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   57 and name   HN) 3.547 1.573 1.573 weight 1.000 ! spec=15N, no=810, id=476, vol=2.412918e+07
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   67 and name   HA) 3.311 1.370 1.370 weight 1.000 ! spec=15N, no=811, id=477, vol=2.447462e+07
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   66 and name   HA) 2.573 0.828 0.828 weight 1.000 ! spec=15N, no=812, id=478, vol=6.772708e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HA2) 3.312 1.371 1.371 weight 1.000 ! spec=15N, no=813, id=479, vol=2.792966e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   68 and name  HA1) 3.014 1.135 1.135 weight 1.000 ! spec=15N, no=814, id=480, vol=3.895734e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name  HB1) 3.162 1.249 1.249 weight 1.000 ! spec=15N, no=815, id=481, vol=4.554331e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name  HB2) 4.173 2.177 2.177 weight 1.000 ! spec=15N, no=816, id=482, vol=3.766972e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name   HA) 2.392 0.715 0.715 weight 1.000 ! spec=15N, no=818, id=483, vol=1.252259e+08
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   69 and name   HN) 4.230 2.237 2.237 weight 1.000 ! spec=15N, no=819, id=484, vol=2.610900e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name   HN) 4.463 2.489 2.489 weight 1.000 ! spec=15N, no=820, id=485, vol=2.107144e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   68 and name   HN) 3.138 1.231 1.231 weight 1.000 ! spec=15N, no=821, id=486, vol=3.370921e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   69 and name   HA) 3.196 1.276 1.276 weight 1.000 ! spec=15N, no=826, id=489, vol=2.438093e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name  HA2) 3.363 1.414 1.414 weight 1.000 ! spec=15N, no=828, id=490, vol=4.671643e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name  HA1) 2.866 0.823 0.823 weight 1.000 ! spec=15N, no=829, id=491, vol=6.529990e+07
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name  HB1) 2.622 0.860 0.860 weight 1.000 ! spec=15N, no=836, id=493, vol=3.636728e+07
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name  HB2) 3.000 1.125 1.125 weight 1.000 ! spec=15N, no=837, id=494, vol=2.392713e+07
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   69 and name  HB1) 4.217 2.222 2.222 weight 1.000 ! spec=15N, no=838, id=495, vol=2.230852e+07
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name   HA) 2.494 0.777 0.777 weight 1.000 ! spec=15N, no=851, id=497, vol=5.327224e+07
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   72 and name   HA) 2.285 0.653 0.653 weight 1.000 ! spec=15N, no=855, id=498, vol=7.656748e+07
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   73 and name   HA) 3.152 1.242 1.242 weight 1.000 ! spec=15N, no=856, id=499, vol=4.987186e+07
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   74 and name   HN) 3.589 0.972 0.972 weight 1.000 ! spec=15N, no=857, id=500, vol=3.179993e+07
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name   HA) 3.267 1.334 1.334 weight 1.000 ! spec=15N, no=859, id=501, vol=5.134257e+07
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name  HD1) 4.934 3.042 3.042 weight 1.000 ! spec=15N, no=860, id=502, vol=2.723249e+07
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name  HB1) 3.050 1.163 1.163 weight 1.000 ! spec=15N, no=862, id=503, vol=4.172799e+07
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name  HB1) 4.684 2.742 2.742 weight 1.000 ! spec=15N, no=863, id=504, vol=7.845988e+06
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   76 and name HG21) 4.183 2.187 2.187 weight 1.000 ! spec=15N, no=865, id=505, vol=2.163034e+07
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   76 and name HG22)
    or (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   76 and name HG23)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name  HB1) 3.641 1.657 1.657 weight 1.000 ! spec=15N, no=877, id=506, vol=4.177771e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name  HE3) 3.647 1.663 1.663 weight 1.000 ! spec=15N, no=880, id=507, vol=1.696873e+07
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HG22) 3.409 1.453 1.453 weight 1.000 ! spec=15N, no=882, id=508, vol=3.892090e+07
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HG21)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HG23)
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HD12) 3.553 1.578 1.578 weight 1.000 ! spec=15N, no=884, id=509, vol=4.361510e+07
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HD11)
    or (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   52 and name HD13)
assign (segid "   A" and resid   89 and name HD21) (segid "   A" and resid   89 and name HD22) 1.766 0.390 0.390 weight 1.000 ! spec=15N, no=896, id=511, vol=5.960309e+07
assign (segid "   A" and resid   79 and name HD22) (segid "   A" and resid   79 and name HD21) 1.905 0.454 0.454 weight 1.000 ! spec=15N, no=897, id=512, vol=7.142612e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name  HB1) 3.922 1.923 1.923 weight 1.000 ! spec=15N, no=899, id=513, vol=4.007604e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name  HB2) 2.924 1.069 1.069 weight 1.000 ! spec=15N, no=901, id=514, vol=2.942344e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   51 and name   HA) 2.796 0.977 0.977 weight 1.000 ! spec=15N, no=902, id=515, vol=6.466950e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name   HA) 3.292 1.354 1.354 weight 1.000 ! spec=15N, no=903, id=516, vol=2.490070e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   53 and name  HD1) 4.360 2.376 2.376 weight 1.000 ! spec=15N, no=904, id=517, vol=1.757000e+07
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   53 and name  HD2)
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   49 and name HG21) 4.342 2.356 2.356 weight 1.000 ! spec=15N, no=907, id=518, vol=2.081428e+07
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   77 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=15N, no=913, id=519, vol=3.168984e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   32 and name   HN) 3.282 1.347 1.347 weight 1.000 ! spec=15N, no=914, id=520, vol=4.023979e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name   HA) 3.164 1.252 1.252 weight 1.000 ! spec=15N, no=916, id=522, vol=3.505798e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB2) 3.095 1.197 1.197 weight 1.000 ! spec=15N, no=919, id=525, vol=3.003601e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   32 and name  HB2) 2.817 0.992 0.992 weight 1.000 ! spec=15N, no=920, id=526, vol=3.293910e+07
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   66 and name  HB2) 3.598 1.618 1.618 weight 1.000 ! spec=15N, no=922, id=528, vol=4.693128e+07
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HB2) 3.037 1.153 1.153 weight 1.000 ! spec=15N, no=924, id=529, vol=3.096987e+07
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name  HB1) 3.870 1.872 1.872 weight 1.000 ! spec=15N, no=925, id=530, vol=5.418517e+07
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name   HA) 2.661 0.885 0.885 weight 1.000 ! spec=15N, no=927, id=532, vol=6.132051e+07
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name  HG2) 4.203 2.208 2.208 weight 1.000 ! spec=15N, no=928, id=533, vol=2.230414e+07
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name  HG1) 4.376 2.393 2.393 weight 1.000 ! spec=15N, no=929, id=534, vol=3.102240e+07
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HG1) 4.552 2.590 2.590 weight 1.000 ! spec=15N, no=932, id=535, vol=3.146296e+07
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   54 and name   HA) 2.509 0.787 0.787 weight 1.000 ! spec=15N, no=944, id=537, vol=7.862751e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB1) 3.352 1.404 1.404 weight 1.000 ! spec=15N, no=946, id=538, vol=5.159005e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name  HB2) 2.572 0.827 0.827 weight 1.000 ! spec=15N, no=947, id=539, vol=3.387257e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB2) 3.112 1.211 1.211 weight 1.000 ! spec=15N, no=949, id=540, vol=2.528015e+07
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name   HA) 3.852 1.855 1.855 weight 1.000 ! spec=15N, no=951, id=541, vol=3.103083e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   70 and name  HB2) 4.565 2.605 2.605 weight 1.000 ! spec=15N, no=956, id=542, vol=1.608104e+07
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   68 and name  HA2) 4.782 2.859 2.859 weight 1.000 ! spec=15N, no=958, id=543, vol=1.210219e+07
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name  HB1) 3.940 1.940 1.940 weight 1.000 ! spec=15N, no=976, id=544, vol=1.722083e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid  101 and name   HA) 5.003 3.129 3.129 weight 1.000 ! spec=15N, no=979, id=545, vol=2.040657e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   80 and name HD22) 4.415 2.436 2.436 weight 1.000 ! spec=15N, no=980, id=546, vol=2.424887e+07
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name  HB1) 3.057 0.883 0.883 weight 1.000 ! spec=15N, no=987, id=548, vol=6.113637e+07
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   95 and name   HN) 4.422 2.444 2.444 weight 1.000 ! spec=15N, no=988, id=549, vol=1.613137e+07
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name HD12) 3.086 1.191 1.191 weight 1.000 ! spec=15N, no=991, id=550, vol=3.931540e+07
    or (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name HD11)
    or (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name HD13)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   85 and name  HB1) 2.940 1.080 1.080 weight 1.000 ! spec=15N, no=992, id=551, vol=2.587412e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   82 and name   HN) 4.459 2.485 2.485 weight 1.000 ! spec=15N, no=994, id=553, vol=2.206888e+07
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name HD22) 3.977 1.977 1.977 weight 1.000 ! spec=15N, no=998, id=554, vol=4.152655e+07
    or (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   57 and name HD23)
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB2) 2.383 0.710 0.710 weight 1.000 ! spec=15N, no=1005, id=555, vol=9.429860e+07
assign (segid "   A" and resid   73 and name HD21) (segid "   A" and resid   73 and name  HB2) 4.083 2.084 2.084 weight 1.000 ! spec=15N, no=1015, id=558, vol=2.014368e+07
assign (segid "   A" and resid   73 and name HD21) (segid "   A" and resid   73 and name  HB1) 3.371 1.421 1.421 weight 1.000 ! spec=15N, no=1016, id=559, vol=1.744427e+07
assign (segid "   A" and resid   73 and name HD22) (segid "   A" and resid   73 and name  HB2) 5.220 3.406 3.406 weight 1.000 ! spec=15N, no=1017, id=560, vol=1.233532e+07
assign (segid "   A" and resid   47 and name HD21) (segid "   A" and resid   47 and name   HA) 2.993 1.120 1.120 weight 1.000 ! spec=15N, no=1033, id=564, vol=6.185055e+07
assign (segid "   A" and resid   47 and name HD22) (segid "   A" and resid   47 and name   HA) 3.894 1.895 1.895 weight 1.000 ! spec=15N, no=1034, id=565, vol=5.127115e+07
assign (segid "   A" and resid   42 and name HD21) (segid "   A" and resid   42 and name HD22) 2.153 0.579 0.579 weight 1.000 ! spec=15N, no=1035, id=566, vol=8.838980e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  101 and name   HA) 2.029 0.515 0.515 weight 1.000 ! spec=15N, no=1037, id=568, vol=1.235212e+08
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   52 and name   HA) 2.269 0.643 0.643 weight 1.000 ! spec=15N, no=1038, id=569, vol=1.550947e+08
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   70 and name   HA) 2.796 0.978 0.978 weight 1.000 ! spec=15N, no=1041, id=570, vol=5.420130e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HB1) 3.908 1.909 1.909 weight 1.000 ! spec=15N, no=1048, id=571, vol=3.155397e+07
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name   HA) 3.182 1.266 1.266 weight 1.000 ! spec=15N, no=1053, id=572, vol=1.395780e+07
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   44 and name   HA) 4.769 2.842 2.842 weight 1.000 ! spec=15N, no=1067, id=573, vol=1.682221e+07
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD12) 3.269 1.336 1.336 weight 1.000 ! spec=15N, no=1070, id=575, vol=3.930274e+07
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   42 and name   HN) 3.450 1.488 1.488 weight 1.000 ! spec=15N, no=1085, id=577, vol=2.304758e+07
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   39 and name   HA) 3.644 1.659 1.659 weight 1.000 ! spec=15N, no=1086, id=578, vol=2.208784e+07
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name  HB2) 2.393 0.716 0.716 weight 1.000 ! spec=15N, no=1091, id=580, vol=4.702873e+07
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   86 and name  HB1) 3.699 1.711 1.711 weight 1.000 ! spec=15N, no=1092, id=581, vol=2.927273e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HD1) 3.460 1.497 1.497 weight 1.000 ! spec=15N, no=1126, id=583, vol=7.875492e+07
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    8 and name   HA) 3.746 1.754 1.754 weight 1.000 ! spec=15N, no=1141, id=588, vol=2.839237e+07
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name   HN) 4.655 2.709 2.709 weight 1.000 ! spec=15N, no=1142, id=589, vol=2.223654e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   26 and name  HB1) 4.415 2.436 2.436 weight 1.000 ! spec=15N, no=1150, id=590, vol=2.789399e+07
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name   HN) 4.319 2.332 2.332 weight 1.000 ! spec=15N, no=1151, id=591, vol=2.122133e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HN) 4.521 2.555 2.555 weight 1.000 ! spec=15N, no=1154, id=592, vol=1.424593e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HA) 2.847 1.013 1.013 weight 1.000 ! spec=15N, no=1156, id=593, vol=2.500785e+07
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   25 and name   HA) 4.245 2.252 2.252 weight 1.000 ! spec=15N, no=1157, id=594, vol=1.298901e+07
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name   HA) 2.595 0.842 0.842 weight 1.000 ! spec=15N, no=1160, id=595, vol=7.468428e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   72 and name  HB2) 3.797 1.803 1.803 weight 1.000 ! spec=15N, no=1162, id=596, vol=2.219928e+07
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   29 and name   HN) 4.411 2.432 2.432 weight 1.000 ! spec=15N, no=1174, id=597, vol=9.917052e+06
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   65 and name HG22) 4.297 2.308 2.308 weight 1.000 ! spec=15N, no=1175, id=598, vol=1.190893e+07
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   39 and name   HN) 4.845 2.935 2.935 weight 1.000 ! spec=15N, no=1179, id=599, vol=1.252506e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD12) 3.547 1.161 1.161 weight 1.000 ! spec=15N, no=1180, id=600, vol=5.416043e+07
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name   HA) 4.289 2.300 2.300 weight 1.000 ! spec=15N, no=1182, id=601, vol=6.681443e+06
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   50 and name  HB2) 4.337 2.351 2.351 weight 1.000 ! spec=15N, no=1184, id=602, vol=1.122229e+07
assign (segid "   A" and resid   51 and name   HN) (segid "   A" and resid   50 and name  HB2) 4.069 2.070 2.070 weight 1.000 ! spec=15N, no=1187, id=603, vol=1.538924e+07
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   53 and name   HA) 2.488 0.774 0.774 weight 1.000 ! spec=15N, no=1190, id=604, vol=1.281911e+08
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   55 and name   HN) 4.869 2.964 2.964 weight 1.000 ! spec=15N, no=1191, id=605, vol=1.360338e+07
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   55 and name   HA) 3.570 1.593 1.593 weight 1.000 ! spec=15N, no=1192, id=606, vol=1.554779e+07
assign (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   56 and name  HE1) 4.867 2.962 2.962 weight 1.000 ! spec=15N, no=1193, id=607, vol=1.179229e+07
    or (segid "   A" and resid   55 and name   HN) (segid "   A" and resid   56 and name  HE2)
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   55 and name  HB2) 4.881 2.978 2.978 weight 1.000 ! spec=15N, no=1195, id=608, vol=1.754604e+07
assign (segid "   A" and resid   58 and name   HN) (segid "   A" and resid   58 and name  HB2) 2.236 0.625 0.625 weight 1.000 ! spec=15N, no=1196, id=609, vol=1.683944e+08
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   61 and name   HA) 3.698 1.709 1.709 weight 1.000 ! spec=15N, no=1198, id=611, vol=2.968097e+07
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG12) 3.513 1.543 1.543 weight 1.000 ! spec=15N, no=1200, id=612, vol=6.312834e+07
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG13)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG22)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name HG11) 2.948 1.087 1.087 weight 1.000 ! spec=15N, no=1201, id=613, vol=1.911237e+07
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name   HA) 3.560 1.584 1.584 weight 1.000 ! spec=15N, no=1202, id=614, vol=1.190018e+07
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   38 and name   HN) 2.806 0.984 0.984 weight 1.000 ! spec=15N, no=1203, id=615, vol=3.071983e+07
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   35 and name   HA) 4.608 2.655 2.655 weight 1.000 ! spec=15N, no=1205, id=616, vol=1.816901e+07
assign (segid "   A" and resid   93 and name   HN) (segid "   A" and resid   93 and name  HB1) 2.701 0.912 0.912 weight 1.000 ! spec=15N, no=1206, id=617, vol=7.506903e+07
assign (segid "   A" and resid   99 and name   HN) (segid "   A" and resid   99 and name  HB2) 2.426 0.736 0.736 weight 1.000 ! spec=15N, no=1207, id=618, vol=9.428797e+07
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name HD21) 4.463 2.490 2.490 weight 1.000 ! spec=15N, no=1211, id=619, vol=1.313484e+07
assign (segid "   A" and resid   32 and name HE22) (segid "   A" and resid   32 and name HE21) 1.567 0.307 0.307 weight 1.000 ! spec=15N, no=1216, id=621, vol=4.041043e+08
assign (segid "   A" and resid   89 and name HD21) (segid "   A" and resid   89 and name  HB2) 4.130 2.132 2.132 weight 1.000 ! spec=15N, no=1226, id=622, vol=1.200946e+07
assign (segid "   A" and resid   89 and name HD22) (segid "   A" and resid   89 and name  HB2) 3.463 1.499 1.499 weight 1.000 ! spec=15N, no=1228, id=623, vol=1.419479e+07
assign (segid "   A" and resid   47 and name HD22) (segid "   A" and resid   47 and name HD21) 1.641 0.337 0.337 weight 1.000 ! spec=15N, no=1229, id=624, vol=4.794022e+08
assign (segid "   A" and resid   13 and name HE22) (segid "   A" and resid   13 and name HE21) 1.622 0.329 0.329 weight 1.000 ! spec=15N, no=1230, id=625, vol=4.343346e+08
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   35 and name  HD1) 3.709 1.720 1.720 weight 1.000 ! spec=15N, no=1242, id=627, vol=3.728376e+07
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HG1) 3.993 1.993 1.993 weight 1.000 ! spec=15N, no=1250, id=628, vol=4.105402e+07
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   29 and name   HN) 2.609 0.851 0.851 weight 1.000 ! spec=15N, no=1252, id=629, vol=5.018480e+07
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   33 and name  HB1) 3.202 1.282 1.282 weight 1.000 ! spec=15N, no=1257, id=631, vol=8.071804e+07
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name   HA) 4.218 2.224 2.224 weight 1.000 ! spec=15N, no=1279, id=634, vol=3.390197e+07
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   44 and name   HA) 2.453 0.752 0.752 weight 1.000 ! spec=15N, no=1280, id=635, vol=1.424961e+08
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   49 and name   HN) 5.512 3.798 3.798 weight 1.000 ! spec=15N, no=1283, id=636, vol=9.367849e+06
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   53 and name  HB1) 5.134 3.295 3.295 weight 1.000 ! spec=15N, no=1287, id=637, vol=1.146652e+07
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name HG21) 5.222 3.409 3.409 weight 1.000 ! spec=15N, no=1289, id=638, vol=6.714591e+06
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name HG22)
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name HG23)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name   HN) 4.690 2.749 2.749 weight 1.000 ! spec=15N, no=1291, id=640, vol=1.168335e+07
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   72 and name   HA) 3.200 1.280 1.280 weight 1.000 ! spec=15N, no=1305, id=641, vol=2.161977e+07
assign (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   78 and name HG12) 4.059 2.060 2.060 weight 1.000 ! spec=15N, no=1316, id=642, vol=1.777043e+07
    or (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   78 and name HG11)
    or (segid "   A" and resid   80 and name   HN) (segid "   A" and resid   78 and name HG13)
assign (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   96 and name  HB2) 3.121 1.218 1.218 weight 1.000 ! spec=15N, no=1325, id=643, vol=1.832211e+07
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   85 and name   HN) (segid "   A" and resid   96 and name  HB3)
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   10 and name  HB2) 2.776 0.963 0.963 weight 1.000 ! spec=15N, no=1327, id=644, vol=2.795259e+07
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   10 and name  HB1)
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   10 and name  HB3)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   84 and name   HA) 3.632 1.649 1.649 weight 1.000 ! spec=15N, no=1331, id=645, vol=2.674240e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid   80 and name HD21) 3.827 0.964 0.964 weight 1.000 ! spec=15N, no=1333, id=646, vol=1.220577e+08
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name   HG) 4.661 2.715 2.715 weight 1.000 ! spec=15N, no=1334, id=647, vol=1.181024e+07
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name HD22) 4.474 2.502 2.502 weight 1.000 ! spec=15N, no=1337, id=649, vol=1.430649e+07
    or (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   83 and name  HD1) 3.894 1.895 1.895 weight 1.000 ! spec=15N, no=1342, id=650, vol=2.557602e+07
    or (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   54 and name HG21) 3.105 1.205 1.205 weight 1.000 ! spec=15N, no=1344, id=652, vol=3.791796e+07
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   54 and name HG22)
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   54 and name HG23)
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   70 and name   HN) 2.686 0.902 0.902 weight 1.000 ! spec=15N, no=1345, id=653, vol=3.201232e+07
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   76 and name   HA) 4.917 3.022 3.022 weight 1.000 ! spec=15N, no=1346, id=654, vol=9.529150e+06
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   56 and name   HA) 2.853 1.018 1.018 weight 1.000 ! spec=15N, no=1348, id=655, vol=6.061343e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HG1) 5.183 3.358 3.358 weight 1.000 ! spec=15N, no=1354, id=656, vol=1.558005e+07
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HN) 4.322 2.335 2.335 weight 1.000 ! spec=15N, no=1371, id=658, vol=1.763366e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   65 and name   HA) 4.215 2.220 2.220 weight 1.000 ! spec=15N, no=1380, id=659, vol=2.481534e+07
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   35 and name  HD1)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HN) 4.227 2.234 2.234 weight 1.000 ! spec=15N, no=1388, id=660, vol=2.919044e+07
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   30 and name   HA) 4.009 2.009 2.009 weight 1.000 ! spec=15N, no=1395, id=662, vol=2.775085e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   27 and name  HD1) 3.756 1.763 1.763 weight 1.000 ! spec=15N, no=1397, id=663, vol=3.887880e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   55 and name  HB2) 3.479 1.513 1.513 weight 1.000 ! spec=15N, no=1399, id=664, vol=1.921848e+07
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   48 and name  HB2) 5.222 3.408 3.408 weight 1.000 ! spec=15N, no=1400, id=665, vol=1.630622e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HE1) 4.733 2.801 2.801 weight 1.000 ! spec=15N, no=1402, id=667, vol=1.365591e+07
    or (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   83 and name  HE2)
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   97 and name   HA) 5.030 3.162 3.162 weight 1.000 ! spec=15N, no=1404, id=668, vol=9.335870e+06
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   70 and name   HG) 4.550 2.588 2.588 weight 1.000 ! spec=15N, no=1410, id=669, vol=1.560213e+07
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   70 and name HD22) 4.658 2.712 2.712 weight 1.000 ! spec=15N, no=1411, id=670, vol=1.359035e+07
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid   89 and name HD21) (segid "   A" and resid   33 and name  HD1) 4.482 2.511 2.511 weight 1.000 ! spec=15N, no=1435, id=672, vol=1.540511e+07
assign (segid "   A" and resid   89 and name HD21) (segid "   A" and resid   92 and name  HA2) 5.523 3.813 3.813 weight 1.000 ! spec=15N, no=1436, id=673, vol=1.123801e+07
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   83 and name  HD1) 4.924 3.030 3.030 weight 1.000 ! spec=15N, no=1456, id=674, vol=1.213852e+07
    or (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   83 and name  HD2)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   70 and name HD22) 4.159 2.162 2.162 weight 1.000 ! spec=15N, no=1489, id=675, vol=1.302255e+07
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   70 and name HD12) 3.845 1.753 1.753 weight 1.000 ! spec=15N, no=1490, id=676, vol=1.414853e+07
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   26 and name   HA) 4.716 2.780 2.780 weight 1.000 ! spec=15N, no=1495, id=677, vol=1.090364e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name HD22) 4.651 2.704 2.704 weight 1.000 ! spec=15N, no=1502, id=678, vol=1.319566e+07
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name HD21)
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name HD23)
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name HD12) 4.415 2.436 2.436 weight 1.000 ! spec=15N, no=1503, id=679, vol=1.110025e+07
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name HD11)
    or (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name HD13)
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   71 and name  HG1) 5.625 3.956 3.956 weight 1.000 ! spec=15N, no=1505, id=680, vol=1.539866e+07
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   72 and name   HN) 3.689 1.701 1.701 weight 1.000 ! spec=15N, no=1513, id=682, vol=1.664214e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   55 and name   HN) 2.954 1.090 1.090 weight 1.000 ! spec=15N, no=1519, id=684, vol=3.878462e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HA) 3.343 1.397 1.397 weight 1.000 ! spec=15N, no=1521, id=685, vol=1.590337e+07
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   30 and name  HB1) 4.643 2.694 2.694 weight 1.000 ! spec=15N, no=1533, id=686, vol=2.000697e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   66 and name  HD2) 3.908 1.909 1.909 weight 1.000 ! spec=15N, no=1553, id=687, vol=1.551797e+07
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   23 and name  HB1) 4.018 2.018 2.018 weight 1.000 ! spec=15N, no=1559, id=688, vol=1.948521e+07
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   25 and name   HB) 3.039 1.155 1.155 weight 1.000 ! spec=15N, no=1564, id=689, vol=2.688079e+07
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   11 and name  HB1) 4.967 3.083 3.083 weight 1.000 ! spec=15N, no=1571, id=690, vol=1.974488e+07
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG12) 2.916 1.063 1.063 weight 1.000 ! spec=15N, no=1583, id=691, vol=3.774962e+07
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG11)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG13)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG22)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   65 and name HG23)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   69 and name   HA) 3.560 1.585 1.585 weight 1.000 ! spec=15N, no=1589, id=692, vol=3.123656e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   25 and name   HB) 4.334 2.348 2.348 weight 1.000 ! spec=15N, no=1597, id=693, vol=1.974620e+07
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   56 and name   HA) 4.129 2.131 2.131 weight 1.000 ! spec=15N, no=1608, id=694, vol=2.243825e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   56 and name   HA) 4.532 2.567 2.567 weight 1.000 ! spec=15N, no=1610, id=695, vol=2.023082e+07
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   30 and name   HA) 3.068 1.176 1.176 weight 1.000 ! spec=15N, no=1618, id=696, vol=9.094297e+07
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   98 and name HD12) 3.312 1.371 1.371 weight 1.000 ! spec=15N, no=1619, id=697, vol=2.617231e+07
    or (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid   82 and name HD21) (segid "   A" and resid   97 and name  HB2) 4.812 2.895 2.895 weight 1.000 ! spec=15N, no=1620, id=698, vol=2.595164e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid    8 and name  HD1) 4.012 1.371 1.371 weight 1.000 ! spec=15N, no=1622
    or (segid "   A" and resid   31 and name   HN) (segid "   A" and resid    8 and name  HD2)
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   40 and name  HB2) 4.131 2.133 2.133 weight 1.000 ! spec=15N, no=1625, id=702, vol=4.252640e+07
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name HG12) 2.213 0.612 0.612 weight 1.000 ! spec=15N, no=1626, id=703, vol=8.829250e+07
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name HG13)
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HE3) 4.029 2.029 2.029 weight 1.000 ! spec=15N, no=1627, id=704, vol=1.713602e+07
assign (segid "   A" and resid   23 and name  HE1) (segid "   A" and resid  102 and name  HB1) 4.381 2.399 2.399 weight 1.000 ! spec=15N, no=1634, id=706, vol=1.918502e+07
assign (segid "   A" and resid   71 and name   HN) (segid "   A" and resid   71 and name  HG1) 4.004 2.004 2.004 weight 1.000 ! spec=15N, no=1635, id=707, vol=3.767716e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  103 and name   HN) 3.427 0.464 0.464 weight 1.000 ! spec=15N, no=1637, id=708, vol=1.220577e+08
!!AMBIG.tbl


assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   23 and name  HH2) 3.994 1.994 1.994 weight 1.000 ! spec=13C, no=137, id=762, vol=1.329698e+07
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid   23 and name  HE3)
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   87 and name   HN) 3.426 1.467 1.467 weight 1.000 ! spec=13C, no=168, id=786, vol=2.592977e+07
    or (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   89 and name   HN)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   85 and name   HN) 3.258 1.327 1.327 weight 1.000 ! spec=13C, no=1065, id=1215, vol=3.532863e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   84 and name   HA) 3.827 1.830 1.830 weight 1.000 ! spec=13C, no=1071, id=1219, vol=1.224037e+07
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   84 and name   HA)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   84 and name   HA)
    or (segid "   A" and resid   86 and name HD12) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   86 and name HD11) (segid "   A" and resid   87 and name   HA)
    or (segid "   A" and resid   86 and name HD13) (segid "   A" and resid   87 and name   HA)
assign (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   25 and name HD12) 2.409 0.725 0.725 weight 1.000 ! spec=13C, no=1220, id=1289, vol=2.615454e+07
    or (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   25 and name HD12)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   25 and name HD11)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   25 and name HD13)
    or (segid "   A" and resid   14 and name HD22) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   14 and name HD21) (segid "   A" and resid   85 and name  HB1)
    or (segid "   A" and resid   14 and name HD23) (segid "   A" and resid   85 and name  HB1)
assign (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   77 and name   HN) 3.973 1.973 1.973 weight 1.000 ! spec=13C, no=1396, id=1348, vol=1.266500e+07
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   78 and name HG22) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   78 and name HG21) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   78 and name HG23) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   98 and name HG22) 3.162 1.250 1.250 weight 1.000 ! spec=13C, no=1619, id=1438, vol=2.360445e+07
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   98 and name HG21)
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   98 and name HG23)
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   59 and name  HB1) (segid "   A" and resid   58 and name   HA) 5.414 3.665 3.665 weight 1.000 ! spec=13C, no=1799, id=1510, vol=9.108145e+06
    or (segid "   A" and resid   59 and name  HB1) (segid "   A" and resid   60 and name   HA)
assign (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   58 and name   HA) 4.523 2.558 2.558 weight 1.000 ! spec=13C, no=1800, id=1511, vol=1.362293e+07
    or (segid "   A" and resid   59 and name  HB2) (segid "   A" and resid   60 and name   HA)
assign (segid "   A" and resid   38 and name  HG2) (segid "   A" and resid   38 and name   HE) 3.656 1.670 1.670 weight 1.000 ! spec=13C, no=1906, id=1552, vol=7.981811e+06
    or (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name  HG2)
    or (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   39 and name   HN)
assign (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   86 and name HD22) 3.162 1.249 1.249 weight 1.000 ! spec=13C, no=1911, id=1557, vol=2.213595e+07
    or (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   86 and name HD21)
    or (segid "   A" and resid   38 and name  HG1) (segid "   A" and resid   86 and name HD23)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   38 and name  HG2)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   38 and name  HG2)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   38 and name  HG2)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   38 and name  HG1)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   38 and name  HG1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   38 and name  HG1)
assign (segid "   A" and resid   59 and name  HG1) (segid "   A" and resid   59 and name   HA) 3.904 1.905 1.905 weight 1.000 ! spec=13C, no=1995, id=1602, vol=2.030298e+07
    or (segid "   A" and resid   59 and name  HG2) (segid "   A" and resid   59 and name   HA)
assign (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   18 and name HG12) 3.512 1.542 1.542 weight 1.000 ! spec=13C, no=2029, id=1623, vol=1.740193e+07
    or (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   18 and name HG13)
    or (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   98 and name HD12)
    or (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   98 and name HD11)
    or (segid "   A" and resid   16 and name   HB) (segid "   A" and resid   98 and name HD13)
assign (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   31 and name   HN) 3.466 1.502 1.502 weight 1.000 ! spec=13C, no=2262, id=1676, vol=2.009094e+07
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   29 and name HG22) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   29 and name HG21) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   29 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   42 and name   HN) 5.641 3.977 3.977 weight 1.000 ! spec=13C, no=4756, id=2073, vol=3.394604e+06
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   98 and name   HN)
assign (segid "   A" and resid   92 and name  HA1) (segid "   A" and resid   93 and name   HA) 4.828 2.914 2.914 weight 1.000 ! spec=13C, no=4845, id=2103, vol=5.529774e+06
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   81 and name  HA2)
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  101 and name  HB2) 4.003 2.003 2.003 weight 1.000 ! spec=13C, no=4928, id=2134, vol=1.511301e+07
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  101 and name  HB1)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  101 and name  HB3)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HE2)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HE1)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HE3)
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   14 and name   HN) 5.725 4.097 4.097 weight 1.000 ! spec=13C, no=5265, id=2225, vol=4.951881e+06
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name  HG1)
assign (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   14 and name HD12) 4.694 2.754 2.754 weight 1.000 ! spec=13C, no=6110, id=2406, vol=1.054169e+07
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   14 and name HD11)
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   14 and name HD13)
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   84 and name HG21)
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   84 and name HG22)
    or (segid "   A" and resid   83 and name  HD1) (segid "   A" and resid   84 and name HG23)
assign (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   27 and name  HB2) 3.037 1.153 1.153 weight 1.000 ! spec=13C, no=6223, id=2434, vol=1.622317e+07
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   14 and name HD12) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   14 and name HD11) (segid "   A" and resid   27 and name  HB1)
    or (segid "   A" and resid   14 and name HD13) (segid "   A" and resid   27 and name  HB1)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   17 and name   HA) 4.602 2.647 2.647 weight 1.000 ! spec=13C, no=6242, id=2440, vol=5.427629e+06
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   15 and name   HA)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   25 and name   HA) 3.013 1.135 1.135 weight 1.000 ! spec=13C, no=6254, id=2442, vol=2.149057e+07
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid  100 and name   HA)
    or (segid "   A" and resid   17 and name  HB1) (segid "   A" and resid  100 and name   HA)
    or (segid "   A" and resid   17 and name  HB3) (segid "   A" and resid  100 and name   HA)
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  102 and name  HB2) 3.405 1.449 1.449 weight 1.000 ! spec=13C, no=6408, id=2461, vol=7.091514e+07
    or (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   45 and name   HB)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   58 and name  HB2)
    or (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   58 and name  HB1)
assign (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   57 and name HD22) 5.982 4.473 4.473 weight 1.000 ! spec=13C, no=6497, id=2485, vol=6.336489e+06
    or (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   57 and name HD23)
    or (segid "   A" and resid   69 and name  HB1) (segid "   A" and resid   71 and name  HG1)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   20 and name  HB1) 7.156 6.400 6.400 weight 1.000 ! spec=13C, no=6501, id=2487, vol=2.481018e+05
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   37 and name   HG)
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   38 and name  HG1)
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   57 and name  HB1)
assign (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   83 and name  HB1) 4.970 3.087 3.087 weight 1.000 ! spec=13C, no=6516, id=2489, vol=2.930503e+06
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   12 and name   HA) 4.393 2.412 2.412 weight 1.000 ! spec=13C, no=6566, id=2497, vol=9.037644e+06
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   12 and name   HA)
assign (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name HD22) 1.739 0.378 0.378 weight 1.000 ! spec=13C, no=6709, id=2515, vol=8.173783e+07
    or (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name HD21)
    or (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name HD23)
    or (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name HD12)
    or (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name HD11)
    or (segid "   A" and resid   57 and name   HG) (segid "   A" and resid   57 and name HD13)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   24 and name  HB1) 4.708 2.771 2.771 weight 1.000 ! spec=13C, no=6716, id=2517, vol=5.443577e+06
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   20 and name  HG1)
    or (segid "   A" and resid   24 and name  HB1) (segid "   A" and resid   26 and name  HG1)
assign (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   82 and name   HA) 4.203 2.208 2.208 weight 1.000 ! spec=13C, no=6824, id=2546, vol=9.102614e+06
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   82 and name   HA)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   82 and name   HA)
    or (segid "   A" and resid   98 and name HG22) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   98 and name HG21) (segid "   A" and resid   14 and name   HA)
    or (segid "   A" and resid   98 and name HG23) (segid "   A" and resid   14 and name   HA)
assign (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   67 and name  HB2) 3.619 1.637 1.637 weight 1.000 ! spec=13C, no=6827, id=2548, vol=2.462405e+07
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   67 and name  HB2)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   67 and name  HB2)
    or (segid "   A" and resid   65 and name HG12) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   65 and name HG11) (segid "   A" and resid   30 and name  HB2)
    or (segid "   A" and resid   65 and name HG13) (segid "   A" and resid   30 and name  HB2)
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG22) 3.492 1.525 1.525 weight 1.000 ! spec=13C, no=6837, id=2557, vol=1.291629e+07
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid   98 and name   HA) 4.274 2.283 2.283 weight 1.000 ! spec=13C, no=6873, id=2586, vol=1.262214e+07
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid   98 and name   HA)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid   98 and name   HA)
    or (segid "   A" and resid   99 and name  HE2) (segid "   A" and resid  100 and name   HA)
    or (segid "   A" and resid   99 and name  HE1) (segid "   A" and resid  100 and name   HA)
    or (segid "   A" and resid   99 and name  HE3) (segid "   A" and resid  100 and name   HA)
assign (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   96 and name  HB2) 1.471 0.270 0.270 weight 1.000 ! spec=13C, no=6914, id=2611, vol=9.972282e+07
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG22) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG21) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid   12 and name HG23) (segid "   A" and resid   96 and name  HB3)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   94 and name  HB2)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   94 and name  HB2) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   94 and name  HB1)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   12 and name HG12) (segid "   A" and resid   94 and name  HB3)
    or (segid "   A" and resid   12 and name HG11) (segid "   A" and resid   94 and name  HB3)
    or (segid "   A" and resid   12 and name HG13) (segid "   A" and resid   94 and name  HB3)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name HG22)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   94 and name  HB3) (segid "   A" and resid   12 and name HG23)
assign (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   65 and name HG22) 3.420 1.462 1.462 weight 1.000 ! spec=13C, no=6925, id=2622, vol=2.172910e+07
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   65 and name HG21)
    or (segid "   A" and resid   30 and name   HN) (segid "   A" and resid   65 and name HG23)
    or (segid "   A" and resid   65 and name HG22) (segid "   A" and resid   66 and name   HN)
    or (segid "   A" and resid   65 and name HG21) (segid "   A" and resid   66 and name   HN)
    or (segid "   A" and resid   65 and name HG23) (segid "   A" and resid   66 and name   HN)
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HG1) 2.220 0.616 0.616 weight 1.000 ! spec=13C, no=6938, id=2633, vol=6.687293e+07
    or (segid "   A" and resid  106 and name  HD2) (segid "   A" and resid  106 and name  HG2)
assign (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   72 and name HD22) 1.889 0.446 0.446 weight 1.000 ! spec=13C, no=6960, id=2643, vol=4.242947e+07
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HD12) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HD11) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HD13) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HG22) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HG21) (segid "   A" and resid   72 and name HD23)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name HD22)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name HD21)
    or (segid "   A" and resid   52 and name HG23) (segid "   A" and resid   72 and name HD23)
assign (segid "   A" and resid   23 and name  HZ3) (segid "   A" and resid   23 and name  HE3) 2.408 0.725 0.725 weight 1.000 ! spec=13C_aro, no=14, id=2660, vol=2.013463e+06
    or (segid "   A" and resid   23 and name  HZ3) (segid "   A" and resid   23 and name  HH2)
!assign (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   18 and name HG22) 4.904 3.006 3.006 weight 1.000 ! spec=13C_aro, no=175, id=2688, vol=1.021772e+05
!    or (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   18 and name HG21)
!    or (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   18 and name HG23)
!    or (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   19 and name  HG1)
!    or (segid "   A" and resid   21 and name  HD2) (segid "   A" and resid   71 and name  HG1)
assign (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    8 and name  HD1) 4.146 1.485 1.485 weight 1.000 ! spec=13C_aro, no=280, id=2714, vol=2.628916e+05
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    8 and name  HD1)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    8 and name  HD1)
    or (segid "   A" and resid    6 and name HG22) (segid "   A" and resid    8 and name  HD2)
    or (segid "   A" and resid    6 and name HG21) (segid "   A" and resid    8 and name  HD2)
    or (segid "   A" and resid    6 and name HG23) (segid "   A" and resid    8 and name  HD2)
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG12)
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    8 and name  HD1) (segid "   A" and resid    6 and name HG13)
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name HG12)
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name HG11)
    or (segid "   A" and resid    8 and name  HD2) (segid "   A" and resid    6 and name HG13)
assign (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   13 and name  HB2) 2.918 1.064 1.064 weight 1.000 ! spec=13C_aro, no=440, id=2750, vol=1.355019e+06
    or (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   13 and name  HB1)
assign (segid "   A" and resid   56 and name  HD1) (segid "   A" and resid   66 and name  HB2) 3.561 1.585 1.585 weight 1.000 ! spec=13C_aro, no=445, id=2753, vol=8.359251e+05
    or (segid "   A" and resid   56 and name  HD1) (segid "   A" and resid   66 and name  HB1)
    or (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   66 and name  HB2) 
    or (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   66 and name  HB1)
assign (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   27 and name  HE1) 3.769 1.776 1.776 weight 1.000 ! spec=15N, no=52, id=34, vol=4.684148e+07
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   39 and name  HH2)
assign (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   42 and name  HB2) 4.092 2.093 2.093 weight 1.000 ! spec=15N, no=164, id=90, vol=2.034885e+07
    or (segid "   A" and resid   42 and name   HN) (segid "   A" and resid   41 and name  HB2)
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   95 and name   HN) 3.980 1.980 1.980 weight 1.000 ! spec=15N, no=416, id=255, vol=2.879735e+07
    or (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   93 and name   HN)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   86 and name HD12) 3.005 1.129 1.129 weight 1.000 ! spec=15N, no=427, id=265, vol=5.313432e+07
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   86 and name HD11)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   86 and name HD13)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG12)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG11)
    or (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   12 and name HG13)
assign (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   84 and name   HA) 3.674 1.688 1.688 weight 1.000 ! spec=15N, no=452, id=281, vol=3.843095e+07
    or (segid "   A" and resid   98 and name   HN) (segid "   A" and resid   82 and name   HA)
assign (segid "   A" and resid  105 and name   HN) (segid "   A" and resid  104 and name   HA) 2.266 0.642 0.642 weight 1.000 ! spec=15N, no=488, id=308, vol=1.625461e+08
    or (segid "   A" and resid  105 and name   HN) (segid "   A" and resid  105 and name   HA)
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB2) 2.115 0.559 0.559 weight 1.000 ! spec=15N, no=767, id=446, vol=1.961044e+08
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB1)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   60 and name  HB3)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   32 and name HE22) (segid "   A" and resid   32 and name  HG2) 4.356 2.372 2.372 weight 1.000 ! spec=15N, no=1235, id=626, vol=2.930378e+07
    or (segid "   A" and resid   32 and name HE22) (segid "   A" and resid   32 and name  HG1)
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HD1) 2.823 0.511 0.511 weight 1.000 ! spec=15N, no=1290, id=639, vol=1.556768e+08
    or (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HD2)
    or (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HE1)
    or (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HE2)
    or (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name   HZ)
    or (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  103 and name   HN)
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG22) 4.443 2.468 2.468 weight 1.000 ! spec=15N, no=1401, id=666, vol=1.579691e+07
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG21)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   12 and name HG23)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name HD22)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name HD21)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   37 and name HD23)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   65 and name HG12)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   65 and name HG11)
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   65 and name HG13)
assign (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name   HB) 2.916 1.063 1.063 weight 1.000 ! spec=15N, no=1621, id=699, vol=3.216324e+07
    or (segid "   A" and resid   50 and name   HN) (segid "   A" and resid   49 and name   HA)
assign (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   54 and name   HB) 4.433 2.457 2.457 weight 1.000 ! spec=15N, no=1630, id=705, vol=2.285253e+07
    or (segid "   A" and resid   39 and name  HE1) (segid "   A" and resid   70 and name   HA)
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ASP   1           H        ASP   1 -34.427   2.187  -7.700
  Start of MODEL    1
    2    H2   ASP   1           H2       ASP   1 -33.774   1.829  -6.187
  Start of MODEL    1
    3    H3   ASP   1           H3       ASP   1 -33.159   1.106  -7.566
  Start of MODEL    1
    4    HA   ASP   1           HA       ASP   1 -32.383   3.148  -8.443
  Start of MODEL    1
    5    HB3  ASP   1           HB2      ASP   1 -33.341   4.344  -5.834
  Start of MODEL    1
    6    HB2  ASP   1           HB3      ASP   1 -34.030   4.669  -7.420
  Start of MODEL    1
    7    HA   ASP   2           HA       ASP   2 -29.283   2.295  -5.268
  Start of MODEL    1
    8    HB3  ASP   2           HB2      ASP   2 -30.331   3.187  -3.252
  Start of MODEL    1
    9    HB2  ASP   2           HB3      ASP   2 -29.338   1.801  -2.825
  Start of MODEL    1
   10    H    ASP   2           HN       ASP   2 -32.162   1.821  -5.185
  Start of MODEL    1
   11    HA   ASP   3           HA       ASP   3 -29.152  -2.069  -5.369
  Start of MODEL    1
   12    HB3  ASP   3           HB2      ASP   3 -26.874  -1.125  -7.132
  Start of MODEL    1
   13    HB2  ASP   3           HB3      ASP   3 -28.486  -1.586  -7.667
  Start of MODEL    1
   14    H    ASP   3           HN       ASP   3 -28.023   0.633  -5.691
  Start of MODEL    1
   15    HA   ASP   4           HA       ASP   4 -25.873  -1.726  -2.400
  Start of MODEL    1
   16    HB3  ASP   4           HB2      ASP   4 -24.017  -1.945  -4.021
  Start of MODEL    1
   17    HB2  ASP   4           HB3      ASP   4 -23.470  -1.105  -2.587
  Start of MODEL    1
   18    H    ASP   4           HN       ASP   4 -26.635   0.068  -4.528
  Start of MODEL    1
   19    HA   ASP   5           HA       ASP   5 -26.826   2.191  -0.735
  Start of MODEL    1
   20    HB3  ASP   5           HB2      ASP   5 -28.108   0.148   1.098
  Start of MODEL    1
   21    HB2  ASP   5           HB3      ASP   5 -28.923   1.069  -0.163
  Start of MODEL    1
   22    H    ASP   5           HN       ASP   5 -26.881  -0.713  -0.894
  Start of MODEL    1
   23    HA   VAL   6           HA       VAL   6 -24.229   0.639   2.907
  Start of MODEL    1
   24    HB   VAL   6           HB       VAL   6 -22.612  -1.299   2.875
  Start of MODEL    1
   25    H    VAL   6           HN       VAL   6 -25.301  -0.533   0.603
  Start of MODEL    1
   26    HA   SER   7           HA       SER   7 -20.985   2.532   0.776
  Start of MODEL    1
   27    HB3  SER   7           HB2      SER   7 -22.259   4.813   2.321
  Start of MODEL    1
   28    HB2  SER   7           HB3      SER   7 -22.717   4.334   0.692
  Start of MODEL    1
   29    HG   SER   7           HG       SER   7 -21.306   6.061   0.674
  Start of MODEL    1
   30    H    SER   7           HN       SER   7 -23.108   2.428   2.775
  Start of MODEL    1
   31    HA   PHE   8           HA       PHE   8 -18.638   2.358   4.469
  Start of MODEL    1
   32    HB3  PHE   8           HB2      PHE   8 -17.026   0.466   4.352
  Start of MODEL    1
   33    HB2  PHE   8           HB3      PHE   8 -17.587   0.119   2.723
  Start of MODEL    1
   34    HD1  PHE   8           HD1      PHE   8 -19.362  -1.303   2.367
  Start of MODEL    1
   35    HD2  PHE   8           HD2      PHE   8 -18.766   0.335   6.231
  Start of MODEL    1
   36    HE1  PHE   8           HE1      PHE   8 -21.109  -2.787   3.252
  Start of MODEL    1
   37    HE2  PHE   8           HE2      PHE   8 -20.516  -1.140   7.132
  Start of MODEL    1
   38    HZ   PHE   8           HZ       PHE   8 -21.689  -2.705   5.638
  Start of MODEL    1
   39    H    PHE   8           HN       PHE   8 -19.400   1.534   1.778
  Start of MODEL    1
   40    HA   CYS   9           HA       CYS   9 -15.826   4.896   2.398
  Start of MODEL    1
   41    HB3  CYS   9           HB2      CYS   9 -15.333   6.673   3.836
  Start of MODEL    1
   42    HB2  CYS   9           HB3      CYS   9 -15.365   5.665   5.274
  Start of MODEL    1
   43    H    CYS   9           HN       CYS   9 -17.079   3.759   4.726
  Start of MODEL    1
   44    HA   ALA  10           HA       ALA  10 -12.163   2.841   3.240
  Start of MODEL    1
   45    HB3  ALA  10           HB1      ALA  10 -11.713   4.045   1.163
  Start of MODEL    1
   46    HB2  ALA  10           HB2      ALA  10 -10.236   3.744   2.084
  Start of MODEL    1
   47    HB1  ALA  10           HB3      ALA  10 -10.964   5.346   2.087
  Start of MODEL    1
   48    H    ALA  10           HN       ALA  10 -13.329   5.488   2.922
  Start of MODEL    1
   49    HA   SER  11           HA       SER  11  -9.684   4.424   6.431
  Start of MODEL    1
   50    HB3  SER  11           HB2      SER  11  -9.828   2.977   8.436
  Start of MODEL    1
   51    HB2  SER  11           HB3      SER  11 -10.728   1.779   7.503
  Start of MODEL    1
   52    HG   SER  11           HG       SER  11 -12.388   3.131   7.317
  Start of MODEL    1
   53    H    SER  11           HN       SER  11 -11.096   2.311   4.985
  Start of MODEL    1
   54    HA   VAL  12           HA       VAL  12  -6.453   1.760   5.320
  Start of MODEL    1
   55    HB   VAL  12           HB       VAL  12  -5.271   4.542   5.621
  Start of MODEL    1
   56    H    VAL  12           HN       VAL  12  -7.496   3.988   6.903
  Start of MODEL    1
   57    HA   GLN  13           HA       GLN  13  -4.111   0.981   8.903
  Start of MODEL    1
   58    HB3  GLN  13           HB2      GLN  13  -4.093  -1.497   9.236
  Start of MODEL    1
   59    HB2  GLN  13           HB3      GLN  13  -5.019  -1.647   7.758
  Start of MODEL    1
   60    HG2  GLN  13           HG2      GLN  13  -5.962  -0.331  10.281
  Start of MODEL    1
   61    HG3  GLN  13           HG3      GLN  13  -6.879  -0.443   8.779
  Start of MODEL    1
   62   HE21  GLN  13          HE21      GLN  13  -8.502  -1.660   9.823
  Start of MODEL    1
   63   HE22  GLN  13          HE22      GLN  13  -8.247  -3.321  10.226
  Start of MODEL    1
   64    H    GLN  13           HN       GLN  13  -5.480   0.304   6.418
  Start of MODEL    1
   65    HA   LEU  14           HA       LEU  14  -0.700  -0.620   6.684
  Start of MODEL    1
   66    HB3  LEU  14           HB2      LEU  14   1.240   1.105   7.038
  Start of MODEL    1
   67    HB2  LEU  14           HB3      LEU  14  -0.022   2.112   7.719
  Start of MODEL    1
   68    HG   LEU  14           HG       LEU  14  -1.264   1.868   5.510
  Start of MODEL    1
   69   HD13  LEU  14          HD11      LEU  14   0.079   3.865   6.037
  Start of MODEL    1
   70   HD12  LEU  14          HD12      LEU  14   0.191   3.421   4.325
  Start of MODEL    1
   71   HD11  LEU  14          HD13      LEU  14   1.499   3.017   5.429
  Start of MODEL    1
   72   HD23  LEU  14          HD21      LEU  14   1.393   0.796   4.634
  Start of MODEL    1
   73   HD22  LEU  14          HD22      LEU  14  -0.007   1.125   3.608
  Start of MODEL    1
   74   HD21  LEU  14          HD23      LEU  14  -0.072  -0.171   4.810
  Start of MODEL    1
   75    H    LEU  14           HN       LEU  14  -1.953   0.842   8.862
  Start of MODEL    1
   76    HA   HIS  15           HA       HIS  15   1.702  -1.860  10.050
  Start of MODEL    1
   77    HB3  HIS  15           HB2      HIS  15   2.280  -4.269   9.549
  Start of MODEL    1
   78    HB2  HIS  15           HB3      HIS  15   1.689  -4.002   7.917
  Start of MODEL    1
   79    HD1  HIS  15           HD1      HIS  15   0.505  -4.410  11.434
  Start of MODEL    1
   80    HD2  HIS  15           HD2      HIS  15  -1.087  -3.899   7.630
  Start of MODEL    1
   81    HE1  HIS  15           HE1      HIS  15  -1.942  -4.939  11.650
  Start of MODEL    1
   82    HE2  HIS  15           HE2      HIS  15  -2.821  -4.842   9.301
  Start of MODEL    1
   83    H    HIS  15           HN       HIS  15   1.422  -1.439   7.194
  Start of MODEL    1
   84    HA   THR  16           HA       THR  16   5.842  -0.976   9.493
  Start of MODEL    1
   85    HB   THR  16           HB       THR  16   6.116  -3.276  11.426
  Start of MODEL    1
   86    HG1  THR  16           HG1      THR  16   5.276  -0.585  11.758
  Start of MODEL    1
   87   HG23  THR  16          HG21      THR  16   8.202  -2.349  10.496
  Start of MODEL    1
   88   HG22  THR  16          HG22      THR  16   8.055  -1.985  12.219
  Start of MODEL    1
   89   HG21  THR  16          HG23      THR  16   7.714  -0.739  11.014
  Start of MODEL    1
   90    H    THR  16           HN       THR  16   3.778  -2.369  10.710
  Start of MODEL    1
   91    HA   ALA  17           HA       ALA  17   7.016  -3.702   6.317
  Start of MODEL    1
   92    HB2  ALA  17           HB1      ALA  17   9.485  -2.034   6.770
  Start of MODEL    1
   93    HB1  ALA  17           HB2      ALA  17   8.123  -1.528   5.790
  Start of MODEL    1
   94    HB3  ALA  17           HB3      ALA  17   9.067  -2.945   5.312
  Start of MODEL    1
   95    H    ALA  17           HN       ALA  17   7.277  -1.519   8.026
  Start of MODEL    1
   96    HA   VAL  18           HA       VAL  18   9.307  -6.394   8.741
  Start of MODEL    1
   97    HB   VAL  18           HB       VAL  18   8.922  -8.758   8.024
  Start of MODEL    1
   98    H    VAL  18           HN       VAL  18   7.905  -5.647   6.322
  Start of MODEL    1
   99    HA   GLU  19           HA       GLU  19  12.965  -6.160   6.646
  Start of MODEL    1
  100    HB3  GLU  19           HB2      GLU  19  14.836  -6.453   8.225
  Start of MODEL    1
  101    HB2  GLU  19           HB3      GLU  19  13.700  -7.043   9.427
  Start of MODEL    1
  102    HG2  GLU  19           HG2      GLU  19  13.593  -4.315   8.163
  Start of MODEL    1
  103    HG3  GLU  19           HG3      GLU  19  12.560  -4.914   9.456
  Start of MODEL    1
  104    H    GLU  19           HN       GLU  19  11.339  -6.895   8.856
  Start of MODEL    1
  105    HA   MET  20           HA       MET  20  14.900  -9.706   5.399
  Start of MODEL    1
  106    HB3  MET  20           HB2      MET  20  12.796 -10.917   5.900
  Start of MODEL    1
  107    HB2  MET  20           HB3      MET  20  13.382 -11.375   4.314
  Start of MODEL    1
  108    HG2  MET  20           HG2      MET  20  11.158  -9.415   4.833
  Start of MODEL    1
  109    HG3  MET  20           HG3      MET  20  11.730  -9.949   3.254
  Start of MODEL    1
  110    HE2  MET  20           HE1      MET  20   8.208 -11.684   3.515
  Start of MODEL    1
  111    HE1  MET  20           HE2      MET  20   9.249 -10.638   2.550
  Start of MODEL    1
  112    HE3  MET  20           HE3      MET  20   8.654 -10.086   4.113
  Start of MODEL    1
  113    H    MET  20           HN       MET  20  13.316  -7.465   5.129
  Start of MODEL    1
  114    HA   HIS  21           HA       HIS  21  16.030  -8.066   1.727
  Start of MODEL    1
  115    HB3  HIS  21           HB2      HIS  21  16.672  -9.484  -0.262
  Start of MODEL    1
  116    HB2  HIS  21           HB3      HIS  21  16.044 -10.873   0.624
  Start of MODEL    1
  117    HD1  HIS  21           HD1      HIS  21  18.077 -12.118   1.401
  Start of MODEL    1
  118    HD2  HIS  21           HD2      HIS  21  18.425  -8.027   1.946
  Start of MODEL    1
  119    HE1  HIS  21           HE1      HIS  21  20.203 -11.787   2.671
  Start of MODEL    1
  120    HE2  HIS  21           HE2      HIS  21  20.262  -9.323   3.177
  Start of MODEL    1
  121    H    HIS  21           HN       HIS  21  15.357 -10.435   3.031
  Start of MODEL    1
  122    HA   HIS  22           HA       HIS  22  12.343  -8.159  -0.835
  Start of MODEL    1
  123    HB3  HIS  22           HB2      HIS  22  10.392  -9.739  -1.072
  Start of MODEL    1
  124    HB2  HIS  22           HB3      HIS  22  11.157 -10.802   0.100
  Start of MODEL    1
  125    HD1  HIS  22           HD1      HIS  22  10.708 -12.254  -2.329
  Start of MODEL    1
  126    HD2  HIS  22           HD2      HIS  22  14.012  -9.766  -1.994
  Start of MODEL    1
  127    HE1  HIS  22           HE1      HIS  22  12.317 -13.033  -4.078
  Start of MODEL    1
  128    HE2  HIS  22           HE2      HIS  22  14.397 -11.680  -3.668
  Start of MODEL    1
  129    H    HIS  22           HN       HIS  22  13.305 -10.098   1.128
  Start of MODEL    1
  130    HA   TRP  23           HA       TRP  23  10.701  -6.587   2.919
  Start of MODEL    1
  131    HB3  TRP  23           HB2      TRP  23  10.573  -4.087   2.717
  Start of MODEL    1
  132    HB2  TRP  23           HB3      TRP  23  11.175  -4.250   1.074
  Start of MODEL    1
  133    HD1  TRP  23           HD1      TRP  23  13.718  -5.494   0.921
  Start of MODEL    1
  134    HE1  TRP  23           HE1      TRP  23  15.752  -5.081   2.453
  Start of MODEL    1
  135    HE3  TRP  23           HE3      TRP  23  11.315  -3.441   4.920
  Start of MODEL    1
  136    HZ2  TRP  23           HZ2      TRP  23  16.264  -4.011   4.995
  Start of MODEL    1
  137    HZ3  TRP  23           HZ3      TRP  23  12.648  -2.736   6.858
  Start of MODEL    1
  138    HH2  TRP  23           HH2      TRP  23  15.071  -3.017   6.891
  Start of MODEL    1
  139    H    TRP  23           HN       TRP  23  11.707  -6.420   0.221
  Start of MODEL    1
  140    HA   CYS  24           HA       CYS  24   6.651  -5.767   1.514
  Start of MODEL    1
  141    HB3  CYS  24           HB2      CYS  24   6.585  -7.870   3.693
  Start of MODEL    1
  142    HB2  CYS  24           HB3      CYS  24   6.747  -8.173   1.971
  Start of MODEL    1
  143    H    CYS  24           HN       CYS  24   8.685  -6.237   3.570
  Start of MODEL    1
  144    HA   ILE  25           HA       ILE  25   5.006  -3.411   4.845
  Start of MODEL    1
  145    HB   ILE  25           HB       ILE  25   4.533  -1.688   2.373
  Start of MODEL    1
  146   HD13  ILE  25          HD11      ILE  25   6.346   0.221   2.027
  Start of MODEL    1
  147   HD12  ILE  25          HD12      ILE  25   7.643   0.343   3.228
  Start of MODEL    1
  148   HD11  ILE  25          HD13      ILE  25   5.987   0.751   3.666
  Start of MODEL    1
  149    H    ILE  25           HN       ILE  25   5.478  -4.079   2.017
  Start of MODEL    1
  150    HA   PRO  26           HA       PRO  26   1.120  -5.431   3.504
  Start of MODEL    1
  151    HB3  PRO  26           HB2      PRO  26   0.813  -6.983   5.152
  Start of MODEL    1
  152    HB2  PRO  26           HB3      PRO  26   0.672  -5.730   6.388
  Start of MODEL    1
  153    HG2  PRO  26           HG2      PRO  26   2.716  -6.593   7.021
  Start of MODEL    1
  154    HG3  PRO  26           HG3      PRO  26   3.100  -7.128   5.378
  Start of MODEL    1
  155    HD2  PRO  26           HD2      PRO  26   3.323  -4.386   6.572
  Start of MODEL    1
  156    HD3  PRO  26           HD3      PRO  26   4.443  -5.255   5.502
  Start of MODEL    1
  157    HA   PHE  27           HA       PHE  27  -1.572  -2.398   5.145
  Start of MODEL    1
  158    HB3  PHE  27           HB2      PHE  27  -0.646  -1.225   3.189
  Start of MODEL    1
  159    HB2  PHE  27           HB3      PHE  27  -2.353  -0.886   3.398
  Start of MODEL    1
  160    HD1  PHE  27           HD1      PHE  27  -4.017  -1.793   1.831
  Start of MODEL    1
  161    HD2  PHE  27           HD2      PHE  27   0.164  -2.277   1.208
  Start of MODEL    1
  162    HE1  PHE  27           HE1      PHE  27  -4.434  -2.332  -0.529
  Start of MODEL    1
  163    HE2  PHE  27           HE2      PHE  27  -0.250  -2.817  -1.154
  Start of MODEL    1
  164    HZ   PHE  27           HZ       PHE  27  -2.553  -2.846  -2.025
  Start of MODEL    1
  165    H    PHE  27           HN       PHE  27  -0.800  -4.445   3.215
  Start of MODEL    1
  166    HA   SER  28           HA       SER  28  -5.589  -3.808   3.956
  Start of MODEL    1
  167    HB3  SER  28           HB2      SER  28  -6.761  -4.275   6.042
  Start of MODEL    1
  168    HB2  SER  28           HB3      SER  28  -5.671  -3.240   6.951
  Start of MODEL    1
  169    HG   SER  28           HG       SER  28  -4.111  -4.894   5.731
  Start of MODEL    1
  170    H    SER  28           HN       SER  28  -3.784  -1.943   5.271
  Start of MODEL    1
  171    HA   VAL  29           HA       VAL  29  -7.897  -0.091   4.191
  Start of MODEL    1
  172    HB   VAL  29           HB       VAL  29  -6.443   0.604   2.326
  Start of MODEL    1
  173    H    VAL  29           HN       VAL  29  -7.047  -2.606   2.977
  Start of MODEL    1
  174    HA   ASP  30           HA       ASP  30 -11.529  -2.157   3.084
  Start of MODEL    1
  175    HB3  ASP  30           HB2      ASP  30 -11.364  -2.326   5.592
  Start of MODEL    1
  176    HB2  ASP  30           HB3      ASP  30 -12.997  -2.370   4.944
  Start of MODEL    1
  177    H    ASP  30           HN       ASP  30 -10.059  -0.034   4.466
  Start of MODEL    1
  178    HA2  GLY  31           HA2      GLY  31 -15.317   0.228   2.583
  Start of MODEL    1
  179    H    GLY  31           HN       GLY  31 -13.665  -1.790   2.503
  Start of MODEL    1
  180    HA3  GLY  31           HA1      GLY  31 -14.066   0.926   1.557
  Start of MODEL    1
  181    HA   GLN  32           HA       GLN  32 -16.457  -1.921  -0.959
  Start of MODEL    1
  182    HB3  GLN  32           HB2      GLN  32 -18.962  -1.520  -1.496
  Start of MODEL    1
  183    HB2  GLN  32           HB3      GLN  32 -18.961  -0.536  -0.040
  Start of MODEL    1
  184    HG2  GLN  32           HG2      GLN  32 -18.180  -2.445   1.251
  Start of MODEL    1
  185    HG3  GLN  32           HG3      GLN  32 -19.734  -2.754   0.470
  Start of MODEL    1
  186   HE21  GLN  32          HE21      GLN  32 -16.328  -3.525   0.539
  Start of MODEL    1
  187   HE22  GLN  32          HE22      GLN  32 -16.461  -4.944  -0.432
  Start of MODEL    1
  188    H    GLN  32           HN       GLN  32 -16.851   0.181   0.976
  Start of MODEL    1
  189    HA   PRO  33           HA       PRO  33 -16.989   1.803  -3.960
  Start of MODEL    1
  190    HB3  PRO  33           HB2      PRO  33 -17.371   4.039  -3.404
  Start of MODEL    1
  191    HB2  PRO  33           HB3      PRO  33 -16.203   3.976  -2.077
  Start of MODEL    1
  192    HG2  PRO  33           HG2      PRO  33 -18.178   4.007  -0.859
  Start of MODEL    1
  193    HG3  PRO  33           HG3      PRO  33 -19.075   3.137  -2.118
  Start of MODEL    1
  194    HD2  PRO  33           HD2      PRO  33 -17.216   2.105  -0.033
  Start of MODEL    1
  195    HD3  PRO  33           HD3      PRO  33 -18.714   1.397  -0.675
  Start of MODEL    1
  196    HA   ALA  34           HA       ALA  34 -12.788   0.683  -3.526
  Start of MODEL    1
  197    HB3  ALA  34           HB1      ALA  34 -13.419  -0.264  -5.690
  Start of MODEL    1
  198    HB2  ALA  34           HB2      ALA  34 -11.793   0.423  -5.722
  Start of MODEL    1
  199    HB1  ALA  34           HB3      ALA  34 -13.135   1.305  -6.450
  Start of MODEL    1
  200    H    ALA  34           HN       ALA  34 -15.117   1.418  -4.912
  Start of MODEL    1
  201    HA   PRO  35           HA       PRO  35 -11.103   4.842  -3.371
  Start of MODEL    1
  202    HB3  PRO  35           HB2      PRO  35 -10.977   4.437  -1.075
  Start of MODEL    1
  203    HB2  PRO  35           HB3      PRO  35  -9.267   4.422  -1.520
  Start of MODEL    1
  204    HG2  PRO  35           HG2      PRO  35  -9.147   2.116  -1.504
  Start of MODEL    1
  205    HG3  PRO  35           HG3      PRO  35 -10.348   2.359  -0.237
  Start of MODEL    1
  206    HD2  PRO  35           HD2      PRO  35 -10.778   0.860  -2.538
  Start of MODEL    1
  207    HD3  PRO  35           HD3      PRO  35 -12.079   1.604  -1.584
  Start of MODEL    1
  208    HA   SER  36           HA       SER  36  -7.587   4.041  -5.816
  Start of MODEL    1
  209    HB3  SER  36           HB2      SER  36  -6.712   6.147  -6.696
  Start of MODEL    1
  210    HB2  SER  36           HB3      SER  36  -7.642   7.052  -5.495
  Start of MODEL    1
  211    HG   SER  36           HG       SER  36  -8.927   5.252  -7.208
  Start of MODEL    1
  212    H    SER  36           HN       SER  36  -9.397   5.735  -4.393
  Start of MODEL    1
  213    HA   LEU  37           HA       LEU  37  -4.793   4.309  -2.441
  Start of MODEL    1
  214    HB3  LEU  37           HB2      LEU  37  -3.370   2.298  -2.448
  Start of MODEL    1
  215    HB2  LEU  37           HB3      LEU  37  -4.050   1.830  -3.991
  Start of MODEL    1
  216    HG   LEU  37           HG       LEU  37  -6.273   1.598  -2.899
  Start of MODEL    1
  217   HD13  LEU  37          HD11      LEU  37  -5.753  -0.470  -1.762
  Start of MODEL    1
  218   HD12  LEU  37          HD12      LEU  37  -4.086   0.042  -1.537
  Start of MODEL    1
  219   HD11  LEU  37          HD13      LEU  37  -4.682  -0.305  -3.154
  Start of MODEL    1
  220   HD21  LEU  37          HD21      LEU  37  -5.961   3.162  -1.087
  Start of MODEL    1
  221   HD23  LEU  37          HD22      LEU  37  -4.663   2.165  -0.426
  Start of MODEL    1
  222   HD22  LEU  37          HD23      LEU  37  -6.318   1.567  -0.413
  Start of MODEL    1
  223    H    LEU  37           HN       LEU  37  -5.796   3.274  -4.977
  Start of MODEL    1
  224    HA   ARG  38           HA       ARG  38  -1.155   5.435  -4.501
  Start of MODEL    1
  225    HB3  ARG  38           HB2      ARG  38  -2.518   7.953  -3.541
  Start of MODEL    1
  226    HB2  ARG  38           HB3      ARG  38  -2.565   7.250  -5.148
  Start of MODEL    1
  227    HG2  ARG  38           HG2      ARG  38  -1.149   9.145  -5.247
  Start of MODEL    1
  228    HG3  ARG  38           HG3      ARG  38  -0.241   8.615  -3.839
  Start of MODEL    1
  229    HD2  ARG  38           HD2      ARG  38   0.893   8.246  -6.027
  Start of MODEL    1
  230    HD3  ARG  38           HD3      ARG  38   0.742   6.817  -5.024
  Start of MODEL    1
  231    HE   ARG  38           HE       ARG  38  -1.401   7.085  -6.890
  Start of MODEL    1
  232   HH11  ARG  38          HH11      ARG  38   2.025   6.026  -6.709
  Start of MODEL    1
  233   HH12  ARG  38          HH12      ARG  38   1.802   4.773  -7.825
  Start of MODEL    1
  234   HH21  ARG  38          HH21      ARG  38  -1.610   5.385  -8.461
  Start of MODEL    1
  235   HH22  ARG  38          HH22      ARG  38  -0.256   4.437  -8.877
  Start of MODEL    1
  236    H    ARG  38           HN       ARG  38  -3.155   5.613  -2.393
  Start of MODEL    1
  237    HA   TRP  39           HA       TRP  39   1.367   5.813  -0.998
  Start of MODEL    1
  238    HB3  TRP  39           HB2      TRP  39   3.574   4.892  -1.537
  Start of MODEL    1
  239    HB2  TRP  39           HB3      TRP  39   3.137   4.841  -3.240
  Start of MODEL    1
  240    HD1  TRP  39           HD1      TRP  39   1.712   2.850  -4.085
  Start of MODEL    1
  241    HE1  TRP  39           HE1      TRP  39   0.953   0.667  -3.039
  Start of MODEL    1
  242    HE3  TRP  39           HE3      TRP  39   2.795   3.926   0.787
  Start of MODEL    1
  243    HZ2  TRP  39           HZ2      TRP  39   0.801  -0.480  -0.431
  Start of MODEL    1
  244    HZ3  TRP  39           HZ3      TRP  39   2.314   2.232   2.499
  Start of MODEL    1
  245    HH2  TRP  39           HH2      TRP  39   1.345   0.074   1.906
  Start of MODEL    1
  246    H    TRP  39           HN       TRP  39   0.830   5.422  -3.811
  Start of MODEL    1
  247    HA   LEU  40           HA       LEU  40   3.621   9.373  -2.158
  Start of MODEL    1
  248    HB3  LEU  40           HB2      LEU  40   2.770   9.869   0.699
  Start of MODEL    1
  249    HB2  LEU  40           HB3      LEU  40   1.674  10.081  -0.655
  Start of MODEL    1
  250    HG   LEU  40           HG       LEU  40   4.250  11.600  -0.440
  Start of MODEL    1
  251   HD13  LEU  40          HD11      LEU  40   3.334  11.463  -2.650
  Start of MODEL    1
  252   HD12  LEU  40          HD12      LEU  40   3.096  13.091  -2.004
  Start of MODEL    1
  253   HD11  LEU  40          HD13      LEU  40   1.747  11.949  -2.050
  Start of MODEL    1
  254   HD21  LEU  40          HD21      LEU  40   2.901  12.109   1.513
  Start of MODEL    1
  255   HD23  LEU  40          HD22      LEU  40   1.494  12.357   0.482
  Start of MODEL    1
  256   HD22  LEU  40          HD23      LEU  40   2.864  13.463   0.378
  Start of MODEL    1
  257    H    LEU  40           HN       LEU  40   2.427   7.466  -0.271
  Start of MODEL    1
  258    HA   PHE  41           HA       PHE  41   7.042   8.415   0.427
  Start of MODEL    1
  259    HB3  PHE  41           HB2      PHE  41   7.989   8.439  -2.450
  Start of MODEL    1
  260    HB2  PHE  41           HB3      PHE  41   7.380   7.047  -1.561
  Start of MODEL    1
  261    HD1  PHE  41           HD1      PHE  41  10.269   8.798  -2.530
  Start of MODEL    1
  262    HD2  PHE  41           HD2      PHE  41   8.645   6.412   0.588
  Start of MODEL    1
  263    HE1  PHE  41           HE1      PHE  41  12.538   8.260  -1.765
  Start of MODEL    1
  264    HE2  PHE  41           HE2      PHE  41  10.909   5.871   1.357
  Start of MODEL    1
  265    HZ   PHE  41           HZ       PHE  41  12.856   6.793   0.182
  Start of MODEL    1
  266    H    PHE  41           HN       PHE  41   5.781   9.736  -1.856
  Start of MODEL    1
  267    HA   ASN  42           HA       ASN  42   8.764  11.817   2.436
  Start of MODEL    1
  268    HB3  ASN  42           HB2      ASN  42  10.701  12.797   1.161
  Start of MODEL    1
  269    HB2  ASN  42           HB3      ASN  42  10.348  11.688  -0.152
  Start of MODEL    1
  270   HD21  ASN  42          HD21      ASN  42  12.414  10.824   0.031
  Start of MODEL    1
  271   HD22  ASN  42          HD22      ASN  42  12.831   9.707   1.266
  Start of MODEL    1
  272    H    ASN  42           HN       ASN  42   7.834   9.901   1.626
  Start of MODEL    1
  273    HA2  GLY  43           HA2      GLY  43   4.954  13.915   0.627
  Start of MODEL    1
  274    H    GLY  43           HN       GLY  43   6.329  12.108   1.085
  Start of MODEL    1
  275    HA3  GLY  43           HA1      GLY  43   6.372  14.947   0.603
  Start of MODEL    1
  276    HA   SER  44           HA       SER  44   6.238  13.953  -3.828
  Start of MODEL    1
  277    HB3  SER  44           HB2      SER  44   8.534  12.019  -3.406
  Start of MODEL    1
  278    HB2  SER  44           HB3      SER  44   8.704  13.765  -3.269
  Start of MODEL    1
  279    HG   SER  44           HG       SER  44   9.263  13.363  -5.277
  Start of MODEL    1
  280    H    SER  44           HN       SER  44   7.077  12.462  -1.414
  Start of MODEL    1
  281    HA   VAL  45           HA       VAL  45   3.815  10.697  -4.976
  Start of MODEL    1
  282    HB   VAL  45           HB       VAL  45   4.748  11.920  -7.589
  Start of MODEL    1
  283    H    VAL  45           HN       VAL  45   5.622  12.781  -5.571
  Start of MODEL    1
  284    HA   LEU  46           HA       LEU  46   6.817   7.622  -5.761
  Start of MODEL    1
  285    HB3  LEU  46           HB2      LEU  46   4.815   6.371  -3.873
  Start of MODEL    1
  286    HB2  LEU  46           HB3      LEU  46   6.314   7.141  -3.400
  Start of MODEL    1
  287    HG   LEU  46           HG       LEU  46   6.131   4.660  -5.111
  Start of MODEL    1
  288   HD12  LEU  46          HD11      LEU  46   8.518   4.428  -4.648
  Start of MODEL    1
  289   HD11  LEU  46          HD12      LEU  46   8.502   5.975  -3.800
  Start of MODEL    1
  290   HD13  LEU  46          HD13      LEU  46   8.156   5.909  -5.529
  Start of MODEL    1
  291   HD21  LEU  46          HD21      LEU  46   5.314   4.215  -2.867
  Start of MODEL    1
  292   HD23  LEU  46          HD22      LEU  46   6.776   4.925  -2.178
  Start of MODEL    1
  293   HD22  LEU  46          HD23      LEU  46   6.874   3.442  -3.136
  Start of MODEL    1
  294    H    LEU  46           HN       LEU  46   4.396   8.673  -4.591
  Start of MODEL    1
  295    HA   ASN  47           HA       ASN  47   4.215   5.592  -8.539
  Start of MODEL    1
  296    HB3  ASN  47           HB2      ASN  47   5.265   5.664 -10.823
  Start of MODEL    1
  297    HB2  ASN  47           HB3      ASN  47   6.706   6.362 -10.098
  Start of MODEL    1
  298   HD21  ASN  47          HD21      ASN  47   3.392   6.934 -10.993
  Start of MODEL    1
  299   HD22  ASN  47          HD22      ASN  47   3.432   8.644 -10.829
  Start of MODEL    1
  300    H    ASN  47           HN       ASN  47   6.765   6.583  -7.591
  Start of MODEL    1
  301    HA   GLU  48           HA       GLU  48   6.039   1.696  -7.699
  Start of MODEL    1
  302    HB3  GLU  48           HB2      GLU  48   4.606  -0.113  -8.246
  Start of MODEL    1
  303    HB2  GLU  48           HB3      GLU  48   3.862   0.765  -9.563
  Start of MODEL    1
  304    HG2  GLU  48           HG2      GLU  48   2.561   0.409  -7.336
  Start of MODEL    1
  305    HG3  GLU  48           HG3      GLU  48   3.531   1.764  -6.768
  Start of MODEL    1
  306    H    GLU  48           HN       GLU  48   4.098   3.395  -8.819
  Start of MODEL    1
  307    HA   THR  49           HA       THR  49   7.958   0.474 -11.492
  Start of MODEL    1
  308    HB   THR  49           HB       THR  49  10.385   0.183 -10.944
  Start of MODEL    1
  309    HG1  THR  49           HG1      THR  49  10.850   0.785  -8.627
  Start of MODEL    1
  310   HG21  THR  49          HG21      THR  49   9.106   2.597  -9.631
  Start of MODEL    1
  311   HG23  THR  49          HG22      THR  49   9.516   2.455 -11.340
  Start of MODEL    1
  312   HG22  THR  49          HG23      THR  49  10.793   2.477 -10.126
  Start of MODEL    1
  313    H    THR  49           HN       THR  49   7.418   0.194  -8.621
  Start of MODEL    1
  314    HA   SER  50           HA       SER  50   8.383  -3.898 -11.176
  Start of MODEL    1
  315    HB3  SER  50           HB2      SER  50  10.231  -5.060 -12.260
  Start of MODEL    1
  316    HB2  SER  50           HB3      SER  50  11.216  -3.598 -12.176
  Start of MODEL    1
  317    HG   SER  50           HG       SER  50   8.716  -3.350 -13.353
  Start of MODEL    1
  318    H    SER  50           HN       SER  50   9.912  -1.535 -11.694
  Start of MODEL    1
  319    HA   PHE  51           HA       PHE  51  11.572  -4.395  -7.867
  Start of MODEL    1
  320    HB3  PHE  51           HB2      PHE  51  13.020  -2.773  -6.656
  Start of MODEL    1
  321    HB2  PHE  51           HB3      PHE  51  12.409  -1.491  -7.686
  Start of MODEL    1
  322    HD1  PHE  51           HD1      PHE  51  13.263  -4.876  -8.847
  Start of MODEL    1
  323    HD2  PHE  51           HD2      PHE  51  14.468  -0.799  -8.668
  Start of MODEL    1
  324    HE1  PHE  51           HE1      PHE  51  15.036  -5.326 -10.493
  Start of MODEL    1
  325    HE2  PHE  51           HE2      PHE  51  16.238  -1.248 -10.311
  Start of MODEL    1
  326    HZ   PHE  51           HZ       PHE  51  16.585  -3.457 -11.171
  Start of MODEL    1
  327    H    PHE  51           HN       PHE  51  10.811  -2.121  -9.500
  Start of MODEL    1
  328    HA   ILE  52           HA       ILE  52   8.819  -2.191  -4.906
  Start of MODEL    1
  329    HB   ILE  52           HB       ILE  52   8.593   0.522  -6.251
  Start of MODEL    1
  330   HD11  ILE  52          HD11      ILE  52  10.210   1.954  -3.993
  Start of MODEL    1
  331   HD13  ILE  52          HD12      ILE  52  10.404   2.250  -5.717
  Start of MODEL    1
  332   HD12  ILE  52          HD13      ILE  52  11.794   1.762  -4.745
  Start of MODEL    1
  333    H    ILE  52           HN       ILE  52   9.718  -1.420  -7.614
  Start of MODEL    1
  334    HA   PHE  53           HA       PHE  53   4.991  -2.028  -7.071
  Start of MODEL    1
  335    HB3  PHE  53           HB2      PHE  53   5.828  -3.801  -8.391
  Start of MODEL    1
  336    HB2  PHE  53           HB3      PHE  53   4.238  -4.310  -7.839
  Start of MODEL    1
  337    HD1  PHE  53           HD1      PHE  53   7.825  -4.973  -7.660
  Start of MODEL    1
  338    HD2  PHE  53           HD2      PHE  53   3.978  -6.103  -6.227
  Start of MODEL    1
  339    HE1  PHE  53           HE1      PHE  53   8.764  -7.073  -6.788
  Start of MODEL    1
  340    HE2  PHE  53           HE2      PHE  53   4.908  -8.195  -5.357
  Start of MODEL    1
  341    HZ   PHE  53           HZ       PHE  53   7.353  -8.697  -5.709
  Start of MODEL    1
  342    H    PHE  53           HN       PHE  53   6.863  -3.303  -5.231
  Start of MODEL    1
  343    HA   THR  54           HA       THR  54   2.165  -2.627  -3.849
  Start of MODEL    1
  344    HB   THR  54           HB       THR  54   0.466  -1.469  -6.081
  Start of MODEL    1
  345    HG1  THR  54           HG1      THR  54   1.189   0.479  -5.501
  Start of MODEL    1
  346   HG23  THR  54          HG21      THR  54  -0.789  -2.310  -4.133
  Start of MODEL    1
  347   HG22  THR  54          HG22      THR  54  -0.881  -0.554  -4.252
  Start of MODEL    1
  348   HG21  THR  54          HG23      THR  54   0.192  -1.302  -3.067
  Start of MODEL    1
  349    H    THR  54           HN       THR  54   2.908  -1.972  -6.548
  Start of MODEL    1
  350    HA   GLU  55           HA       GLU  55   0.197  -6.223  -5.429
  Start of MODEL    1
  351    HB3  GLU  55           HB2      GLU  55   0.184  -7.989  -3.748
  Start of MODEL    1
  352    HB2  GLU  55           HB3      GLU  55   0.766  -6.850  -2.548
  Start of MODEL    1
  353    HG2  GLU  55           HG2      GLU  55   2.271  -7.594  -5.024
  Start of MODEL    1
  354    HG3  GLU  55           HG3      GLU  55   2.844  -6.620  -3.664
  Start of MODEL    1
  355    H    GLU  55           HN       GLU  55   1.362  -4.585  -3.351
  Start of MODEL    1
  356    HA   PHE  56           HA       PHE  56  -3.709  -5.608  -3.508
  Start of MODEL    1
  357    HB3  PHE  56           HB2      PHE  56  -5.422  -5.550  -5.363
  Start of MODEL    1
  358    HB2  PHE  56           HB3      PHE  56  -4.127  -5.835  -6.512
  Start of MODEL    1
  359    HD1  PHE  56           HD1      PHE  56  -5.920  -3.396  -4.630
  Start of MODEL    1
  360    HD2  PHE  56           HD2      PHE  56  -2.313  -4.088  -6.776
  Start of MODEL    1
  361    HE1  PHE  56           HE1      PHE  56  -5.587  -0.977  -4.838
  Start of MODEL    1
  362    HE2  PHE  56           HE2      PHE  56  -1.964  -1.662  -6.980
  Start of MODEL    1
  363    HZ   PHE  56           HZ       PHE  56  -3.599  -0.098  -6.000
  Start of MODEL    1
  364    H    PHE  56           HN       PHE  56  -1.878  -6.307  -5.695
  Start of MODEL    1
  365    HA   LEU  57           HA       LEU  57  -4.203  -9.906  -4.015
  Start of MODEL    1
  366    HB3  LEU  57           HB2      LEU  57  -2.746  -9.939  -2.004
  Start of MODEL    1
  367    HB2  LEU  57           HB3      LEU  57  -3.947 -11.201  -1.991
  Start of MODEL    1
  368    HG   LEU  57           HG       LEU  57  -4.389  -8.737  -0.371
  Start of MODEL    1
  369   HD12  LEU  57          HD11      LEU  57  -5.690 -10.362   1.019
  Start of MODEL    1
  370   HD11  LEU  57          HD12      LEU  57  -5.342 -11.588  -0.200
  Start of MODEL    1
  371   HD13  LEU  57          HD13      LEU  57  -6.295 -10.175  -0.630
  Start of MODEL    1
  372   HD21  LEU  57          HD21      LEU  57  -2.182  -9.566   0.244
  Start of MODEL    1
  373   HD23  LEU  57          HD22      LEU  57  -2.831 -11.193   0.436
  Start of MODEL    1
  374   HD22  LEU  57          HD23      LEU  57  -3.351  -9.905   1.521
  Start of MODEL    1
  375    H    LEU  57           HN       LEU  57  -4.169  -7.488  -2.403
  Start of MODEL    1
  376    HA   GLU  58           HA       GLU  58  -8.399 -10.208  -4.096
  Start of MODEL    1
  377    HB3  GLU  58           HB2      GLU  58  -9.186 -12.560  -4.331
  Start of MODEL    1
  378    HB2  GLU  58           HB3      GLU  58  -7.577 -13.082  -3.851
  Start of MODEL    1
  379    HG2  GLU  58           HG2      GLU  58  -6.633 -11.903  -5.794
  Start of MODEL    1
  380    HG3  GLU  58           HG3      GLU  58  -7.770 -13.181  -6.227
  Start of MODEL    1
  381    H    GLU  58           HN       GLU  58  -5.885 -11.430  -3.720
  Start of MODEL    1
  382    HA   PRO  59           HA       PRO  59  -9.475 -10.461   0.317
  Start of MODEL    1
  383    HB3  PRO  59           HB2      PRO  59 -10.372  -8.377   0.573
  Start of MODEL    1
  384    HB2  PRO  59           HB3      PRO  59 -11.791  -8.855  -0.358
  Start of MODEL    1
  385    HG2  PRO  59           HG2      PRO  59 -10.961  -7.355  -1.891
  Start of MODEL    1
  386    HG3  PRO  59           HG3      PRO  59  -9.315  -7.487  -1.251
  Start of MODEL    1
  387    HD2  PRO  59           HD2      PRO  59 -10.736  -9.261  -3.193
  Start of MODEL    1
  388    HD3  PRO  59           HD3      PRO  59  -9.057  -8.667  -3.185
  Start of MODEL    1
  389    HA   ALA  60           HA       ALA  60 -12.806 -13.270  -0.066
  Start of MODEL    1
  390    HB2  ALA  60           HB1      ALA  60 -13.751 -13.856   2.145
  Start of MODEL    1
  391    HB1  ALA  60           HB2      ALA  60 -12.935 -12.460   2.849
  Start of MODEL    1
  392    HB3  ALA  60           HB3      ALA  60 -11.987 -13.793   2.189
  Start of MODEL    1
  393    H    ALA  60           HN       ALA  60 -11.329 -11.324   1.452
  Start of MODEL    1
  394    HA   ALA  61           HA       ALA  61 -16.061 -10.600  -0.961
  Start of MODEL    1
  395    HB3  ALA  61           HB1      ALA  61 -16.526 -12.552  -2.370
  Start of MODEL    1
  396    HB2  ALA  61           HB2      ALA  61 -18.007 -11.773  -1.816
  Start of MODEL    1
  397    HB1  ALA  61           HB3      ALA  61 -17.457 -13.267  -1.054
  Start of MODEL    1
  398    H    ALA  61           HN       ALA  61 -14.996 -13.172  -0.459
  Start of MODEL    1
  399    HA   ASN  62           HA       ASN  62 -18.436 -11.122   2.845
  Start of MODEL    1
  400    HB3  ASN  62           HB2      ASN  62 -18.080 -12.644   4.844
  Start of MODEL    1
  401    HB2  ASN  62           HB3      ASN  62 -16.744 -13.362   3.945
  Start of MODEL    1
  402   HD21  ASN  62          HD21      ASN  62 -17.163 -14.706   2.188
  Start of MODEL    1
  403   HD22  ASN  62          HD22      ASN  62 -18.762 -15.272   1.862
  Start of MODEL    1
  404    H    ASN  62           HN       ASN  62 -15.949 -12.281   1.846
  Start of MODEL    1
  405    HA   GLU  63           HA       GLU  63 -15.428  -8.818   5.163
  Start of MODEL    1
  406    HB3  GLU  63           HB2      GLU  63 -13.467 -10.430   4.937
  Start of MODEL    1
  407    HB2  GLU  63           HB3      GLU  63 -13.028  -8.774   5.296
  Start of MODEL    1
  408    HG2  GLU  63           HG2      GLU  63 -12.899 -10.020   2.563
  Start of MODEL    1
  409    HG3  GLU  63           HG3      GLU  63 -12.376  -8.398   3.002
  Start of MODEL    1
  410    H    GLU  63           HN       GLU  63 -15.283 -10.258   2.621
  Start of MODEL    1
  411    HA   THR  64           HA       THR  64 -15.499  -5.454   2.426
  Start of MODEL    1
  412    HB   THR  64           HB       THR  64 -15.295  -3.920   5.034
  Start of MODEL    1
  413    HG1  THR  64           HG1      THR  64 -16.736  -5.631   5.382
  Start of MODEL    1
  414   HG22  THR  64          HG21      THR  64 -16.963  -2.472   3.957
  Start of MODEL    1
  415   HG21  THR  64          HG22      THR  64 -16.972  -3.539   2.552
  Start of MODEL    1
  416   HG23  THR  64          HG23      THR  64 -15.518  -2.626   2.953
  Start of MODEL    1
  417    H    THR  64           HN       THR  64 -14.957  -6.579   5.062
  Start of MODEL    1
  418    HA   VAL  65           HA       VAL  65 -11.276  -4.005   3.651
  Start of MODEL    1
  419    HB   VAL  65           HB       VAL  65 -10.368  -6.580   4.923
  Start of MODEL    1
  420    H    VAL  65           HN       VAL  65 -12.860  -6.438   3.938
  Start of MODEL    1
  421    HA   ARG  66           HA       ARG  66  -9.251  -5.985   0.289
  Start of MODEL    1
  422    HB3  ARG  66           HB2      ARG  66  -8.717  -3.001   0.166
  Start of MODEL    1
  423    HB2  ARG  66           HB3      ARG  66 -10.033  -3.816  -0.656
  Start of MODEL    1
  424    HG2  ARG  66           HG2      ARG  66  -7.119  -4.303  -1.219
  Start of MODEL    1
  425    HG3  ARG  66           HG3      ARG  66  -8.496  -4.982  -2.087
  Start of MODEL    1
  426    HD2  ARG  66           HD2      ARG  66  -7.782  -2.057  -1.894
  Start of MODEL    1
  427    HD3  ARG  66           HD3      ARG  66  -7.521  -3.072  -3.300
  Start of MODEL    1
  428    HE   ARG  66           HE       ARG  66 -10.210  -2.518  -2.222
  Start of MODEL    1
  429   HH11  ARG  66          HH11      ARG  66  -8.047  -2.779  -5.019
  Start of MODEL    1
  430   HH12  ARG  66          HH12      ARG  66  -9.197  -2.265  -6.152
  Start of MODEL    1
  431   HH21  ARG  66          HH21      ARG  66 -11.798  -1.879  -3.758
  Start of MODEL    1
  432   HH22  ARG  66          HH22      ARG  66 -11.402  -1.774  -5.423
  Start of MODEL    1
  433    H    ARG  66           HN       ARG  66  -9.896  -3.782   2.087
  Start of MODEL    1
  434    HA   HIS  67           HA       HIS  67  -5.322  -5.596   2.270
  Start of MODEL    1
  435    HB3  HIS  67           HB2      HIS  67  -4.454  -7.902   2.635
  Start of MODEL    1
  436    HB2  HIS  67           HB3      HIS  67  -5.704  -8.500   1.565
  Start of MODEL    1
  437    HD1  HIS  67           HD1      HIS  67  -5.072  -7.808   5.050
  Start of MODEL    1
  438    HD2  HIS  67           HD2      HIS  67  -8.388  -8.150   2.585
  Start of MODEL    1
  439    HE1  HIS  67           HE1      HIS  67  -7.042  -8.172   6.592
  Start of MODEL    1
  440    HE2  HIS  67           HE2      HIS  67  -8.971  -8.674   4.981
  Start of MODEL    1
  441    H    HIS  67           HN       HIS  67  -7.116  -6.749   0.225
  Start of MODEL    1
  442    HA2  GLY  68           HA2      GLY  68  -2.075  -7.190  -0.446
  Start of MODEL    1
  443    H    GLY  68           HN       GLY  68  -3.019  -6.012   1.868
  Start of MODEL    1
  444    HA3  GLY  68           HA1      GLY  68  -2.294  -5.470  -0.756
  Start of MODEL    1
  445    HA   CYS  69           HA       CYS  69   1.386  -4.791   1.358
  Start of MODEL    1
  446    HB3  CYS  69           HB2      CYS  69   2.195  -7.274  -0.180
  Start of MODEL    1
  447    HB2  CYS  69           HB3      CYS  69   1.827  -7.153   1.541
  Start of MODEL    1
  448    H    CYS  69           HN       CYS  69   0.030  -5.591  -1.043
  Start of MODEL    1
  449    HA   LEU  70           HA       LEU  70   3.537  -2.913  -1.995
  Start of MODEL    1
  450    HB3  LEU  70           HB2      LEU  70   4.623  -1.459   0.433
  Start of MODEL    1
  451    HB2  LEU  70           HB3      LEU  70   3.206  -0.933  -0.451
  Start of MODEL    1
  452    HG   LEU  70           HG       LEU  70   5.991  -1.114  -1.601
  Start of MODEL    1
  453   HD12  LEU  70          HD11      LEU  70   5.044   0.251  -3.411
  Start of MODEL    1
  454   HD11  LEU  70          HD12      LEU  70   3.446   0.038  -2.701
  Start of MODEL    1
  455   HD13  LEU  70          HD13      LEU  70   4.335  -1.361  -3.319
  Start of MODEL    1
  456   HD23  LEU  70          HD21      LEU  70   4.434   1.280  -0.657
  Start of MODEL    1
  457   HD22  LEU  70          HD22      LEU  70   5.964   1.325  -1.528
  Start of MODEL    1
  458   HD21  LEU  70          HD23      LEU  70   5.896   0.621   0.088
  Start of MODEL    1
  459    H    LEU  70           HN       LEU  70   2.959  -3.327   0.838
  Start of MODEL    1
  460    HA   ARG  71           HA       ARG  71   6.873  -5.401  -0.745
  Start of MODEL    1
  461    HB3  ARG  71           HB2      ARG  71   5.986  -6.807  -3.257
  Start of MODEL    1
  462    HB2  ARG  71           HB3      ARG  71   5.236  -7.060  -1.686
  Start of MODEL    1
  463    HG2  ARG  71           HG2      ARG  71   8.140  -7.555  -2.318
  Start of MODEL    1
  464    HG3  ARG  71           HG3      ARG  71   7.332  -7.873  -0.786
  Start of MODEL    1
  465    HD2  ARG  71           HD2      ARG  71   6.824  -9.225  -3.431
  Start of MODEL    1
  466    HD3  ARG  71           HD3      ARG  71   7.552  -9.930  -1.989
  Start of MODEL    1
  467    HE   ARG  71           HE       ARG  71   4.762  -8.978  -1.986
  Start of MODEL    1
  468   HH11  ARG  71          HH11      ARG  71   7.056 -11.642  -1.360
  Start of MODEL    1
  469   HH12  ARG  71          HH12      ARG  71   5.839 -12.687  -0.813
  Start of MODEL    1
  470   HH21  ARG  71          HH21      ARG  71   3.236 -10.327  -1.353
  Start of MODEL    1
  471   HH22  ARG  71          HH22      ARG  71   3.511 -11.951  -0.825
  Start of MODEL    1
  472    H    ARG  71           HN       ARG  71   4.891  -4.464  -2.671
  Start of MODEL    1
  473    HA   LEU  72           HA       LEU  72   9.724  -4.122  -3.700
  Start of MODEL    1
  474    HB3  LEU  72           HB2      LEU  72  11.718  -3.145  -2.548
  Start of MODEL    1
  475    HB2  LEU  72           HB3      LEU  72  11.033  -3.597  -1.009
  Start of MODEL    1
  476    HG   LEU  72           HG       LEU  72   9.599  -1.772  -2.904
  Start of MODEL    1
  477   HD13  LEU  72          HD11      LEU  72   8.210  -2.639  -1.152
  Start of MODEL    1
  478   HD12  LEU  72          HD12      LEU  72   8.501  -0.914  -0.898
  Start of MODEL    1
  479   HD11  LEU  72          HD13      LEU  72   9.363  -2.106   0.073
  Start of MODEL    1
  480   HD23  LEU  72          HD21      LEU  72  11.499  -0.888  -0.746
  Start of MODEL    1
  481   HD22  LEU  72          HD22      LEU  72  10.491   0.134  -1.792
  Start of MODEL    1
  482   HD21  LEU  72          HD23      LEU  72  11.800  -0.814  -2.486
  Start of MODEL    1
  483    H    LEU  72           HN       LEU  72   8.890  -5.059  -1.071
  Start of MODEL    1
  484    HA   ASN  73           HA       ASN  73  11.573  -8.073  -3.760
  Start of MODEL    1
  485    HB3  ASN  73           HB2      ASN  73  11.500  -6.926  -6.569
  Start of MODEL    1
  486    HB2  ASN  73           HB3      ASN  73  10.347  -8.049  -5.863
  Start of MODEL    1
  487   HD21  ASN  73          HD21      ASN  73  11.913  -8.315  -8.248
  Start of MODEL    1
  488   HD22  ASN  73          HD22      ASN  73  12.823  -9.763  -8.087
  Start of MODEL    1
  489    H    ASN  73           HN       ASN  73  10.456  -5.627  -4.771
  Start of MODEL    1
  490    HA   GLN  74           HA       GLN  74  15.556  -5.966  -4.334
  Start of MODEL    1
  491    HB3  GLN  74           HB2      GLN  74  14.923  -4.356  -6.826
  Start of MODEL    1
  492    HB2  GLN  74           HB3      GLN  74  15.121  -6.088  -6.878
  Start of MODEL    1
  493    HG2  GLN  74           HG2      GLN  74  17.457  -5.860  -6.162
  Start of MODEL    1
  494    HG3  GLN  74           HG3      GLN  74  17.116  -5.036  -7.674
  Start of MODEL    1
  495   HE21  GLN  74          HE21      GLN  74  18.111  -4.736  -4.423
  Start of MODEL    1
  496   HE22  GLN  74          HE22      GLN  74  18.460  -3.058  -4.450
  Start of MODEL    1
  497    H    GLN  74           HN       GLN  74  12.919  -5.180  -5.301
  Start of MODEL    1
  498    HA   PRO  75           HA       PRO  75  14.278  -2.056  -2.378
  Start of MODEL    1
  499    HB3  PRO  75           HB2      PRO  75  14.164  -3.260  -0.407
  Start of MODEL    1
  500    HB2  PRO  75           HB3      PRO  75  15.660  -2.365  -0.111
  Start of MODEL    1
  501    HG2  PRO  75           HG2      PRO  75  16.999  -4.171  -0.619
  Start of MODEL    1
  502    HG3  PRO  75           HG3      PRO  75  15.591  -5.040   0.002
  Start of MODEL    1
  503    HD2  PRO  75           HD2      PRO  75  16.654  -5.365  -2.524
  Start of MODEL    1
  504    HD3  PRO  75           HD3      PRO  75  14.983  -5.762  -2.079
  Start of MODEL    1
  505    HA   THR  76           HA       THR  76  18.219  -0.099  -2.497
  Start of MODEL    1
  506    HB   THR  76           HB       THR  76  17.895   2.024  -3.920
  Start of MODEL    1
  507    HG1  THR  76           HG1      THR  76  15.291   1.364  -3.550
  Start of MODEL    1
  508   HG23  THR  76          HG21      THR  76  18.729  -0.084  -4.834
  Start of MODEL    1
  509   HG22  THR  76          HG22      THR  76  17.683   0.739  -5.991
  Start of MODEL    1
  510   HG21  THR  76          HG23      THR  76  17.074  -0.640  -5.073
  Start of MODEL    1
  511    H    THR  76           HN       THR  76  15.318  -0.076  -2.200
  Start of MODEL    1
  512    HA   HIS  77           HA       HIS  77  18.201   2.450   0.951
  Start of MODEL    1
  513    HB3  HIS  77           HB2      HIS  77  20.559   1.997   1.044
  Start of MODEL    1
  514    HB2  HIS  77           HB3      HIS  77  20.346   3.719   1.211
  Start of MODEL    1
  515    HD1  HIS  77           HD1      HIS  77  21.330   1.244  -1.486
  Start of MODEL    1
  516    HD2  HIS  77           HD2      HIS  77  21.766   5.250  -0.473
  Start of MODEL    1
  517    HE1  HIS  77           HE1      HIS  77  22.970   2.188  -3.142
  Start of MODEL    1
  518    HE2  HIS  77           HE2      HIS  77  22.972   4.653  -2.678
  Start of MODEL    1
  519    H    HIS  77           HN       HIS  77  19.269   1.335  -1.344
  Start of MODEL    1
  520    HA   VAL  78           HA       VAL  78  17.524   6.516  -1.038
  Start of MODEL    1
  521    HB   VAL  78           HB       VAL  78  16.453   7.063  -3.224
  Start of MODEL    1
  522    H    VAL  78           HN       VAL  78  17.766   3.818  -2.045
  Start of MODEL    1
  523    HA   ASN  79           HA       ASN  79  13.062   4.808  -0.821
  Start of MODEL    1
  524    HB3  ASN  79           HB2      ASN  79  12.417   2.468  -0.307
  Start of MODEL    1
  525    HB2  ASN  79           HB3      ASN  79  14.113   2.016  -0.282
  Start of MODEL    1
  526   HD21  ASN  79          HD21      ASN  79  12.575   4.180  -2.588
  Start of MODEL    1
  527   HD22  ASN  79          HD22      ASN  79  12.844   3.167  -3.956
  Start of MODEL    1
  528    H    ASN  79           HN       ASN  79  15.730   3.681  -0.994
  Start of MODEL    1
  529    HA   ASN  80           HA       ASN  80  14.438   4.041   3.623
  Start of MODEL    1
  530    HB3  ASN  80           HB2      ASN  80  17.044   5.416   2.910
  Start of MODEL    1
  531    HB2  ASN  80           HB3      ASN  80  16.829   3.702   3.220
  Start of MODEL    1
  532   HD21  ASN  80          HD21      ASN  80  18.676   5.294   4.480
  Start of MODEL    1
  533   HD22  ASN  80          HD22      ASN  80  18.308   5.406   6.151
  Start of MODEL    1
  534    H    ASN  80           HN       ASN  80  15.628   4.751   1.119
  Start of MODEL    1
  535    HA2  GLY  81           HA2      GLY  81  12.929   7.943   4.695
  Start of MODEL    1
  536    H    GLY  81           HN       GLY  81  12.591   5.372   3.533
  Start of MODEL    1
  537    HA3  GLY  81           HA1      GLY  81  12.376   8.026   3.027
  Start of MODEL    1
  538    HA   ASN  82           HA       ASN  82   8.730   7.244   5.398
  Start of MODEL    1
  539    HB3  ASN  82           HB2      ASN  82   8.415  10.129   4.574
  Start of MODEL    1
  540    HB2  ASN  82           HB3      ASN  82   8.874   9.516   6.162
  Start of MODEL    1
  541   HD21  ASN  82          HD21      ASN  82   7.293   8.559   7.457
  Start of MODEL    1
  542   HD22  ASN  82          HD22      ASN  82   5.604   8.757   7.130
  Start of MODEL    1
  543    H    ASN  82           HN       ASN  82  10.401   8.928   3.712
  Start of MODEL    1
  544    HA   TYR  83           HA       TYR  83   6.077   6.528   1.979
  Start of MODEL    1
  545    HB3  TYR  83           HB2      TYR  83   5.166   4.169   2.473
  Start of MODEL    1
  546    HB2  TYR  83           HB3      TYR  83   6.222   4.195   3.897
  Start of MODEL    1
  547    HD1  TYR  83           HD1      TYR  83   6.138   3.750   0.306
  Start of MODEL    1
  548    HD2  TYR  83           HD2      TYR  83   8.611   4.208   3.731
  Start of MODEL    1
  549    HE1  TYR  83           HE1      TYR  83   8.063   2.920  -0.970
  Start of MODEL    1
  550    HE2  TYR  83           HE2      TYR  83  10.539   3.378   2.453
  Start of MODEL    1
  551    HH   TYR  83           HH       TYR  83  10.468   3.076  -0.895
  Start of MODEL    1
  552    H    TYR  83           HN       TYR  83   7.115   6.150   4.683
  Start of MODEL    1
  553    HA   THR  84           HA       THR  84   2.220   6.640   4.216
  Start of MODEL    1
  554    HB   THR  84           HB       THR  84   2.421   9.206   2.595
  Start of MODEL    1
  555    HG1  THR  84           HG1      THR  84   4.028   8.742   4.259
  Start of MODEL    1
  556   HG22  THR  84          HG21      THR  84   0.748  10.129   4.172
  Start of MODEL    1
  557   HG21  THR  84          HG22      THR  84   0.596   8.541   4.926
  Start of MODEL    1
  558   HG23  THR  84          HG23      THR  84   0.088   8.775   3.253
  Start of MODEL    1
  559    H    THR  84           HN       THR  84   3.874   6.946   1.835
  Start of MODEL    1
  560    HA   LEU  85           HA       LEU  85  -0.358   5.499   0.894
  Start of MODEL    1
  561    HB3  LEU  85           HB2      LEU  85  -1.457   4.008   3.283
  Start of MODEL    1
  562    HB2  LEU  85           HB3      LEU  85  -0.162   3.440   2.246
  Start of MODEL    1
  563    HG   LEU  85           HG       LEU  85  -3.040   3.839   1.397
  Start of MODEL    1
  564   HD12  LEU  85          HD11      LEU  85  -2.323   2.699  -0.626
  Start of MODEL    1
  565   HD11  LEU  85          HD12      LEU  85  -0.658   2.733  -0.002
  Start of MODEL    1
  566   HD13  LEU  85          HD13      LEU  85  -1.485   4.247  -0.403
  Start of MODEL    1
  567   HD21  LEU  85          HD21      LEU  85  -2.651   1.948   2.916
  Start of MODEL    1
  568   HD23  LEU  85          HD22      LEU  85  -1.472   1.295   1.768
  Start of MODEL    1
  569   HD22  LEU  85          HD23      LEU  85  -3.171   1.470   1.306
  Start of MODEL    1
  570    H    LEU  85           HN       LEU  85   0.196   5.901   3.741
  Start of MODEL    1
  571    HA   LEU  86           HA       LEU  86  -3.939   7.884   1.736
  Start of MODEL    1
  572    HB3  LEU  86           HB2      LEU  86  -4.277   9.459  -0.151
  Start of MODEL    1
  573    HB2  LEU  86           HB3      LEU  86  -2.994   8.684  -1.036
  Start of MODEL    1
  574    HG   LEU  86           HG       LEU  86  -2.440  10.900  -0.066
  Start of MODEL    1
  575   HD13  LEU  86          HD11      LEU  86  -3.586  10.797   2.012
  Start of MODEL    1
  576   HD12  LEU  86          HD12      LEU  86  -1.869  11.091   2.280
  Start of MODEL    1
  577   HD11  LEU  86          HD13      LEU  86  -2.546   9.487   2.567
  Start of MODEL    1
  578   HD21  LEU  86          HD21      LEU  86  -0.652   9.395  -0.728
  Start of MODEL    1
  579   HD23  LEU  86          HD22      LEU  86  -0.710   8.603   0.847
  Start of MODEL    1
  580   HD22  LEU  86          HD23      LEU  86  -0.193  10.282   0.727
  Start of MODEL    1
  581    H    LEU  86           HN       LEU  86  -1.871   6.665   0.041
  Start of MODEL    1
  582    HA   ALA  87           HA       ALA  87  -6.555   5.708  -1.081
  Start of MODEL    1
  583    HB2  ALA  87           HB1      ALA  87  -8.108   4.248   0.180
  Start of MODEL    1
  584    HB1  ALA  87           HB2      ALA  87  -7.628   5.057   1.665
  Start of MODEL    1
  585    HB3  ALA  87           HB3      ALA  87  -6.457   4.091   0.781
  Start of MODEL    1
  586    H    ALA  87           HN       ALA  87  -5.914   7.046   1.480
  Start of MODEL    1
  587    HA   ALA  88           HA       ALA  88  -9.896   8.464  -0.601
  Start of MODEL    1
  588    HB1  ALA  88           HB1      ALA  88  -8.695   9.128  -3.285
  Start of MODEL    1
  589    HB3  ALA  88           HB2      ALA  88  -8.218   9.840  -1.744
  Start of MODEL    1
  590    HB2  ALA  88           HB3      ALA  88  -9.839  10.121  -2.384
  Start of MODEL    1
  591    H    ALA  88           HN       ALA  88  -8.037   6.801  -2.161
  Start of MODEL    1
  592    HA   ASN  89           HA       ASN  89 -12.842   7.069  -3.434
  Start of MODEL    1
  593    HB3  ASN  89           HB2      ASN  89 -12.784   4.963  -2.108
  Start of MODEL    1
  594    HB2  ASN  89           HB3      ASN  89 -14.427   5.390  -2.472
  Start of MODEL    1
  595   HD21  ASN  89          HD21      ASN  89 -13.684   3.580  -0.579
  Start of MODEL    1
  596   HD22  ASN  89          HD22      ASN  89 -14.163   4.114   0.985
  Start of MODEL    1
  597    H    ASN  89           HN       ASN  89 -11.914   7.866  -0.805
  Start of MODEL    1
  598    HA   PRO  90           HA       PRO  90 -16.048  10.065  -3.258
  Start of MODEL    1
  599    HB3  PRO  90           HB2      PRO  90 -18.178   9.327  -3.813
  Start of MODEL    1
  600    HB2  PRO  90           HB3      PRO  90 -18.121   7.989  -2.661
  Start of MODEL    1
  601    HG2  PRO  90           HG2      PRO  90 -17.673   6.917  -4.713
  Start of MODEL    1
  602    HG3  PRO  90           HG3      PRO  90 -16.703   8.282  -5.299
  Start of MODEL    1
  603    HD2  PRO  90           HD2      PRO  90 -16.011   6.174  -3.314
  Start of MODEL    1
  604    HD3  PRO  90           HD3      PRO  90 -14.983   6.910  -4.564
  Start of MODEL    1
  605    HA   CYS  91           HA       CYS  91 -17.911   9.578   1.001
  Start of MODEL    1
  606    HB3  CYS  91           HB2      CYS  91 -16.541   7.022   1.854
  Start of MODEL    1
  607    HB2  CYS  91           HB3      CYS  91 -18.242   7.201   1.427
  Start of MODEL    1
  608    H    CYS  91           HN       CYS  91 -16.596   7.695  -0.639
  Start of MODEL    1
  609    HA2  GLY  92           HA2      GLY  92 -13.666  11.055   1.915
  Start of MODEL    1
  610    H    GLY  92           HN       GLY  92 -14.464   8.556   0.938
  Start of MODEL    1
  611    HA3  GLY  92           HA1      GLY  92 -13.747   9.920   3.251
  Start of MODEL    1
  612    HA   GLN  93           HA       GLN  93  -9.845   8.917   1.514
  Start of MODEL    1
  613    HB3  GLN  93           HB2      GLN  93  -9.110  11.767   2.193
  Start of MODEL    1
  614    HB2  GLN  93           HB3      GLN  93  -9.596  11.201   0.600
  Start of MODEL    1
  615    HG2  GLN  93           HG2      GLN  93  -7.156  10.298   2.118
  Start of MODEL    1
  616    HG3  GLN  93           HG3      GLN  93  -7.641   9.732   0.525
  Start of MODEL    1
  617   HE21  GLN  93          HE21      GLN  93  -6.196  12.298   2.340
  Start of MODEL    1
  618   HE22  GLN  93          HE22      GLN  93  -5.702  13.222   0.984
  Start of MODEL    1
  619    H    GLN  93           HN       GLN  93 -11.440  10.904   2.952
  Start of MODEL    1
  620    HA   ALA  94           HA       ALA  94  -8.096   8.479   5.525
  Start of MODEL    1
  621    HB1  ALA  94           HB1      ALA  94  -8.064   5.862   4.077
  Start of MODEL    1
  622    HB3  ALA  94           HB2      ALA  94  -9.241   6.378   5.292
  Start of MODEL    1
  623    HB2  ALA  94           HB3      ALA  94  -7.558   6.049   5.742
  Start of MODEL    1
  624    H    ALA  94           HN       ALA  94  -8.459   7.817   2.672
  Start of MODEL    1
  625    HA   SER  95           HA       SER  95  -3.904   7.555   4.451
  Start of MODEL    1
  626    HB3  SER  95           HB2      SER  95  -4.071   9.959   4.385
  Start of MODEL    1
  627    HB2  SER  95           HB3      SER  95  -2.619   9.525   5.287
  Start of MODEL    1
  628    HG   SER  95           HG       SER  95  -5.126  10.140   6.446
  Start of MODEL    1
  629    H    SER  95           HN       SER  95  -5.980   8.078   6.381
  Start of MODEL    1
  630    HA   ALA  96           HA       ALA  96  -1.763   6.666   8.230
  Start of MODEL    1
  631    HB1  ALA  96           HB1      ALA  96  -1.907   4.145   6.540
  Start of MODEL    1
  632    HB3  ALA  96           HB2      ALA  96  -3.012   4.577   7.839
  Start of MODEL    1
  633    HB2  ALA  96           HB3      ALA  96  -1.331   4.197   8.203
  Start of MODEL    1
  634    H    ALA  96           HN       ALA  96  -2.104   6.704   5.368
  Start of MODEL    1
  635    HA   SER  97           HA       SER  97   2.135   6.695   6.302
  Start of MODEL    1
  636    HB3  SER  97           HB2      SER  97   2.635   8.021   8.980
  Start of MODEL    1
  637    HB2  SER  97           HB3      SER  97   1.774   8.802   7.659
  Start of MODEL    1
  638    HG   SER  97           HG       SER  97   3.574   8.745   6.424
  Start of MODEL    1
  639    H    SER  97           HN       SER  97   0.504   6.385   8.714
  Start of MODEL    1
  640    HA   ILE  98           HA       ILE  98   4.894   3.995   8.463
  Start of MODEL    1
  641    HB   ILE  98           HB       ILE  98   3.907   2.300   7.224
  Start of MODEL    1
  642   HD11  ILE  98          HD11      ILE  98   5.791   1.002   8.285
  Start of MODEL    1
  643   HD13  ILE  98          HD12      ILE  98   6.959   2.344   8.079
  Start of MODEL    1
  644   HD12  ILE  98          HD13      ILE  98   7.295   0.765   7.359
  Start of MODEL    1
  645    H    ILE  98           HN       ILE  98   4.132   5.723   6.276
  Start of MODEL    1
  646    HA   MET  99           HA       MET  99   8.666   5.511   6.882
  Start of MODEL    1
  647    HB3  MET  99           HB2      MET  99   9.131   5.796   9.850
  Start of MODEL    1
  648    HB2  MET  99           HB3      MET  99   7.987   6.851   9.042
  Start of MODEL    1
  649    HG2  MET  99           HG2      MET  99   9.781   7.633   7.552
  Start of MODEL    1
  650    HG3  MET  99           HG3      MET  99  10.075   7.978   9.248
  Start of MODEL    1
  651    HE2  MET  99           HE1      MET  99  13.596   7.512   7.563
  Start of MODEL    1
  652    HE1  MET  99           HE2      MET  99  12.541   8.620   8.439
  Start of MODEL    1
  653    HE3  MET  99           HE3      MET  99  12.135   8.135   6.794
  Start of MODEL    1
  654    H    MET  99           HN       MET  99   6.941   4.297   8.928
  Start of MODEL    1
  655    HA   ALA 100           HA       ALA 100  10.737   1.815   8.005
  Start of MODEL    1
  656    HB1  ALA 100           HB1      ALA 100  10.340   1.695   5.018
  Start of MODEL    1
  657    HB3  ALA 100           HB2      ALA 100   9.228   1.060   6.222
  Start of MODEL    1
  658    HB2  ALA 100           HB3      ALA 100  10.831   0.347   6.041
  Start of MODEL    1
  659    H    ALA 100           HN       ALA 100   9.997   3.981   6.166
  Start of MODEL    1
  660    HA   ALA 101           HA       ALA 101  14.733   2.867   6.672
  Start of MODEL    1
  661    HB2  ALA 101           HB1      ALA 101  16.342   1.828   8.197
  Start of MODEL    1
  662    HB1  ALA 101           HB2      ALA 101  15.099   0.688   8.714
  Start of MODEL    1
  663    HB3  ALA 101           HB3      ALA 101  14.909   2.409   9.044
  Start of MODEL    1
  664    H    ALA 101           HN       ALA 101  12.832   0.872   7.663
  Start of MODEL    1
  665    HA   PHE 102           HA       PHE 102  15.856  -0.401   3.956
  Start of MODEL    1
  666    HB3  PHE 102           HB2      PHE 102  15.791   0.483   1.582
  Start of MODEL    1
  667    HB2  PHE 102           HB3      PHE 102  15.156   1.987   2.226
  Start of MODEL    1
  668    HD1  PHE 102           HD1      PHE 102  14.374  -1.422   1.307
  Start of MODEL    1
  669    HD2  PHE 102           HD2      PHE 102  12.957   2.059   3.272
  Start of MODEL    1
  670    HE1  PHE 102           HE1      PHE 102  12.076  -2.301   1.210
  Start of MODEL    1
  671    HE2  PHE 102           HE2      PHE 102  10.671   1.193   3.168
  Start of MODEL    1
  672    HZ   PHE 102           HZ       PHE 102  10.244  -1.023   2.027
  Start of MODEL    1
  673    H    PHE 102           HN       PHE 102  15.050   2.334   4.639
  Start of MODEL    1
  674    HA   MET 103           HA       MET 103  19.663   1.839   4.033
  Start of MODEL    1
  675    HB3  MET 103           HB2      MET 103  20.995   1.413   6.089
  Start of MODEL    1
  676    HB2  MET 103           HB3      MET 103  19.783   0.234   6.595
  Start of MODEL    1
  677    HG2  MET 103           HG2      MET 103  19.336   3.186   6.182
  Start of MODEL    1
  678    HG3  MET 103           HG3      MET 103  18.088   2.020   6.584
  Start of MODEL    1
  679    HE3  MET 103           HE1      MET 103  18.643   4.711   8.145
  Start of MODEL    1
  680    HE2  MET 103           HE2      MET 103  18.497   4.190   9.819
  Start of MODEL    1
  681    HE1  MET 103           HE3      MET 103  17.366   3.592   8.608
  Start of MODEL    1
  682    H    MET 103           HN       MET 103  17.819  -0.168   5.094
  Start of MODEL    1
  683    HA   ASP 104           HA       ASP 104  21.697  -1.669   2.324
  Start of MODEL    1
  684    HB3  ASP 104           HB2      ASP 104  22.721  -1.068   0.135
  Start of MODEL    1
  685    HB2  ASP 104           HB3      ASP 104  22.079   0.543   0.312
  Start of MODEL    1
  686    H    ASP 104           HN       ASP 104  20.971   1.179   2.532
  Start of MODEL    1
  687    HA   ASN 105           HA       ASN 105  25.747  -0.272   2.511
  Start of MODEL    1
  688    HB3  ASN 105           HB2      ASN 105  27.228  -2.171   3.274
  Start of MODEL    1
  689    HB2  ASN 105           HB3      ASN 105  25.873  -3.270   3.060
  Start of MODEL    1
  690   HD21  ASN 105          HD21      ASN 105  27.164  -0.688   4.974
  Start of MODEL    1
  691   HD22  ASN 105          HD22      ASN 105  26.113  -0.893   6.319
  Start of MODEL    1
  692    H    ASN 105           HN       ASN 105  23.765  -2.275   1.889
  Start of MODEL    1
  693    HA   PRO 106           HA       PRO 106  26.016  -0.968  -1.986
  Start of MODEL    1
  694    HB3  PRO 106           HB2      PRO 106  27.316   0.801  -2.716
  Start of MODEL    1
  695    HB2  PRO 106           HB3      PRO 106  28.471   0.627  -1.386
  Start of MODEL    1
  696    HG2  PRO 106           HG2      PRO 106  27.194   2.449  -0.662
  Start of MODEL    1
  697    HG3  PRO 106           HG3      PRO 106  25.702   1.792  -1.362
  Start of MODEL    1
  698    HD2  PRO 106           HD2      PRO 106  27.067   1.079   1.193
  Start of MODEL    1
  699    HD3  PRO 106           HD3      PRO 106  25.339   1.101   0.795
  Start of MODEL    1
  700    HA   PHE 107           HA       PHE 107  28.302  -4.040  -3.920
  Start of MODEL    1
  701    HB3  PHE 107           HB2      PHE 107  30.390  -3.136  -1.902
  Start of MODEL    1
  702    HB2  PHE 107           HB3      PHE 107  30.323  -2.655  -3.590
  Start of MODEL    1
  703    HD1  PHE 107           HD1      PHE 107  30.517  -4.521  -5.345
  Start of MODEL    1
  704    HD2  PHE 107           HD2      PHE 107  31.651  -4.984  -1.285
  Start of MODEL    1
  705    HE1  PHE 107           HE1      PHE 107  31.953  -6.417  -5.972
  Start of MODEL    1
  706    HE2  PHE 107           HE2      PHE 107  33.092  -6.886  -1.896
  Start of MODEL    1
  707    HZ   PHE 107           HZ       PHE 107  33.240  -7.604  -4.247
  Start of MODEL    1
  708    H    PHE 107           HN       PHE 107  27.048  -2.383  -3.213
  Start of MODEL    2
  709    H1   ASP   1           H        ASP   1 -30.636  -4.759  -1.514
  Start of MODEL    2
  710    H2   ASP   1           H2       ASP   1 -31.390  -6.226  -1.912
  Start of MODEL    2
  711    H3   ASP   1           H3       ASP   1 -30.269  -5.535  -2.955
  Start of MODEL    2
  712    HA   ASP   1           HA       ASP   1 -29.611  -6.451  -0.248
  Start of MODEL    2
  713    HB3  ASP   1           HB2      ASP   1 -30.130  -8.362  -1.764
  Start of MODEL    2
  714    HB2  ASP   1           HB3      ASP   1 -28.428  -8.322  -1.329
  Start of MODEL    2
  715    HA   ASP   2           HA       ASP   2 -25.942  -4.317   0.646
  Start of MODEL    2
  716    HB3  ASP   2           HB2      ASP   2 -24.224  -4.480  -1.197
  Start of MODEL    2
  717    HB2  ASP   2           HB3      ASP   2 -25.367  -5.469  -2.094
  Start of MODEL    2
  718    H    ASP   2           HN       ASP   2 -27.755  -5.686   0.467
  Start of MODEL    2
  719    HA   ASP   3           HA       ASP   3 -27.761  -1.521  -2.495
  Start of MODEL    2
  720    HB3  ASP   3           HB2      ASP   3 -29.961  -2.180  -2.549
  Start of MODEL    2
  721    HB2  ASP   3           HB3      ASP   3 -30.097  -0.544  -1.916
  Start of MODEL    2
  722    H    ASP   3           HN       ASP   3 -28.254  -3.140  -0.175
  Start of MODEL    2
  723    HA   ASP   4           HA       ASP   4 -24.721   0.629   0.064
  Start of MODEL    2
  724    HB3  ASP   4           HB2      ASP   4 -26.136   2.367  -1.959
  Start of MODEL    2
  725    HB2  ASP   4           HB3      ASP   4 -24.797   1.288  -2.316
  Start of MODEL    2
  726    H    ASP   4           HN       ASP   4 -25.941  -0.936  -1.038
  Start of MODEL    2
  727    HA   ASP   5           HA       ASP   5 -27.533   2.786   2.661
  Start of MODEL    2
  728    HB3  ASP   5           HB2      ASP   5 -27.922   0.067   3.928
  Start of MODEL    2
  729    HB2  ASP   5           HB3      ASP   5 -29.088   0.879   2.883
  Start of MODEL    2
  730    H    ASP   5           HN       ASP   5 -26.456   0.192   1.837
  Start of MODEL    2
  731    HA   VAL   6           HA       VAL   6 -24.295   2.084   5.625
  Start of MODEL    2
  732    HB   VAL   6           HB       VAL   6 -22.964   0.075   6.496
  Start of MODEL    2
  733    H    VAL   6           HN       VAL   6 -25.536   0.124   3.926
  Start of MODEL    2
  734    HA   SER   7           HA       SER   7 -21.405   2.067   2.460
  Start of MODEL    2
  735    HB3  SER   7           HB2      SER   7 -22.392   4.069   1.721
  Start of MODEL    2
  736    HB2  SER   7           HB3      SER   7 -20.739   4.537   2.110
  Start of MODEL    2
  737    HG   SER   7           HG       SER   7 -23.120   5.275   3.274
  Start of MODEL    2
  738    H    SER   7           HN       SER   7 -23.033   3.287   4.480
  Start of MODEL    2
  739    HA   PHE   8           HA       PHE   8 -18.396   1.989   5.659
  Start of MODEL    2
  740    HB3  PHE   8           HB2      PHE   8 -16.924   0.053   5.376
  Start of MODEL    2
  741    HB2  PHE   8           HB3      PHE   8 -17.635  -0.292   3.809
  Start of MODEL    2
  742    HD1  PHE   8           HD1      PHE   8 -18.750  -2.350   3.949
  Start of MODEL    2
  743    HD2  PHE   8           HD2      PHE   8 -19.174   0.493   7.091
  Start of MODEL    2
  744    HE1  PHE   8           HE1      PHE   8 -20.424  -3.782   5.008
  Start of MODEL    2
  745    HE2  PHE   8           HE2      PHE   8 -20.856  -0.965   8.167
  Start of MODEL    2
  746    HZ   PHE   8           HZ       PHE   8 -21.379  -3.203   7.119
  Start of MODEL    2
  747    H    PHE   8           HN       PHE   8 -19.869   0.932   3.456
  Start of MODEL    2
  748    HA   CYS   9           HA       CYS   9 -16.127   4.396   2.833
  Start of MODEL    2
  749    HB3  CYS   9           HB2      CYS   9 -15.284   6.325   4.047
  Start of MODEL    2
  750    HB2  CYS   9           HB3      CYS   9 -15.519   5.487   5.585
  Start of MODEL    2
  751    H    CYS   9           HN       CYS   9 -17.004   3.542   5.446
  Start of MODEL    2
  752    HA   ALA  10           HA       ALA  10 -12.270   2.682   3.333
  Start of MODEL    2
  753    HB3  ALA  10           HB1      ALA  10 -12.060   3.742   1.134
  Start of MODEL    2
  754    HB2  ALA  10           HB2      ALA  10 -10.495   3.580   1.948
  Start of MODEL    2
  755    HB1  ALA  10           HB3      ALA  10 -11.294   5.142   1.898
  Start of MODEL    2
  756    H    ALA  10           HN       ALA  10 -13.597   5.245   3.006
  Start of MODEL    2
  757    HA   SER  11           HA       SER  11  -9.588   4.490   6.165
  Start of MODEL    2
  758    HB3  SER  11           HB2      SER  11  -9.674   3.167   8.227
  Start of MODEL    2
  759    HB2  SER  11           HB3      SER  11 -10.565   1.893   7.394
  Start of MODEL    2
  760    HG   SER  11           HG       SER  11 -12.287   3.029   7.442
  Start of MODEL    2
  761    H    SER  11           HN       SER  11 -11.000   2.306   4.837
  Start of MODEL    2
  762    HA   VAL  12           HA       VAL  12  -6.390   1.783   5.020
  Start of MODEL    2
  763    HB   VAL  12           HB       VAL  12  -5.194   4.564   5.314
  Start of MODEL    2
  764    H    VAL  12           HN       VAL  12  -7.401   4.022   6.615
  Start of MODEL    2
  765    HA   GLN  13           HA       GLN  13  -4.122   1.039   8.676
  Start of MODEL    2
  766    HB3  GLN  13           HB2      GLN  13  -4.234  -1.459   9.047
  Start of MODEL    2
  767    HB2  GLN  13           HB3      GLN  13  -5.083  -1.574   7.519
  Start of MODEL    2
  768    HG2  GLN  13           HG2      GLN  13  -6.068  -0.130   9.959
  Start of MODEL    2
  769    HG3  GLN  13           HG3      GLN  13  -6.899  -0.202   8.408
  Start of MODEL    2
  770   HE21  GLN  13          HE21      GLN  13  -5.901  -2.016  11.201
  Start of MODEL    2
  771   HE22  GLN  13          HE22      GLN  13  -6.954  -3.354  10.968
  Start of MODEL    2
  772    H    GLN  13           HN       GLN  13  -5.390   0.343   6.146
  Start of MODEL    2
  773    HA   LEU  14           HA       LEU  14  -0.552  -0.436   6.572
  Start of MODEL    2
  774    HB3  LEU  14           HB2      LEU  14   1.314   1.352   6.860
  Start of MODEL    2
  775    HB2  LEU  14           HB3      LEU  14   0.027   2.370   7.471
  Start of MODEL    2
  776    HG   LEU  14           HG       LEU  14  -1.168   2.068   5.281
  Start of MODEL    2
  777   HD11  LEU  14          HD11      LEU  14   1.637   3.154   5.140
  Start of MODEL    2
  778   HD13  LEU  14          HD12      LEU  14   0.211   4.038   5.696
  Start of MODEL    2
  779   HD12  LEU  14          HD13      LEU  14   0.329   3.505   4.015
  Start of MODEL    2
  780   HD22  LEU  14          HD21      LEU  14   0.117   1.209   3.409
  Start of MODEL    2
  781   HD21  LEU  14          HD22      LEU  14  -0.116  -0.035   4.643
  Start of MODEL    2
  782   HD23  LEU  14          HD23      LEU  14   1.437   0.798   4.503
  Start of MODEL    2
  783    H    LEU  14           HN       LEU  14  -1.955   1.214   8.536
  Start of MODEL    2
  784    HA   HIS  15           HA       HIS  15   1.722  -1.546  10.078
  Start of MODEL    2
  785    HB3  HIS  15           HB2      HIS  15   2.014  -4.019   9.843
  Start of MODEL    2
  786    HB2  HIS  15           HB3      HIS  15   1.490  -3.894   8.169
  Start of MODEL    2
  787    HD1  HIS  15           HD1      HIS  15   0.196  -3.941  11.648
  Start of MODEL    2
  788    HD2  HIS  15           HD2      HIS  15  -1.279  -3.495   7.789
  Start of MODEL    2
  789    HE1  HIS  15           HE1      HIS  15  -2.291  -4.181  11.844
  Start of MODEL    2
  790    HE2  HIS  15           HE2      HIS  15  -3.095  -4.237   9.473
  Start of MODEL    2
  791    H    HIS  15           HN       HIS  15   1.349  -1.416   7.184
  Start of MODEL    2
  792    HA   THR  16           HA       THR  16   5.904  -1.073   9.325
  Start of MODEL    2
  793    HB   THR  16           HB       THR  16   6.146  -3.322  11.316
  Start of MODEL    2
  794    HG1  THR  16           HG1      THR  16   5.206  -0.669  11.597
  Start of MODEL    2
  795   HG21  THR  16          HG21      THR  16   7.760  -0.801  10.841
  Start of MODEL    2
  796   HG23  THR  16          HG22      THR  16   8.230  -2.424  10.338
  Start of MODEL    2
  797   HG22  THR  16          HG23      THR  16   8.112  -2.034  12.053
  Start of MODEL    2
  798    H    THR  16           HN       THR  16   3.791  -2.205  10.701
  Start of MODEL    2
  799    HA   ALA  17           HA       ALA  17   6.843  -3.967   6.190
  Start of MODEL    2
  800    HB1  ALA  17           HB1      ALA  17   8.239  -1.984   5.649
  Start of MODEL    2
  801    HB3  ALA  17           HB2      ALA  17   9.030  -3.512   5.276
  Start of MODEL    2
  802    HB2  ALA  17           HB3      ALA  17   9.484  -2.616   6.724
  Start of MODEL    2
  803    H    ALA  17           HN       ALA  17   7.301  -1.819   7.871
  Start of MODEL    2
  804    HA   VAL  18           HA       VAL  18   8.760  -6.933   8.643
  Start of MODEL    2
  805    HB   VAL  18           HB       VAL  18   8.032  -9.237   8.024
  Start of MODEL    2
  806    H    VAL  18           HN       VAL  18   7.327  -6.032   6.294
  Start of MODEL    2
  807    HA   GLU  19           HA       GLU  19  12.371  -7.532   6.483
  Start of MODEL    2
  808    HB3  GLU  19           HB2      GLU  19  12.654  -8.807   9.184
  Start of MODEL    2
  809    HB2  GLU  19           HB3      GLU  19  13.106  -7.166   8.744
  Start of MODEL    2
  810    HG2  GLU  19           HG2      GLU  19  14.396  -9.685   7.731
  Start of MODEL    2
  811    HG3  GLU  19           HG3      GLU  19  14.841  -8.040   7.277
  Start of MODEL    2
  812    H    GLU  19           HN       GLU  19  10.595  -7.944   8.655
  Start of MODEL    2
  813    HA   MET  20           HA       MET  20  12.581 -11.692   5.240
  Start of MODEL    2
  814    HB3  MET  20           HB2      MET  20  10.912 -12.218   3.455
  Start of MODEL    2
  815    HB2  MET  20           HB3      MET  20  10.482 -10.521   3.376
  Start of MODEL    2
  816    HG2  MET  20           HG2      MET  20  10.104 -12.225   5.827
  Start of MODEL    2
  817    HG3  MET  20           HG3      MET  20   9.533 -10.580   5.574
  Start of MODEL    2
  818    HE3  MET  20           HE1      MET  20   7.734  -9.982   3.601
  Start of MODEL    2
  819    HE2  MET  20           HE2      MET  20   6.872 -11.213   2.679
  Start of MODEL    2
  820    HE1  MET  20           HE3      MET  20   8.593 -10.953   2.403
  Start of MODEL    2
  821    H    MET  20           HN       MET  20  12.208  -8.842   4.822
  Start of MODEL    2
  822    HA   HIS  21           HA       HIS  21  15.027 -11.179   1.655
  Start of MODEL    2
  823    HB3  HIS  21           HB2      HIS  21  14.577 -12.342  -0.555
  Start of MODEL    2
  824    HB2  HIS  21           HB3      HIS  21  13.048 -12.886   0.121
  Start of MODEL    2
  825    HD1  HIS  21           HD1      HIS  21  13.100 -14.975   1.574
  Start of MODEL    2
  826    HD2  HIS  21           HD2      HIS  21  16.870 -13.429   0.792
  Start of MODEL    2
  827    HE1  HIS  21           HE1      HIS  21  14.697 -16.677   2.395
  Start of MODEL    2
  828    HE2  HIS  21           HE2      HIS  21  16.920 -15.879   1.567
  Start of MODEL    2
  829    H    HIS  21           HN       HIS  21  12.535 -12.320   2.461
  Start of MODEL    2
  830    HA   HIS  22           HA       HIS  22  12.518  -8.179  -0.433
  Start of MODEL    2
  831    HB3  HIS  22           HB2      HIS  22  11.494  -9.529  -2.248
  Start of MODEL    2
  832    HB2  HIS  22           HB3      HIS  22  10.471  -8.165  -1.851
  Start of MODEL    2
  833    HD1  HIS  22           HD1      HIS  22  10.358 -11.791  -2.274
  Start of MODEL    2
  834    HD2  HIS  22           HD2      HIS  22   8.040  -8.885  -0.409
  Start of MODEL    2
  835    HE1  HIS  22           HE1      HIS  22   8.115 -12.831  -1.951
  Start of MODEL    2
  836    HE2  HIS  22           HE2      HIS  22   6.678 -10.947  -1.215
  Start of MODEL    2
  837    H    HIS  22           HN       HIS  22  11.705 -10.775   0.616
  Start of MODEL    2
  838    HA   TRP  23           HA       TRP  23  10.428  -6.889   3.003
  Start of MODEL    2
  839    HB3  TRP  23           HB2      TRP  23  10.421  -4.396   3.182
  Start of MODEL    2
  840    HB2  TRP  23           HB3      TRP  23  10.988  -4.328   1.513
  Start of MODEL    2
  841    HD1  TRP  23           HD1      TRP  23  13.418  -5.393   1.038
  Start of MODEL    2
  842    HE1  TRP  23           HE1      TRP  23  15.497  -5.555   2.552
  Start of MODEL    2
  843    HE3  TRP  23           HE3      TRP  23  11.172  -4.573   5.532
  Start of MODEL    2
  844    HZ2  TRP  23           HZ2      TRP  23  16.092  -5.326   5.310
  Start of MODEL    2
  845    HZ3  TRP  23           HZ3      TRP  23  12.558  -4.546   7.566
  Start of MODEL    2
  846    HH2  TRP  23           HH2      TRP  23  14.971  -4.915   7.450
  Start of MODEL    2
  847    H    TRP  23           HN       TRP  23  11.416  -6.412   0.328
  Start of MODEL    2
  848    HA   CYS  24           HA       CYS  24   6.474  -6.062   1.612
  Start of MODEL    2
  849    HB3  CYS  24           HB2      CYS  24   6.335  -8.095   3.840
  Start of MODEL    2
  850    HB2  CYS  24           HB3      CYS  24   6.631  -8.456   2.147
  Start of MODEL    2
  851    H    CYS  24           HN       CYS  24   8.465  -6.637   3.675
  Start of MODEL    2
  852    HA   ILE  25           HA       ILE  25   4.965  -3.551   4.878
  Start of MODEL    2
  853    HB   ILE  25           HB       ILE  25   4.633  -1.892   2.346
  Start of MODEL    2
  854   HD12  ILE  25          HD11      ILE  25   7.755   0.053   3.279
  Start of MODEL    2
  855   HD11  ILE  25          HD12      ILE  25   6.101   0.550   3.639
  Start of MODEL    2
  856   HD13  ILE  25          HD13      ILE  25   6.509  -0.054   2.035
  Start of MODEL    2
  857    H    ILE  25           HN       ILE  25   5.527  -4.225   2.086
  Start of MODEL    2
  858    HA   PRO  26           HA       PRO  26   1.043  -5.436   3.576
  Start of MODEL    2
  859    HB3  PRO  26           HB2      PRO  26   0.750  -6.964   5.230
  Start of MODEL    2
  860    HB2  PRO  26           HB3      PRO  26   0.464  -5.682   6.406
  Start of MODEL    2
  861    HG2  PRO  26           HG2      PRO  26   2.478  -6.374   7.248
  Start of MODEL    2
  862    HG3  PRO  26           HG3      PRO  26   2.996  -7.065   5.698
  Start of MODEL    2
  863    HD2  PRO  26           HD2      PRO  26   3.115  -4.234   6.656
  Start of MODEL    2
  864    HD3  PRO  26           HD3      PRO  26   4.301  -5.186   5.729
  Start of MODEL    2
  865    HA   PHE  27           HA       PHE  27  -1.487  -2.215   4.994
  Start of MODEL    2
  866    HB3  PHE  27           HB2      PHE  27  -0.498  -1.169   2.948
  Start of MODEL    2
  867    HB2  PHE  27           HB3      PHE  27  -2.178  -0.739   3.214
  Start of MODEL    2
  868    HD1  PHE  27           HD1      PHE  27  -3.958  -1.556   1.716
  Start of MODEL    2
  869    HD2  PHE  27           HD2      PHE  27   0.163  -2.426   1.030
  Start of MODEL    2
  870    HE1  PHE  27           HE1      PHE  27  -4.482  -2.215  -0.577
  Start of MODEL    2
  871    HE2  PHE  27           HE2      PHE  27  -0.373  -3.088  -1.264
  Start of MODEL    2
  872    HZ   PHE  27           HZ       PHE  27  -2.694  -2.982  -2.075
  Start of MODEL    2
  873    H    PHE  27           HN       PHE  27  -0.630  -4.246   3.079
  Start of MODEL    2
  874    HA   SER  28           HA       SER  28  -5.351  -3.710   3.648
  Start of MODEL    2
  875    HB3  SER  28           HB2      SER  28  -6.577  -4.252   5.720
  Start of MODEL    2
  876    HB2  SER  28           HB3      SER  28  -5.377  -3.364   6.658
  Start of MODEL    2
  877    HG   SER  28           HG       SER  28  -4.031  -5.022   5.131
  Start of MODEL    2
  878    H    SER  28           HN       SER  28  -3.660  -1.877   5.099
  Start of MODEL    2
  879    HA   VAL  29           HA       VAL  29  -7.599  -0.062   3.993
  Start of MODEL    2
  880    HB   VAL  29           HB       VAL  29  -6.424   0.680   1.975
  Start of MODEL    2
  881    H    VAL  29           HN       VAL  29  -6.681  -2.467   2.641
  Start of MODEL    2
  882    HA   ASP  30           HA       ASP  30 -11.361  -2.221   3.725
  Start of MODEL    2
  883    HB3  ASP  30           HB2      ASP  30 -11.268  -0.636   6.302
  Start of MODEL    2
  884    HB2  ASP  30           HB3      ASP  30 -10.891  -2.340   6.115
  Start of MODEL    2
  885    H    ASP  30           HN       ASP  30  -9.512  -0.134   4.682
  Start of MODEL    2
  886    HA2  GLY  31           HA2      GLY  31 -14.778   0.527   3.216
  Start of MODEL    2
  887    H    GLY  31           HN       GLY  31 -13.283  -1.681   2.869
  Start of MODEL    2
  888    HA3  GLY  31           HA1      GLY  31 -13.597   1.005   1.997
  Start of MODEL    2
  889    HA   GLN  32           HA       GLN  32 -16.646  -1.809   0.166
  Start of MODEL    2
  890    HB3  GLN  32           HB2      GLN  32 -18.826   0.185   0.844
  Start of MODEL    2
  891    HB2  GLN  32           HB3      GLN  32 -18.508  -1.298   1.729
  Start of MODEL    2
  892    HG2  GLN  32           HG2      GLN  32 -19.309  -1.162  -1.162
  Start of MODEL    2
  893    HG3  GLN  32           HG3      GLN  32 -19.090  -2.619  -0.190
  Start of MODEL    2
  894   HE21  GLN  32          HE21      GLN  32 -21.060   0.105  -0.830
  Start of MODEL    2
  895   HE22  GLN  32          HE22      GLN  32 -22.445  -0.399   0.077
  Start of MODEL    2
  896    H    GLN  32           HN       GLN  32 -16.491   0.527   1.856
  Start of MODEL    2
  897    HA   PRO  33           HA       PRO  33 -17.203   1.658  -3.217
  Start of MODEL    2
  898    HB3  PRO  33           HB2      PRO  33 -17.972   3.726  -2.514
  Start of MODEL    2
  899    HB2  PRO  33           HB3      PRO  33 -16.262   4.144  -2.401
  Start of MODEL    2
  900    HG2  PRO  33           HG2      PRO  33 -16.178   3.739  -0.128
  Start of MODEL    2
  901    HG3  PRO  33           HG3      PRO  33 -17.858   4.294  -0.266
  Start of MODEL    2
  902    HD2  PRO  33           HD2      PRO  33 -17.287   1.942   0.842
  Start of MODEL    2
  903    HD3  PRO  33           HD3      PRO  33 -18.705   2.143  -0.208
  Start of MODEL    2
  904    HA   ALA  34           HA       ALA  34 -13.008   0.496  -3.175
  Start of MODEL    2
  905    HB2  ALA  34           HB1      ALA  34 -12.315  -0.141  -5.422
  Start of MODEL    2
  906    HB1  ALA  34           HB2      ALA  34 -13.726   0.691  -6.088
  Start of MODEL    2
  907    HB3  ALA  34           HB3      ALA  34 -13.945  -0.723  -5.063
  Start of MODEL    2
  908    H    ALA  34           HN       ALA  34 -15.474   1.160  -4.381
  Start of MODEL    2
  909    HA   PRO  35           HA       PRO  35 -11.389   4.668  -3.634
  Start of MODEL    2
  910    HB3  PRO  35           HB2      PRO  35 -11.112   4.508  -1.318
  Start of MODEL    2
  911    HB2  PRO  35           HB3      PRO  35  -9.432   4.466  -1.856
  Start of MODEL    2
  912    HG2  PRO  35           HG2      PRO  35  -9.287   2.164  -1.628
  Start of MODEL    2
  913    HG3  PRO  35           HG3      PRO  35 -10.401   2.521  -0.309
  Start of MODEL    2
  914    HD2  PRO  35           HD2      PRO  35 -10.986   0.797  -2.363
  Start of MODEL    2
  915    HD3  PRO  35           HD3      PRO  35 -12.213   1.687  -1.442
  Start of MODEL    2
  916    HA   SER  36           HA       SER  36  -7.726   3.780  -5.895
  Start of MODEL    2
  917    HB3  SER  36           HB2      SER  36  -8.513   5.605  -7.194
  Start of MODEL    2
  918    HB2  SER  36           HB3      SER  36  -6.856   6.042  -6.767
  Start of MODEL    2
  919    HG   SER  36           HG       SER  36  -9.259   7.129  -6.008
  Start of MODEL    2
  920    H    SER  36           HN       SER  36  -9.435   5.588  -4.402
  Start of MODEL    2
  921    HA   LEU  37           HA       LEU  37  -4.836   4.559  -2.717
  Start of MODEL    2
  922    HB3  LEU  37           HB2      LEU  37  -3.263   2.716  -2.565
  Start of MODEL    2
  923    HB2  LEU  37           HB3      LEU  37  -3.761   2.114  -4.130
  Start of MODEL    2
  924    HG   LEU  37           HG       LEU  37  -5.994   1.607  -3.200
  Start of MODEL    2
  925   HD13  LEU  37          HD11      LEU  37  -4.214  -0.059  -3.213
  Start of MODEL    2
  926   HD12  LEU  37          HD12      LEU  37  -5.297  -0.262  -1.838
  Start of MODEL    2
  927   HD11  LEU  37          HD13      LEU  37  -3.710   0.472  -1.609
  Start of MODEL    2
  928   HD21  LEU  37          HD21      LEU  37  -6.113   3.273  -1.451
  Start of MODEL    2
  929   HD23  LEU  37          HD22      LEU  37  -4.731   2.532  -0.642
  Start of MODEL    2
  930   HD22  LEU  37          HD23      LEU  37  -6.265   1.659  -0.738
  Start of MODEL    2
  931    H    LEU  37           HN       LEU  37  -5.633   3.354  -5.249
  Start of MODEL    2
  932    HA   ARG  38           HA       ARG  38  -1.122   5.804  -4.775
  Start of MODEL    2
  933    HB3  ARG  38           HB2      ARG  38  -2.447   8.162  -3.425
  Start of MODEL    2
  934    HB2  ARG  38           HB3      ARG  38  -2.668   7.654  -5.091
  Start of MODEL    2
  935    HG2  ARG  38           HG2      ARG  38  -0.116   8.723  -3.909
  Start of MODEL    2
  936    HG3  ARG  38           HG3      ARG  38  -0.337   8.201  -5.580
  Start of MODEL    2
  937    HD2  ARG  38           HD2      ARG  38  -0.505  10.643  -5.341
  Start of MODEL    2
  938    HD3  ARG  38           HD3      ARG  38  -2.005   9.926  -5.931
  Start of MODEL    2
  939    HE   ARG  38           HE       ARG  38  -2.648  10.043  -3.439
  Start of MODEL    2
  940   HH11  ARG  38          HH11      ARG  38  -0.762  12.506  -5.162
  Start of MODEL    2
  941   HH12  ARG  38          HH12      ARG  38  -1.307  13.785  -4.187
  Start of MODEL    2
  942   HH21  ARG  38          HH21      ARG  38  -3.409  11.835  -2.153
  Start of MODEL    2
  943   HH22  ARG  38          HH22      ARG  38  -2.819  13.416  -2.470
  Start of MODEL    2
  944    H    ARG  38           HN       ARG  38  -2.974   5.634  -2.518
  Start of MODEL    2
  945    HA   TRP  39           HA       TRP  39   1.377   5.965  -1.188
  Start of MODEL    2
  946    HB3  TRP  39           HB2      TRP  39   3.659   5.126  -1.750
  Start of MODEL    2
  947    HB2  TRP  39           HB3      TRP  39   3.188   5.081  -3.440
  Start of MODEL    2
  948    HD1  TRP  39           HD1      TRP  39   1.863   3.033  -4.290
  Start of MODEL    2
  949    HE1  TRP  39           HE1      TRP  39   1.159   0.812  -3.236
  Start of MODEL    2
  950    HE3  TRP  39           HE3      TRP  39   2.837   4.151   0.597
  Start of MODEL    2
  951    HZ2  TRP  39           HZ2      TRP  39   1.005  -0.322  -0.634
  Start of MODEL    2
  952    HZ3  TRP  39           HZ3      TRP  39   2.387   2.442   2.310
  Start of MODEL    2
  953    HH2  TRP  39           HH2      TRP  39   1.496   0.255   1.707
  Start of MODEL    2
  954    H    TRP  39           HN       TRP  39   0.953   5.859  -4.068
  Start of MODEL    2
  955    HA   LEU  40           HA       LEU  40   3.422   9.691  -2.072
  Start of MODEL    2
  956    HB3  LEU  40           HB2      LEU  40   2.223  10.204   0.660
  Start of MODEL    2
  957    HB2  LEU  40           HB3      LEU  40   1.333  10.427  -0.841
  Start of MODEL    2
  958    HG   LEU  40           HG       LEU  40   3.863  11.914  -0.233
  Start of MODEL    2
  959   HD11  LEU  40          HD11      LEU  40   1.687  12.255  -2.264
  Start of MODEL    2
  960   HD13  LEU  40          HD12      LEU  40   3.335  11.698  -2.565
  Start of MODEL    2
  961   HD12  LEU  40          HD13      LEU  40   3.047  13.358  -2.025
  Start of MODEL    2
  962   HD21  LEU  40          HD21      LEU  40   2.159  12.481   1.437
  Start of MODEL    2
  963   HD23  LEU  40          HD22      LEU  40   0.993  12.776   0.145
  Start of MODEL    2
  964   HD22  LEU  40          HD23      LEU  40   2.410  13.811   0.305
  Start of MODEL    2
  965    H    LEU  40           HN       LEU  40   1.925   7.824  -0.392
  Start of MODEL    2
  966    HA   PHE  41           HA       PHE  41   6.629   8.672   0.705
  Start of MODEL    2
  967    HB3  PHE  41           HB2      PHE  41   7.637   8.677  -2.146
  Start of MODEL    2
  968    HB2  PHE  41           HB3      PHE  41   6.975   7.301  -1.272
  Start of MODEL    2
  969    HD1  PHE  41           HD1      PHE  41   9.893   9.245  -1.943
  Start of MODEL    2
  970    HD2  PHE  41           HD2      PHE  41   8.187   6.357   0.664
  Start of MODEL    2
  971    HE1  PHE  41           HE1      PHE  41  12.127   8.641  -1.151
  Start of MODEL    2
  972    HE2  PHE  41           HE2      PHE  41  10.422   5.745   1.456
  Start of MODEL    2
  973    HZ   PHE  41           HZ       PHE  41  12.386   6.862   0.545
  Start of MODEL    2
  974    H    PHE  41           HN       PHE  41   5.504   9.939  -1.676
  Start of MODEL    2
  975    HA   ASN  42           HA       ASN  42   8.227  12.185   2.685
  Start of MODEL    2
  976    HB3  ASN  42           HB2      ASN  42  10.302  13.035   1.419
  Start of MODEL    2
  977    HB2  ASN  42           HB3      ASN  42  10.036  11.701   0.309
  Start of MODEL    2
  978   HD21  ASN  42          HD21      ASN  42  12.283  12.234   2.048
  Start of MODEL    2
  979   HD22  ASN  42          HD22      ASN  42  12.456  10.861   3.080
  Start of MODEL    2
  980    H    ASN  42           HN       ASN  42   7.270  10.285   1.916
  Start of MODEL    2
  981    HA2  GLY  43           HA2      GLY  43   4.871  14.470   0.314
  Start of MODEL    2
  982    H    GLY  43           HN       GLY  43   6.084  12.390   0.564
  Start of MODEL    2
  983    HA3  GLY  43           HA1      GLY  43   6.420  15.284   0.146
  Start of MODEL    2
  984    HA   SER  44           HA       SER  44   5.946  13.860  -4.126
  Start of MODEL    2
  985    HB3  SER  44           HB2      SER  44   7.952  12.917  -5.139
  Start of MODEL    2
  986    HB2  SER  44           HB3      SER  44   8.421  12.197  -3.596
  Start of MODEL    2
  987    HG   SER  44           HG       SER  44   8.085  14.957  -4.091
  Start of MODEL    2
  988    H    SER  44           HN       SER  44   7.056  12.756  -1.614
  Start of MODEL    2
  989    HA   VAL  45           HA       VAL  45   3.846  10.239  -4.503
  Start of MODEL    2
  990    HB   VAL  45           HB       VAL  45   4.002  11.180  -7.387
  Start of MODEL    2
  991    H    VAL  45           HN       VAL  45   5.277  12.426  -5.664
  Start of MODEL    2
  992    HA   LEU  46           HA       LEU  46   7.016   7.460  -5.527
  Start of MODEL    2
  993    HB3  LEU  46           HB2      LEU  46   5.061   5.973  -3.774
  Start of MODEL    2
  994    HB2  LEU  46           HB3      LEU  46   6.487   6.831  -3.230
  Start of MODEL    2
  995    HG   LEU  46           HG       LEU  46   6.535   4.377  -4.988
  Start of MODEL    2
  996   HD12  LEU  46          HD11      LEU  46   8.915   4.321  -4.453
  Start of MODEL    2
  997   HD11  LEU  46          HD12      LEU  46   8.753   5.845  -3.579
  Start of MODEL    2
  998   HD13  LEU  46          HD13      LEU  46   8.472   5.789  -5.321
  Start of MODEL    2
  999   HD21  LEU  46          HD21      LEU  46   5.683   3.841  -2.771
  Start of MODEL    2
 1000   HD23  LEU  46          HD22      LEU  46   7.061   4.655  -2.031
  Start of MODEL    2
 1001   HD22  LEU  46          HD23      LEU  46   7.309   3.194  -2.988
  Start of MODEL    2
 1002    H    LEU  46           HN       LEU  46   4.497   8.253  -4.361
  Start of MODEL    2
 1003    HA   ASN  47           HA       ASN  47   4.702   5.634  -8.706
  Start of MODEL    2
 1004    HB3  ASN  47           HB2      ASN  47   5.932   7.162 -10.136
  Start of MODEL    2
 1005    HB2  ASN  47           HB3      ASN  47   6.031   5.554 -10.833
  Start of MODEL    2
 1006   HD21  ASN  47          HD21      ASN  47   7.783   8.146  -9.411
  Start of MODEL    2
 1007   HD22  ASN  47          HD22      ASN  47   9.363   7.532  -9.695
  Start of MODEL    2
 1008    H    ASN  47           HN       ASN  47   7.057   6.771  -7.531
  Start of MODEL    2
 1009    HA   GLU  48           HA       GLU  48   6.086   1.614  -7.942
  Start of MODEL    2
 1010    HB3  GLU  48           HB2      GLU  48   4.497  -0.027  -8.885
  Start of MODEL    2
 1011    HB2  GLU  48           HB3      GLU  48   3.759   1.264  -9.824
  Start of MODEL    2
 1012    HG2  GLU  48           HG2      GLU  48   3.825   1.062  -6.831
  Start of MODEL    2
 1013    HG3  GLU  48           HG3      GLU  48   3.152   2.410  -7.745
  Start of MODEL    2
 1014    H    GLU  48           HN       GLU  48   4.497   3.543  -9.372
  Start of MODEL    2
 1015    HA   THR  49           HA       THR  49   8.150   0.390 -11.622
  Start of MODEL    2
 1016    HB   THR  49           HB       THR  49  10.531   0.047 -10.833
  Start of MODEL    2
 1017    HG1  THR  49           HG1      THR  49   9.944   1.163  -8.382
  Start of MODEL    2
 1018   HG21  THR  49          HG21      THR  49   9.155   2.599  -9.967
  Start of MODEL    2
 1019   HG23  THR  49          HG22      THR  49   9.753   2.252 -11.588
  Start of MODEL    2
 1020   HG22  THR  49          HG23      THR  49  10.886   2.417 -10.244
  Start of MODEL    2
 1021    H    THR  49           HN       THR  49   7.457   0.169  -8.783
  Start of MODEL    2
 1022    HA   SER  50           HA       SER  50   8.644  -3.964 -11.426
  Start of MODEL    2
 1023    HB3  SER  50           HB2      SER  50  10.583  -4.952 -12.428
  Start of MODEL    2
 1024    HB2  SER  50           HB3      SER  50  11.585  -3.588 -11.928
  Start of MODEL    2
 1025    HG   SER  50           HG       SER  50   9.329  -3.297 -13.605
  Start of MODEL    2
 1026    H    SER  50           HN       SER  50  10.130  -1.573 -11.671
  Start of MODEL    2
 1027    HA   PHE  51           HA       PHE  51  11.387  -4.648  -7.784
  Start of MODEL    2
 1028    HB3  PHE  51           HB2      PHE  51  12.998  -3.216  -6.478
  Start of MODEL    2
 1029    HB2  PHE  51           HB3      PHE  51  12.772  -1.969  -7.693
  Start of MODEL    2
 1030    HD1  PHE  51           HD1      PHE  51  13.316  -5.659  -7.864
  Start of MODEL    2
 1031    HD2  PHE  51           HD2      PHE  51  14.631  -1.785  -9.034
  Start of MODEL    2
 1032    HE1  PHE  51           HE1      PHE  51  15.105  -6.672  -9.191
  Start of MODEL    2
 1033    HE2  PHE  51           HE2      PHE  51  16.420  -2.797 -10.377
  Start of MODEL    2
 1034    HZ   PHE  51           HZ       PHE  51  16.658  -5.249 -10.454
  Start of MODEL    2
 1035    H    PHE  51           HN       PHE  51  11.086  -2.318  -9.484
  Start of MODEL    2
 1036    HA   ILE  52           HA       ILE  52   8.748  -2.267  -5.048
  Start of MODEL    2
 1037    HB   ILE  52           HB       ILE  52   9.032   0.509  -6.223
  Start of MODEL    2
 1038   HD11  ILE  52          HD11      ILE  52  10.483   1.608  -3.721
  Start of MODEL    2
 1039   HD13  ILE  52          HD12      ILE  52  11.011   1.900  -5.377
  Start of MODEL    2
 1040   HD12  ILE  52          HD13      ILE  52  12.126   1.185  -4.211
  Start of MODEL    2
 1041    H    ILE  52           HN       ILE  52   9.709  -1.600  -7.752
  Start of MODEL    2
 1042    HA   PHE  53           HA       PHE  53   4.923  -1.271  -6.808
  Start of MODEL    2
 1043    HB3  PHE  53           HB2      PHE  53   5.635  -2.666  -8.679
  Start of MODEL    2
 1044    HB2  PHE  53           HB3      PHE  53   3.950  -2.978  -8.293
  Start of MODEL    2
 1045    HD1  PHE  53           HD1      PHE  53   7.335  -4.389  -8.235
  Start of MODEL    2
 1046    HD2  PHE  53           HD2      PHE  53   3.203  -5.106  -7.527
  Start of MODEL    2
 1047    HE1  PHE  53           HE1      PHE  53   7.782  -6.802  -8.096
  Start of MODEL    2
 1048    HE2  PHE  53           HE2      PHE  53   3.642  -7.512  -7.387
  Start of MODEL    2
 1049    HZ   PHE  53           HZ       PHE  53   5.915  -8.377  -7.812
  Start of MODEL    2
 1050    H    PHE  53           HN       PHE  53   6.732  -3.074  -5.477
  Start of MODEL    2
 1051    HA   THR  54           HA       THR  54   2.303  -2.750  -3.787
  Start of MODEL    2
 1052    HB   THR  54           HB       THR  54   0.218  -1.716  -5.716
  Start of MODEL    2
 1053    HG1  THR  54           HG1      THR  54   1.773  -0.230  -5.699
  Start of MODEL    2
 1054   HG23  THR  54          HG21      THR  54  -0.542  -2.716  -3.610
  Start of MODEL    2
 1055   HG22  THR  54          HG22      THR  54  -0.870  -0.982  -3.658
  Start of MODEL    2
 1056   HG21  THR  54          HG23      THR  54   0.491  -1.601  -2.719
  Start of MODEL    2
 1057    H    THR  54           HN       THR  54   2.709  -1.763  -6.463
  Start of MODEL    2
 1058    HA   GLU  55           HA       GLU  55   0.796  -6.376  -5.767
  Start of MODEL    2
 1059    HB3  GLU  55           HB2      GLU  55   2.276  -7.364  -3.318
  Start of MODEL    2
 1060    HB2  GLU  55           HB3      GLU  55   2.995  -7.165  -4.908
  Start of MODEL    2
 1061    HG2  GLU  55           HG2      GLU  55   0.749  -9.038  -4.214
  Start of MODEL    2
 1062    HG3  GLU  55           HG3      GLU  55   1.466  -8.842  -5.810
  Start of MODEL    2
 1063    H    GLU  55           HN       GLU  55   2.050  -4.898  -3.599
  Start of MODEL    2
 1064    HA   PHE  56           HA       PHE  56  -2.581  -6.364  -2.945
  Start of MODEL    2
 1065    HB3  PHE  56           HB2      PHE  56  -4.674  -6.450  -4.286
  Start of MODEL    2
 1066    HB2  PHE  56           HB3      PHE  56  -3.711  -6.556  -5.747
  Start of MODEL    2
 1067    HD1  PHE  56           HD1      PHE  56  -5.188  -4.387  -3.341
  Start of MODEL    2
 1068    HD2  PHE  56           HD2      PHE  56  -2.233  -4.622  -6.383
  Start of MODEL    2
 1069    HE1  PHE  56           HE1      PHE  56  -5.191  -1.951  -3.521
  Start of MODEL    2
 1070    HE2  PHE  56           HE2      PHE  56  -2.223  -2.171  -6.572
  Start of MODEL    2
 1071    HZ   PHE  56           HZ       PHE  56  -3.703  -0.828  -5.143
  Start of MODEL    2
 1072    H    PHE  56           HN       PHE  56  -1.307  -6.394  -5.541
  Start of MODEL    2
 1073    HA   LEU  57           HA       LEU  57  -3.355 -10.598  -3.588
  Start of MODEL    2
 1074    HB3  LEU  57           HB2      LEU  57  -2.203 -10.605  -1.381
  Start of MODEL    2
 1075    HB2  LEU  57           HB3      LEU  57  -3.465 -11.806  -1.466
  Start of MODEL    2
 1076    HG   LEU  57           HG       LEU  57  -4.029  -9.215  -0.102
  Start of MODEL    2
 1077   HD11  LEU  57          HD11      LEU  57  -5.051 -12.027   0.235
  Start of MODEL    2
 1078   HD13  LEU  57          HD12      LEU  57  -5.907 -10.696  -0.525
  Start of MODEL    2
 1079   HD12  LEU  57          HD13      LEU  57  -5.561 -10.651   1.210
  Start of MODEL    2
 1080   HD23  LEU  57          HD21      LEU  57  -2.643 -11.604   1.110
  Start of MODEL    2
 1081   HD22  LEU  57          HD22      LEU  57  -3.281 -10.225   2.007
  Start of MODEL    2
 1082   HD21  LEU  57          HD23      LEU  57  -1.948  -9.999   0.875
  Start of MODEL    2
 1083    H    LEU  57           HN       LEU  57  -3.739  -8.116  -2.115
  Start of MODEL    2
 1084    HA   GLU  58           HA       GLU  58  -7.554 -10.673  -4.092
  Start of MODEL    2
 1085    HB3  GLU  58           HB2      GLU  58  -8.417 -13.013  -4.391
  Start of MODEL    2
 1086    HB2  GLU  58           HB3      GLU  58  -6.857 -13.568  -3.784
  Start of MODEL    2
 1087    HG2  GLU  58           HG2      GLU  58  -7.467 -12.070  -6.307
  Start of MODEL    2
 1088    HG3  GLU  58           HG3      GLU  58  -5.836 -12.128  -5.673
  Start of MODEL    2
 1089    H    GLU  58           HN       GLU  58  -5.163 -12.057  -3.387
  Start of MODEL    2
 1090    HA   PRO  59           HA       PRO  59  -8.765 -10.720   0.246
  Start of MODEL    2
 1091    HB3  PRO  59           HB2      PRO  59  -9.435  -8.566   0.444
  Start of MODEL    2
 1092    HB2  PRO  59           HB3      PRO  59 -10.934  -8.939  -0.404
  Start of MODEL    2
 1093    HG2  PRO  59           HG2      PRO  59 -10.074  -7.618  -2.055
  Start of MODEL    2
 1094    HG3  PRO  59           HG3      PRO  59  -8.421  -7.788  -1.447
  Start of MODEL    2
 1095    HD2  PRO  59           HD2      PRO  59  -9.954  -9.571  -3.290
  Start of MODEL    2
 1096    HD3  PRO  59           HD3      PRO  59  -8.237  -9.094  -3.303
  Start of MODEL    2
 1097    HA   ALA  60           HA       ALA  60 -12.026 -13.578  -0.003
  Start of MODEL    2
 1098    HB1  ALA  60           HB1      ALA  60 -11.746 -12.862   2.920
  Start of MODEL    2
 1099    HB3  ALA  60           HB2      ALA  60 -10.953 -14.211   2.098
  Start of MODEL    2
 1100    HB2  ALA  60           HB3      ALA  60 -12.705 -14.198   2.296
  Start of MODEL    2
 1101    H    ALA  60           HN       ALA  60 -10.221 -11.861   1.325
  Start of MODEL    2
 1102    HA   ALA  61           HA       ALA  61 -15.195 -10.781  -0.572
  Start of MODEL    2
 1103    HB2  ALA  61           HB1      ALA  61 -16.679 -13.389  -0.655
  Start of MODEL    2
 1104    HB1  ALA  61           HB2      ALA  61 -15.811 -12.665  -2.010
  Start of MODEL    2
 1105    HB3  ALA  61           HB3      ALA  61 -17.228 -11.856  -1.333
  Start of MODEL    2
 1106    H    ALA  61           HN       ALA  61 -14.160 -13.368  -0.290
  Start of MODEL    2
 1107    HA   ASN  62           HA       ASN  62 -17.611 -11.907   3.317
  Start of MODEL    2
 1108    HB3  ASN  62           HB2      ASN  62 -16.736 -13.038   5.379
  Start of MODEL    2
 1109    HB2  ASN  62           HB3      ASN  62 -15.258 -13.390   4.487
  Start of MODEL    2
 1110   HD21  ASN  62          HD21      ASN  62 -15.527 -15.589   4.777
  Start of MODEL    2
 1111   HD22  ASN  62          HD22      ASN  62 -16.688 -16.485   3.856
  Start of MODEL    2
 1112    H    ASN  62           HN       ASN  62 -15.240 -12.896   2.067
  Start of MODEL    2
 1113    HA   GLU  63           HA       GLU  63 -14.595  -8.963   5.324
  Start of MODEL    2
 1114    HB3  GLU  63           HB2      GLU  63 -12.245  -8.411   4.763
  Start of MODEL    2
 1115    HB2  GLU  63           HB3      GLU  63 -12.306  -9.535   3.424
  Start of MODEL    2
 1116    HG2  GLU  63           HG2      GLU  63 -12.555 -10.263   6.323
  Start of MODEL    2
 1117    HG3  GLU  63           HG3      GLU  63 -12.621 -11.388   4.967
  Start of MODEL    2
 1118    H    GLU  63           HN       GLU  63 -14.376 -10.780   3.042
  Start of MODEL    2
 1119    HA   THR  64           HA       THR  64 -15.035  -5.750   2.277
  Start of MODEL    2
 1120    HB   THR  64           HB       THR  64 -14.906  -3.973   4.677
  Start of MODEL    2
 1121    HG1  THR  64           HG1      THR  64 -17.059  -5.797   4.157
  Start of MODEL    2
 1122   HG22  THR  64          HG21      THR  64 -16.839  -2.929   3.625
  Start of MODEL    2
 1123   HG21  THR  64          HG22      THR  64 -16.908  -4.206   2.415
  Start of MODEL    2
 1124   HG23  THR  64          HG23      THR  64 -15.536  -3.094   2.450
  Start of MODEL    2
 1125    H    THR  64           HN       THR  64 -14.432  -6.692   4.986
  Start of MODEL    2
 1126    HA   VAL  65           HA       VAL  65 -10.918  -4.108   3.593
  Start of MODEL    2
 1127    HB   VAL  65           HB       VAL  65  -9.922  -6.663   4.819
  Start of MODEL    2
 1128    H    VAL  65           HN       VAL  65 -12.415  -6.618   3.718
  Start of MODEL    2
 1129    HA   ARG  66           HA       ARG  66  -8.842  -6.027   0.250
  Start of MODEL    2
 1130    HB3  ARG  66           HB2      ARG  66  -7.892  -4.258  -1.141
  Start of MODEL    2
 1131    HB2  ARG  66           HB3      ARG  66  -8.128  -3.098   0.147
  Start of MODEL    2
 1132    HG2  ARG  66           HG2      ARG  66 -10.279  -4.475  -1.455
  Start of MODEL    2
 1133    HG3  ARG  66           HG3      ARG  66 -10.581  -3.412  -0.073
  Start of MODEL    2
 1134    HD2  ARG  66           HD2      ARG  66 -10.820  -2.215  -2.201
  Start of MODEL    2
 1135    HD3  ARG  66           HD3      ARG  66  -9.488  -1.564  -1.248
  Start of MODEL    2
 1136    HE   ARG  66           HE       ARG  66  -8.441  -3.500  -2.921
  Start of MODEL    2
 1137   HH11  ARG  66          HH11      ARG  66  -9.875  -0.294  -3.222
  Start of MODEL    2
 1138   HH12  ARG  66          HH12      ARG  66  -9.196   0.015  -4.758
  Start of MODEL    2
 1139   HH21  ARG  66          HH21      ARG  66  -7.538  -3.091  -5.053
  Start of MODEL    2
 1140   HH22  ARG  66          HH22      ARG  66  -7.886  -1.622  -5.822
  Start of MODEL    2
 1141    H    ARG  66           HN       ARG  66  -9.535  -3.836   2.055
  Start of MODEL    2
 1142    HA   HIS  67           HA       HIS  67  -5.086  -5.828   2.527
  Start of MODEL    2
 1143    HB3  HIS  67           HB2      HIS  67  -4.284  -8.147   2.988
  Start of MODEL    2
 1144    HB2  HIS  67           HB3      HIS  67  -5.541  -8.758   1.934
  Start of MODEL    2
 1145    HD1  HIS  67           HD1      HIS  67  -5.066  -7.257   5.346
  Start of MODEL    2
 1146    HD2  HIS  67           HD2      HIS  67  -8.087  -8.912   3.018
  Start of MODEL    2
 1147    HE1  HIS  67           HE1      HIS  67  -6.978  -7.659   6.910
  Start of MODEL    2
 1148    HE2  HIS  67           HE2      HIS  67  -8.662  -8.937   5.521
  Start of MODEL    2
 1149    H    HIS  67           HN       HIS  67  -7.058  -7.110   0.768
  Start of MODEL    2
 1150    HA2  GLY  68           HA2      GLY  68  -2.027  -7.115  -0.405
  Start of MODEL    2
 1151    H    GLY  68           HN       GLY  68  -2.933  -5.752   1.925
  Start of MODEL    2
 1152    HA3  GLY  68           HA1      GLY  68  -2.277  -5.393  -0.673
  Start of MODEL    2
 1153    HA   CYS  69           HA       CYS  69   1.539  -5.040   1.313
  Start of MODEL    2
 1154    HB3  CYS  69           HB2      CYS  69   2.168  -7.501  -0.300
  Start of MODEL    2
 1155    HB2  CYS  69           HB3      CYS  69   1.834  -7.397   1.423
  Start of MODEL    2
 1156    H    CYS  69           HN       CYS  69   0.135  -5.953  -1.069
  Start of MODEL    2
 1157    HA   LEU  70           HA       LEU  70   3.660  -3.035  -2.008
  Start of MODEL    2
 1158    HB3  LEU  70           HB2      LEU  70   4.546  -1.508   0.464
  Start of MODEL    2
 1159    HB2  LEU  70           HB3      LEU  70   3.208  -1.029  -0.555
  Start of MODEL    2
 1160    HG   LEU  70           HG       LEU  70   6.077  -1.217  -1.485
  Start of MODEL    2
 1161   HD11  LEU  70          HD11      LEU  70   3.657  -0.005  -2.776
  Start of MODEL    2
 1162   HD13  LEU  70          HD12      LEU  70   4.530  -1.449  -3.311
  Start of MODEL    2
 1163   HD12  LEU  70          HD13      LEU  70   5.310   0.134  -3.362
  Start of MODEL    2
 1164   HD21  LEU  70          HD21      LEU  70   5.872   0.534   0.203
  Start of MODEL    2
 1165   HD23  LEU  70          HD22      LEU  70   4.508   1.226  -0.688
  Start of MODEL    2
 1166   HD22  LEU  70          HD23      LEU  70   6.117   1.205  -1.410
  Start of MODEL    2
 1167    H    LEU  70           HN       LEU  70   2.925  -3.429   0.789
  Start of MODEL    2
 1168    HA   ARG  71           HA       ARG  71   7.133  -5.246  -0.776
  Start of MODEL    2
 1169    HB3  ARG  71           HB2      ARG  71   5.981  -7.048  -1.768
  Start of MODEL    2
 1170    HB2  ARG  71           HB3      ARG  71   7.595  -7.054  -2.456
  Start of MODEL    2
 1171    HG2  ARG  71           HG2      ARG  71   5.103  -6.016  -3.798
  Start of MODEL    2
 1172    HG3  ARG  71           HG3      ARG  71   6.727  -5.963  -4.478
  Start of MODEL    2
 1173    HD2  ARG  71           HD2      ARG  71   5.333  -8.506  -3.647
  Start of MODEL    2
 1174    HD3  ARG  71           HD3      ARG  71   5.295  -7.856  -5.281
  Start of MODEL    2
 1175    HE   ARG  71           HE       ARG  71   7.967  -8.061  -4.502
  Start of MODEL    2
 1176   HH11  ARG  71          HH11      ARG  71   5.258 -10.244  -5.269
  Start of MODEL    2
 1177   HH12  ARG  71          HH12      ARG  71   6.264 -11.485  -5.836
  Start of MODEL    2
 1178   HH21  ARG  71          HH21      ARG  71   9.320  -9.774  -5.305
  Start of MODEL    2
 1179   HH22  ARG  71          HH22      ARG  71   8.633 -11.233  -5.848
  Start of MODEL    2
 1180    H    ARG  71           HN       ARG  71   5.291  -4.162  -2.756
  Start of MODEL    2
 1181    HA   LEU  72           HA       LEU  72  10.233  -3.225  -3.079
  Start of MODEL    2
 1182    HB3  LEU  72           HB2      LEU  72  11.915  -2.455  -1.655
  Start of MODEL    2
 1183    HB2  LEU  72           HB3      LEU  72  11.624  -3.580  -0.394
  Start of MODEL    2
 1184    HG   LEU  72           HG       LEU  72   9.351  -2.235  -0.131
  Start of MODEL    2
 1185   HD11  LEU  72          HD11      LEU  72  12.034  -1.023   0.561
  Start of MODEL    2
 1186   HD13  LEU  72          HD12      LEU  72  11.142  -2.222   1.505
  Start of MODEL    2
 1187   HD12  LEU  72          HD13      LEU  72  10.479  -0.596   1.298
  Start of MODEL    2
 1188   HD21  LEU  72          HD21      LEU  72   9.601  -1.043  -2.210
  Start of MODEL    2
 1189   HD23  LEU  72          HD22      LEU  72  11.099  -0.315  -1.607
  Start of MODEL    2
 1190   HD22  LEU  72          HD23      LEU  72   9.554   0.071  -0.835
  Start of MODEL    2
 1191    H    LEU  72           HN       LEU  72   9.035  -4.417  -0.696
  Start of MODEL    2
 1192    HA   ASN  73           HA       ASN  73  11.803  -7.378  -3.419
  Start of MODEL    2
 1193    HB3  ASN  73           HB2      ASN  73  12.488  -7.788  -5.770
  Start of MODEL    2
 1194    HB2  ASN  73           HB3      ASN  73  12.098  -6.111  -6.147
  Start of MODEL    2
 1195   HD21  ASN  73          HD21      ASN  73  10.585  -6.795  -7.658
  Start of MODEL    2
 1196   HD22  ASN  73          HD22      ASN  73   9.049  -7.405  -7.188
  Start of MODEL    2
 1197    H    ASN  73           HN       ASN  73  10.936  -4.799  -4.358
  Start of MODEL    2
 1198    HA   GLN  74           HA       GLN  74  15.711  -5.326  -3.331
  Start of MODEL    2
 1199    HB3  GLN  74           HB2      GLN  74  15.731  -4.403  -6.220
  Start of MODEL    2
 1200    HB2  GLN  74           HB3      GLN  74  16.241  -5.980  -5.648
  Start of MODEL    2
 1201    HG2  GLN  74           HG2      GLN  74  18.184  -4.650  -6.123
  Start of MODEL    2
 1202    HG3  GLN  74           HG3      GLN  74  17.566  -3.343  -5.115
  Start of MODEL    2
 1203   HE21  GLN  74          HE21      GLN  74  17.875  -3.431  -2.908
  Start of MODEL    2
 1204   HE22  GLN  74          HE22      GLN  74  18.797  -4.667  -2.136
  Start of MODEL    2
 1205    H    GLN  74           HN       GLN  74  13.440  -4.719  -5.012
  Start of MODEL    2
 1206    HA   PRO  75           HA       PRO  75  14.161  -1.258  -2.315
  Start of MODEL    2
 1207    HB3  PRO  75           HB2      PRO  75  14.311  -1.204  -0.029
  Start of MODEL    2
 1208    HB2  PRO  75           HB3      PRO  75  16.023  -1.631  -0.045
  Start of MODEL    2
 1209    HG2  PRO  75           HG2      PRO  75  15.114  -3.630   0.700
  Start of MODEL    2
 1210    HG3  PRO  75           HG3      PRO  75  13.622  -3.395  -0.226
  Start of MODEL    2
 1211    HD2  PRO  75           HD2      PRO  75  16.315  -4.284  -1.169
  Start of MODEL    2
 1212    HD3  PRO  75           HD3      PRO  75  14.700  -4.910  -1.586
  Start of MODEL    2
 1213    HA   THR  76           HA       THR  76  18.067   0.580  -3.250
  Start of MODEL    2
 1214    HB   THR  76           HB       THR  76  17.595   2.704  -4.490
  Start of MODEL    2
 1215    HG1  THR  76           HG1      THR  76  14.873   2.100  -3.985
  Start of MODEL    2
 1216   HG23  THR  76          HG21      THR  76  17.496   0.554  -5.683
  Start of MODEL    2
 1217   HG22  THR  76          HG22      THR  76  16.263   1.655  -6.296
  Start of MODEL    2
 1218   HG21  THR  76          HG23      THR  76  15.814   0.355  -5.192
  Start of MODEL    2
 1219    H    THR  76           HN       THR  76  15.280   0.761  -2.374
  Start of MODEL    2
 1220    HA   HIS  77           HA       HIS  77  19.552   3.469  -0.353
  Start of MODEL    2
 1221    HB3  HIS  77           HB2      HIS  77  21.081   4.207  -2.112
  Start of MODEL    2
 1222    HB2  HIS  77           HB3      HIS  77  20.603   5.548  -1.079
  Start of MODEL    2
 1223    HD1  HIS  77           HD1      HIS  77  20.467   7.591  -2.506
  Start of MODEL    2
 1224    HD2  HIS  77           HD2      HIS  77  18.942   4.273  -4.442
  Start of MODEL    2
 1225    HE1  HIS  77           HE1      HIS  77  19.653   8.431  -4.707
  Start of MODEL    2
 1226    HE2  HIS  77           HE2      HIS  77  18.952   6.366  -5.955
  Start of MODEL    2
 1227    H    HIS  77           HN       HIS  77  19.107   2.866  -3.004
  Start of MODEL    2
 1228    HA   VAL  78           HA       VAL  78  16.521   6.919  -0.574
  Start of MODEL    2
 1229    HB   VAL  78           HB       VAL  78  14.467   7.435  -1.970
  Start of MODEL    2
 1230    H    VAL  78           HN       VAL  78  17.041   4.864  -2.439
  Start of MODEL    2
 1231    HA   ASN  79           HA       ASN  79  13.014   3.933   0.274
  Start of MODEL    2
 1232    HB3  ASN  79           HB2      ASN  79  13.257   1.398   0.643
  Start of MODEL    2
 1233    HB2  ASN  79           HB3      ASN  79  14.844   1.581  -0.100
  Start of MODEL    2
 1234   HD21  ASN  79          HD21      ASN  79  11.884   3.307  -0.924
  Start of MODEL    2
 1235   HD22  ASN  79          HD22      ASN  79  11.772   2.688  -2.534
  Start of MODEL    2
 1236    H    ASN  79           HN       ASN  79  15.760   3.718  -0.546
  Start of MODEL    2
 1237    HA   ASN  80           HA       ASN  80  14.428   3.978   4.492
  Start of MODEL    2
 1238    HB3  ASN  80           HB2      ASN  80  16.232   5.452   5.318
  Start of MODEL    2
 1239    HB2  ASN  80           HB3      ASN  80  16.434   6.131   3.717
  Start of MODEL    2
 1240   HD21  ASN  80          HD21      ASN  80  18.525   5.646   3.558
  Start of MODEL    2
 1241   HD22  ASN  80          HD22      ASN  80  19.131   4.029   3.406
  Start of MODEL    2
 1242    H    ASN  80           HN       ASN  80  14.995   5.166   1.854
  Start of MODEL    2
 1243    HA2  GLY  81           HA2      GLY  81  12.228   7.831   4.387
  Start of MODEL    2
 1244    H    GLY  81           HN       GLY  81  12.263   5.043   3.459
  Start of MODEL    2
 1245    HA3  GLY  81           HA1      GLY  81  11.619   7.450   2.791
  Start of MODEL    2
 1246    HA   ASN  82           HA       ASN  82   8.190   7.029   5.599
  Start of MODEL    2
 1247    HB3  ASN  82           HB2      ASN  82   6.861   9.088   5.781
  Start of MODEL    2
 1248    HB2  ASN  82           HB3      ASN  82   7.841   9.829   4.523
  Start of MODEL    2
 1249   HD21  ASN  82          HD21      ASN  82   7.719   8.861   7.820
  Start of MODEL    2
 1250   HD22  ASN  82          HD22      ASN  82   9.156   9.653   8.330
  Start of MODEL    2
 1251    H    ASN  82           HN       ASN  82   9.763   8.543   3.666
  Start of MODEL    2
 1252    HA   TYR  83           HA       TYR  83   5.702   6.254   1.998
  Start of MODEL    2
 1253    HB3  TYR  83           HB2      TYR  83   4.997   3.886   2.013
  Start of MODEL    2
 1254    HB2  TYR  83           HB3      TYR  83   5.552   3.720   3.671
  Start of MODEL    2
 1255    HD1  TYR  83           HD1      TYR  83   6.520   3.622   0.192
  Start of MODEL    2
 1256    HD2  TYR  83           HD2      TYR  83   8.021   3.858   4.168
  Start of MODEL    2
 1257    HE1  TYR  83           HE1      TYR  83   8.746   2.953  -0.599
  Start of MODEL    2
 1258    HE2  TYR  83           HE2      TYR  83  10.235   3.200   3.376
  Start of MODEL    2
 1259    HH   TYR  83           HH       TYR  83  11.218   2.042   1.552
  Start of MODEL    2
 1260    H    TYR  83           HN       TYR  83   6.724   5.681   4.679
  Start of MODEL    2
 1261    HA   THR  84           HA       THR  84   1.895   6.718   4.151
  Start of MODEL    2
 1262    HB   THR  84           HB       THR  84   2.245   9.207   2.463
  Start of MODEL    2
 1263    HG1  THR  84           HG1      THR  84   3.825   8.737   4.040
  Start of MODEL    2
 1264   HG22  THR  84          HG21      THR  84   0.612  10.245   4.011
  Start of MODEL    2
 1265   HG21  THR  84          HG22      THR  84   0.398   8.694   4.823
  Start of MODEL    2
 1266   HG23  THR  84          HG23      THR  84  -0.112   8.889   3.146
  Start of MODEL    2
 1267    H    THR  84           HN       THR  84   3.789   7.255   1.975
  Start of MODEL    2
 1268    HA   LEU  85           HA       LEU  85  -0.413   5.427   0.685
  Start of MODEL    2
 1269    HB3  LEU  85           HB2      LEU  85  -1.522   3.868   3.029
  Start of MODEL    2
 1270    HB2  LEU  85           HB3      LEU  85  -0.202   3.360   1.993
  Start of MODEL    2
 1271    HG   LEU  85           HG       LEU  85  -3.058   3.720   1.089
  Start of MODEL    2
 1272   HD11  LEU  85          HD11      LEU  85  -0.602   2.696  -0.241
  Start of MODEL    2
 1273   HD13  LEU  85          HD12      LEU  85  -1.508   4.162  -0.685
  Start of MODEL    2
 1274   HD12  LEU  85          HD13      LEU  85  -2.231   2.549  -0.902
  Start of MODEL    2
 1275   HD21  LEU  85          HD21      LEU  85  -2.700   1.816   2.601
  Start of MODEL    2
 1276   HD23  LEU  85          HD22      LEU  85  -1.473   1.194   1.492
  Start of MODEL    2
 1277   HD22  LEU  85          HD23      LEU  85  -3.158   1.344   0.970
  Start of MODEL    2
 1278    H    LEU  85           HN       LEU  85   0.116   5.704   3.541
  Start of MODEL    2
 1279    HA   LEU  86           HA       LEU  86  -3.976   7.868   1.466
  Start of MODEL    2
 1280    HB3  LEU  86           HB2      LEU  86  -4.365   9.292  -0.545
  Start of MODEL    2
 1281    HB2  LEU  86           HB3      LEU  86  -2.998   8.538  -1.322
  Start of MODEL    2
 1282    HG   LEU  86           HG       LEU  86  -2.559  10.816  -0.511
  Start of MODEL    2
 1283   HD11  LEU  86          HD11      LEU  86  -2.806   9.639   2.219
  Start of MODEL    2
 1284   HD13  LEU  86          HD12      LEU  86  -3.896  10.813   1.475
  Start of MODEL    2
 1285   HD12  LEU  86          HD13      LEU  86  -2.226  11.260   1.833
  Start of MODEL    2
 1286   HD23  LEU  86          HD21      LEU  86  -0.879   8.678   0.774
  Start of MODEL    2
 1287   HD22  LEU  86          HD22      LEU  86  -0.400  10.358   0.539
  Start of MODEL    2
 1288   HD21  LEU  86          HD23      LEU  86  -0.697   9.321  -0.859
  Start of MODEL    2
 1289    H    LEU  86           HN       LEU  86  -1.841   6.674  -0.155
  Start of MODEL    2
 1290    HA   ALA  87           HA       ALA  87  -6.653   5.834  -1.362
  Start of MODEL    2
 1291    HB3  ALA  87           HB1      ALA  87  -6.672   4.264   0.536
  Start of MODEL    2
 1292    HB2  ALA  87           HB2      ALA  87  -8.294   4.502  -0.107
  Start of MODEL    2
 1293    HB1  ALA  87           HB3      ALA  87  -7.812   5.309   1.385
  Start of MODEL    2
 1294    H    ALA  87           HN       ALA  87  -6.017   7.294   1.110
  Start of MODEL    2
 1295    HA   ALA  88           HA       ALA  88  -9.676   8.944  -1.069
  Start of MODEL    2
 1296    HB3  ALA  88           HB1      ALA  88  -7.991   9.903  -2.581
  Start of MODEL    2
 1297    HB2  ALA  88           HB2      ALA  88  -9.630  10.287  -3.084
  Start of MODEL    2
 1298    HB1  ALA  88           HB3      ALA  88  -8.721   9.031  -3.928
  Start of MODEL    2
 1299    H    ALA  88           HN       ALA  88  -8.058   6.954  -2.498
  Start of MODEL    2
 1300    HA   ASN  89           HA       ASN  89 -13.129   7.529  -3.454
  Start of MODEL    2
 1301    HB3  ASN  89           HB2      ASN  89 -12.634   5.791  -1.621
  Start of MODEL    2
 1302    HB2  ASN  89           HB3      ASN  89 -14.324   5.942  -2.067
  Start of MODEL    2
 1303   HD21  ASN  89          HD21      ASN  89 -11.973   6.680   0.389
  Start of MODEL    2
 1304   HD22  ASN  89          HD22      ASN  89 -13.088   6.983   1.667
  Start of MODEL    2
 1305    H    ASN  89           HN       ASN  89 -11.829   8.941  -1.306
  Start of MODEL    2
 1306    HA   PRO  90           HA       PRO  90 -16.261  10.675  -2.856
  Start of MODEL    2
 1307    HB3  PRO  90           HB2      PRO  90 -18.410   9.922  -3.255
  Start of MODEL    2
 1308    HB2  PRO  90           HB3      PRO  90 -18.298   8.662  -2.019
  Start of MODEL    2
 1309    HG2  PRO  90           HG2      PRO  90 -18.061   7.426  -4.006
  Start of MODEL    2
 1310    HG3  PRO  90           HG3      PRO  90 -17.119   8.710  -4.786
  Start of MODEL    2
 1311    HD2  PRO  90           HD2      PRO  90 -16.271   6.761  -2.678
  Start of MODEL    2
 1312    HD3  PRO  90           HD3      PRO  90 -15.384   7.318  -4.113
  Start of MODEL    2
 1313    HA   CYS  91           HA       CYS  91 -17.663  10.012   1.588
  Start of MODEL    2
 1314    HB3  CYS  91           HB2      CYS  91 -16.299   7.348   2.053
  Start of MODEL    2
 1315    HB2  CYS  91           HB3      CYS  91 -18.016   7.605   1.778
  Start of MODEL    2
 1316    H    CYS  91           HN       CYS  91 -16.378   8.252  -0.254
  Start of MODEL    2
 1317    HA2  GLY  92           HA2      GLY  92 -13.465  11.855   1.767
  Start of MODEL    2
 1318    H    GLY  92           HN       GLY  92 -14.392   9.689   0.604
  Start of MODEL    2
 1319    HA3  GLY  92           HA1      GLY  92 -13.429  10.729   3.111
  Start of MODEL    2
 1320    HA   GLN  93           HA       GLN  93  -9.735   9.468   1.196
  Start of MODEL    2
 1321    HB3  GLN  93           HB2      GLN  93  -8.929  12.189   2.205
  Start of MODEL    2
 1322    HB2  GLN  93           HB3      GLN  93  -9.522  11.849   0.588
  Start of MODEL    2
 1323    HG2  GLN  93           HG2      GLN  93  -7.002  10.675   1.729
  Start of MODEL    2
 1324    HG3  GLN  93           HG3      GLN  93  -7.582  10.557   0.065
  Start of MODEL    2
 1325   HE21  GLN  93          HE21      GLN  93  -5.779  11.591  -0.798
  Start of MODEL    2
 1326   HE22  GLN  93          HE22      GLN  93  -5.531  13.286  -0.589
  Start of MODEL    2
 1327    H    GLN  93           HN       GLN  93 -11.181  11.136   3.111
  Start of MODEL    2
 1328    HA   ALA  94           HA       ALA  94  -8.088   8.462   5.125
  Start of MODEL    2
 1329    HB3  ALA  94           HB1      ALA  94  -9.297   6.425   4.659
  Start of MODEL    2
 1330    HB2  ALA  94           HB2      ALA  94  -7.635   6.001   5.128
  Start of MODEL    2
 1331    HB1  ALA  94           HB3      ALA  94  -8.110   5.980   3.441
  Start of MODEL    2
 1332    H    ALA  94           HN       ALA  94  -8.599   8.040   2.267
  Start of MODEL    2
 1333    HA   SER  95           HA       SER  95  -3.859   7.633   4.071
  Start of MODEL    2
 1334    HB3  SER  95           HB2      SER  95  -4.032   9.953   3.786
  Start of MODEL    2
 1335    HB2  SER  95           HB3      SER  95  -2.764   9.767   4.998
  Start of MODEL    2
 1336    HG   SER  95           HG       SER  95  -4.789   9.953   6.484
  Start of MODEL    2
 1337    H    SER  95           HN       SER  95  -6.013   8.036   5.919
  Start of MODEL    2
 1338    HA   ALA  96           HA       ALA  96  -1.895   6.766   7.920
  Start of MODEL    2
 1339    HB3  ALA  96           HB1      ALA  96  -3.188   4.700   7.537
  Start of MODEL    2
 1340    HB2  ALA  96           HB2      ALA  96  -1.539   4.310   8.018
  Start of MODEL    2
 1341    HB1  ALA  96           HB3      ALA  96  -2.015   4.186   6.329
  Start of MODEL    2
 1342    H    ALA  96           HN       ALA  96  -2.240   6.608   5.027
  Start of MODEL    2
 1343    HA   SER  97           HA       SER  97   2.114   6.296   6.161
  Start of MODEL    2
 1344    HB3  SER  97           HB2      SER  97   3.550   7.888   7.342
  Start of MODEL    2
 1345    HB2  SER  97           HB3      SER  97   2.414   7.925   8.693
  Start of MODEL    2
 1346    HG   SER  97           HG       SER  97   2.109   8.895   6.059
  Start of MODEL    2
 1347    H    SER  97           HN       SER  97   0.358   6.170   8.494
  Start of MODEL    2
 1348    HA   ILE  98           HA       ILE  98   4.767   3.941   8.788
  Start of MODEL    2
 1349    HB   ILE  98           HB       ILE  98   3.293   2.319   7.648
  Start of MODEL    2
 1350   HD12  ILE  98          HD11      ILE  98   7.018   0.202   7.658
  Start of MODEL    2
 1351   HD11  ILE  98          HD12      ILE  98   7.125   1.922   7.265
  Start of MODEL    2
 1352   HD13  ILE  98          HD13      ILE  98   6.373   0.798   6.129
  Start of MODEL    2
 1353    H    ILE  98           HN       ILE  98   4.029   5.218   6.308
  Start of MODEL    2
 1354    HA   MET  99           HA       MET  99   8.486   4.909   6.679
  Start of MODEL    2
 1355    HB3  MET  99           HB2      MET  99   9.194   5.411   9.584
  Start of MODEL    2
 1356    HB2  MET  99           HB3      MET  99   8.416   6.597   8.539
  Start of MODEL    2
 1357    HG2  MET  99           HG2      MET  99  11.120   5.350   8.119
  Start of MODEL    2
 1358    HG3  MET  99           HG3      MET  99  10.343   6.472   7.016
  Start of MODEL    2
 1359    HE3  MET  99           HE1      MET  99  13.187   7.026   7.812
  Start of MODEL    2
 1360    HE2  MET  99           HE2      MET  99  13.097   8.754   8.203
  Start of MODEL    2
 1361    HE1  MET  99           HE3      MET  99  12.137   8.083   6.876
  Start of MODEL    2
 1362    H    MET  99           HN       MET  99   6.900   4.204   9.053
  Start of MODEL    2
 1363    HA   ALA 100           HA       ALA 100  11.043   1.571   7.947
  Start of MODEL    2
 1364    HB1  ALA 100           HB1      ALA 100  10.445   1.167   4.992
  Start of MODEL    2
 1365    HB3  ALA 100           HB2      ALA 100   9.461   0.575   6.317
  Start of MODEL    2
 1366    HB2  ALA 100           HB3      ALA 100  11.093  -0.044   6.093
  Start of MODEL    2
 1367    H    ALA 100           HN       ALA 100  10.247   3.713   6.137
  Start of MODEL    2
 1368    HA   ALA 101           HA       ALA 101  14.802   2.733   5.968
  Start of MODEL    2
 1369    HB1  ALA 101           HB1      ALA 101  15.438   2.071   8.841
  Start of MODEL    2
 1370    HB3  ALA 101           HB2      ALA 101  14.856   3.627   8.247
  Start of MODEL    2
 1371    HB2  ALA 101           HB3      ALA 101  16.440   3.028   7.748
  Start of MODEL    2
 1372    H    ALA 101           HN       ALA 101  13.234   1.002   7.735
  Start of MODEL    2
 1373    HA   PHE 102           HA       PHE 102  16.103  -1.358   5.022
  Start of MODEL    2
 1374    HB3  PHE 102           HB2      PHE 102  16.541   0.422   2.639
  Start of MODEL    2
 1375    HB2  PHE 102           HB3      PHE 102  15.229  -0.718   2.900
  Start of MODEL    2
 1376    HD1  PHE 102           HD1      PHE 102  16.089  -3.213   3.352
  Start of MODEL    2
 1377    HD2  PHE 102           HD2      PHE 102  18.187  -0.224   1.172
  Start of MODEL    2
 1378    HE1  PHE 102           HE1      PHE 102  17.307  -4.956   2.144
  Start of MODEL    2
 1379    HE2  PHE 102           HE2      PHE 102  19.423  -1.962  -0.037
  Start of MODEL    2
 1380    HZ   PHE 102           HZ       PHE 102  18.991  -4.339   0.443
  Start of MODEL    2
 1381    H    PHE 102           HN       PHE 102  15.478   1.378   4.557
  Start of MODEL    2
 1382    HA   MET 103           HA       MET 103  20.533  -0.117   5.371
  Start of MODEL    2
 1383    HB3  MET 103           HB2      MET 103  20.386  -0.684   2.953
  Start of MODEL    2
 1384    HB2  MET 103           HB3      MET 103  21.880   0.147   3.379
  Start of MODEL    2
 1385    HG2  MET 103           HG2      MET 103  19.472   1.406   2.053
  Start of MODEL    2
 1386    HG3  MET 103           HG3      MET 103  20.956   2.244   2.483
  Start of MODEL    2
 1387    HE2  MET 103           HE1      MET 103  23.561   0.512   0.069
  Start of MODEL    2
 1388    HE1  MET 103           HE2      MET 103  23.154  -0.031   1.694
  Start of MODEL    2
 1389    HE3  MET 103           HE3      MET 103  23.342   1.693   1.360
  Start of MODEL    2
 1390    H    MET 103           HN       MET 103  18.322   1.418   4.251
  Start of MODEL    2
 1391    HA   ASP 104           HA       ASP 104  21.820   4.056   5.946
  Start of MODEL    2
 1392    HB3  ASP 104           HB2      ASP 104  24.573   2.846   5.540
  Start of MODEL    2
 1393    HB2  ASP 104           HB3      ASP 104  23.678   2.731   7.052
  Start of MODEL    2
 1394    H    ASP 104           HN       ASP 104  22.555   1.400   5.033
  Start of MODEL    2
 1395    HA   ASN 105           HA       ASN 105  21.945   5.062   1.784
  Start of MODEL    2
 1396    HB3  ASN 105           HB2      ASN 105  20.141   6.511   2.615
  Start of MODEL    2
 1397    HB2  ASN 105           HB3      ASN 105  21.064   7.299   1.352
  Start of MODEL    2
 1398   HD21  ASN 105          HD21      ASN 105  22.250   9.186   1.818
  Start of MODEL    2
 1399   HD22  ASN 105          HD22      ASN 105  22.138   9.960   3.337
  Start of MODEL    2
 1400    H    ASN 105           HN       ASN 105  21.721   5.680   4.548
  Start of MODEL    2
 1401    HA   PRO 106           HA       PRO 106  26.096   6.678   1.186
  Start of MODEL    2
 1402    HB3  PRO 106           HB2      PRO 106  26.716   5.526  -0.697
  Start of MODEL    2
 1403    HB2  PRO 106           HB3      PRO 106  25.582   6.454  -1.675
  Start of MODEL    2
 1404    HG2  PRO 106           HG2      PRO 106  24.461   4.469  -1.814
  Start of MODEL    2
 1405    HG3  PRO 106           HG3      PRO 106  25.209   3.836  -0.334
  Start of MODEL    2
 1406    HD2  PRO 106           HD2      PRO 106  22.803   5.561  -0.665
  Start of MODEL    2
 1407    HD3  PRO 106           HD3      PRO 106  23.136   4.256   0.498
  Start of MODEL    2
 1408    HA   PHE 107           HA       PHE 107  26.215  11.010   1.039
  Start of MODEL    2
 1409    HB3  PHE 107           HB2      PHE 107  25.048  10.324  -1.678
  Start of MODEL    2
 1410    HB2  PHE 107           HB3      PHE 107  26.745  10.591  -1.321
  Start of MODEL    2
 1411    HD1  PHE 107           HD1      PHE 107  23.872  12.060  -2.626
  Start of MODEL    2
 1412    HD2  PHE 107           HD2      PHE 107  27.271  12.944  -0.234
  Start of MODEL    2
 1413    HE1  PHE 107           HE1      PHE 107  23.603  14.449  -3.133
  Start of MODEL    2
 1414    HE2  PHE 107           HE2      PHE 107  27.012  15.332  -0.744
  Start of MODEL    2
 1415    HZ   PHE 107           HZ       PHE 107  25.241  16.066  -2.315
  Start of MODEL    2
 1416    H    PHE 107           HN       PHE 107  26.264   8.820   1.407
  Start of MODEL    3
 1417    H1   ASP   1           H        ASP   1 -25.189  -1.966  -2.901
  Start of MODEL    3
 1418    H2   ASP   1           H2       ASP   1 -24.627  -1.798  -4.474
  Start of MODEL    3
 1419    H3   ASP   1           H3       ASP   1 -25.841  -2.930  -4.137
  Start of MODEL    3
 1420    HA   ASP   1           HA       ASP   1 -26.078  -0.035  -3.807
  Start of MODEL    3
 1421    HB3  ASP   1           HB2      ASP   1 -25.989  -0.507  -6.180
  Start of MODEL    3
 1422    HB2  ASP   1           HB3      ASP   1 -27.647  -0.112  -5.764
  Start of MODEL    3
 1423    HA   ASP   2           HA       ASP   2 -29.985  -1.682  -2.241
  Start of MODEL    3
 1424    HB3  ASP   2           HB2      ASP   2 -30.186  -4.358  -3.629
  Start of MODEL    3
 1425    HB2  ASP   2           HB3      ASP   2 -30.982  -2.861  -4.096
  Start of MODEL    3
 1426    H    ASP   2           HN       ASP   2 -28.038  -3.055  -3.945
  Start of MODEL    3
 1427    HA   ASP   3           HA       ASP   3 -29.094  -5.150   0.766
  Start of MODEL    3
 1428    HB3  ASP   3           HB2      ASP   3 -27.692  -7.263   0.616
  Start of MODEL    3
 1429    HB2  ASP   3           HB3      ASP   3 -27.576  -6.998  -1.114
  Start of MODEL    3
 1430    H    ASP   3           HN       ASP   3 -28.849  -5.080  -2.097
  Start of MODEL    3
 1431    HA   ASP   4           HA       ASP   4 -24.555  -4.116   0.430
  Start of MODEL    3
 1432    HB3  ASP   4           HB2      ASP   4 -24.718  -3.885  -2.576
  Start of MODEL    3
 1433    HB2  ASP   4           HB3      ASP   4 -23.830  -5.086  -1.657
  Start of MODEL    3
 1434    H    ASP   4           HN       ASP   4 -26.601  -4.674  -1.506
  Start of MODEL    3
 1435    HA   ASP   5           HA       ASP   5 -26.241   0.056   0.332
  Start of MODEL    3
 1436    HB3  ASP   5           HB2      ASP   5 -27.341  -1.068   2.925
  Start of MODEL    3
 1437    HB2  ASP   5           HB3      ASP   5 -28.275  -0.865   1.451
  Start of MODEL    3
 1438    H    ASP   5           HN       ASP   5 -26.238  -2.686   1.363
  Start of MODEL    3
 1439    HA   VAL   6           HA       VAL   6 -23.709  -0.380   4.514
  Start of MODEL    3
 1440    HB   VAL   6           HB       VAL   6 -22.010  -2.235   4.853
  Start of MODEL    3
 1441    H    VAL   6           HN       VAL   6 -24.847  -1.998   2.655
  Start of MODEL    3
 1442    HA   SER   7           HA       SER   7 -20.801   1.257   1.896
  Start of MODEL    3
 1443    HB3  SER   7           HB2      SER   7 -21.252   3.843   2.076
  Start of MODEL    3
 1444    HB2  SER   7           HB3      SER   7 -22.618   3.197   3.077
  Start of MODEL    3
 1445    HG   SER   7           HG       SER   7 -23.402   2.068   1.479
  Start of MODEL    3
 1446    H    SER   7           HN       SER   7 -22.748   1.323   4.026
  Start of MODEL    3
 1447    HA   PHE   8           HA       PHE   8 -18.050   2.014   5.202
  Start of MODEL    3
 1448    HB3  PHE   8           HB2      PHE   8 -16.240   0.289   5.125
  Start of MODEL    3
 1449    HB2  PHE   8           HB3      PHE   8 -17.012  -0.428   3.719
  Start of MODEL    3
 1450    HD1  PHE   8           HD1      PHE   8 -18.736  -2.020   3.962
  Start of MODEL    3
 1451    HD2  PHE   8           HD2      PHE   8 -17.510   0.324   7.286
  Start of MODEL    3
 1452    HE1  PHE   8           HE1      PHE   8 -20.093  -3.423   5.439
  Start of MODEL    3
 1453    HE2  PHE   8           HE2      PHE   8 -18.864  -1.080   8.777
  Start of MODEL    3
 1454    HZ   PHE   8           HZ       PHE   8 -20.162  -2.957   7.848
  Start of MODEL    3
 1455    H    PHE   8           HN       PHE   8 -19.078   0.572   2.898
  Start of MODEL    3
 1456    HA   CYS   9           HA       CYS   9 -15.841   4.065   2.176
  Start of MODEL    3
 1457    HB3  CYS   9           HB2      CYS   9 -15.289   6.325   3.049
  Start of MODEL    3
 1458    HB2  CYS   9           HB3      CYS   9 -15.776   5.786   4.656
  Start of MODEL    3
 1459    H    CYS   9           HN       CYS   9 -16.586   3.547   4.905
  Start of MODEL    3
 1460    HA   ALA  10           HA       ALA  10 -11.767   3.271   2.791
  Start of MODEL    3
 1461    HB1  ALA  10           HB1      ALA  10 -11.044   6.141   2.327
  Start of MODEL    3
 1462    HB3  ALA  10           HB2      ALA  10 -11.518   4.984   1.072
  Start of MODEL    3
 1463    HB2  ALA  10           HB3      ALA  10 -10.028   4.741   2.006
  Start of MODEL    3
 1464    H    ALA  10           HN       ALA  10 -13.400   5.677   3.041
  Start of MODEL    3
 1465    HA   SER  11           HA       SER  11  -9.947   4.393   6.526
  Start of MODEL    3
 1466    HB3  SER  11           HB2      SER  11 -10.434   2.712   8.301
  Start of MODEL    3
 1467    HB2  SER  11           HB3      SER  11 -11.142   1.660   7.078
  Start of MODEL    3
 1468    HG   SER  11           HG       SER  11 -11.994   4.278   7.660
  Start of MODEL    3
 1469    H    SER  11           HN       SER  11 -11.209   2.522   4.688
  Start of MODEL    3
 1470    HA   VAL  12           HA       VAL  12  -6.458   1.917   5.490
  Start of MODEL    3
 1471    HB   VAL  12           HB       VAL  12  -5.414   4.737   5.889
  Start of MODEL    3
 1472    H    VAL  12           HN       VAL  12  -7.773   4.149   6.904
  Start of MODEL    3
 1473    HA   GLN  13           HA       GLN  13  -4.006   1.644   9.109
  Start of MODEL    3
 1474    HB3  GLN  13           HB2      GLN  13  -4.266  -0.576  10.151
  Start of MODEL    3
 1475    HB2  GLN  13           HB3      GLN  13  -5.096  -1.164   8.722
  Start of MODEL    3
 1476    HG2  GLN  13           HG2      GLN  13  -6.951   0.345   9.146
  Start of MODEL    3
 1477    HG3  GLN  13           HG3      GLN  13  -6.665  -0.740  10.500
  Start of MODEL    3
 1478   HE21  GLN  13          HE21      GLN  13  -4.362   0.858  11.474
  Start of MODEL    3
 1479   HE22  GLN  13          HE22      GLN  13  -5.052   2.248  12.193
  Start of MODEL    3
 1480    H    GLN  13           HN       GLN  13  -5.344   0.581   6.741
  Start of MODEL    3
 1481    HA   LEU  14           HA       LEU  14  -0.801  -0.356   6.888
  Start of MODEL    3
 1482    HB3  LEU  14           HB2      LEU  14   1.288   1.133   7.074
  Start of MODEL    3
 1483    HB2  LEU  14           HB3      LEU  14   0.232   2.293   7.849
  Start of MODEL    3
 1484    HG   LEU  14           HG       LEU  14  -1.231   2.140   5.761
  Start of MODEL    3
 1485   HD11  LEU  14          HD11      LEU  14   1.602   3.120   5.494
  Start of MODEL    3
 1486   HD13  LEU  14          HD12      LEU  14   0.243   4.036   6.164
  Start of MODEL    3
 1487   HD12  LEU  14          HD13      LEU  14   0.249   3.574   4.461
  Start of MODEL    3
 1488   HD23  LEU  14          HD21      LEU  14   1.242   0.770   4.750
  Start of MODEL    3
 1489   HD22  LEU  14          HD22      LEU  14  -0.104   1.327   3.759
  Start of MODEL    3
 1490   HD21  LEU  14          HD23      LEU  14  -0.351   0.029   4.929
  Start of MODEL    3
 1491    H    LEU  14           HN       LEU  14  -1.845   1.519   8.865
  Start of MODEL    3
 1492    HA   HIS  15           HA       HIS  15   1.702  -1.940  10.128
  Start of MODEL    3
 1493    HB3  HIS  15           HB2      HIS  15   2.077  -4.333   9.394
  Start of MODEL    3
 1494    HB2  HIS  15           HB3      HIS  15   1.438  -3.908   7.821
  Start of MODEL    3
 1495    HD1  HIS  15           HD1      HIS  15   0.403  -5.451  10.846
  Start of MODEL    3
 1496    HD2  HIS  15           HD2      HIS  15  -1.420  -2.907   8.103
  Start of MODEL    3
 1497    HE1  HIS  15           HE1      HIS  15  -2.053  -5.743  11.190
  Start of MODEL    3
 1498    HE2  HIS  15           HE2      HIS  15  -3.047  -3.879   9.863
  Start of MODEL    3
 1499    H    HIS  15           HN       HIS  15   1.248  -1.358   7.289
  Start of MODEL    3
 1500    HA   THR  16           HA       THR  16   5.786  -1.137   9.001
  Start of MODEL    3
 1501    HB   THR  16           HB       THR  16   6.037  -3.069  11.313
  Start of MODEL    3
 1502    HG1  THR  16           HG1      THR  16   5.942  -0.225  11.301
  Start of MODEL    3
 1503   HG23  THR  16          HG21      THR  16   8.147  -2.718  10.152
  Start of MODEL    3
 1504   HG22  THR  16          HG22      THR  16   8.170  -1.906  11.722
  Start of MODEL    3
 1505   HG21  THR  16          HG23      THR  16   7.941  -0.971  10.245
  Start of MODEL    3
 1506    H    THR  16           HN       THR  16   3.833  -2.351  10.574
  Start of MODEL    3
 1507    HA   ALA  17           HA       ALA  17   6.830  -4.261   6.114
  Start of MODEL    3
 1508    HB1  ALA  17           HB1      ALA  17   8.262  -2.326   5.483
  Start of MODEL    3
 1509    HB3  ALA  17           HB2      ALA  17   9.025  -3.889   5.225
  Start of MODEL    3
 1510    HB2  ALA  17           HB3      ALA  17   9.475  -2.910   6.622
  Start of MODEL    3
 1511    H    ALA  17           HN       ALA  17   7.203  -1.982   7.592
  Start of MODEL    3
 1512    HA   VAL  18           HA       VAL  18   8.571  -7.168   8.775
  Start of MODEL    3
 1513    HB   VAL  18           HB       VAL  18   8.005  -9.466   8.015
  Start of MODEL    3
 1514    H    VAL  18           HN       VAL  18   7.532  -6.289   6.212
  Start of MODEL    3
 1515    HA   GLU  19           HA       GLU  19  12.567  -7.662   7.432
  Start of MODEL    3
 1516    HB3  GLU  19           HB2      GLU  19  12.304  -9.528   9.777
  Start of MODEL    3
 1517    HB2  GLU  19           HB3      GLU  19  12.732  -7.825   9.838
  Start of MODEL    3
 1518    HG2  GLU  19           HG2      GLU  19  14.371  -9.870   8.388
  Start of MODEL    3
 1519    HG3  GLU  19           HG3      GLU  19  14.815  -8.216   8.807
  Start of MODEL    3
 1520    H    GLU  19           HN       GLU  19  10.355  -8.379   9.039
  Start of MODEL    3
 1521    HA   MET  20           HA       MET  20  13.209 -11.410   5.419
  Start of MODEL    3
 1522    HB3  MET  20           HB2      MET  20  11.888 -11.779   3.335
  Start of MODEL    3
 1523    HB2  MET  20           HB3      MET  20  11.166 -10.194   3.525
  Start of MODEL    3
 1524    HG2  MET  20           HG2      MET  20  10.832 -12.456   5.474
  Start of MODEL    3
 1525    HG3  MET  20           HG3      MET  20  10.027 -10.890   5.528
  Start of MODEL    3
 1526    HE2  MET  20           HE1      MET  20   7.788 -11.097   2.274
  Start of MODEL    3
 1527    HE1  MET  20           HE2      MET  20   9.449 -10.518   2.320
  Start of MODEL    3
 1528    HE3  MET  20           HE3      MET  20   8.322 -10.071   3.604
  Start of MODEL    3
 1529    H    MET  20           HN       MET  20  12.485  -8.604   5.455
  Start of MODEL    3
 1530    HA   HIS  21           HA       HIS  21  15.859  -9.751   2.427
  Start of MODEL    3
 1531    HB3  HIS  21           HB2      HIS  21  16.313 -10.949   0.265
  Start of MODEL    3
 1532    HB2  HIS  21           HB3      HIS  21  14.931 -11.986   0.594
  Start of MODEL    3
 1533    HD1  HIS  21           HD1      HIS  21  16.661 -14.031   0.617
  Start of MODEL    3
 1534    HD2  HIS  21           HD2      HIS  21  17.134 -11.231   3.656
  Start of MODEL    3
 1535    HE1  HIS  21           HE1      HIS  21  18.147 -15.103   2.307
  Start of MODEL    3
 1536    HE2  HIS  21           HE2      HIS  21  18.654 -13.242   3.934
  Start of MODEL    3
 1537    H    HIS  21           HN       HIS  21  13.699 -11.639   2.727
  Start of MODEL    3
 1538    HA   HIS  22           HA       HIS  22  12.962  -7.872  -0.488
  Start of MODEL    3
 1539    HB3  HIS  22           HB2      HIS  22  10.933  -8.617  -1.690
  Start of MODEL    3
 1540    HB2  HIS  22           HB3      HIS  22  10.860 -10.070  -0.700
  Start of MODEL    3
 1541    HD1  HIS  22           HD1      HIS  22  12.869  -8.558  -3.561
  Start of MODEL    3
 1542    HD2  HIS  22           HD2      HIS  22  12.486 -12.163  -1.508
  Start of MODEL    3
 1543    HE1  HIS  22           HE1      HIS  22  14.168 -10.207  -4.852
  Start of MODEL    3
 1544    HE2  HIS  22           HE2      HIS  22  13.757 -12.412  -3.717
  Start of MODEL    3
 1545    H    HIS  22           HN       HIS  22  12.785 -10.405   0.966
  Start of MODEL    3
 1546    HA   TRP  23           HA       TRP  23  10.720  -6.607   2.931
  Start of MODEL    3
 1547    HB3  TRP  23           HB2      TRP  23  10.621  -4.110   2.980
  Start of MODEL    3
 1548    HB2  TRP  23           HB3      TRP  23  11.211  -4.136   1.312
  Start of MODEL    3
 1549    HD1  TRP  23           HD1      TRP  23  13.721  -4.911   0.891
  Start of MODEL    3
 1550    HE1  TRP  23           HE1      TRP  23  15.798  -4.918   2.432
  Start of MODEL    3
 1551    HE3  TRP  23           HE3      TRP  23  11.379  -4.375   5.389
  Start of MODEL    3
 1552    HZ2  TRP  23           HZ2      TRP  23  16.349  -4.692   5.184
  Start of MODEL    3
 1553    HZ3  TRP  23           HZ3      TRP  23  12.748  -4.270   7.432
  Start of MODEL    3
 1554    HH2  TRP  23           HH2      TRP  23  15.180  -4.422   7.328
  Start of MODEL    3
 1555    H    TRP  23           HN       TRP  23  11.825  -6.200   0.304
  Start of MODEL    3
 1556    HA   CYS  24           HA       CYS  24   6.696  -6.028   1.385
  Start of MODEL    3
 1557    HB3  CYS  24           HB2      CYS  24   6.707  -8.264   3.434
  Start of MODEL    3
 1558    HB2  CYS  24           HB3      CYS  24   6.825  -8.444   1.695
  Start of MODEL    3
 1559    H    CYS  24           HN       CYS  24   8.696  -6.715   3.418
  Start of MODEL    3
 1560    HA   ILE  25           HA       ILE  25   5.089  -3.708   4.795
  Start of MODEL    3
 1561    HB   ILE  25           HB       ILE  25   4.606  -1.992   2.326
  Start of MODEL    3
 1562   HD13  ILE  25          HD11      ILE  25   6.429  -0.193   1.876
  Start of MODEL    3
 1563   HD12  ILE  25          HD12      ILE  25   7.736  -0.010   3.049
  Start of MODEL    3
 1564   HD11  ILE  25          HD13      ILE  25   6.084   0.438   3.482
  Start of MODEL    3
 1565    H    ILE  25           HN       ILE  25   5.594  -4.292   1.962
  Start of MODEL    3
 1566    HA   PRO  26           HA       PRO  26   1.125  -5.597   3.467
  Start of MODEL    3
 1567    HB3  PRO  26           HB2      PRO  26   0.837  -7.228   5.036
  Start of MODEL    3
 1568    HB2  PRO  26           HB3      PRO  26   0.711  -6.034   6.331
  Start of MODEL    3
 1569    HG2  PRO  26           HG2      PRO  26   2.767  -6.950   6.905
  Start of MODEL    3
 1570    HG3  PRO  26           HG3      PRO  26   3.133  -7.391   5.227
  Start of MODEL    3
 1571    HD2  PRO  26           HD2      PRO  26   3.317  -4.703   6.553
  Start of MODEL    3
 1572    HD3  PRO  26           HD3      PRO  26   4.484  -5.523   5.484
  Start of MODEL    3
 1573    HA   PHE  27           HA       PHE  27  -1.316  -2.464   5.285
  Start of MODEL    3
 1574    HB3  PHE  27           HB2      PHE  27  -0.605  -1.368   3.222
  Start of MODEL    3
 1575    HB2  PHE  27           HB3      PHE  27  -2.307  -1.055   3.524
  Start of MODEL    3
 1576    HD1  PHE  27           HD1      PHE  27  -4.047  -2.197   2.173
  Start of MODEL    3
 1577    HD2  PHE  27           HD2      PHE  27   0.094  -2.460   1.234
  Start of MODEL    3
 1578    HE1  PHE  27           HE1      PHE  27  -4.614  -2.969  -0.095
  Start of MODEL    3
 1579    HE2  PHE  27           HE2      PHE  27  -0.466  -3.230  -1.030
  Start of MODEL    3
 1580    HZ   PHE  27           HZ       PHE  27  -2.820  -3.488  -1.698
  Start of MODEL    3
 1581    H    PHE  27           HN       PHE  27  -0.780  -4.564   3.317
  Start of MODEL    3
 1582    HA   SER  28           HA       SER  28  -5.459  -3.801   4.469
  Start of MODEL    3
 1583    HB3  SER  28           HB2      SER  28  -6.499  -4.020   6.697
  Start of MODEL    3
 1584    HB2  SER  28           HB3      SER  28  -5.195  -3.054   7.395
  Start of MODEL    3
 1585    HG   SER  28           HG       SER  28  -4.085  -4.964   5.970
  Start of MODEL    3
 1586    H    SER  28           HN       SER  28  -3.557  -1.893   5.510
  Start of MODEL    3
 1587    HA   VAL  29           HA       VAL  29  -7.651  -0.045   4.522
  Start of MODEL    3
 1588    HB   VAL  29           HB       VAL  29  -6.189   0.596   2.575
  Start of MODEL    3
 1589    H    VAL  29           HN       VAL  29  -6.747  -2.563   3.355
  Start of MODEL    3
 1590    HA   ASP  30           HA       ASP  30 -11.189  -2.205   3.416
  Start of MODEL    3
 1591    HB3  ASP  30           HB2      ASP  30 -11.161  -2.473   5.942
  Start of MODEL    3
 1592    HB2  ASP  30           HB3      ASP  30 -12.732  -2.577   5.167
  Start of MODEL    3
 1593    H    ASP  30           HN       ASP  30  -9.773  -0.160   4.937
  Start of MODEL    3
 1594    HA2  GLY  31           HA2      GLY  31 -14.945   0.308   3.084
  Start of MODEL    3
 1595    H    GLY  31           HN       GLY  31 -13.479  -1.848   3.113
  Start of MODEL    3
 1596    HA3  GLY  31           HA1      GLY  31 -13.772   0.713   1.831
  Start of MODEL    3
 1597    HA   GLN  32           HA       GLN  32 -16.418  -2.078  -0.194
  Start of MODEL    3
 1598    HB3  GLN  32           HB2      GLN  32 -18.881  -1.661  -0.595
  Start of MODEL    3
 1599    HB2  GLN  32           HB3      GLN  32 -18.746  -0.265   0.474
  Start of MODEL    3
 1600    HG2  GLN  32           HG2      GLN  32 -17.864  -1.834   2.219
  Start of MODEL    3
 1601    HG3  GLN  32           HG3      GLN  32 -19.566  -2.071   1.790
  Start of MODEL    3
 1602   HE21  GLN  32          HE21      GLN  32 -16.288  -3.351   1.514
  Start of MODEL    3
 1603   HE22  GLN  32          HE22      GLN  32 -16.799  -4.938   1.050
  Start of MODEL    3
 1604    H    GLN  32           HN       GLN  32 -16.400   0.453   1.245
  Start of MODEL    3
 1605    HA   PRO  33           HA       PRO  33 -16.649   1.104  -3.717
  Start of MODEL    3
 1606    HB3  PRO  33           HB2      PRO  33 -17.672   3.166  -3.331
  Start of MODEL    3
 1607    HB2  PRO  33           HB3      PRO  33 -16.034   3.709  -2.961
  Start of MODEL    3
 1608    HG2  PRO  33           HG2      PRO  33 -16.348   3.536  -0.685
  Start of MODEL    3
 1609    HG3  PRO  33           HG3      PRO  33 -18.022   3.874  -1.158
  Start of MODEL    3
 1610    HD2  PRO  33           HD2      PRO  33 -17.348   1.687   0.264
  Start of MODEL    3
 1611    HD3  PRO  33           HD3      PRO  33 -18.663   1.666  -0.928
  Start of MODEL    3
 1612    HA   ALA  34           HA       ALA  34 -12.519   0.175  -2.742
  Start of MODEL    3
 1613    HB1  ALA  34           HB1      ALA  34 -12.595   0.115  -5.753
  Start of MODEL    3
 1614    HB3  ALA  34           HB2      ALA  34 -12.962  -1.241  -4.687
  Start of MODEL    3
 1615    HB2  ALA  34           HB3      ALA  34 -11.330  -0.574  -4.737
  Start of MODEL    3
 1616    H    ALA  34           HN       ALA  34 -14.698   0.661  -4.487
  Start of MODEL    3
 1617    HA   PRO  35           HA       PRO  35 -10.849   4.289  -3.264
  Start of MODEL    3
 1618    HB3  PRO  35           HB2      PRO  35 -10.868   4.342  -0.939
  Start of MODEL    3
 1619    HB2  PRO  35           HB3      PRO  35  -9.131   4.240  -1.251
  Start of MODEL    3
 1620    HG2  PRO  35           HG2      PRO  35  -9.072   1.956  -0.842
  Start of MODEL    3
 1621    HG3  PRO  35           HG3      PRO  35 -10.292   2.439   0.340
  Start of MODEL    3
 1622    HD2  PRO  35           HD2      PRO  35 -10.713   0.553  -1.599
  Start of MODEL    3
 1623    HD3  PRO  35           HD3      PRO  35 -12.023   1.564  -0.952
  Start of MODEL    3
 1624    HA   SER  36           HA       SER  36  -7.356   3.003  -5.541
  Start of MODEL    3
 1625    HB3  SER  36           HB2      SER  36  -7.430   6.027  -5.844
  Start of MODEL    3
 1626    HB2  SER  36           HB3      SER  36  -8.318   4.910  -6.875
  Start of MODEL    3
 1627    HG   SER  36           HG       SER  36  -6.641   4.932  -8.008
  Start of MODEL    3
 1628    H    SER  36           HN       SER  36  -9.276   4.850  -4.582
  Start of MODEL    3
 1629    HA   LEU  37           HA       LEU  37  -4.542   4.118  -2.403
  Start of MODEL    3
 1630    HB3  LEU  37           HB2      LEU  37  -2.964   2.337  -2.039
  Start of MODEL    3
 1631    HB2  LEU  37           HB3      LEU  37  -3.400   1.578  -3.551
  Start of MODEL    3
 1632    HG   LEU  37           HG       LEU  37  -5.608   1.040  -2.665
  Start of MODEL    3
 1633   HD13  LEU  37          HD11      LEU  37  -4.888  -0.594  -1.035
  Start of MODEL    3
 1634   HD12  LEU  37          HD12      LEU  37  -3.407   0.311  -0.755
  Start of MODEL    3
 1635   HD11  LEU  37          HD13      LEU  37  -3.678  -0.458  -2.315
  Start of MODEL    3
 1636   HD22  LEU  37          HD21      LEU  37  -5.962   2.912  -1.183
  Start of MODEL    3
 1637   HD21  LEU  37          HD22      LEU  37  -4.582   2.411  -0.208
  Start of MODEL    3
 1638   HD23  LEU  37          HD23      LEU  37  -6.041   1.418  -0.230
  Start of MODEL    3
 1639    H    LEU  37           HN       LEU  37  -5.288   2.711  -4.852
  Start of MODEL    3
 1640    HA   ARG  38           HA       ARG  38  -1.100   5.503  -4.640
  Start of MODEL    3
 1641    HB3  ARG  38           HB2      ARG  38  -2.559   7.911  -3.534
  Start of MODEL    3
 1642    HB2  ARG  38           HB3      ARG  38  -2.723   7.238  -5.136
  Start of MODEL    3
 1643    HG2  ARG  38           HG2      ARG  38  -1.439   9.174  -5.395
  Start of MODEL    3
 1644    HG3  ARG  38           HG3      ARG  38  -0.401   8.789  -4.026
  Start of MODEL    3
 1645    HD2  ARG  38           HD2      ARG  38   0.518   8.446  -6.394
  Start of MODEL    3
 1646    HD3  ARG  38           HD3      ARG  38   0.764   7.152  -5.224
  Start of MODEL    3
 1647    HE   ARG  38           HE       ARG  38  -1.601   6.886  -6.820
  Start of MODEL    3
 1648   HH11  ARG  38          HH11      ARG  38   1.919   6.328  -6.895
  Start of MODEL    3
 1649   HH12  ARG  38          HH12      ARG  38   1.767   4.892  -7.784
  Start of MODEL    3
 1650   HH21  ARG  38          HH21      ARG  38  -1.743   4.849  -7.941
  Start of MODEL    3
 1651   HH22  ARG  38          HH22      ARG  38  -0.334   3.964  -8.294
  Start of MODEL    3
 1652    H    ARG  38           HN       ARG  38  -3.125   5.613  -2.532
  Start of MODEL    3
 1653    HA   TRP  39           HA       TRP  39   1.390   5.893  -1.118
  Start of MODEL    3
 1654    HB3  TRP  39           HB2      TRP  39   3.625   4.940  -1.609
  Start of MODEL    3
 1655    HB2  TRP  39           HB3      TRP  39   3.151   4.798  -3.300
  Start of MODEL    3
 1656    HD1  TRP  39           HD1      TRP  39   1.592   2.826  -3.986
  Start of MODEL    3
 1657    HE1  TRP  39           HE1      TRP  39   0.786   0.737  -2.797
  Start of MODEL    3
 1658    HE3  TRP  39           HE3      TRP  39   2.912   4.104   0.784
  Start of MODEL    3
 1659    HZ2  TRP  39           HZ2      TRP  39   0.694  -0.272  -0.131
  Start of MODEL    3
 1660    HZ3  TRP  39           HZ3      TRP  39   2.431   2.512   2.600
  Start of MODEL    3
 1661    HH2  TRP  39           HH2      TRP  39   1.349   0.374   2.153
  Start of MODEL    3
 1662    H    TRP  39           HN       TRP  39   0.905   5.521  -3.954
  Start of MODEL    3
 1663    HA   LEU  40           HA       LEU  40   3.991   9.316  -2.155
  Start of MODEL    3
 1664    HB3  LEU  40           HB2      LEU  40   3.218   9.662   0.693
  Start of MODEL    3
 1665    HB2  LEU  40           HB3      LEU  40   1.955   9.647  -0.531
  Start of MODEL    3
 1666    HG   LEU  40           HG       LEU  40   4.222  11.611  -0.539
  Start of MODEL    3
 1667   HD12  LEU  40          HD11      LEU  40   2.734  12.809  -2.054
  Start of MODEL    3
 1668   HD11  LEU  40          HD12      LEU  40   1.596  11.447  -1.981
  Start of MODEL    3
 1669   HD13  LEU  40          HD13      LEU  40   3.197  11.227  -2.680
  Start of MODEL    3
 1670   HD23  LEU  40          HD21      LEU  40   1.416  11.885   0.525
  Start of MODEL    3
 1671   HD22  LEU  40          HD22      LEU  40   2.596  13.180   0.352
  Start of MODEL    3
 1672   HD21  LEU  40          HD23      LEU  40   2.894  11.865   1.492
  Start of MODEL    3
 1673    H    LEU  40           HN       LEU  40   3.159   7.115  -0.401
  Start of MODEL    3
 1674    HA   PHE  41           HA       PHE  41   7.465   8.516   0.523
  Start of MODEL    3
 1675    HB3  PHE  41           HB2      PHE  41   8.453   9.175  -2.262
  Start of MODEL    3
 1676    HB2  PHE  41           HB3      PHE  41   8.249   7.578  -1.557
  Start of MODEL    3
 1677    HD1  PHE  41           HD1      PHE  41  10.572  10.052  -2.347
  Start of MODEL    3
 1678    HD2  PHE  41           HD2      PHE  41   9.670   7.177   0.652
  Start of MODEL    3
 1679    HE1  PHE  41           HE1      PHE  41  12.918  10.101  -1.609
  Start of MODEL    3
 1680    HE2  PHE  41           HE2      PHE  41  12.017   7.213   1.387
  Start of MODEL    3
 1681    HZ   PHE  41           HZ       PHE  41  13.641   8.678   0.261
  Start of MODEL    3
 1682    H    PHE  41           HN       PHE  41   6.107   9.908  -1.676
  Start of MODEL    3
 1683    HA   ASN  42           HA       ASN  42   8.047  11.923   3.171
  Start of MODEL    3
 1684    HB3  ASN  42           HB2      ASN  42  10.056  13.243   2.465
  Start of MODEL    3
 1685    HB2  ASN  42           HB3      ASN  42  10.106  12.316   0.978
  Start of MODEL    3
 1686   HD21  ASN  42          HD21      ASN  42  12.174  11.697   1.431
  Start of MODEL    3
 1687   HD22  ASN  42          HD22      ASN  42  12.543  10.457   2.566
  Start of MODEL    3
 1688    H    ASN  42           HN       ASN  42   7.531  10.029   2.011
  Start of MODEL    3
 1689    HA2  GLY  43           HA2      GLY  43   4.541  13.940   0.889
  Start of MODEL    3
 1690    H    GLY  43           HN       GLY  43   5.980  12.075   1.239
  Start of MODEL    3
 1691    HA3  GLY  43           HA1      GLY  43   5.956  14.981   0.858
  Start of MODEL    3
 1692    HA   SER  44           HA       SER  44   6.288  14.106  -3.491
  Start of MODEL    3
 1693    HB3  SER  44           HB2      SER  44   8.522  12.128  -2.946
  Start of MODEL    3
 1694    HB2  SER  44           HB3      SER  44   8.723  13.875  -2.858
  Start of MODEL    3
 1695    HG   SER  44           HG       SER  44   8.525  12.209  -5.042
  Start of MODEL    3
 1696    H    SER  44           HN       SER  44   7.177  12.824  -1.001
  Start of MODEL    3
 1697    HA   VAL  45           HA       VAL  45   3.721  10.884  -4.623
  Start of MODEL    3
 1698    HB   VAL  45           HB       VAL  45   4.477  12.373  -7.146
  Start of MODEL    3
 1699    H    VAL  45           HN       VAL  45   5.338  13.121  -5.088
  Start of MODEL    3
 1700    HA   LEU  46           HA       LEU  46   6.761   7.946  -5.632
  Start of MODEL    3
 1701    HB3  LEU  46           HB2      LEU  46   4.783   6.525  -3.845
  Start of MODEL    3
 1702    HB2  LEU  46           HB3      LEU  46   6.241   7.329  -3.303
  Start of MODEL    3
 1703    HG   LEU  46           HG       LEU  46   6.231   4.980  -5.190
  Start of MODEL    3
 1704   HD12  LEU  46          HD11      LEU  46   8.586   4.773  -4.576
  Start of MODEL    3
 1705   HD11  LEU  46          HD12      LEU  46   8.454   6.245  -3.614
  Start of MODEL    3
 1706   HD13  LEU  46          HD13      LEU  46   8.221   6.310  -5.363
  Start of MODEL    3
 1707   HD21  LEU  46          HD21      LEU  46   5.284   4.244  -3.100
  Start of MODEL    3
 1708   HD23  LEU  46          HD22      LEU  46   6.582   5.014  -2.198
  Start of MODEL    3
 1709   HD22  LEU  46          HD23      LEU  46   6.934   3.629  -3.233
  Start of MODEL    3
 1710    H    LEU  46           HN       LEU  46   4.276   8.853  -4.458
  Start of MODEL    3
 1711    HA   ASN  47           HA       ASN  47   4.281   6.087  -8.611
  Start of MODEL    3
 1712    HB3  ASN  47           HB2      ASN  47   5.677   5.636 -10.704
  Start of MODEL    3
 1713    HB2  ASN  47           HB3      ASN  47   7.028   6.362  -9.840
  Start of MODEL    3
 1714   HD21  ASN  47          HD21      ASN  47   4.013   6.932 -11.397
  Start of MODEL    3
 1715   HD22  ASN  47          HD22      ASN  47   4.091   8.649 -11.401
  Start of MODEL    3
 1716    H    ASN  47           HN       ASN  47   6.790   6.915  -7.483
  Start of MODEL    3
 1717    HA   GLU  48           HA       GLU  48   5.202   1.944  -7.593
  Start of MODEL    3
 1718    HB3  GLU  48           HB2      GLU  48   3.360   0.533  -8.323
  Start of MODEL    3
 1719    HB2  GLU  48           HB3      GLU  48   2.826   1.763  -9.455
  Start of MODEL    3
 1720    HG2  GLU  48           HG2      GLU  48   2.752   1.868  -6.460
  Start of MODEL    3
 1721    HG3  GLU  48           HG3      GLU  48   2.448   3.266  -7.489
  Start of MODEL    3
 1722    H    GLU  48           HN       GLU  48   3.808   3.994  -9.065
  Start of MODEL    3
 1723    HA   THR  49           HA       THR  49   7.183   1.406 -11.546
  Start of MODEL    3
 1724    HB   THR  49           HB       THR  49   8.796   3.001 -10.617
  Start of MODEL    3
 1725    HG1  THR  49           HG1      THR  49  10.424   2.352 -11.803
  Start of MODEL    3
 1726   HG23  THR  49          HG21      THR  49   9.060   2.060  -8.384
  Start of MODEL    3
 1727   HG22  THR  49          HG22      THR  49  10.637   2.251  -9.153
  Start of MODEL    3
 1728   HG21  THR  49          HG23      THR  49   9.885   0.657  -9.060
  Start of MODEL    3
 1729    H    THR  49           HN       THR  49   7.130   1.951  -8.723
  Start of MODEL    3
 1730    HA   SER  50           HA       SER  50   7.954  -2.828 -11.671
  Start of MODEL    3
 1731    HB3  SER  50           HB2      SER  50   9.904  -3.713 -12.706
  Start of MODEL    3
 1732    HB2  SER  50           HB3      SER  50  10.858  -2.305 -12.232
  Start of MODEL    3
 1733    HG   SER  50           HG       SER  50   8.546  -1.927 -13.770
  Start of MODEL    3
 1734    H    SER  50           HN       SER  50   9.149  -0.325 -12.018
  Start of MODEL    3
 1735    HA   PHE  51           HA       PHE  51  11.017  -3.585  -8.286
  Start of MODEL    3
 1736    HB3  PHE  51           HB2      PHE  51  12.720  -2.244  -7.142
  Start of MODEL    3
 1737    HB2  PHE  51           HB3      PHE  51  12.140  -0.804  -7.968
  Start of MODEL    3
 1738    HD1  PHE  51           HD1      PHE  51  13.238  -4.266  -8.819
  Start of MODEL    3
 1739    HD2  PHE  51           HD2      PHE  51  13.316  -0.135  -9.821
  Start of MODEL    3
 1740    HE1  PHE  51           HE1      PHE  51  14.740  -4.756 -10.702
  Start of MODEL    3
 1741    HE2  PHE  51           HE2      PHE  51  14.815  -0.618 -11.703
  Start of MODEL    3
 1742    HZ   PHE  51           HZ       PHE  51  15.525  -2.926 -12.150
  Start of MODEL    3
 1743    H    PHE  51           HN       PHE  51  10.413  -1.187  -9.787
  Start of MODEL    3
 1744    HA   ILE  52           HA       ILE  52   8.320  -1.765  -5.169
  Start of MODEL    3
 1745    HB   ILE  52           HB       ILE  52   7.967   1.036  -6.303
  Start of MODEL    3
 1746   HD11  ILE  52          HD11      ILE  52   9.637   2.379  -4.059
  Start of MODEL    3
 1747   HD13  ILE  52          HD12      ILE  52   9.795   2.785  -5.768
  Start of MODEL    3
 1748   HD12  ILE  52          HD13      ILE  52  11.214   2.277  -4.845
  Start of MODEL    3
 1749    H    ILE  52           HN       ILE  52   8.743  -1.100  -8.004
  Start of MODEL    3
 1750    HA   PHE  53           HA       PHE  53   4.344  -1.427  -6.961
  Start of MODEL    3
 1751    HB3  PHE  53           HB2      PHE  53   5.210  -3.005  -8.570
  Start of MODEL    3
 1752    HB2  PHE  53           HB3      PHE  53   3.586  -3.483  -8.098
  Start of MODEL    3
 1753    HD1  PHE  53           HD1      PHE  53   7.111  -4.407  -8.041
  Start of MODEL    3
 1754    HD2  PHE  53           HD2      PHE  53   3.188  -5.502  -6.796
  Start of MODEL    3
 1755    HE1  PHE  53           HE1      PHE  53   7.895  -6.688  -7.562
  Start of MODEL    3
 1756    HE2  PHE  53           HE2      PHE  53   3.978  -7.780  -6.304
  Start of MODEL    3
 1757    HZ   PHE  53           HZ       PHE  53   6.332  -8.371  -6.689
  Start of MODEL    3
 1758    H    PHE  53           HN       PHE  53   6.362  -2.875  -5.451
  Start of MODEL    3
 1759    HA   THR  54           HA       THR  54   1.850  -2.767  -3.713
  Start of MODEL    3
 1760    HB   THR  54           HB       THR  54  -0.170  -1.498  -5.574
  Start of MODEL    3
 1761    HG1  THR  54           HG1      THR  54   0.963   0.228  -5.397
  Start of MODEL    3
 1762   HG22  THR  54          HG21      THR  54  -1.269  -0.864  -3.484
  Start of MODEL    3
 1763   HG21  THR  54          HG22      THR  54   0.051  -1.600  -2.570
  Start of MODEL    3
 1764   HG23  THR  54          HG23      THR  54  -1.011  -2.613  -3.545
  Start of MODEL    3
 1765    H    THR  54           HN       THR  54   2.266  -1.727  -6.377
  Start of MODEL    3
 1766    HA   GLU  55           HA       GLU  55  -0.094  -5.985  -5.899
  Start of MODEL    3
 1767    HB3  GLU  55           HB2      GLU  55   1.434  -7.605  -3.854
  Start of MODEL    3
 1768    HB2  GLU  55           HB3      GLU  55   2.097  -7.113  -5.409
  Start of MODEL    3
 1769    HG2  GLU  55           HG2      GLU  55  -0.360  -8.819  -5.011
  Start of MODEL    3
 1770    HG3  GLU  55           HG3      GLU  55   0.340  -8.359  -6.558
  Start of MODEL    3
 1771    H    GLU  55           HN       GLU  55   1.452  -4.941  -3.668
  Start of MODEL    3
 1772    HA   PHE  56           HA       PHE  56  -3.258  -6.208  -2.911
  Start of MODEL    3
 1773    HB3  PHE  56           HB2      PHE  56  -5.378  -5.976  -4.105
  Start of MODEL    3
 1774    HB2  PHE  56           HB3      PHE  56  -4.565  -6.182  -5.644
  Start of MODEL    3
 1775    HD1  PHE  56           HD1      PHE  56  -5.476  -3.837  -3.059
  Start of MODEL    3
 1776    HD2  PHE  56           HD2      PHE  56  -3.097  -4.432  -6.529
  Start of MODEL    3
 1777    HE1  PHE  56           HE1      PHE  56  -5.170  -1.403  -3.259
  Start of MODEL    3
 1778    HE2  PHE  56           HE2      PHE  56  -2.790  -2.011  -6.736
  Start of MODEL    3
 1779    HZ   PHE  56           HZ       PHE  56  -3.976  -0.481  -5.176
  Start of MODEL    3
 1780    H    PHE  56           HN       PHE  56  -2.105  -6.063  -5.568
  Start of MODEL    3
 1781    HA   LEU  57           HA       LEU  57  -3.655 -10.413  -3.836
  Start of MODEL    3
 1782    HB3  LEU  57           HB2      LEU  57  -2.870 -10.771  -1.596
  Start of MODEL    3
 1783    HB2  LEU  57           HB3      LEU  57  -4.283 -11.781  -1.821
  Start of MODEL    3
 1784    HG   LEU  57           HG       LEU  57  -4.491  -9.188  -0.363
  Start of MODEL    3
 1785   HD12  LEU  57          HD11      LEU  57  -6.444 -10.318   0.653
  Start of MODEL    3
 1786   HD11  LEU  57          HD12      LEU  57  -6.135 -11.695  -0.411
  Start of MODEL    3
 1787   HD13  LEU  57          HD13      LEU  57  -6.574 -10.140  -1.099
  Start of MODEL    3
 1788   HD21  LEU  57          HD21      LEU  57  -2.768 -10.501   0.736
  Start of MODEL    3
 1789   HD23  LEU  57          HD22      LEU  57  -3.833 -11.903   0.764
  Start of MODEL    3
 1790   HD22  LEU  57          HD23      LEU  57  -4.237 -10.470   1.708
  Start of MODEL    3
 1791    H    LEU  57           HN       LEU  57  -4.076  -8.131  -2.124
  Start of MODEL    3
 1792    HA   GLU  58           HA       GLU  58  -7.597 -11.007  -5.254
  Start of MODEL    3
 1793    HB3  GLU  58           HB2      GLU  58  -8.528 -13.297  -5.184
  Start of MODEL    3
 1794    HB2  GLU  58           HB3      GLU  58  -7.288 -13.750  -4.024
  Start of MODEL    3
 1795    HG2  GLU  58           HG2      GLU  58  -5.559 -13.310  -5.683
  Start of MODEL    3
 1796    HG3  GLU  58           HG3      GLU  58  -6.734 -14.489  -6.267
  Start of MODEL    3
 1797    H    GLU  58           HN       GLU  58  -5.417 -12.109  -3.901
  Start of MODEL    3
 1798    HA   PRO  59           HA       PRO  59  -9.751  -9.462  -1.684
  Start of MODEL    3
 1799    HB3  PRO  59           HB2      PRO  59 -11.489  -8.227  -2.538
  Start of MODEL    3
 1800    HB2  PRO  59           HB3      PRO  59 -12.152  -9.607  -3.423
  Start of MODEL    3
 1801    HG2  PRO  59           HG2      PRO  59 -11.221  -8.389  -5.177
  Start of MODEL    3
 1802    HG3  PRO  59           HG3      PRO  59  -9.902  -7.775  -4.164
  Start of MODEL    3
 1803    HD2  PRO  59           HD2      PRO  59 -10.253 -10.484  -5.373
  Start of MODEL    3
 1804    HD3  PRO  59           HD3      PRO  59  -8.777  -9.465  -5.294
  Start of MODEL    3
 1805    HA   ALA  60           HA       ALA  60 -11.410 -13.170  -0.422
  Start of MODEL    3
 1806    HB2  ALA  60           HB1      ALA  60 -11.509 -13.248   2.048
  Start of MODEL    3
 1807    HB1  ALA  60           HB2      ALA  60 -11.164 -11.520   2.098
  Start of MODEL    3
 1808    HB3  ALA  60           HB3      ALA  60  -9.958 -12.641   1.469
  Start of MODEL    3
 1809    H    ALA  60           HN       ALA  60 -10.470 -10.536  -0.050
  Start of MODEL    3
 1810    HA   ALA  61           HA       ALA  61 -15.461 -12.061  -1.181
  Start of MODEL    3
 1811    HB1  ALA  61           HB1      ALA  61 -15.311 -14.383  -1.927
  Start of MODEL    3
 1812    HB3  ALA  61           HB2      ALA  61 -16.889 -14.015  -1.233
  Start of MODEL    3
 1813    HB2  ALA  61           HB3      ALA  61 -15.704 -14.927  -0.298
  Start of MODEL    3
 1814    H    ALA  61           HN       ALA  61 -13.409 -13.804  -0.501
  Start of MODEL    3
 1815    HA   ASN  62           HA       ASN  62 -17.144 -12.562   3.116
  Start of MODEL    3
 1816    HB3  ASN  62           HB2      ASN  62 -16.208 -13.491   5.211
  Start of MODEL    3
 1817    HB2  ASN  62           HB3      ASN  62 -14.693 -13.802   4.379
  Start of MODEL    3
 1818   HD21  ASN  62          HD21      ASN  62 -17.992 -14.773   4.730
  Start of MODEL    3
 1819   HD22  ASN  62          HD22      ASN  62 -17.843 -16.286   3.920
  Start of MODEL    3
 1820    H    ASN  62           HN       ASN  62 -14.579 -13.296   1.912
  Start of MODEL    3
 1821    HA   GLU  63           HA       GLU  63 -14.333  -9.451   4.934
  Start of MODEL    3
 1822    HB3  GLU  63           HB2      GLU  63 -12.130  -8.583   4.224
  Start of MODEL    3
 1823    HB2  GLU  63           HB3      GLU  63 -12.214  -9.605   2.802
  Start of MODEL    3
 1824    HG2  GLU  63           HG2      GLU  63 -12.218 -11.582   4.182
  Start of MODEL    3
 1825    HG3  GLU  63           HG3      GLU  63 -10.807 -10.581   4.513
  Start of MODEL    3
 1826    H    GLU  63           HN       GLU  63 -14.296 -10.935   2.412
  Start of MODEL    3
 1827    HA   THR  64           HA       THR  64 -15.269  -5.890   2.537
  Start of MODEL    3
 1828    HB   THR  64           HB       THR  64 -15.797  -4.100   4.335
  Start of MODEL    3
 1829    HG1  THR  64           HG1      THR  64 -15.274  -4.657   6.278
  Start of MODEL    3
 1830   HG21  THR  64          HG21      THR  64 -17.311  -6.726   4.316
  Start of MODEL    3
 1831   HG23  THR  64          HG22      THR  64 -17.560  -5.364   3.210
  Start of MODEL    3
 1832   HG22  THR  64          HG23      THR  64 -17.939  -5.192   4.922
  Start of MODEL    3
 1833    H    THR  64           HN       THR  64 -14.436  -7.245   4.972
  Start of MODEL    3
 1834    HA   VAL  65           HA       VAL  65 -11.246  -4.070   3.843
  Start of MODEL    3
 1835    HB   VAL  65           HB       VAL  65 -10.111  -6.602   5.025
  Start of MODEL    3
 1836    H    VAL  65           HN       VAL  65 -12.541  -6.707   3.844
  Start of MODEL    3
 1837    HA   ARG  66           HA       ARG  66  -9.073  -5.859   0.434
  Start of MODEL    3
 1838    HB3  ARG  66           HB2      ARG  66  -7.912  -4.129  -0.845
  Start of MODEL    3
 1839    HB2  ARG  66           HB3      ARG  66  -8.043  -3.010   0.492
  Start of MODEL    3
 1840    HG2  ARG  66           HG2      ARG  66 -10.367  -4.036  -1.133
  Start of MODEL    3
 1841    HG3  ARG  66           HG3      ARG  66 -10.453  -2.863   0.183
  Start of MODEL    3
 1842    HD2  ARG  66           HD2      ARG  66 -10.497  -1.698  -1.951
  Start of MODEL    3
 1843    HD3  ARG  66           HD3      ARG  66  -8.989  -1.334  -1.114
  Start of MODEL    3
 1844    HE   ARG  66           HE       ARG  66  -8.537  -3.520  -2.713
  Start of MODEL    3
 1845   HH11  ARG  66          HH11      ARG  66  -9.054  -0.018  -3.168
  Start of MODEL    3
 1846   HH12  ARG  66          HH12      ARG  66  -8.502  -0.018  -4.761
  Start of MODEL    3
 1847   HH21  ARG  66          HH21      ARG  66  -7.807  -3.472  -4.978
  Start of MODEL    3
 1848   HH22  ARG  66          HH22      ARG  66  -7.805  -2.003  -5.819
  Start of MODEL    3
 1849    H    ARG  66           HN       ARG  66  -9.698  -3.728   2.320
  Start of MODEL    3
 1850    HA   HIS  67           HA       HIS  67  -5.137  -5.903   2.381
  Start of MODEL    3
 1851    HB3  HIS  67           HB2      HIS  67  -4.474  -8.303   2.727
  Start of MODEL    3
 1852    HB2  HIS  67           HB3      HIS  67  -5.907  -8.773   1.831
  Start of MODEL    3
 1853    HD1  HIS  67           HD1      HIS  67  -4.798  -7.595   5.168
  Start of MODEL    3
 1854    HD2  HIS  67           HD2      HIS  67  -8.346  -8.448   3.175
  Start of MODEL    3
 1855    HE1  HIS  67           HE1      HIS  67  -6.558  -7.661   6.930
  Start of MODEL    3
 1856    HE2  HIS  67           HE2      HIS  67  -8.531  -8.615   5.738
  Start of MODEL    3
 1857    H    HIS  67           HN       HIS  67  -7.090  -6.854   0.420
  Start of MODEL    3
 1858    HA2  GLY  68           HA2      GLY  68  -2.031  -7.755  -0.273
  Start of MODEL    3
 1859    H    GLY  68           HN       GLY  68  -2.957  -6.400   1.884
  Start of MODEL    3
 1860    HA3  GLY  68           HA1      GLY  68  -2.372  -6.116  -0.836
  Start of MODEL    3
 1861    HA   CYS  69           HA       CYS  69   1.230  -5.070   1.221
  Start of MODEL    3
 1862    HB3  CYS  69           HB2      CYS  69   2.287  -7.581  -0.062
  Start of MODEL    3
 1863    HB2  CYS  69           HB3      CYS  69   1.732  -7.408   1.603
  Start of MODEL    3
 1864    H    CYS  69           HN       CYS  69   0.023  -6.297  -1.100
  Start of MODEL    3
 1865    HA   LEU  70           HA       LEU  70   3.359  -3.162  -2.116
  Start of MODEL    3
 1866    HB3  LEU  70           HB2      LEU  70   4.269  -1.709   0.387
  Start of MODEL    3
 1867    HB2  LEU  70           HB3      LEU  70   2.862  -1.247  -0.546
  Start of MODEL    3
 1868    HG   LEU  70           HG       LEU  70   5.663  -1.262  -1.659
  Start of MODEL    3
 1869   HD13  LEU  70          HD11      LEU  70   4.027  -1.394  -3.380
  Start of MODEL    3
 1870   HD12  LEU  70          HD12      LEU  70   4.645   0.270  -3.326
  Start of MODEL    3
 1871   HD11  LEU  70          HD13      LEU  70   3.083  -0.112  -2.629
  Start of MODEL    3
 1872   HD21  LEU  70          HD21      LEU  70   5.555   0.344   0.172
  Start of MODEL    3
 1873   HD23  LEU  70          HD22      LEU  70   4.102   1.054  -0.539
  Start of MODEL    3
 1874   HD22  LEU  70          HD23      LEU  70   5.639   1.164  -1.388
  Start of MODEL    3
 1875    H    LEU  70           HN       LEU  70   2.732  -3.617   0.691
  Start of MODEL    3
 1876    HA   ARG  71           HA       ARG  71   6.930  -5.284  -0.824
  Start of MODEL    3
 1877    HB3  ARG  71           HB2      ARG  71   7.472  -7.285  -2.140
  Start of MODEL    3
 1878    HB2  ARG  71           HB3      ARG  71   6.179  -6.897  -3.262
  Start of MODEL    3
 1879    HG2  ARG  71           HG2      ARG  71   5.690  -7.363  -0.338
  Start of MODEL    3
 1880    HG3  ARG  71           HG3      ARG  71   4.518  -7.331  -1.652
  Start of MODEL    3
 1881    HD2  ARG  71           HD2      ARG  71   6.635  -9.410  -1.133
  Start of MODEL    3
 1882    HD3  ARG  71           HD3      ARG  71   4.891  -9.616  -1.030
  Start of MODEL    3
 1883    HE   ARG  71           HE       ARG  71   6.524  -9.481  -3.428
  Start of MODEL    3
 1884   HH11  ARG  71          HH11      ARG  71   3.267  -9.799  -2.049
  Start of MODEL    3
 1885   HH12  ARG  71          HH12      ARG  71   2.571 -10.289  -3.528
  Start of MODEL    3
 1886   HH21  ARG  71          HH21      ARG  71   5.545 -10.163  -5.407
  Start of MODEL    3
 1887   HH22  ARG  71          HH22      ARG  71   3.857 -10.437  -5.462
  Start of MODEL    3
 1888    H    ARG  71           HN       ARG  71   4.850  -4.648  -2.769
  Start of MODEL    3
 1889    HA   LEU  72           HA       LEU  72   9.629  -3.314  -3.465
  Start of MODEL    3
 1890    HB3  LEU  72           HB2      LEU  72  11.654  -2.873  -2.143
  Start of MODEL    3
 1891    HB2  LEU  72           HB3      LEU  72  11.083  -3.950  -0.886
  Start of MODEL    3
 1892    HG   LEU  72           HG       LEU  72   9.067  -2.378  -0.676
  Start of MODEL    3
 1893   HD11  LEU  72          HD11      LEU  72  11.828  -1.323  -0.082
  Start of MODEL    3
 1894   HD13  LEU  72          HD12      LEU  72  10.800  -2.308   0.981
  Start of MODEL    3
 1895   HD12  LEU  72          HD13      LEU  72  10.328  -0.668   0.572
  Start of MODEL    3
 1896   HD23  LEU  72          HD21      LEU  72  10.861  -0.642  -2.317
  Start of MODEL    3
 1897   HD22  LEU  72          HD22      LEU  72   9.357  -0.142  -1.533
  Start of MODEL    3
 1898   HD21  LEU  72          HD23      LEU  72   9.328  -1.342  -2.838
  Start of MODEL    3
 1899    H    LEU  72           HN       LEU  72   8.834  -4.707  -1.076
  Start of MODEL    3
 1900    HA   ASN  73           HA       ASN  73  10.830  -7.292  -4.847
  Start of MODEL    3
 1901    HB3  ASN  73           HB2      ASN  73  11.212  -5.498  -7.254
  Start of MODEL    3
 1902    HB2  ASN  73           HB3      ASN  73   9.674  -6.235  -6.825
  Start of MODEL    3
 1903   HD21  ASN  73          HD21      ASN  73  12.833  -6.772  -8.169
  Start of MODEL    3
 1904   HD22  ASN  73          HD22      ASN  73  12.554  -8.390  -8.650
  Start of MODEL    3
 1905    H    ASN  73           HN       ASN  73  10.122  -4.542  -5.045
  Start of MODEL    3
 1906    HA   GLN  74           HA       GLN  74  15.013  -5.733  -4.712
  Start of MODEL    3
 1907    HB3  GLN  74           HB2      GLN  74  14.804  -3.800  -7.041
  Start of MODEL    3
 1908    HB2  GLN  74           HB3      GLN  74  15.200  -5.509  -7.156
  Start of MODEL    3
 1909    HG2  GLN  74           HG2      GLN  74  16.859  -3.403  -5.790
  Start of MODEL    3
 1910    HG3  GLN  74           HG3      GLN  74  17.259  -5.113  -5.883
  Start of MODEL    3
 1911   HE21  GLN  74          HE21      GLN  74  18.717  -2.801  -6.856
  Start of MODEL    3
 1912   HE22  GLN  74          HE22      GLN  74  18.935  -3.053  -8.549
  Start of MODEL    3
 1913    H    GLN  74           HN       GLN  74  12.627  -4.389  -5.656
  Start of MODEL    3
 1914    HA   PRO  75           HA       PRO  75  14.283  -2.194  -2.094
  Start of MODEL    3
 1915    HB3  PRO  75           HB2      PRO  75  14.625  -3.486  -0.247
  Start of MODEL    3
 1916    HB2  PRO  75           HB3      PRO  75  16.241  -2.778  -0.279
  Start of MODEL    3
 1917    HG2  PRO  75           HG2      PRO  75  17.189  -4.646  -1.230
  Start of MODEL    3
 1918    HG3  PRO  75           HG3      PRO  75  15.844  -5.440  -0.397
  Start of MODEL    3
 1919    HD2  PRO  75           HD2      PRO  75  16.284  -5.604  -3.085
  Start of MODEL    3
 1920    HD3  PRO  75           HD3      PRO  75  14.684  -5.778  -2.338
  Start of MODEL    3
 1921    HA   THR  76           HA       THR  76  17.852   0.071  -3.252
  Start of MODEL    3
 1922    HB   THR  76           HB       THR  76  16.919   2.046  -4.540
  Start of MODEL    3
 1923    HG1  THR  76           HG1      THR  76  14.459   0.713  -3.997
  Start of MODEL    3
 1924   HG21  THR  76          HG21      THR  76  15.890  -0.700  -5.308
  Start of MODEL    3
 1925   HG23  THR  76          HG22      THR  76  17.481  -0.051  -5.700
  Start of MODEL    3
 1926   HG22  THR  76          HG23      THR  76  16.035   0.675  -6.401
  Start of MODEL    3
 1927    H    THR  76           HN       THR  76  15.093  -0.258  -2.323
  Start of MODEL    3
 1928    HA   HIS  77           HA       HIS  77  18.176   3.049  -0.118
  Start of MODEL    3
 1929    HB3  HIS  77           HB2      HIS  77  20.336   3.473  -1.381
  Start of MODEL    3
 1930    HB2  HIS  77           HB3      HIS  77  19.824   4.751  -0.300
  Start of MODEL    3
 1931    HD1  HIS  77           HD1      HIS  77  20.303   6.946  -1.209
  Start of MODEL    3
 1932    HD2  HIS  77           HD2      HIS  77  19.323   4.232  -4.173
  Start of MODEL    3
 1933    HE1  HIS  77           HE1      HIS  77  20.473   8.240  -3.368
  Start of MODEL    3
 1934    HE2  HIS  77           HE2      HIS  77  20.224   6.464  -5.132
  Start of MODEL    3
 1935    H    HIS  77           HN       HIS  77  18.483   2.490  -2.939
  Start of MODEL    3
 1936    HA   VAL  78           HA       VAL  78  15.327   6.277  -1.377
  Start of MODEL    3
 1937    HB   VAL  78           HB       VAL  78  13.384   6.302  -2.998
  Start of MODEL    3
 1938    H    VAL  78           HN       VAL  78  16.230   3.944  -2.715
  Start of MODEL    3
 1939    HA   ASN  79           HA       ASN  79  12.224   3.105   0.090
  Start of MODEL    3
 1940    HB3  ASN  79           HB2      ASN  79  12.611   0.699   0.568
  Start of MODEL    3
 1941    HB2  ASN  79           HB3      ASN  79  14.273   0.879   0.018
  Start of MODEL    3
 1942   HD21  ASN  79          HD21      ASN  79  11.496   2.443  -1.507
  Start of MODEL    3
 1943   HD22  ASN  79          HD22      ASN  79  11.611   1.536  -2.969
  Start of MODEL    3
 1944    H    ASN  79           HN       ASN  79  14.971   3.063  -0.873
  Start of MODEL    3
 1945    HA   ASN  80           HA       ASN  80  14.297   3.590   4.019
  Start of MODEL    3
 1946    HB3  ASN  80           HB2      ASN  80  16.401   5.351   2.750
  Start of MODEL    3
 1947    HB2  ASN  80           HB3      ASN  80  16.521   3.603   2.768
  Start of MODEL    3
 1948   HD21  ASN  80          HD21      ASN  80  18.147   5.745   3.963
  Start of MODEL    3
 1949   HD22  ASN  80          HD22      ASN  80  18.327   5.284   5.606
  Start of MODEL    3
 1950    H    ASN  80           HN       ASN  80  14.233   4.716   1.301
  Start of MODEL    3
 1951    HA2  GLY  81           HA2      GLY  81  12.526   7.457   4.973
  Start of MODEL    3
 1952    H    GLY  81           HN       GLY  81  12.167   4.903   3.784
  Start of MODEL    3
 1953    HA3  GLY  81           HA1      GLY  81  12.026   7.627   3.307
  Start of MODEL    3
 1954    HA   ASN  82           HA       ASN  82   8.302   6.959   5.627
  Start of MODEL    3
 1955    HB3  ASN  82           HB2      ASN  82   6.882   8.999   5.733
  Start of MODEL    3
 1956    HB2  ASN  82           HB3      ASN  82   8.057   9.841   4.736
  Start of MODEL    3
 1957   HD21  ASN  82          HD21      ASN  82   9.986  10.469   5.589
  Start of MODEL    3
 1958   HD22  ASN  82          HD22      ASN  82  10.328  10.503   7.272
  Start of MODEL    3
 1959    H    ASN  82           HN       ASN  82  10.094   8.606   4.037
  Start of MODEL    3
 1960    HA   TYR  83           HA       TYR  83   5.827   6.776   2.023
  Start of MODEL    3
 1961    HB3  TYR  83           HB2      TYR  83   5.018   4.408   1.686
  Start of MODEL    3
 1962    HB2  TYR  83           HB3      TYR  83   5.845   3.984   3.177
  Start of MODEL    3
 1963    HD1  TYR  83           HD1      TYR  83   6.660   5.858   0.054
  Start of MODEL    3
 1964    HD2  TYR  83           HD2      TYR  83   7.895   2.938   2.888
  Start of MODEL    3
 1965    HE1  TYR  83           HE1      TYR  83   8.714   5.480  -1.238
  Start of MODEL    3
 1966    HE2  TYR  83           HE2      TYR  83   9.960   2.563   1.596
  Start of MODEL    3
 1967    HH   TYR  83           HH       TYR  83  11.055   4.634  -0.757
  Start of MODEL    3
 1968    H    TYR  83           HN       TYR  83   6.621   5.891   4.679
  Start of MODEL    3
 1969    HA   THR  84           HA       THR  84   2.029   7.135   4.120
  Start of MODEL    3
 1970    HB   THR  84           HB       THR  84   1.913   9.298   2.012
  Start of MODEL    3
 1971    HG1  THR  84           HG1      THR  84   2.635  10.048   4.549
  Start of MODEL    3
 1972   HG21  THR  84          HG21      THR  84   0.607   9.045   4.735
  Start of MODEL    3
 1973   HG23  THR  84          HG22      THR  84  -0.199   8.864   3.176
  Start of MODEL    3
 1974   HG22  THR  84          HG23      THR  84   0.462  10.429   3.652
  Start of MODEL    3
 1975    H    THR  84           HN       THR  84   3.966   7.678   1.990
  Start of MODEL    3
 1976    HA   LEU  85           HA       LEU  85  -0.367   5.417   0.895
  Start of MODEL    3
 1977    HB3  LEU  85           HB2      LEU  85  -1.464   4.217   3.448
  Start of MODEL    3
 1978    HB2  LEU  85           HB3      LEU  85  -0.192   3.537   2.449
  Start of MODEL    3
 1979    HG   LEU  85           HG       LEU  85  -3.091   3.827   1.667
  Start of MODEL    3
 1980   HD11  LEU  85          HD11      LEU  85  -0.714   2.732   0.222
  Start of MODEL    3
 1981   HD13  LEU  85          HD12      LEU  85  -1.731   4.108  -0.276
  Start of MODEL    3
 1982   HD12  LEU  85          HD13      LEU  85  -2.391   2.459  -0.236
  Start of MODEL    3
 1983   HD21  LEU  85          HD21      LEU  85  -2.562   2.075   3.314
  Start of MODEL    3
 1984   HD23  LEU  85          HD22      LEU  85  -1.448   1.358   2.136
  Start of MODEL    3
 1985   HD22  LEU  85          HD23      LEU  85  -3.174   1.465   1.780
  Start of MODEL    3
 1986    H    LEU  85           HN       LEU  85   0.140   6.155   3.677
  Start of MODEL    3
 1987    HA   LEU  86           HA       LEU  86  -3.807   8.103   1.303
  Start of MODEL    3
 1988    HB3  LEU  86           HB2      LEU  86  -4.026   9.284  -0.899
  Start of MODEL    3
 1989    HB2  LEU  86           HB3      LEU  86  -2.678   8.359  -1.496
  Start of MODEL    3
 1990    HG   LEU  86           HG       LEU  86  -2.131  10.697  -0.979
  Start of MODEL    3
 1991   HD13  LEU  86          HD11      LEU  86  -3.567  11.049   0.914
  Start of MODEL    3
 1992   HD12  LEU  86          HD12      LEU  86  -1.891  11.463   1.279
  Start of MODEL    3
 1993   HD11  LEU  86          HD13      LEU  86  -2.569   9.940   1.861
  Start of MODEL    3
 1994   HD23  LEU  86          HD21      LEU  86  -0.642   8.699   0.713
  Start of MODEL    3
 1995   HD22  LEU  86          HD22      LEU  86  -0.047  10.290   0.235
  Start of MODEL    3
 1996   HD21  LEU  86          HD23      LEU  86  -0.338   9.051  -0.988
  Start of MODEL    3
 1997    H    LEU  86           HN       LEU  86  -1.680   6.651  -0.092
  Start of MODEL    3
 1998    HA   ALA  87           HA       ALA  87  -6.373   5.445  -1.105
  Start of MODEL    3
 1999    HB2  ALA  87           HB1      ALA  87  -7.963   4.221   0.358
  Start of MODEL    3
 2000    HB1  ALA  87           HB2      ALA  87  -7.441   5.215   1.710
  Start of MODEL    3
 2001    HB3  ALA  87           HB3      ALA  87  -6.305   4.108   0.948
  Start of MODEL    3
 2002    H    ALA  87           HN       ALA  87  -5.694   7.047   1.289
  Start of MODEL    3
 2003    HA   ALA  88           HA       ALA  88  -9.671   8.326  -1.073
  Start of MODEL    3
 2004    HB1  ALA  88           HB1      ALA  88  -8.413   8.561  -3.800
  Start of MODEL    3
 2005    HB3  ALA  88           HB2      ALA  88  -7.933   9.472  -2.370
  Start of MODEL    3
 2006    HB2  ALA  88           HB3      ALA  88  -9.536   9.706  -3.070
  Start of MODEL    3
 2007    H    ALA  88           HN       ALA  88  -7.863   6.370  -2.341
  Start of MODEL    3
 2008    HA   ASN  89           HA       ASN  89 -12.669   6.819  -3.846
  Start of MODEL    3
 2009    HB3  ASN  89           HB2      ASN  89 -12.594   4.857  -2.317
  Start of MODEL    3
 2010    HB2  ASN  89           HB3      ASN  89 -14.245   5.240  -2.689
  Start of MODEL    3
 2011   HD21  ASN  89          HD21      ASN  89 -13.503   3.629  -0.618
  Start of MODEL    3
 2012   HD22  ASN  89          HD22      ASN  89 -13.897   4.379   0.881
  Start of MODEL    3
 2013    H    ASN  89           HN       ASN  89 -11.734   8.026  -1.401
  Start of MODEL    3
 2014    HA   PRO  90           HA       PRO  90 -15.980   9.810  -3.892
  Start of MODEL    3
 2015    HB3  PRO  90           HB2      PRO  90 -18.152   8.996  -4.092
  Start of MODEL    3
 2016    HB2  PRO  90           HB3      PRO  90 -17.936   7.824  -2.786
  Start of MODEL    3
 2017    HG2  PRO  90           HG2      PRO  90 -17.687   6.500  -4.722
  Start of MODEL    3
 2018    HG3  PRO  90           HG3      PRO  90 -16.812   7.785  -5.572
  Start of MODEL    3
 2019    HD2  PRO  90           HD2      PRO  90 -15.880   5.937  -3.445
  Start of MODEL    3
 2020    HD3  PRO  90           HD3      PRO  90 -14.989   6.546  -4.859
  Start of MODEL    3
 2021    HA   CYS  91           HA       CYS  91 -17.352   9.792   0.705
  Start of MODEL    3
 2022    HB3  CYS  91           HB2      CYS  91 -16.417   8.535   2.594
  Start of MODEL    3
 2023    HB2  CYS  91           HB3      CYS  91 -15.354   7.695   1.474
  Start of MODEL    3
 2024    H    CYS  91           HN       CYS  91 -15.868   7.957  -0.899
  Start of MODEL    3
 2025    HA2  GLY  92           HA2      GLY  92 -13.019  11.804   0.479
  Start of MODEL    3
 2026    H    GLY  92           HN       GLY  92 -13.882   9.299   0.079
  Start of MODEL    3
 2027    HA3  GLY  92           HA1      GLY  92 -13.116  11.152   2.106
  Start of MODEL    3
 2028    HA   GLN  93           HA       GLN  93  -9.411   9.219   0.878
  Start of MODEL    3
 2029    HB3  GLN  93           HB2      GLN  93  -8.389  12.049   1.053
  Start of MODEL    3
 2030    HB2  GLN  93           HB3      GLN  93  -9.018  11.304  -0.403
  Start of MODEL    3
 2031    HG2  GLN  93           HG2      GLN  93  -6.570  10.409   1.102
  Start of MODEL    3
 2032    HG3  GLN  93           HG3      GLN  93  -7.187   9.683  -0.382
  Start of MODEL    3
 2033   HE21  GLN  93          HE21      GLN  93  -5.396  10.178  -1.630
  Start of MODEL    3
 2034   HE22  GLN  93          HE22      GLN  93  -4.998  11.813  -2.039
  Start of MODEL    3
 2035    H    GLN  93           HN       GLN  93 -10.807  11.473   2.109
  Start of MODEL    3
 2036    HA   ALA  94           HA       ALA  94  -7.716   9.278   4.932
  Start of MODEL    3
 2037    HB2  ALA  94           HB1      ALA  94  -7.422   6.934   5.626
  Start of MODEL    3
 2038    HB1  ALA  94           HB2      ALA  94  -7.748   6.424   3.977
  Start of MODEL    3
 2039    HB3  ALA  94           HB3      ALA  94  -9.020   7.206   4.921
  Start of MODEL    3
 2040    H    ALA  94           HN       ALA  94  -8.199   8.167   2.249
  Start of MODEL    3
 2041    HA   SER  95           HA       SER  95  -3.557   8.099   3.998
  Start of MODEL    3
 2042    HB3  SER  95           HB2      SER  95  -3.663  10.384   3.394
  Start of MODEL    3
 2043    HB2  SER  95           HB3      SER  95  -2.236  10.223   4.421
  Start of MODEL    3
 2044    HG   SER  95           HG       SER  95  -4.544  10.786   5.783
  Start of MODEL    3
 2045    H    SER  95           HN       SER  95  -5.614   9.048   5.807
  Start of MODEL    3
 2046    HA   ALA  96           HA       ALA  96  -1.701   7.282   7.902
  Start of MODEL    3
 2047    HB3  ALA  96           HB1      ALA  96  -3.070   5.247   7.652
  Start of MODEL    3
 2048    HB2  ALA  96           HB2      ALA  96  -1.428   4.808   8.114
  Start of MODEL    3
 2049    HB1  ALA  96           HB3      ALA  96  -1.948   4.637   6.439
  Start of MODEL    3
 2050    H    ALA  96           HN       ALA  96  -2.272   6.808   5.048
  Start of MODEL    3
 2051    HA   SER  97           HA       SER  97   2.314   6.935   6.137
  Start of MODEL    3
 2052    HB3  SER  97           HB2      SER  97   3.663   8.525   7.276
  Start of MODEL    3
 2053    HB2  SER  97           HB3      SER  97   2.814   8.257   8.799
  Start of MODEL    3
 2054    HG   SER  97           HG       SER  97   1.097   9.285   8.066
  Start of MODEL    3
 2055    H    SER  97           HN       SER  97   0.542   6.875   8.488
  Start of MODEL    3
 2056    HA   ILE  98           HA       ILE  98   4.520   4.007   8.545
  Start of MODEL    3
 2057    HB   ILE  98           HB       ILE  98   3.033   2.555   7.191
  Start of MODEL    3
 2058   HD11  ILE  98          HD11      ILE  98   6.858   1.996   7.157
  Start of MODEL    3
 2059   HD13  ILE  98          HD12      ILE  98   6.195   1.017   5.846
  Start of MODEL    3
 2060   HD12  ILE  98          HD13      ILE  98   6.649   0.256   7.373
  Start of MODEL    3
 2061    H    ILE  98           HN       ILE  98   3.725   5.294   6.046
  Start of MODEL    3
 2062    HA   MET  99           HA       MET  99   8.334   5.305   6.865
  Start of MODEL    3
 2063    HB3  MET  99           HB2      MET  99   9.005   5.039   9.805
  Start of MODEL    3
 2064    HB2  MET  99           HB3      MET  99   8.065   6.387   9.199
  Start of MODEL    3
 2065    HG2  MET  99           HG2      MET  99   9.953   6.994   7.720
  Start of MODEL    3
 2066    HG3  MET  99           HG3      MET  99  10.295   7.122   9.436
  Start of MODEL    3
 2067    HE3  MET  99           HE1      MET  99  12.345   7.160   7.029
  Start of MODEL    3
 2068    HE2  MET  99           HE2      MET  99  13.684   6.188   7.641
  Start of MODEL    3
 2069    HE1  MET  99           HE3      MET  99  12.889   7.368   8.695
  Start of MODEL    3
 2070    H    MET  99           HN       MET  99   6.589   4.306   8.978
  Start of MODEL    3
 2071    HA   ALA 100           HA       ALA 100  10.278   1.398   7.105
  Start of MODEL    3
 2072    HB2  ALA 100           HB1      ALA 100  10.729   0.628   4.830
  Start of MODEL    3
 2073    HB1  ALA 100           HB2      ALA 100  10.479   2.265   4.219
  Start of MODEL    3
 2074    HB3  ALA 100           HB3      ALA 100   9.137   1.377   4.941
  Start of MODEL    3
 2075    H    ALA 100           HN       ALA 100   9.908   4.080   5.980
  Start of MODEL    3
 2076    HA   ALA 101           HA       ALA 101  14.425   2.802   7.153
  Start of MODEL    3
 2077    HB1  ALA 101           HB1      ALA 101  14.108   1.006   9.562
  Start of MODEL    3
 2078    HB3  ALA 101           HB2      ALA 101  13.893   2.757   9.542
  Start of MODEL    3
 2079    HB2  ALA 101           HB3      ALA 101  15.484   2.061   9.232
  Start of MODEL    3
 2080    H    ALA 101           HN       ALA 101  12.194   1.125   7.990
  Start of MODEL    3
 2081    HA   PHE 102           HA       PHE 102  15.570  -0.945   5.172
  Start of MODEL    3
 2082    HB3  PHE 102           HB2      PHE 102  16.356   1.349   3.375
  Start of MODEL    3
 2083    HB2  PHE 102           HB3      PHE 102  14.985   0.273   3.185
  Start of MODEL    3
 2084    HD1  PHE 102           HD1      PHE 102  16.080  -2.361   3.473
  Start of MODEL    3
 2085    HD2  PHE 102           HD2      PHE 102  17.752   1.043   1.546
  Start of MODEL    3
 2086    HE1  PHE 102           HE1      PHE 102  17.376  -3.835   1.998
  Start of MODEL    3
 2087    HE2  PHE 102           HE2      PHE 102  19.048  -0.429   0.071
  Start of MODEL    3
 2088    HZ   PHE 102           HZ       PHE 102  18.948  -2.812   0.322
  Start of MODEL    3
 2089    H    PHE 102           HN       PHE 102  15.252   1.905   5.464
  Start of MODEL    3
 2090    HA   MET 103           HA       MET 103  19.896   0.033   6.485
  Start of MODEL    3
 2091    HB3  MET 103           HB2      MET 103  20.094  -0.717   4.088
  Start of MODEL    3
 2092    HB2  MET 103           HB3      MET 103  21.583  -0.067   4.768
  Start of MODEL    3
 2093    HG2  MET 103           HG2      MET 103  19.685   1.364   2.908
  Start of MODEL    3
 2094    HG3  MET 103           HG3      MET 103  21.130   2.073   3.624
  Start of MODEL    3
 2095    HE1  MET 103           HE1      MET 103  22.102   2.785   1.304
  Start of MODEL    3
 2096    HE3  MET 103           HE2      MET 103  20.640   2.172   0.531
  Start of MODEL    3
 2097    HE2  MET 103           HE3      MET 103  22.225   1.707  -0.087
  Start of MODEL    3
 2098    H    MET 103           HN       MET 103  18.079   1.654   4.930
  Start of MODEL    3
 2099    HA   ASP 104           HA       ASP 104  21.317   4.128   6.971
  Start of MODEL    3
 2100    HB3  ASP 104           HB2      ASP 104  23.041   2.948   8.380
  Start of MODEL    3
 2101    HB2  ASP 104           HB3      ASP 104  23.625   4.465   7.718
  Start of MODEL    3
 2102    H    ASP 104           HN       ASP 104  22.079   1.421   6.370
  Start of MODEL    3
 2103    HA   ASN 105           HA       ASN 105  22.443   5.159   2.899
  Start of MODEL    3
 2104    HB3  ASN 105           HB2      ASN 105  20.225   7.026   3.778
  Start of MODEL    3
 2105    HB2  ASN 105           HB3      ASN 105  20.035   5.564   2.824
  Start of MODEL    3
 2106   HD21  ASN 105          HD21      ASN 105  20.845   8.893   2.779
  Start of MODEL    3
 2107   HD22  ASN 105          HD22      ASN 105  20.977   9.066   1.074
  Start of MODEL    3
 2108    H    ASN 105           HN       ASN 105  21.162   5.577   5.488
  Start of MODEL    3
 2109    HA   PRO 106           HA       PRO 106  25.440   8.067   4.480
  Start of MODEL    3
 2110    HB3  PRO 106           HB2      PRO 106  27.123   6.930   3.429
  Start of MODEL    3
 2111    HB2  PRO 106           HB3      PRO 106  26.973   8.187   2.215
  Start of MODEL    3
 2112    HG2  PRO 106           HG2      PRO 106  25.757   6.852   0.782
  Start of MODEL    3
 2113    HG3  PRO 106           HG3      PRO 106  26.645   5.573   1.626
  Start of MODEL    3
 2114    HD2  PRO 106           HD2      PRO 106  23.923   5.710   1.508
  Start of MODEL    3
 2115    HD3  PRO 106           HD3      PRO 106  24.804   4.935   2.840
  Start of MODEL    3
 2116    HA   PHE 107           HA       PHE 107  24.173  12.134   4.313
  Start of MODEL    3
 2117    HB3  PHE 107           HB2      PHE 107  25.180  13.315   2.309
  Start of MODEL    3
 2118    HB2  PHE 107           HB3      PHE 107  25.835  11.745   1.837
  Start of MODEL    3
 2119    HD1  PHE 107           HD1      PHE 107  25.950  14.360   4.441
  Start of MODEL    3
 2120    HD2  PHE 107           HD2      PHE 107  27.707  10.811   2.897
  Start of MODEL    3
 2121    HE1  PHE 107           HE1      PHE 107  27.907  14.701   5.890
  Start of MODEL    3
 2122    HE2  PHE 107           HE2      PHE 107  29.663  11.146   4.343
  Start of MODEL    3
 2123    HZ   PHE 107           HZ       PHE 107  29.707  13.094   5.918
  Start of MODEL    3
 2124    H    PHE 107           HN       PHE 107  24.802  10.048   4.661
  Start of MODEL    4
 2125    H1   ASP   1           H        ASP   1 -26.763  -4.623  -4.003
  Start of MODEL    4
 2126    H2   ASP   1           H2       ASP   1 -27.613  -5.510  -5.140
  Start of MODEL    4
 2127    H3   ASP   1           H3       ASP   1 -27.941  -5.746  -3.532
  Start of MODEL    4
 2128    HA   ASP   1           HA       ASP   1 -28.474  -3.292  -5.118
  Start of MODEL    4
 2129    HB3  ASP   1           HB2      ASP   1 -30.378  -5.242  -3.812
  Start of MODEL    4
 2130    HB2  ASP   1           HB3      ASP   1 -29.990  -5.215  -5.528
  Start of MODEL    4
 2131    HA   ASP   2           HA       ASP   2 -29.002  -2.343  -0.609
  Start of MODEL    4
 2132    HB3  ASP   2           HB2      ASP   2 -28.295  -3.606   1.387
  Start of MODEL    4
 2133    HB2  ASP   2           HB3      ASP   2 -27.393  -4.730   0.389
  Start of MODEL    4
 2134    H    ASP   2           HN       ASP   2 -27.661  -4.503  -2.085
  Start of MODEL    4
 2135    HA   ASP   3           HA       ASP   3 -24.191  -2.348  -0.962
  Start of MODEL    4
 2136    HB3  ASP   3           HB2      ASP   3 -23.103  -1.947  -3.115
  Start of MODEL    4
 2137    HB2  ASP   3           HB3      ASP   3 -24.671  -1.750  -3.883
  Start of MODEL    4
 2138    H    ASP   3           HN       ASP   3 -26.567  -2.533  -2.471
  Start of MODEL    4
 2139    HA   ASP   4           HA       ASP   4 -24.411   2.166  -1.636
  Start of MODEL    4
 2140    HB3  ASP   4           HB2      ASP   4 -27.389   2.473  -2.149
  Start of MODEL    4
 2141    HB2  ASP   4           HB3      ASP   4 -26.126   2.551  -3.372
  Start of MODEL    4
 2142    H    ASP   4           HN       ASP   4 -26.446   0.084  -1.952
  Start of MODEL    4
 2143    HA   ASP   5           HA       ASP   5 -27.148   2.700   2.086
  Start of MODEL    4
 2144    HB3  ASP   5           HB2      ASP   5 -28.597   1.076   3.320
  Start of MODEL    4
 2145    HB2  ASP   5           HB3      ASP   5 -28.344  -0.064   2.001
  Start of MODEL    4
 2146    H    ASP   5           HN       ASP   5 -27.011   0.701   0.044
  Start of MODEL    4
 2147    HA   VAL   6           HA       VAL   6 -24.463   0.045   4.443
  Start of MODEL    4
 2148    HB   VAL   6           HB       VAL   6 -23.236  -2.141   4.128
  Start of MODEL    4
 2149    H    VAL   6           HN       VAL   6 -25.712  -0.572   1.942
  Start of MODEL    4
 2150    HA   SER   7           HA       SER   7 -21.286   1.561   2.053
  Start of MODEL    4
 2151    HB3  SER   7           HB2      SER   7 -22.067   3.905   3.791
  Start of MODEL    4
 2152    HB2  SER   7           HB3      SER   7 -22.761   3.541   2.212
  Start of MODEL    4
 2153    HG   SER   7           HG       SER   7 -20.556   4.863   2.808
  Start of MODEL    4
 2154    H    SER   7           HN       SER   7 -23.105   1.591   4.317
  Start of MODEL    4
 2155    HA   PHE   8           HA       PHE   8 -18.477   0.730   5.295
  Start of MODEL    4
 2156    HB3  PHE   8           HB2      PHE   8 -16.857  -0.934   4.370
  Start of MODEL    4
 2157    HB2  PHE   8           HB3      PHE   8 -17.699  -0.873   2.835
  Start of MODEL    4
 2158    HD1  PHE   8           HD1      PHE   8 -20.126  -1.701   2.719
  Start of MODEL    4
 2159    HD2  PHE   8           HD2      PHE   8 -17.560  -2.388   6.051
  Start of MODEL    4
 2160    HE1  PHE   8           HE1      PHE   8 -21.544  -3.560   3.422
  Start of MODEL    4
 2161    HE2  PHE   8           HE2      PHE   8 -18.997  -4.251   6.760
  Start of MODEL    4
 2162    HZ   PHE   8           HZ       PHE   8 -20.984  -4.841   5.443
  Start of MODEL    4
 2163    H    PHE   8           HN       PHE   8 -19.783   0.338   2.771
  Start of MODEL    4
 2164    HA   CYS   9           HA       CYS   9 -16.446   3.956   3.125
  Start of MODEL    4
 2165    HB3  CYS   9           HB2      CYS   9 -15.913   4.771   5.986
  Start of MODEL    4
 2166    HB2  CYS   9           HB3      CYS   9 -17.505   4.974   5.260
  Start of MODEL    4
 2167    H    CYS   9           HN       CYS   9 -17.275   2.506   5.501
  Start of MODEL    4
 2168    HA   ALA  10           HA       ALA  10 -12.426   2.627   3.501
  Start of MODEL    4
 2169    HB3  ALA  10           HB1      ALA  10 -12.336   4.041   1.506
  Start of MODEL    4
 2170    HB2  ALA  10           HB2      ALA  10 -10.763   3.932   2.312
  Start of MODEL    4
 2171    HB1  ALA  10           HB3      ALA  10 -11.739   5.379   2.495
  Start of MODEL    4
 2172    H    ALA  10           HN       ALA  10 -14.052   5.043   3.551
  Start of MODEL    4
 2173    HA   SER  11           HA       SER  11  -9.808   4.185   6.571
  Start of MODEL    4
 2174    HB3  SER  11           HB2      SER  11  -9.653   2.491   8.395
  Start of MODEL    4
 2175    HB2  SER  11           HB3      SER  11 -10.679   1.420   7.447
  Start of MODEL    4
 2176    HG   SER  11           HG       SER  11 -12.344   2.550   7.882
  Start of MODEL    4
 2177    H    SER  11           HN       SER  11 -11.164   2.125   4.992
  Start of MODEL    4
 2178    HA   VAL  12           HA       VAL  12  -6.514   1.819   5.033
  Start of MODEL    4
 2179    HB   VAL  12           HB       VAL  12  -5.553   4.678   5.462
  Start of MODEL    4
 2180    H    VAL  12           HN       VAL  12  -7.625   3.917   6.751
  Start of MODEL    4
 2181    HA   GLN  13           HA       GLN  13  -4.143   1.279   8.592
  Start of MODEL    4
 2182    HB3  GLN  13           HB2      GLN  13  -4.279  -1.056   9.434
  Start of MODEL    4
 2183    HB2  GLN  13           HB3      GLN  13  -5.300  -1.442   8.056
  Start of MODEL    4
 2184    HG2  GLN  13           HG2      GLN  13  -5.969   0.696  10.053
  Start of MODEL    4
 2185    HG3  GLN  13           HG3      GLN  13  -7.011   0.018   8.805
  Start of MODEL    4
 2186   HE21  GLN  13          HE21      GLN  13  -6.055  -2.755   9.391
  Start of MODEL    4
 2187   HE22  GLN  13          HE22      GLN  13  -6.849  -3.168  10.850
  Start of MODEL    4
 2188    H    GLN  13           HN       GLN  13  -5.569   0.336   6.252
  Start of MODEL    4
 2189    HA   LEU  14           HA       LEU  14  -0.773  -0.420   6.551
  Start of MODEL    4
 2190    HB3  LEU  14           HB2      LEU  14   1.187   1.231   6.940
  Start of MODEL    4
 2191    HB2  LEU  14           HB3      LEU  14  -0.034   2.305   7.601
  Start of MODEL    4
 2192    HG   LEU  14           HG       LEU  14  -1.253   2.099   5.374
  Start of MODEL    4
 2193   HD13  LEU  14          HD11      LEU  14   0.141   4.051   5.898
  Start of MODEL    4
 2194   HD12  LEU  14          HD12      LEU  14   0.223   3.597   4.195
  Start of MODEL    4
 2195   HD11  LEU  14          HD13      LEU  14   1.555   3.189   5.281
  Start of MODEL    4
 2196   HD22  LEU  14          HD21      LEU  14   0.030   1.308   3.496
  Start of MODEL    4
 2197   HD21  LEU  14          HD22      LEU  14  -0.181   0.021   4.693
  Start of MODEL    4
 2198   HD23  LEU  14          HD23      LEU  14   1.358   0.878   4.573
  Start of MODEL    4
 2199    H    LEU  14           HN       LEU  14  -2.113   1.391   8.381
  Start of MODEL    4
 2200    HA   HIS  15           HA       HIS  15   1.386  -1.724  10.122
  Start of MODEL    4
 2201    HB3  HIS  15           HB2      HIS  15   1.996  -4.131   9.555
  Start of MODEL    4
 2202    HB2  HIS  15           HB3      HIS  15   1.355  -3.815   7.952
  Start of MODEL    4
 2203    HD1  HIS  15           HD1      HIS  15   0.352  -4.768  11.312
  Start of MODEL    4
 2204    HD2  HIS  15           HD2      HIS  15  -1.472  -3.299   7.893
  Start of MODEL    4
 2205    HE1  HIS  15           HE1      HIS  15  -2.109  -5.194  11.623
  Start of MODEL    4
 2206    HE2  HIS  15           HE2      HIS  15  -3.047  -4.693   9.358
  Start of MODEL    4
 2207    H    HIS  15           HN       HIS  15   1.260  -1.295   7.238
  Start of MODEL    4
 2208    HA   THR  16           HA       THR  16   5.586  -1.025   9.856
  Start of MODEL    4
 2209    HB   THR  16           HB       THR  16   5.688  -3.488  11.571
  Start of MODEL    4
 2210    HG1  THR  16           HG1      THR  16   5.250  -1.221  12.994
  Start of MODEL    4
 2211   HG22  THR  16          HG21      THR  16   7.376  -2.157  12.762
  Start of MODEL    4
 2212   HG21  THR  16          HG22      THR  16   7.045  -0.798  11.690
  Start of MODEL    4
 2213   HG23  THR  16          HG23      THR  16   7.766  -2.266  11.041
  Start of MODEL    4
 2214    H    THR  16           HN       THR  16   3.384  -2.304  10.874
  Start of MODEL    4
 2215    HA   ALA  17           HA       ALA  17   6.748  -3.811   6.662
  Start of MODEL    4
 2216    HB3  ALA  17           HB1      ALA  17   8.985  -3.329   5.862
  Start of MODEL    4
 2217    HB2  ALA  17           HB2      ALA  17   9.356  -2.455   7.347
  Start of MODEL    4
 2218    HB1  ALA  17           HB3      ALA  17   8.165  -1.806   6.224
  Start of MODEL    4
 2219    H    ALA  17           HN       ALA  17   7.183  -1.720   8.490
  Start of MODEL    4
 2220    HA   VAL  18           HA       VAL  18   8.426  -6.849   9.161
  Start of MODEL    4
 2221    HB   VAL  18           HB       VAL  18   8.103  -9.142   8.195
  Start of MODEL    4
 2222    H    VAL  18           HN       VAL  18   7.639  -5.850   6.556
  Start of MODEL    4
 2223    HA   GLU  19           HA       GLU  19  12.458  -6.741   8.061
  Start of MODEL    4
 2224    HB3  GLU  19           HB2      GLU  19  13.839  -7.259  10.040
  Start of MODEL    4
 2225    HB2  GLU  19           HB3      GLU  19  12.413  -7.921  10.830
  Start of MODEL    4
 2226    HG2  GLU  19           HG2      GLU  19  12.787  -5.080   9.904
  Start of MODEL    4
 2227    HG3  GLU  19           HG3      GLU  19  11.319  -5.725  10.626
  Start of MODEL    4
 2228    H    GLU  19           HN       GLU  19  10.293  -7.633   9.685
  Start of MODEL    4
 2229    HA   MET  20           HA       MET  20  14.209 -10.327   6.783
  Start of MODEL    4
 2230    HB3  MET  20           HB2      MET  20  12.052 -11.473   6.821
  Start of MODEL    4
 2231    HB2  MET  20           HB3      MET  20  12.849 -11.817   5.301
  Start of MODEL    4
 2232    HG2  MET  20           HG2      MET  20  10.606  -9.859   5.700
  Start of MODEL    4
 2233    HG3  MET  20           HG3      MET  20  11.419 -10.192   4.171
  Start of MODEL    4
 2234    HE2  MET  20           HE1      MET  20   7.886 -11.927   3.725
  Start of MODEL    4
 2235    HE1  MET  20           HE2      MET  20   8.990 -10.713   3.077
  Start of MODEL    4
 2236    HE3  MET  20           HE3      MET  20   8.201 -10.450   4.628
  Start of MODEL    4
 2237    H    MET  20           HN       MET  20  12.572  -8.050   6.399
  Start of MODEL    4
 2238    HA   HIS  21           HA       HIS  21  15.686  -8.603   3.214
  Start of MODEL    4
 2239    HB3  HIS  21           HB2      HIS  21  15.568 -11.200   1.661
  Start of MODEL    4
 2240    HB2  HIS  21           HB3      HIS  21  16.827 -10.813   2.829
  Start of MODEL    4
 2241    HD1  HIS  21           HD1      HIS  21  16.372 -10.834  -0.658
  Start of MODEL    4
 2242    HD2  HIS  21           HD2      HIS  21  18.036  -8.092   1.986
  Start of MODEL    4
 2243    HE1  HIS  21           HE1      HIS  21  17.879  -9.403  -2.039
  Start of MODEL    4
 2244    HE2  HIS  21           HE2      HIS  21  18.896  -7.751  -0.421
  Start of MODEL    4
 2245    H    HIS  21           HN       HIS  21  14.611 -11.071   4.169
  Start of MODEL    4
 2246    HA   HIS  22           HA       HIS  22  12.136  -8.630   0.323
  Start of MODEL    4
 2247    HB3  HIS  22           HB2      HIS  22   9.996  -9.876   0.251
  Start of MODEL    4
 2248    HB2  HIS  22           HB3      HIS  22  10.465 -10.768   1.690
  Start of MODEL    4
 2249    HD1  HIS  22           HD1      HIS  22  11.865 -10.341  -1.829
  Start of MODEL    4
 2250    HD2  HIS  22           HD2      HIS  22  11.446 -13.173   1.164
  Start of MODEL    4
 2251    HE1  HIS  22           HE1      HIS  22  12.777 -12.468  -2.776
  Start of MODEL    4
 2252    HE2  HIS  22           HE2      HIS  22  12.331 -14.192  -1.024
  Start of MODEL    4
 2253    H    HIS  22           HN       HIS  22  12.854 -10.406   2.521
  Start of MODEL    4
 2254    HA   TRP  23           HA       TRP  23  10.506  -6.318   3.671
  Start of MODEL    4
 2255    HB3  TRP  23           HB2      TRP  23  10.741  -3.861   3.254
  Start of MODEL    4
 2256    HB2  TRP  23           HB3      TRP  23  11.447  -4.262   1.685
  Start of MODEL    4
 2257    HD1  TRP  23           HD1      TRP  23  13.906  -5.084   1.618
  Start of MODEL    4
 2258    HE1  TRP  23           HE1      TRP  23  15.798  -5.219   3.402
  Start of MODEL    4
 2259    HE3  TRP  23           HE3      TRP  23  11.149  -4.208   5.806
  Start of MODEL    4
 2260    HZ2  TRP  23           HZ2      TRP  23  16.061  -4.940   6.183
  Start of MODEL    4
 2261    HZ3  TRP  23           HZ3      TRP  23  12.278  -4.137   7.985
  Start of MODEL    4
 2262    HH2  TRP  23           HH2      TRP  23  14.687  -4.502   8.173
  Start of MODEL    4
 2263    H    TRP  23           HN       TRP  23  11.767  -6.600   1.111
  Start of MODEL    4
 2264    HA   CYS  24           HA       CYS  24   6.680  -5.943   1.662
  Start of MODEL    4
 2265    HB3  CYS  24           HB2      CYS  24   6.500  -8.125   3.761
  Start of MODEL    4
 2266    HB2  CYS  24           HB3      CYS  24   6.765  -8.364   2.043
  Start of MODEL    4
 2267    H    CYS  24           HN       CYS  24   8.574  -6.886   3.668
  Start of MODEL    4
 2268    HA   ILE  25           HA       ILE  25   4.996  -3.628   5.020
  Start of MODEL    4
 2269    HB   ILE  25           HB       ILE  25   4.584  -1.881   2.566
  Start of MODEL    4
 2270   HD13  ILE  25          HD11      ILE  25   6.449  -0.111   2.156
  Start of MODEL    4
 2271   HD12  ILE  25          HD12      ILE  25   7.829  -0.070   3.251
  Start of MODEL    4
 2272   HD11  ILE  25          HD13      ILE  25   6.243   0.473   3.806
  Start of MODEL    4
 2273    H    ILE  25           HN       ILE  25   5.501  -4.245   2.193
  Start of MODEL    4
 2274    HA   PRO  26           HA       PRO  26   1.056  -5.469   3.640
  Start of MODEL    4
 2275    HB3  PRO  26           HB2      PRO  26   0.694  -6.997   5.274
  Start of MODEL    4
 2276    HB2  PRO  26           HB3      PRO  26   0.439  -5.728   6.474
  Start of MODEL    4
 2277    HG2  PRO  26           HG2      PRO  26   2.438  -6.506   7.304
  Start of MODEL    4
 2278    HG3  PRO  26           HG3      PRO  26   2.932  -7.169   5.738
  Start of MODEL    4
 2279    HD2  PRO  26           HD2      PRO  26   3.146  -4.362   6.761
  Start of MODEL    4
 2280    HD3  PRO  26           HD3      PRO  26   4.298  -5.321   5.803
  Start of MODEL    4
 2281    HA   PHE  27           HA       PHE  27  -1.629  -2.391   5.147
  Start of MODEL    4
 2282    HB3  PHE  27           HB2      PHE  27  -0.600  -1.200   3.217
  Start of MODEL    4
 2283    HB2  PHE  27           HB3      PHE  27  -2.290  -0.802   3.438
  Start of MODEL    4
 2284    HD1  PHE  27           HD1      PHE  27  -3.994  -1.446   1.766
  Start of MODEL    4
 2285    HD2  PHE  27           HD2      PHE  27   0.152  -2.345   1.236
  Start of MODEL    4
 2286    HE1  PHE  27           HE1      PHE  27  -4.390  -1.872  -0.597
  Start of MODEL    4
 2287    HE2  PHE  27           HE2      PHE  27  -0.264  -2.771  -1.146
  Start of MODEL    4
 2288    HZ   PHE  27           HZ       PHE  27  -2.534  -2.534  -2.065
  Start of MODEL    4
 2289    H    PHE  27           HN       PHE  27  -0.766  -4.380   3.210
  Start of MODEL    4
 2290    HA   SER  28           HA       SER  28  -5.494  -3.906   3.803
  Start of MODEL    4
 2291    HB3  SER  28           HB2      SER  28  -6.679  -4.519   5.811
  Start of MODEL    4
 2292    HB2  SER  28           HB3      SER  28  -5.679  -3.434   6.778
  Start of MODEL    4
 2293    HG   SER  28           HG       SER  28  -4.198  -5.182   5.326
  Start of MODEL    4
 2294    H    SER  28           HN       SER  28  -3.792  -2.089   5.308
  Start of MODEL    4
 2295    HA   VAL  29           HA       VAL  29  -7.753  -0.270   4.237
  Start of MODEL    4
 2296    HB   VAL  29           HB       VAL  29  -6.554   0.637   2.307
  Start of MODEL    4
 2297    H    VAL  29           HN       VAL  29  -6.762  -2.550   2.750
  Start of MODEL    4
 2298    HA   ASP  30           HA       ASP  30 -11.480  -2.398   3.676
  Start of MODEL    4
 2299    HB3  ASP  30           HB2      ASP  30 -11.621  -0.940   6.334
  Start of MODEL    4
 2300    HB2  ASP  30           HB3      ASP  30 -11.179  -2.624   6.097
  Start of MODEL    4
 2301    H    ASP  30           HN       ASP  30  -9.713  -0.347   4.829
  Start of MODEL    4
 2302    HA2  GLY  31           HA2      GLY  31 -14.858   0.274   2.943
  Start of MODEL    4
 2303    H    GLY  31           HN       GLY  31 -13.166  -1.830   2.610
  Start of MODEL    4
 2304    HA3  GLY  31           HA1      GLY  31 -13.591   0.872   1.871
  Start of MODEL    4
 2305    HA   GLN  32           HA       GLN  32 -16.212  -2.275  -0.239
  Start of MODEL    4
 2306    HB3  GLN  32           HB2      GLN  32 -18.719  -0.673   0.348
  Start of MODEL    4
 2307    HB2  GLN  32           HB3      GLN  32 -18.239  -2.134   1.196
  Start of MODEL    4
 2308    HG2  GLN  32           HG2      GLN  32 -18.851  -1.986  -1.740
  Start of MODEL    4
 2309    HG3  GLN  32           HG3      GLN  32 -18.474  -3.436  -0.812
  Start of MODEL    4
 2310   HE21  GLN  32          HE21      GLN  32 -20.780  -0.993  -1.449
  Start of MODEL    4
 2311   HE22  GLN  32          HE22      GLN  32 -22.121  -1.718  -0.650
  Start of MODEL    4
 2312    H    GLN  32           HN       GLN  32 -16.519  -0.118   1.641
  Start of MODEL    4
 2313    HA   PRO  33           HA       PRO  33 -16.916   1.246  -3.498
  Start of MODEL    4
 2314    HB3  PRO  33           HB2      PRO  33 -18.042   3.165  -2.809
  Start of MODEL    4
 2315    HB2  PRO  33           HB3      PRO  33 -16.424   3.781  -2.462
  Start of MODEL    4
 2316    HG2  PRO  33           HG2      PRO  33 -16.580   3.310  -0.211
  Start of MODEL    4
 2317    HG3  PRO  33           HG3      PRO  33 -18.295   3.601  -0.550
  Start of MODEL    4
 2318    HD2  PRO  33           HD2      PRO  33 -17.448   1.317   0.562
  Start of MODEL    4
 2319    HD3  PRO  33           HD3      PRO  33 -18.796   1.348  -0.593
  Start of MODEL    4
 2320    HA   ALA  34           HA       ALA  34 -12.677   0.603  -2.884
  Start of MODEL    4
 2321    HB1  ALA  34           HB1      ALA  34 -13.242  -0.677  -4.875
  Start of MODEL    4
 2322    HB3  ALA  34           HB2      ALA  34 -11.620   0.027  -4.976
  Start of MODEL    4
 2323    HB2  ALA  34           HB3      ALA  34 -12.965   0.749  -5.873
  Start of MODEL    4
 2324    H    ALA  34           HN       ALA  34 -15.009   1.018  -4.434
  Start of MODEL    4
 2325    HA   PRO  35           HA       PRO  35 -11.481   4.949  -3.133
  Start of MODEL    4
 2326    HB3  PRO  35           HB2      PRO  35 -11.232   4.769  -0.822
  Start of MODEL    4
 2327    HB2  PRO  35           HB3      PRO  35  -9.542   4.867  -1.325
  Start of MODEL    4
 2328    HG2  PRO  35           HG2      PRO  35  -9.273   2.536  -1.203
  Start of MODEL    4
 2329    HG3  PRO  35           HG3      PRO  35 -10.349   2.831   0.173
  Start of MODEL    4
 2330    HD2  PRO  35           HD2      PRO  35 -10.986   1.087  -1.769
  Start of MODEL    4
 2331    HD3  PRO  35           HD3      PRO  35 -12.220   2.077  -0.970
  Start of MODEL    4
 2332    HA   SER  36           HA       SER  36  -8.039   4.452  -5.768
  Start of MODEL    4
 2333    HB3  SER  36           HB2      SER  36  -7.409   6.597  -6.672
  Start of MODEL    4
 2334    HB2  SER  36           HB3      SER  36  -8.057   7.433  -5.259
  Start of MODEL    4
 2335    HG   SER  36           HG       SER  36  -9.480   5.993  -7.250
  Start of MODEL    4
 2336    H    SER  36           HN       SER  36  -9.787   6.007  -4.131
  Start of MODEL    4
 2337    HA   LEU  37           HA       LEU  37  -5.062   4.648  -2.464
  Start of MODEL    4
 2338    HB3  LEU  37           HB2      LEU  37  -3.692   2.612  -2.499
  Start of MODEL    4
 2339    HB2  LEU  37           HB3      LEU  37  -4.444   2.125  -4.000
  Start of MODEL    4
 2340    HG   LEU  37           HG       LEU  37  -6.629   1.963  -2.786
  Start of MODEL    4
 2341   HD11  LEU  37          HD11      LEU  37  -5.119   0.043  -3.192
  Start of MODEL    4
 2342   HD13  LEU  37          HD12      LEU  37  -6.108  -0.137  -1.753
  Start of MODEL    4
 2343   HD12  LEU  37          HD13      LEU  37  -4.406   0.297  -1.596
  Start of MODEL    4
 2344   HD21  LEU  37          HD21      LEU  37  -6.149   3.484  -0.950
  Start of MODEL    4
 2345   HD23  LEU  37          HD22      LEU  37  -4.848   2.437  -0.401
  Start of MODEL    4
 2346   HD22  LEU  37          HD23      LEU  37  -6.514   1.884  -0.296
  Start of MODEL    4
 2347    H    LEU  37           HN       LEU  37  -6.310   3.506  -4.818
  Start of MODEL    4
 2348    HA   ARG  38           HA       ARG  38  -1.435   5.540  -4.702
  Start of MODEL    4
 2349    HB3  ARG  38           HB2      ARG  38  -2.611   8.189  -3.824
  Start of MODEL    4
 2350    HB2  ARG  38           HB3      ARG  38  -2.665   7.468  -5.417
  Start of MODEL    4
 2351    HG2  ARG  38           HG2      ARG  38  -1.088   9.281  -5.419
  Start of MODEL    4
 2352    HG3  ARG  38           HG3      ARG  38  -0.241   8.601  -4.036
  Start of MODEL    4
 2353    HD2  ARG  38           HD2      ARG  38   0.946   8.166  -6.140
  Start of MODEL    4
 2354    HD3  ARG  38           HD3      ARG  38   0.449   6.691  -5.341
  Start of MODEL    4
 2355    HE   ARG  38           HE       ARG  38  -1.429   7.649  -7.260
  Start of MODEL    4
 2356   HH11  ARG  38          HH11      ARG  38   1.612   5.793  -6.981
  Start of MODEL    4
 2357   HH12  ARG  38          HH12      ARG  38   1.253   4.713  -8.205
  Start of MODEL    4
 2358   HH21  ARG  38          HH21      ARG  38  -1.904   6.168  -9.038
  Start of MODEL    4
 2359   HH22  ARG  38          HH22      ARG  38  -0.784   4.947  -9.436
  Start of MODEL    4
 2360    H    ARG  38           HN       ARG  38  -3.367   5.911  -2.557
  Start of MODEL    4
 2361    HA   TRP  39           HA       TRP  39   1.131   5.850  -1.206
  Start of MODEL    4
 2362    HB3  TRP  39           HB2      TRP  39   3.344   4.878  -1.794
  Start of MODEL    4
 2363    HB2  TRP  39           HB3      TRP  39   2.775   4.703  -3.448
  Start of MODEL    4
 2364    HD1  TRP  39           HD1      TRP  39   1.180   2.717  -4.016
  Start of MODEL    4
 2365    HE1  TRP  39           HE1      TRP  39   0.518   0.604  -2.735
  Start of MODEL    4
 2366    HE3  TRP  39           HE3      TRP  39   2.845   4.057   0.617
  Start of MODEL    4
 2367    HZ2  TRP  39           HZ2      TRP  39   0.676  -0.377  -0.087
  Start of MODEL    4
 2368    HZ3  TRP  39           HZ3      TRP  39   2.555   2.471   2.475
  Start of MODEL    4
 2369    HH2  TRP  39           HH2      TRP  39   1.498   0.302   2.125
  Start of MODEL    4
 2370    H    TRP  39           HN       TRP  39   0.561   5.375  -3.997
  Start of MODEL    4
 2371    HA   LEU  40           HA       LEU  40   3.497   9.306  -2.481
  Start of MODEL    4
 2372    HB3  LEU  40           HB2      LEU  40   2.818   9.867   0.412
  Start of MODEL    4
 2373    HB2  LEU  40           HB3      LEU  40   1.714  10.227  -0.908
  Start of MODEL    4
 2374    HG   LEU  40           HG       LEU  40   4.445  11.449  -0.733
  Start of MODEL    4
 2375   HD13  LEU  40          HD11      LEU  40   3.482  11.434  -2.924
  Start of MODEL    4
 2376   HD12  LEU  40          HD12      LEU  40   3.441  13.076  -2.270
  Start of MODEL    4
 2377   HD11  LEU  40          HD13      LEU  40   1.972  12.088  -2.296
  Start of MODEL    4
 2378   HD23  LEU  40          HD21      LEU  40   1.810  12.555   0.243
  Start of MODEL    4
 2379   HD22  LEU  40          HD22      LEU  40   3.333  13.441   0.154
  Start of MODEL    4
 2380   HD21  LEU  40          HD23      LEU  40   3.169  12.077   1.259
  Start of MODEL    4
 2381    H    LEU  40           HN       LEU  40   2.156   7.565  -0.541
  Start of MODEL    4
 2382    HA   PHE  41           HA       PHE  41   6.937   7.795  -0.239
  Start of MODEL    4
 2383    HB3  PHE  41           HB2      PHE  41   7.423   7.828  -3.207
  Start of MODEL    4
 2384    HB2  PHE  41           HB3      PHE  41   7.090   6.448  -2.169
  Start of MODEL    4
 2385    HD1  PHE  41           HD1      PHE  41   9.549   8.020  -3.993
  Start of MODEL    4
 2386    HD2  PHE  41           HD2      PHE  41   8.938   6.144  -0.226
  Start of MODEL    4
 2387    HE1  PHE  41           HE1      PHE  41  11.958   7.590  -3.825
  Start of MODEL    4
 2388    HE2  PHE  41           HE2      PHE  41  11.352   5.705  -0.056
  Start of MODEL    4
 2389    HZ   PHE  41           HZ       PHE  41  12.862   6.431  -1.857
  Start of MODEL    4
 2390    H    PHE  41           HN       PHE  41   5.660   9.328  -2.379
  Start of MODEL    4
 2391    HA   ASN  42           HA       ASN  42   9.100  10.875   1.821
  Start of MODEL    4
 2392    HB3  ASN  42           HB2      ASN  42  10.742  10.390  -0.681
  Start of MODEL    4
 2393    HB2  ASN  42           HB3      ASN  42  10.828   9.400   0.766
  Start of MODEL    4
 2394   HD21  ASN  42          HD21      ASN  42  12.918  10.810  -0.462
  Start of MODEL    4
 2395   HD22  ASN  42          HD22      ASN  42  13.544  11.939   0.680
  Start of MODEL    4
 2396    H    ASN  42           HN       ASN  42   7.876   9.161   1.005
  Start of MODEL    4
 2397    HA2  GLY  43           HA2      GLY  43   5.973  13.865   0.320
  Start of MODEL    4
 2398    H    GLY  43           HN       GLY  43   6.969  11.874   0.873
  Start of MODEL    4
 2399    HA3  GLY  43           HA1      GLY  43   7.583  14.549   0.190
  Start of MODEL    4
 2400    HA   SER  44           HA       SER  44   6.612  13.619  -4.167
  Start of MODEL    4
 2401    HB3  SER  44           HB2      SER  44   8.746  11.467  -4.077
  Start of MODEL    4
 2402    HB2  SER  44           HB3      SER  44   9.100  13.178  -3.848
  Start of MODEL    4
 2403    HG   SER  44           HG       SER  44   9.033  11.951  -6.096
  Start of MODEL    4
 2404    H    SER  44           HN       SER  44   7.352  11.917  -1.874
  Start of MODEL    4
 2405    HA   VAL  45           HA       VAL  45   3.887  10.607  -5.207
  Start of MODEL    4
 2406    HB   VAL  45           HB       VAL  45   4.787  11.650  -7.909
  Start of MODEL    4
 2407    H    VAL  45           HN       VAL  45   5.975  12.393  -5.975
  Start of MODEL    4
 2408    HA   LEU  46           HA       LEU  46   6.463   7.231  -6.179
  Start of MODEL    4
 2409    HB3  LEU  46           HB2      LEU  46   4.282   6.027  -4.479
  Start of MODEL    4
 2410    HB2  LEU  46           HB3      LEU  46   5.882   6.486  -3.935
  Start of MODEL    4
 2411    HG   LEU  46           HG       LEU  46   5.269   4.230  -5.915
  Start of MODEL    4
 2412   HD13  LEU  46          HD11      LEU  46   7.421   5.255  -6.378
  Start of MODEL    4
 2413   HD12  LEU  46          HD12      LEU  46   7.626   3.649  -5.677
  Start of MODEL    4
 2414   HD11  LEU  46          HD13      LEU  46   7.889   5.084  -4.687
  Start of MODEL    4
 2415   HD21  LEU  46          HD21      LEU  46   4.585   3.678  -3.628
  Start of MODEL    4
 2416   HD23  LEU  46          HD22      LEU  46   6.177   4.143  -3.034
  Start of MODEL    4
 2417   HD22  LEU  46          HD23      LEU  46   6.010   2.756  -4.108
  Start of MODEL    4
 2418    H    LEU  46           HN       LEU  46   4.192   8.472  -4.942
  Start of MODEL    4
 2419    HA   ASN  47           HA       ASN  47   3.873   5.896  -9.339
  Start of MODEL    4
 2420    HB3  ASN  47           HB2      ASN  47   6.436   6.971 -10.584
  Start of MODEL    4
 2421    HB2  ASN  47           HB3      ASN  47   4.815   7.615 -10.760
  Start of MODEL    4
 2422   HD21  ASN  47          HD21      ASN  47   3.405   6.690 -12.268
  Start of MODEL    4
 2423   HD22  ASN  47          HD22      ASN  47   3.961   5.553 -13.439
  Start of MODEL    4
 2424    H    ASN  47           HN       ASN  47   6.140   7.252  -8.282
  Start of MODEL    4
 2425    HA   GLU  48           HA       GLU  48   6.181   2.544  -7.637
  Start of MODEL    4
 2426    HB3  GLU  48           HB2      GLU  48   4.108   1.967  -6.689
  Start of MODEL    4
 2427    HB2  GLU  48           HB3      GLU  48   4.726   0.524  -7.473
  Start of MODEL    4
 2428    HG2  GLU  48           HG2      GLU  48   3.361   1.373  -9.431
  Start of MODEL    4
 2429    HG3  GLU  48           HG3      GLU  48   2.600   0.425  -8.123
  Start of MODEL    4
 2430    H    GLU  48           HN       GLU  48   3.922   3.825  -8.623
  Start of MODEL    4
 2431    HA   THR  49           HA       THR  49   7.768   0.896 -11.288
  Start of MODEL    4
 2432    HB   THR  49           HB       THR  49  10.231   0.772 -10.846
  Start of MODEL    4
 2433    HG1  THR  49           HG1      THR  49  10.676   1.769  -8.636
  Start of MODEL    4
 2434   HG23  THR  49          HG21      THR  49   9.116   2.896 -11.466
  Start of MODEL    4
 2435   HG22  THR  49          HG22      THR  49  10.516   3.151 -10.426
  Start of MODEL    4
 2436   HG21  THR  49          HG23      THR  49   8.888   3.246  -9.751
  Start of MODEL    4
 2437    H    THR  49           HN       THR  49   7.650   1.257  -8.389
  Start of MODEL    4
 2438    HA   SER  50           HA       SER  50   8.578  -3.414 -10.546
  Start of MODEL    4
 2439    HB3  SER  50           HB2      SER  50  10.271  -4.477 -11.909
  Start of MODEL    4
 2440    HB2  SER  50           HB3      SER  50  11.186  -2.969 -12.016
  Start of MODEL    4
 2441    HG   SER  50           HG       SER  50   8.599  -2.681 -12.829
  Start of MODEL    4
 2442    H    SER  50           HN       SER  50   9.786  -0.975 -11.482
  Start of MODEL    4
 2443    HA   PHE  51           HA       PHE  51  12.305  -2.952  -7.769
  Start of MODEL    4
 2444    HB3  PHE  51           HB2      PHE  51  13.402  -0.904  -6.925
  Start of MODEL    4
 2445    HB2  PHE  51           HB3      PHE  51  12.260   0.080  -7.831
  Start of MODEL    4
 2446    HD1  PHE  51           HD1      PHE  51  14.991  -2.402  -8.210
  Start of MODEL    4
 2447    HD2  PHE  51           HD2      PHE  51  12.637   0.611 -10.079
  Start of MODEL    4
 2448    HE1  PHE  51           HE1      PHE  51  16.486  -2.438 -10.168
  Start of MODEL    4
 2449    HE2  PHE  51           HE2      PHE  51  14.116   0.570 -12.028
  Start of MODEL    4
 2450    HZ   PHE  51           HZ       PHE  51  16.061  -0.997 -12.064
  Start of MODEL    4
 2451    H    PHE  51           HN       PHE  51  10.703  -1.129  -9.355
  Start of MODEL    4
 2452    HA   ILE  52           HA       ILE  52   9.141  -1.628  -4.735
  Start of MODEL    4
 2453    HB   ILE  52           HB       ILE  52   8.589   1.192  -5.716
  Start of MODEL    4
 2454   HD13  ILE  52          HD11      ILE  52  10.259   3.004  -5.199
  Start of MODEL    4
 2455   HD12  ILE  52          HD12      ILE  52  11.604   2.666  -4.108
  Start of MODEL    4
 2456   HD11  ILE  52          HD13      ILE  52   9.947   2.692  -3.490
  Start of MODEL    4
 2457    H    ILE  52           HN       ILE  52   9.749  -0.559  -7.422
  Start of MODEL    4
 2458    HA   PHE  53           HA       PHE  53   5.294  -1.522  -6.784
  Start of MODEL    4
 2459    HB3  PHE  53           HB2      PHE  53   6.228  -2.937  -8.436
  Start of MODEL    4
 2460    HB2  PHE  53           HB3      PHE  53   4.688  -3.641  -7.977
  Start of MODEL    4
 2461    HD1  PHE  53           HD1      PHE  53   8.224  -4.168  -8.236
  Start of MODEL    4
 2462    HD2  PHE  53           HD2      PHE  53   4.626  -5.684  -6.565
  Start of MODEL    4
 2463    HE1  PHE  53           HE1      PHE  53   9.290  -6.358  -7.937
  Start of MODEL    4
 2464    HE2  PHE  53           HE2      PHE  53   5.697  -7.875  -6.245
  Start of MODEL    4
 2465    HZ   PHE  53           HZ       PHE  53   8.031  -8.213  -6.937
  Start of MODEL    4
 2466    H    PHE  53           HN       PHE  53   7.307  -2.886  -5.202
  Start of MODEL    4
 2467    HA   THR  54           HA       THR  54   2.638  -2.941  -3.814
  Start of MODEL    4
 2468    HB   THR  54           HB       THR  54   0.700  -1.860  -5.874
  Start of MODEL    4
 2469    HG1  THR  54           HG1      THR  54   1.281   0.149  -5.260
  Start of MODEL    4
 2470   HG21  THR  54          HG21      THR  54   0.703  -1.848  -2.854
  Start of MODEL    4
 2471   HG23  THR  54          HG22      THR  54  -0.279  -2.900  -3.873
  Start of MODEL    4
 2472   HG22  THR  54          HG23      THR  54  -0.551  -1.157  -3.886
  Start of MODEL    4
 2473    H    THR  54           HN       THR  54   3.185  -2.127  -6.534
  Start of MODEL    4
 2474    HA   GLU  55           HA       GLU  55   1.178  -6.735  -5.613
  Start of MODEL    4
 2475    HB3  GLU  55           HB2      GLU  55   1.587  -8.503  -3.830
  Start of MODEL    4
 2476    HB2  GLU  55           HB3      GLU  55   2.357  -7.244  -2.877
  Start of MODEL    4
 2477    HG2  GLU  55           HG2      GLU  55   3.855  -6.889  -4.917
  Start of MODEL    4
 2478    HG3  GLU  55           HG3      GLU  55   4.129  -8.310  -3.909
  Start of MODEL    4
 2479    H    GLU  55           HN       GLU  55   2.344  -5.047  -3.558
  Start of MODEL    4
 2480    HA   PHE  56           HA       PHE  56  -2.499  -6.182  -3.314
  Start of MODEL    4
 2481    HB3  PHE  56           HB2      PHE  56  -4.477  -6.375  -4.932
  Start of MODEL    4
 2482    HB2  PHE  56           HB3      PHE  56  -3.281  -6.410  -6.215
  Start of MODEL    4
 2483    HD1  PHE  56           HD1      PHE  56  -4.974  -4.333  -3.761
  Start of MODEL    4
 2484    HD2  PHE  56           HD2      PHE  56  -1.887  -4.482  -6.680
  Start of MODEL    4
 2485    HE1  PHE  56           HE1      PHE  56  -4.878  -1.874  -3.782
  Start of MODEL    4
 2486    HE2  PHE  56           HE2      PHE  56  -1.785  -2.038  -6.714
  Start of MODEL    4
 2487    HZ   PHE  56           HZ       PHE  56  -3.375  -0.718  -5.214
  Start of MODEL    4
 2488    H    PHE  56           HN       PHE  56  -0.984  -6.738  -5.706
  Start of MODEL    4
 2489    HA   LEU  57           HA       LEU  57  -3.507 -10.351  -3.030
  Start of MODEL    4
 2490    HB3  LEU  57           HB2      LEU  57  -4.632 -10.418  -0.614
  Start of MODEL    4
 2491    HB2  LEU  57           HB3      LEU  57  -3.808  -8.864  -0.513
  Start of MODEL    4
 2492    HG   LEU  57           HG       LEU  57  -1.686 -10.052  -1.112
  Start of MODEL    4
 2493   HD11  LEU  57          HD11      LEU  57  -3.170 -10.931   1.378
  Start of MODEL    4
 2494   HD13  LEU  57          HD12      LEU  57  -2.278  -9.422   1.206
  Start of MODEL    4
 2495   HD12  LEU  57          HD13      LEU  57  -1.419 -10.965   1.168
  Start of MODEL    4
 2496   HD23  LEU  57          HD21      LEU  57  -3.461 -12.401  -0.572
  Start of MODEL    4
 2497   HD22  LEU  57          HD22      LEU  57  -1.703 -12.499  -0.770
  Start of MODEL    4
 2498   HD21  LEU  57          HD23      LEU  57  -2.739 -12.022  -2.127
  Start of MODEL    4
 2499    H    LEU  57           HN       LEU  57  -3.748  -7.550  -2.305
  Start of MODEL    4
 2500    HA   GLU  58           HA       GLU  58  -7.479 -10.340  -4.459
  Start of MODEL    4
 2501    HB3  GLU  58           HB2      GLU  58  -8.128 -12.705  -4.848
  Start of MODEL    4
 2502    HB2  GLU  58           HB3      GLU  58  -6.735 -13.163  -3.852
  Start of MODEL    4
 2503    HG2  GLU  58           HG2      GLU  58  -5.201 -12.209  -5.418
  Start of MODEL    4
 2504    HG3  GLU  58           HG3      GLU  58  -6.273 -13.340  -6.246
  Start of MODEL    4
 2505    H    GLU  58           HN       GLU  58  -5.178 -11.520  -3.411
  Start of MODEL    4
 2506    HA   PRO  59           HA       PRO  59  -9.847 -10.686  -0.580
  Start of MODEL    4
 2507    HB3  PRO  59           HB2      PRO  59 -10.291  -8.456  -0.416
  Start of MODEL    4
 2508    HB2  PRO  59           HB3      PRO  59 -11.641  -8.717  -1.517
  Start of MODEL    4
 2509    HG2  PRO  59           HG2      PRO  59 -10.523  -7.437  -3.022
  Start of MODEL    4
 2510    HG3  PRO  59           HG3      PRO  59  -9.054  -7.475  -2.038
  Start of MODEL    4
 2511    HD2  PRO  59           HD2      PRO  59  -9.901  -9.311  -4.234
  Start of MODEL    4
 2512    HD3  PRO  59           HD3      PRO  59  -8.283  -8.767  -3.731
  Start of MODEL    4
 2513    HA   ALA  60           HA       ALA  60 -13.100 -12.890  -2.444
  Start of MODEL    4
 2514    HB1  ALA  60           HB1      ALA  60 -14.027 -12.794   0.426
  Start of MODEL    4
 2515    HB3  ALA  60           HB2      ALA  60 -12.942 -14.004  -0.260
  Start of MODEL    4
 2516    HB2  ALA  60           HB3      ALA  60 -14.610 -13.901  -0.820
  Start of MODEL    4
 2517    H    ALA  60           HN       ALA  60 -11.965 -11.537  -0.191
  Start of MODEL    4
 2518    HA   ALA  61           HA       ALA  61 -16.060 -10.113  -3.469
  Start of MODEL    4
 2519    HB3  ALA  61           HB1      ALA  61 -18.256 -10.850  -4.207
  Start of MODEL    4
 2520    HB2  ALA  61           HB2      ALA  61 -18.106 -12.318  -3.247
  Start of MODEL    4
 2521    HB1  ALA  61           HB3      ALA  61 -17.038 -12.054  -4.624
  Start of MODEL    4
 2522    H    ALA  61           HN       ALA  61 -15.646 -12.770  -2.588
  Start of MODEL    4
 2523    HA   ASN  62           HA       ASN  62 -19.078  -9.809   0.039
  Start of MODEL    4
 2524    HB3  ASN  62           HB2      ASN  62 -19.604 -11.250   2.007
  Start of MODEL    4
 2525    HB2  ASN  62           HB3      ASN  62 -18.402 -12.394   1.432
  Start of MODEL    4
 2526   HD21  ASN  62          HD21      ASN  62 -19.872 -14.024   1.087
  Start of MODEL    4
 2527   HD22  ASN  62          HD22      ASN  62 -21.036 -13.965  -0.188
  Start of MODEL    4
 2528    H    ASN  62           HN       ASN  62 -17.182 -11.871  -0.679
  Start of MODEL    4
 2529    HA   GLU  63           HA       GLU  63 -16.092  -8.688   3.149
  Start of MODEL    4
 2530    HB3  GLU  63           HB2      GLU  63 -14.419 -10.527   2.993
  Start of MODEL    4
 2531    HB2  GLU  63           HB3      GLU  63 -13.716  -8.991   3.465
  Start of MODEL    4
 2532    HG2  GLU  63           HG2      GLU  63 -13.612 -10.149   0.702
  Start of MODEL    4
 2533    HG3  GLU  63           HG3      GLU  63 -12.862  -8.650   1.240
  Start of MODEL    4
 2534    H    GLU  63           HN       GLU  63 -15.829  -9.942   0.515
  Start of MODEL    4
 2535    HA   THR  64           HA       THR  64 -14.943  -5.097   1.051
  Start of MODEL    4
 2536    HB   THR  64           HB       THR  64 -15.333  -3.194   2.680
  Start of MODEL    4
 2537    HG1  THR  64           HG1      THR  64 -14.797  -4.017   4.647
  Start of MODEL    4
 2538   HG22  THR  64          HG21      THR  64 -17.718  -3.742   2.932
  Start of MODEL    4
 2539   HG21  THR  64          HG22      THR  64 -17.364  -5.430   2.560
  Start of MODEL    4
 2540   HG23  THR  64          HG23      THR  64 -17.125  -4.188   1.331
  Start of MODEL    4
 2541    H    THR  64           HN       THR  64 -14.883  -6.681   3.501
  Start of MODEL    4
 2542    HA   VAL  65           HA       VAL  65 -10.952  -4.313   2.958
  Start of MODEL    4
 2543    HB   VAL  65           HB       VAL  65 -10.287  -7.155   3.707
  Start of MODEL    4
 2544    H    VAL  65           HN       VAL  65 -12.678  -6.628   2.475
  Start of MODEL    4
 2545    HA   ARG  66           HA       ARG  66  -8.845  -5.781  -0.528
  Start of MODEL    4
 2546    HB3  ARG  66           HB2      ARG  66  -7.846  -3.834  -1.669
  Start of MODEL    4
 2547    HB2  ARG  66           HB3      ARG  66  -8.225  -2.827  -0.284
  Start of MODEL    4
 2548    HG2  ARG  66           HG2      ARG  66 -10.159  -4.121  -2.203
  Start of MODEL    4
 2549    HG3  ARG  66           HG3      ARG  66 -10.656  -3.344  -0.700
  Start of MODEL    4
 2550    HD2  ARG  66           HD2      ARG  66 -10.902  -1.834  -2.604
  Start of MODEL    4
 2551    HD3  ARG  66           HD3      ARG  66  -9.699  -1.236  -1.464
  Start of MODEL    4
 2552    HE   ARG  66           HE       ARG  66  -8.515  -2.780  -3.521
  Start of MODEL    4
 2553   HH11  ARG  66          HH11      ARG  66  -9.896   0.378  -2.935
  Start of MODEL    4
 2554   HH12  ARG  66          HH12      ARG  66  -8.969   1.196  -4.108
  Start of MODEL    4
 2555   HH21  ARG  66          HH21      ARG  66  -7.229  -1.672  -5.178
  Start of MODEL    4
 2556   HH22  ARG  66          HH22      ARG  66  -7.418   0.005  -5.386
  Start of MODEL    4
 2557    H    ARG  66           HN       ARG  66  -9.552  -3.851   1.551
  Start of MODEL    4
 2558    HA   HIS  67           HA       HIS  67  -5.296  -6.035   2.022
  Start of MODEL    4
 2559    HB3  HIS  67           HB2      HIS  67  -4.554  -8.329   2.162
  Start of MODEL    4
 2560    HB2  HIS  67           HB3      HIS  67  -5.349  -8.763   0.661
  Start of MODEL    4
 2561    HD1  HIS  67           HD1      HIS  67  -6.011  -8.319   4.279
  Start of MODEL    4
 2562    HD2  HIS  67           HD2      HIS  67  -8.040  -9.285   0.805
  Start of MODEL    4
 2563    HE1  HIS  67           HE1      HIS  67  -8.234  -9.211   5.029
  Start of MODEL    4
 2564    HE2  HIS  67           HE2      HIS  67  -9.534  -9.559   2.884
  Start of MODEL    4
 2565    H    HIS  67           HN       HIS  67  -7.050  -6.879  -0.193
  Start of MODEL    4
 2566    HA2  GLY  68           HA2      GLY  68  -1.918  -6.776  -0.786
  Start of MODEL    4
 2567    H    GLY  68           HN       GLY  68  -3.013  -5.932   1.665
  Start of MODEL    4
 2568    HA3  GLY  68           HA1      GLY  68  -2.196  -5.041  -0.780
  Start of MODEL    4
 2569    HA   CYS  69           HA       CYS  69   1.536  -4.923   1.372
  Start of MODEL    4
 2570    HB3  CYS  69           HB2      CYS  69   2.202  -7.381  -0.245
  Start of MODEL    4
 2571    HB2  CYS  69           HB3      CYS  69   1.879  -7.277   1.481
  Start of MODEL    4
 2572    H    CYS  69           HN       CYS  69   0.239  -5.739  -1.099
  Start of MODEL    4
 2573    HA   LEU  70           HA       LEU  70   3.717  -2.855  -1.824
  Start of MODEL    4
 2574    HB3  LEU  70           HB2      LEU  70   4.574  -1.393   0.689
  Start of MODEL    4
 2575    HB2  LEU  70           HB3      LEU  70   3.167  -0.950  -0.255
  Start of MODEL    4
 2576    HG   LEU  70           HG       LEU  70   6.000  -0.927  -1.294
  Start of MODEL    4
 2577   HD12  LEU  70          HD11      LEU  70   5.041   0.433  -3.095
  Start of MODEL    4
 2578   HD11  LEU  70          HD12      LEU  70   3.434   0.131  -2.438
  Start of MODEL    4
 2579   HD13  LEU  70          HD13      LEU  70   4.397  -1.211  -3.067
  Start of MODEL    4
 2580   HD22  LEU  70          HD21      LEU  70   5.838   1.499  -1.134
  Start of MODEL    4
 2581   HD21  LEU  70          HD22      LEU  70   5.747   0.733   0.451
  Start of MODEL    4
 2582   HD23  LEU  70          HD23      LEU  70   4.279   1.339  -0.331
  Start of MODEL    4
 2583    H    LEU  70           HN       LEU  70   2.966  -3.354   0.943
  Start of MODEL    4
 2584    HA   ARG  71           HA       ARG  71   7.213  -5.117  -0.628
  Start of MODEL    4
 2585    HB3  ARG  71           HB2      ARG  71   6.353  -6.056  -3.355
  Start of MODEL    4
 2586    HB2  ARG  71           HB3      ARG  71   6.003  -6.805  -1.803
  Start of MODEL    4
 2587    HG2  ARG  71           HG2      ARG  71   8.757  -6.525  -2.983
  Start of MODEL    4
 2588    HG3  ARG  71           HG3      ARG  71   8.321  -7.387  -1.509
  Start of MODEL    4
 2589    HD2  ARG  71           HD2      ARG  71   7.117  -9.027  -2.739
  Start of MODEL    4
 2590    HD3  ARG  71           HD3      ARG  71   7.232  -8.082  -4.228
  Start of MODEL    4
 2591    HE   ARG  71           HE       ARG  71   9.753  -8.748  -3.071
  Start of MODEL    4
 2592   HH11  ARG  71          HH11      ARG  71   7.204  -9.982  -5.194
  Start of MODEL    4
 2593   HH12  ARG  71          HH12      ARG  71   8.256 -10.898  -6.159
  Start of MODEL    4
 2594   HH21  ARG  71          HH21      ARG  71  11.217 -10.025  -4.428
  Start of MODEL    4
 2595   HH22  ARG  71          HH22      ARG  71  10.582 -10.956  -5.694
  Start of MODEL    4
 2596    H    ARG  71           HN       ARG  71   5.397  -3.930  -2.582
  Start of MODEL    4
 2597    HA   LEU  72           HA       LEU  72  10.240  -2.882  -2.826
  Start of MODEL    4
 2598    HB3  LEU  72           HB2      LEU  72  12.166  -2.574  -1.393
  Start of MODEL    4
 2599    HB2  LEU  72           HB3      LEU  72  11.579  -3.716  -0.224
  Start of MODEL    4
 2600    HG   LEU  72           HG       LEU  72   9.565  -2.082   0.030
  Start of MODEL    4
 2601   HD12  LEU  72          HD11      LEU  72  10.827  -0.558   1.474
  Start of MODEL    4
 2602   HD11  LEU  72          HD12      LEU  72  12.345  -1.204   0.811
  Start of MODEL    4
 2603   HD13  LEU  72          HD13      LEU  72  11.246  -2.249   1.721
  Start of MODEL    4
 2604   HD21  LEU  72          HD21      LEU  72   9.976  -0.905  -2.041
  Start of MODEL    4
 2605   HD23  LEU  72          HD22      LEU  72  11.519  -0.335  -1.393
  Start of MODEL    4
 2606   HD22  LEU  72          HD23      LEU  72  10.002   0.191  -0.653
  Start of MODEL    4
 2607    H    LEU  72           HN       LEU  72   9.163  -4.320  -0.568
  Start of MODEL    4
 2608    HA   ASN  73           HA       ASN  73  11.503  -6.846  -4.252
  Start of MODEL    4
 2609    HB3  ASN  73           HB2      ASN  73  11.652  -4.893  -6.561
  Start of MODEL    4
 2610    HB2  ASN  73           HB3      ASN  73  10.317  -5.972  -6.195
  Start of MODEL    4
 2611   HD21  ASN  73          HD21      ASN  73  11.787  -5.777  -8.614
  Start of MODEL    4
 2612   HD22  ASN  73          HD22      ASN  73  12.521  -7.298  -8.927
  Start of MODEL    4
 2613    H    ASN  73           HN       ASN  73  10.802  -4.072  -4.427
  Start of MODEL    4
 2614    HA   GLN  74           HA       GLN  74  15.724  -5.288  -4.465
  Start of MODEL    4
 2615    HB3  GLN  74           HB2      GLN  74  15.307  -2.887  -6.250
  Start of MODEL    4
 2616    HB2  GLN  74           HB3      GLN  74  15.578  -4.522  -6.839
  Start of MODEL    4
 2617    HG2  GLN  74           HG2      GLN  74  17.615  -3.186  -6.954
  Start of MODEL    4
 2618    HG3  GLN  74           HG3      GLN  74  17.510  -2.866  -5.223
  Start of MODEL    4
 2619   HE21  GLN  74          HE21      GLN  74  16.796  -5.961  -6.720
  Start of MODEL    4
 2620   HE22  GLN  74          HE22      GLN  74  18.127  -6.797  -6.026
  Start of MODEL    4
 2621    H    GLN  74           HN       GLN  74  13.253  -3.913  -5.188
  Start of MODEL    4
 2622    HA   PRO  75           HA       PRO  75  15.062  -2.287  -1.130
  Start of MODEL    4
 2623    HB3  PRO  75           HB2      PRO  75  15.598  -3.494   0.745
  Start of MODEL    4
 2624    HB2  PRO  75           HB3      PRO  75  17.231  -3.813   0.163
  Start of MODEL    4
 2625    HG2  PRO  75           HG2      PRO  75  16.344  -5.939  -0.081
  Start of MODEL    4
 2626    HG3  PRO  75           HG3      PRO  75  14.704  -5.319  -0.359
  Start of MODEL    4
 2627    HD2  PRO  75           HD2      PRO  75  17.010  -5.480  -2.255
  Start of MODEL    4
 2628    HD3  PRO  75           HD3      PRO  75  15.289  -5.843  -2.517
  Start of MODEL    4
 2629    HA   THR  76           HA       THR  76  18.979  -0.204  -1.589
  Start of MODEL    4
 2630    HB   THR  76           HB       THR  76  18.273   1.882  -2.980
  Start of MODEL    4
 2631    HG1  THR  76           HG1      THR  76  15.874   0.382  -3.104
  Start of MODEL    4
 2632   HG23  THR  76          HG21      THR  76  19.267  -0.121  -4.037
  Start of MODEL    4
 2633   HG22  THR  76          HG22      THR  76  18.003   0.575  -5.052
  Start of MODEL    4
 2634   HG21  THR  76          HG23      THR  76  17.670  -0.869  -4.094
  Start of MODEL    4
 2635    H    THR  76           HN       THR  76  16.091  -0.417  -1.116
  Start of MODEL    4
 2636    HA   HIS  77           HA       HIS  77  18.499   2.690   1.614
  Start of MODEL    4
 2637    HB3  HIS  77           HB2      HIS  77  20.982   2.866   1.254
  Start of MODEL    4
 2638    HB2  HIS  77           HB3      HIS  77  20.278   4.268   2.023
  Start of MODEL    4
 2639    HD1  HIS  77           HD1      HIS  77  22.316   3.302  -0.895
  Start of MODEL    4
 2640    HD2  HIS  77           HD2      HIS  77  20.254   6.645   0.443
  Start of MODEL    4
 2641    HE1  HIS  77           HE1      HIS  77  23.171   5.207  -2.259
  Start of MODEL    4
 2642    HE2  HIS  77           HE2      HIS  77  22.122   7.225  -1.226
  Start of MODEL    4
 2643    H    HIS  77           HN       HIS  77  19.621   2.165  -1.011
  Start of MODEL    4
 2644    HA   VAL  78           HA       VAL  78  16.572   6.200  -0.560
  Start of MODEL    4
 2645    HB   VAL  78           HB       VAL  78  15.404   6.316  -2.705
  Start of MODEL    4
 2646    H    VAL  78           HN       VAL  78  17.598   3.640  -1.395
  Start of MODEL    4
 2647    HA   ASN  79           HA       ASN  79  12.791   3.290  -0.168
  Start of MODEL    4
 2648    HB3  ASN  79           HB2      ASN  79  12.786   0.941   0.621
  Start of MODEL    4
 2649    HB2  ASN  79           HB3      ASN  79  14.539   0.948   0.618
  Start of MODEL    4
 2650   HD21  ASN  79          HD21      ASN  79  12.519   2.431  -1.852
  Start of MODEL    4
 2651   HD22  ASN  79          HD22      ASN  79  13.017   1.347  -3.098
  Start of MODEL    4
 2652    H    ASN  79           HN       ASN  79  15.654   2.917  -0.360
  Start of MODEL    4
 2653    HA   ASN  80           HA       ASN  80  14.114   3.356   4.301
  Start of MODEL    4
 2654    HB3  ASN  80           HB2      ASN  80  16.755   4.600   3.464
  Start of MODEL    4
 2655    HB2  ASN  80           HB3      ASN  80  16.529   2.958   4.031
  Start of MODEL    4
 2656   HD21  ASN  80          HD21      ASN  80  17.099   6.155   4.910
  Start of MODEL    4
 2657   HD22  ASN  80          HD22      ASN  80  17.140   5.913   6.614
  Start of MODEL    4
 2658    H    ASN  80           HN       ASN  80  15.369   3.809   1.746
  Start of MODEL    4
 2659    HA2  GLY  81           HA2      GLY  81  12.599   7.412   4.505
  Start of MODEL    4
 2660    H    GLY  81           HN       GLY  81  12.290   4.664   3.727
  Start of MODEL    4
 2661    HA3  GLY  81           HA1      GLY  81  12.161   7.195   2.817
  Start of MODEL    4
 2662    HA   ASN  82           HA       ASN  82   8.407   6.892   5.245
  Start of MODEL    4
 2663    HB3  ASN  82           HB2      ASN  82   8.364   9.763   4.325
  Start of MODEL    4
 2664    HB2  ASN  82           HB3      ASN  82   8.717   9.178   5.946
  Start of MODEL    4
 2665   HD21  ASN  82          HD21      ASN  82   7.031   8.499   7.259
  Start of MODEL    4
 2666   HD22  ASN  82          HD22      ASN  82   5.378   8.808   6.862
  Start of MODEL    4
 2667    H    ASN  82           HN       ASN  82  10.327   8.450   3.706
  Start of MODEL    4
 2668    HA   TYR  83           HA       TYR  83   5.847   6.495   1.690
  Start of MODEL    4
 2669    HB3  TYR  83           HB2      TYR  83   4.933   4.159   1.689
  Start of MODEL    4
 2670    HB2  TYR  83           HB3      TYR  83   5.724   3.884   3.233
  Start of MODEL    4
 2671    HD1  TYR  83           HD1      TYR  83   6.205   4.152  -0.366
  Start of MODEL    4
 2672    HD2  TYR  83           HD2      TYR  83   8.174   3.648   3.375
  Start of MODEL    4
 2673    HE1  TYR  83           HE1      TYR  83   8.220   3.366  -1.533
  Start of MODEL    4
 2674    HE2  TYR  83           HE2      TYR  83  10.190   2.872   2.209
  Start of MODEL    4
 2675    HH   TYR  83           HH       TYR  83  10.763   1.855   0.120
  Start of MODEL    4
 2676    H    TYR  83           HN       TYR  83   6.749   5.833   4.398
  Start of MODEL    4
 2677    HA   THR  84           HA       THR  84   2.121   6.926   3.987
  Start of MODEL    4
 2678    HB   THR  84           HB       THR  84   2.237   9.368   2.177
  Start of MODEL    4
 2679    HG1  THR  84           HG1      THR  84   4.002   9.062   3.748
  Start of MODEL    4
 2680   HG22  THR  84          HG21      THR  84   0.690  10.392   3.796
  Start of MODEL    4
 2681   HG21  THR  84          HG22      THR  84   0.628   8.876   4.699
  Start of MODEL    4
 2682   HG23  THR  84          HG23      THR  84  -0.027   8.956   3.064
  Start of MODEL    4
 2683    H    THR  84           HN       THR  84   3.887   7.393   1.679
  Start of MODEL    4
 2684    HA   LEU  85           HA       LEU  85  -0.428   5.539   0.720
  Start of MODEL    4
 2685    HB3  LEU  85           HB2      LEU  85  -1.510   4.114   3.168
  Start of MODEL    4
 2686    HB2  LEU  85           HB3      LEU  85  -0.236   3.511   2.128
  Start of MODEL    4
 2687    HG   LEU  85           HG       LEU  85  -3.124   3.913   1.319
  Start of MODEL    4
 2688   HD12  LEU  85          HD11      LEU  85  -2.438   2.749  -0.714
  Start of MODEL    4
 2689   HD11  LEU  85          HD12      LEU  85  -0.765   2.805  -0.116
  Start of MODEL    4
 2690   HD13  LEU  85          HD13      LEU  85  -1.611   4.307  -0.513
  Start of MODEL    4
 2691   HD21  LEU  85          HD21      LEU  85  -2.683   2.032   2.856
  Start of MODEL    4
 2692   HD23  LEU  85          HD22      LEU  85  -1.559   1.362   1.663
  Start of MODEL    4
 2693   HD22  LEU  85          HD23      LEU  85  -3.275   1.546   1.273
  Start of MODEL    4
 2694    H    LEU  85           HN       LEU  85   0.193   5.992   3.543
  Start of MODEL    4
 2695    HA   LEU  86           HA       LEU  86  -3.841   8.145   1.566
  Start of MODEL    4
 2696    HB3  LEU  86           HB2      LEU  86  -4.149   9.673  -0.370
  Start of MODEL    4
 2697    HB2  LEU  86           HB3      LEU  86  -2.907   8.821  -1.241
  Start of MODEL    4
 2698    HG   LEU  86           HG       LEU  86  -2.262  11.045  -0.361
  Start of MODEL    4
 2699   HD11  LEU  86          HD11      LEU  86  -2.383   9.712   2.307
  Start of MODEL    4
 2700   HD13  LEU  86          HD12      LEU  86  -3.384  11.042   1.726
  Start of MODEL    4
 2701   HD12  LEU  86          HD13      LEU  86  -1.655  11.284   1.977
  Start of MODEL    4
 2702   HD21  LEU  86          HD21      LEU  86  -0.554   9.448  -0.989
  Start of MODEL    4
 2703   HD23  LEU  86          HD22      LEU  86  -0.616   8.720   0.618
  Start of MODEL    4
 2704   HD22  LEU  86          HD23      LEU  86  -0.035  10.374   0.422
  Start of MODEL    4
 2705    H    LEU  86           HN       LEU  86  -1.804   6.870  -0.110
  Start of MODEL    4
 2706    HA   ALA  87           HA       ALA  87  -6.551   6.122  -1.221
  Start of MODEL    4
 2707    HB2  ALA  87           HB1      ALA  87  -8.248   4.876   0.056
  Start of MODEL    4
 2708    HB1  ALA  87           HB2      ALA  87  -7.781   5.749   1.508
  Start of MODEL    4
 2709    HB3  ALA  87           HB3      ALA  87  -6.646   4.637   0.759
  Start of MODEL    4
 2710    H    ALA  87           HN       ALA  87  -5.902   7.495   1.293
  Start of MODEL    4
 2711    HA   ALA  88           HA       ALA  88  -9.296   9.512  -1.117
  Start of MODEL    4
 2712    HB1  ALA  88           HB1      ALA  88  -8.618   9.106  -4.030
  Start of MODEL    4
 2713    HB3  ALA  88           HB2      ALA  88  -7.754  10.149  -2.892
  Start of MODEL    4
 2714    HB2  ALA  88           HB3      ALA  88  -9.424  10.509  -3.327
  Start of MODEL    4
 2715    H    ALA  88           HN       ALA  88  -7.806   7.345  -2.397
  Start of MODEL    4
 2716    HA   ASN  89           HA       ASN  89 -13.054   7.875  -2.766
  Start of MODEL    4
 2717    HB3  ASN  89           HB2      ASN  89 -12.894   7.501   0.248
  Start of MODEL    4
 2718    HB2  ASN  89           HB3      ASN  89 -12.238   6.389  -0.930
  Start of MODEL    4
 2719   HD21  ASN  89          HD21      ASN  89 -13.395   4.645  -0.305
  Start of MODEL    4
 2720   HD22  ASN  89          HD22      ASN  89 -15.091   4.497  -0.533
  Start of MODEL    4
 2721    H    ASN  89           HN       ASN  89 -11.424   9.570  -1.089
  Start of MODEL    4
 2722    HA   PRO  90           HA       PRO  90 -15.640  11.561  -2.119
  Start of MODEL    4
 2723    HB3  PRO  90           HB2      PRO  90 -17.509  11.166  -3.416
  Start of MODEL    4
 2724    HB2  PRO  90           HB3      PRO  90 -17.807   9.593  -2.671
  Start of MODEL    4
 2725    HG2  PRO  90           HG2      PRO  90 -16.928   8.949  -4.733
  Start of MODEL    4
 2726    HG3  PRO  90           HG3      PRO  90 -15.840  10.345  -4.801
  Start of MODEL    4
 2727    HD2  PRO  90           HD2      PRO  90 -15.538   7.799  -3.259
  Start of MODEL    4
 2728    HD3  PRO  90           HD3      PRO  90 -14.318   8.782  -4.098
  Start of MODEL    4
 2729    HA   CYS  91           HA       CYS  91 -17.955   9.534   1.484
  Start of MODEL    4
 2730    HB3  CYS  91           HB2      CYS  91 -16.116   7.120   1.539
  Start of MODEL    4
 2731    HB2  CYS  91           HB3      CYS  91 -17.795   7.132   1.026
  Start of MODEL    4
 2732    H    CYS  91           HN       CYS  91 -16.030   8.560  -0.427
  Start of MODEL    4
 2733    HA2  GLY  92           HA2      GLY  92 -13.753  11.582   2.622
  Start of MODEL    4
 2734    H    GLY  92           HN       GLY  92 -14.560   9.735   1.035
  Start of MODEL    4
 2735    HA3  GLY  92           HA1      GLY  92 -14.013  10.320   3.823
  Start of MODEL    4
 2736    HA   GLN  93           HA       GLN  93 -10.193   9.451   1.518
  Start of MODEL    4
 2737    HB3  GLN  93           HB2      GLN  93  -9.299  12.223   2.348
  Start of MODEL    4
 2738    HB2  GLN  93           HB3      GLN  93  -9.710  11.690   0.733
  Start of MODEL    4
 2739    HG2  GLN  93           HG2      GLN  93  -7.332  10.817   2.347
  Start of MODEL    4
 2740    HG3  GLN  93           HG3      GLN  93  -7.775  10.157   0.776
  Start of MODEL    4
 2741   HE21  GLN  93          HE21      GLN  93  -6.583  12.931   2.482
  Start of MODEL    4
 2742   HE22  GLN  93          HE22      GLN  93  -5.985  13.762   1.102
  Start of MODEL    4
 2743    H    GLN  93           HN       GLN  93 -11.555  11.590   2.905
  Start of MODEL    4
 2744    HA   ALA  94           HA       ALA  94  -8.325   8.444   5.333
  Start of MODEL    4
 2745    HB2  ALA  94           HB1      ALA  94  -8.049   5.957   5.301
  Start of MODEL    4
 2746    HB1  ALA  94           HB2      ALA  94  -8.569   5.976   3.622
  Start of MODEL    4
 2747    HB3  ALA  94           HB3      ALA  94  -9.681   6.493   4.893
  Start of MODEL    4
 2748    H    ALA  94           HN       ALA  94  -8.791   8.151   2.445
  Start of MODEL    4
 2749    HA   SER  95           HA       SER  95  -4.206   7.228   4.109
  Start of MODEL    4
 2750    HB3  SER  95           HB2      SER  95  -4.280   9.485   3.472
  Start of MODEL    4
 2751    HB2  SER  95           HB3      SER  95  -2.888   9.361   4.547
  Start of MODEL    4
 2752    HG   SER  95           HG       SER  95  -5.458  10.108   5.433
  Start of MODEL    4
 2753    H    SER  95           HN       SER  95  -6.181   7.848   6.033
  Start of MODEL    4
 2754    HA   ALA  96           HA       ALA  96  -1.854   6.944   7.856
  Start of MODEL    4
 2755    HB2  ALA  96           HB1      ALA  96  -1.314   4.516   8.041
  Start of MODEL    4
 2756    HB1  ALA  96           HB2      ALA  96  -1.896   4.288   6.390
  Start of MODEL    4
 2757    HB3  ALA  96           HB3      ALA  96  -3.009   4.801   7.652
  Start of MODEL    4
 2758    H    ALA  96           HN       ALA  96  -2.257   6.687   4.997
  Start of MODEL    4
 2759    HA   SER  97           HA       SER  97   2.131   6.707   5.960
  Start of MODEL    4
 2760    HB3  SER  97           HB2      SER  97   2.471   8.414   8.438
  Start of MODEL    4
 2761    HB2  SER  97           HB3      SER  97   1.561   8.955   7.032
  Start of MODEL    4
 2762    HG   SER  97           HG       SER  97   3.381   8.943   5.817
  Start of MODEL    4
 2763    H    SER  97           HN       SER  97   0.482   6.441   8.357
  Start of MODEL    4
 2764    HA   ILE  98           HA       ILE  98   4.797   4.417   8.637
  Start of MODEL    4
 2765    HB   ILE  98           HB       ILE  98   3.157   2.843   7.610
  Start of MODEL    4
 2766   HD13  ILE  98          HD11      ILE  98   6.159   0.947   6.383
  Start of MODEL    4
 2767   HD12  ILE  98          HD12      ILE  98   6.677   0.426   7.982
  Start of MODEL    4
 2768   HD11  ILE  98          HD13      ILE  98   6.960   2.092   7.464
  Start of MODEL    4
 2769    H    ILE  98           HN       ILE  98   3.973   5.488   6.062
  Start of MODEL    4
 2770    HA   MET  99           HA       MET  99   8.487   4.888   6.327
  Start of MODEL    4
 2771    HB3  MET  99           HB2      MET  99   9.239   5.564   9.189
  Start of MODEL    4
 2772    HB2  MET  99           HB3      MET  99   8.803   6.702   7.920
  Start of MODEL    4
 2773    HG2  MET  99           HG2      MET  99  11.277   4.977   8.041
  Start of MODEL    4
 2774    HG3  MET  99           HG3      MET  99  10.823   5.951   6.652
  Start of MODEL    4
 2775    HE2  MET  99           HE1      MET  99  11.233   9.591   7.970
  Start of MODEL    4
 2776    HE1  MET  99           HE2      MET  99   9.743   8.656   7.969
  Start of MODEL    4
 2777    HE3  MET  99           HE3      MET  99  10.846   8.554   6.595
  Start of MODEL    4
 2778    H    MET  99           HN       MET  99   6.999   4.322   8.792
  Start of MODEL    4
 2779    HA   ALA 100           HA       ALA 100  10.294   1.090   7.309
  Start of MODEL    4
 2780    HB1  ALA 100           HB1      ALA 100  10.698   1.392   4.327
  Start of MODEL    4
 2781    HB3  ALA 100           HB2      ALA 100   9.293   0.648   5.089
  Start of MODEL    4
 2782    HB2  ALA 100           HB3      ALA 100  10.885  -0.096   5.255
  Start of MODEL    4
 2783    H    ALA 100           HN       ALA 100   9.795   3.399   5.593
  Start of MODEL    4
 2784    HA   ALA 101           HA       ALA 101  14.287   2.774   7.285
  Start of MODEL    4
 2785    HB1  ALA 101           HB1      ALA 101  14.033   1.417   9.969
  Start of MODEL    4
 2786    HB3  ALA 101           HB2      ALA 101  13.690   3.115   9.636
  Start of MODEL    4
 2787    HB2  ALA 101           HB3      ALA 101  15.335   2.499   9.478
  Start of MODEL    4
 2788    H    ALA 101           HN       ALA 101  12.144   1.154   8.374
  Start of MODEL    4
 2789    HA   PHE 102           HA       PHE 102  15.755  -1.129   5.948
  Start of MODEL    4
 2790    HB3  PHE 102           HB2      PHE 102  16.723   0.931   3.953
  Start of MODEL    4
 2791    HB2  PHE 102           HB3      PHE 102  15.330  -0.119   3.764
  Start of MODEL    4
 2792    HD1  PHE 102           HD1      PHE 102  16.143  -2.741   4.341
  Start of MODEL    4
 2793    HD2  PHE 102           HD2      PHE 102  18.418   0.356   2.526
  Start of MODEL    4
 2794    HE1  PHE 102           HE1      PHE 102  17.542  -4.422   3.231
  Start of MODEL    4
 2795    HE2  PHE 102           HE2      PHE 102  19.828  -1.328   1.416
  Start of MODEL    4
 2796    HZ   PHE 102           HZ       PHE 102  19.393  -3.719   1.771
  Start of MODEL    4
 2797    H    PHE 102           HN       PHE 102  15.115   1.640   5.764
  Start of MODEL    4
 2798    HA   MET 103           HA       MET 103  19.728   0.297   7.810
  Start of MODEL    4
 2799    HB3  MET 103           HB2      MET 103  20.398  -0.061   5.415
  Start of MODEL    4
 2800    HB2  MET 103           HB3      MET 103  21.633   0.755   6.376
  Start of MODEL    4
 2801    HG2  MET 103           HG2      MET 103  19.757   1.972   4.334
  Start of MODEL    4
 2802    HG3  MET 103           HG3      MET 103  20.743   2.929   5.428
  Start of MODEL    4
 2803    HE1  MET 103           HE1      MET 103  20.723   0.430   2.427
  Start of MODEL    4
 2804    HE3  MET 103           HE2      MET 103  21.711  -0.446   3.596
  Start of MODEL    4
 2805    HE2  MET 103           HE3      MET 103  22.443   0.195   2.124
  Start of MODEL    4
 2806    H    MET 103           HN       MET 103  17.900   1.827   6.217
  Start of MODEL    4
 2807    HA   ASP 104           HA       ASP 104  20.108   4.506   8.882
  Start of MODEL    4
 2808    HB3  ASP 104           HB2      ASP 104  20.762   3.731  11.097
  Start of MODEL    4
 2809    HB2  ASP 104           HB3      ASP 104  21.897   4.975  10.604
  Start of MODEL    4
 2810    H    ASP 104           HN       ASP 104  21.015   1.812   9.020
  Start of MODEL    4
 2811    HA   ASN 105           HA       ASN 105  22.172   5.000   5.251
  Start of MODEL    4
 2812    HB3  ASN 105           HB2      ASN 105  21.375   7.829   5.922
  Start of MODEL    4
 2813    HB2  ASN 105           HB3      ASN 105  20.314   6.627   5.197
  Start of MODEL    4
 2814   HD21  ASN 105          HD21      ASN 105  22.957   8.785   4.651
  Start of MODEL    4
 2815   HD22  ASN 105          HD22      ASN 105  23.044   8.580   2.947
  Start of MODEL    4
 2816    H    ASN 105           HN       ASN 105  20.687   5.803   7.445
  Start of MODEL    4
 2817    HA   PRO 106           HA       PRO 106  26.257   6.159   6.639
  Start of MODEL    4
 2818    HB3  PRO 106           HB2      PRO 106  27.048   4.087   6.155
  Start of MODEL    4
 2819    HB2  PRO 106           HB3      PRO 106  27.551   4.830   4.641
  Start of MODEL    4
 2820    HG2  PRO 106           HG2      PRO 106  25.938   3.806   3.449
  Start of MODEL    4
 2821    HG3  PRO 106           HG3      PRO 106  25.774   2.728   4.839
  Start of MODEL    4
 2822    HD2  PRO 106           HD2      PRO 106  23.846   4.547   3.840
  Start of MODEL    4
 2823    HD3  PRO 106           HD3      PRO 106  23.759   3.604   5.338
  Start of MODEL    4
 2824    HA   PHE 107           HA       PHE 107  27.448   9.253   3.978
  Start of MODEL    4
 2825    HB3  PHE 107           HB2      PHE 107  29.950   9.623   3.800
  Start of MODEL    4
 2826    HB2  PHE 107           HB3      PHE 107  30.122   8.048   4.589
  Start of MODEL    4
 2827    HD1  PHE 107           HD1      PHE 107  28.653  11.428   5.082
  Start of MODEL    4
 2828    HD2  PHE 107           HD2      PHE 107  30.045   7.837   6.893
  Start of MODEL    4
 2829    HE1  PHE 107           HE1      PHE 107  28.487  12.480   7.287
  Start of MODEL    4
 2830    HE2  PHE 107           HE2      PHE 107  29.874   8.888   9.108
  Start of MODEL    4
 2831    HZ   PHE 107           HZ       PHE 107  28.966  11.185   9.309
  Start of MODEL    4
 2832    H    PHE 107           HN       PHE 107  28.239   6.896   5.333
  Start of MODEL    5
 2833    H1   ASP   1           H        ASP   1 -33.666   2.573  -7.735
  Start of MODEL    5
 2834    H2   ASP   1           H2       ASP   1 -32.554   1.800  -8.765
  Start of MODEL    5
 2835    H3   ASP   1           H3       ASP   1 -32.094   3.148  -7.913
  Start of MODEL    5
 2836    HA   ASP   1           HA       ASP   1 -32.269   1.986  -5.829
  Start of MODEL    5
 2837    HB3  ASP   1           HB2      ASP   1 -32.838  -0.454  -7.536
  Start of MODEL    5
 2838    HB2  ASP   1           HB3      ASP   1 -34.112   0.463  -6.739
  Start of MODEL    5
 2839    HA   ASP   2           HA       ASP   2 -28.331   0.897  -7.464
  Start of MODEL    5
 2840    HB3  ASP   2           HB2      ASP   2 -26.608   2.451  -6.582
  Start of MODEL    5
 2841    HB2  ASP   2           HB3      ASP   2 -27.785   3.082  -5.442
  Start of MODEL    5
 2842    H    ASP   2           HN       ASP   2 -30.120   1.919  -5.357
  Start of MODEL    5
 2843    HA   ASP   3           HA       ASP   3 -26.739  -1.717  -4.439
  Start of MODEL    5
 2844    HB3  ASP   3           HB2      ASP   3 -26.105  -2.756  -6.610
  Start of MODEL    5
 2845    HB2  ASP   3           HB3      ASP   3 -24.943  -3.105  -5.345
  Start of MODEL    5
 2846    H    ASP   3           HN       ASP   3 -26.350  -0.066  -6.780
  Start of MODEL    5
 2847    HA   ASP   4           HA       ASP   4 -23.628   0.761  -2.515
  Start of MODEL    5
 2848    HB3  ASP   4           HB2      ASP   4 -23.941   3.341  -2.403
  Start of MODEL    5
 2849    HB2  ASP   4           HB3      ASP   4 -25.173   3.099  -3.626
  Start of MODEL    5
 2850    H    ASP   4           HN       ASP   4 -26.351   0.756  -3.642
  Start of MODEL    5
 2851    HA   ASP   5           HA       ASP   5 -27.108   1.339   0.460
  Start of MODEL    5
 2852    HB3  ASP   5           HB2      ASP   5 -26.968  -1.683   0.545
  Start of MODEL    5
 2853    HB2  ASP   5           HB3      ASP   5 -28.260  -0.719  -0.170
  Start of MODEL    5
 2854    H    ASP   5           HN       ASP   5 -25.763  -0.480  -1.317
  Start of MODEL    5
 2855    HA   VAL   6           HA       VAL   6 -23.999   0.180   3.401
  Start of MODEL    5
 2856    HB   VAL   6           HB       VAL   6 -22.454  -1.804   3.803
  Start of MODEL    5
 2857    H    VAL   6           HN       VAL   6 -24.597  -1.152   0.914
  Start of MODEL    5
 2858    HA   SER   7           HA       SER   7 -20.706   1.657   1.066
  Start of MODEL    5
 2859    HB3  SER   7           HB2      SER   7 -21.887   4.156   2.295
  Start of MODEL    5
 2860    HB2  SER   7           HB3      SER   7 -22.412   3.456   0.764
  Start of MODEL    5
 2861    HG   SER   7           HG       SER   7 -20.750   4.238  -0.184
  Start of MODEL    5
 2862    H    SER   7           HN       SER   7 -22.854   1.869   3.019
  Start of MODEL    5
 2863    HA   PHE   8           HA       PHE   8 -18.299   1.881   4.702
  Start of MODEL    5
 2864    HB3  PHE   8           HB2      PHE   8 -16.419   0.216   4.475
  Start of MODEL    5
 2865    HB2  PHE   8           HB3      PHE   8 -17.140  -0.299   2.955
  Start of MODEL    5
 2866    HD1  PHE   8           HD1      PHE   8 -19.361  -1.418   2.959
  Start of MODEL    5
 2867    HD2  PHE   8           HD2      PHE   8 -17.302  -0.478   6.550
  Start of MODEL    5
 2868    HE1  PHE   8           HE1      PHE   8 -20.782  -3.003   4.180
  Start of MODEL    5
 2869    HE2  PHE   8           HE2      PHE   8 -18.721  -2.063   7.781
  Start of MODEL    5
 2870    HZ   PHE   8           HZ       PHE   8 -20.468  -3.324   6.589
  Start of MODEL    5
 2871    H    PHE   8           HN       PHE   8 -19.132   0.777   2.171
  Start of MODEL    5
 2872    HA   CYS   9           HA       CYS   9 -15.829   4.708   2.567
  Start of MODEL    5
 2873    HB3  CYS   9           HB2      CYS   9 -15.166   6.418   4.147
  Start of MODEL    5
 2874    HB2  CYS   9           HB3      CYS   9 -15.441   5.326   5.503
  Start of MODEL    5
 2875    H    CYS   9           HN       CYS   9 -16.816   3.367   4.919
  Start of MODEL    5
 2876    HA   ALA  10           HA       ALA  10 -11.934   3.082   2.939
  Start of MODEL    5
 2877    HB2  ALA  10           HB1      ALA  10 -10.145   4.407   2.001
  Start of MODEL    5
 2878    HB1  ALA  10           HB2      ALA  10 -11.036   5.884   2.350
  Start of MODEL    5
 2879    HB3  ALA  10           HB3      ALA  10 -11.659   4.741   1.147
  Start of MODEL    5
 2880    H    ALA  10           HN       ALA  10 -13.353   5.605   3.182
  Start of MODEL    5
 2881    HA   SER  11           HA       SER  11  -9.819   4.197   6.502
  Start of MODEL    5
 2882    HB3  SER  11           HB2      SER  11 -10.242   2.576   8.243
  Start of MODEL    5
 2883    HB2  SER  11           HB3      SER  11 -10.792   1.372   7.083
  Start of MODEL    5
 2884    HG   SER  11           HG       SER  11 -12.661   2.204   7.662
  Start of MODEL    5
 2885    H    SER  11           HN       SER  11 -11.025   2.350   4.595
  Start of MODEL    5
 2886    HA   VAL  12           HA       VAL  12  -6.431   1.669   5.293
  Start of MODEL    5
 2887    HB   VAL  12           HB       VAL  12  -5.360   4.489   5.651
  Start of MODEL    5
 2888    H    VAL  12           HN       VAL  12  -7.602   3.780   6.959
  Start of MODEL    5
 2889    HA   GLN  13           HA       GLN  13  -3.948   1.288   8.809
  Start of MODEL    5
 2890    HB3  GLN  13           HB2      GLN  13  -4.183  -1.039   9.772
  Start of MODEL    5
 2891    HB2  GLN  13           HB3      GLN  13  -5.360  -1.357   8.504
  Start of MODEL    5
 2892    HG2  GLN  13           HG2      GLN  13  -6.713   0.501   9.321
  Start of MODEL    5
 2893    HG3  GLN  13           HG3      GLN  13  -6.483  -0.744  10.550
  Start of MODEL    5
 2894   HE21  GLN  13          HE21      GLN  13  -7.151   2.055  10.867
  Start of MODEL    5
 2895   HE22  GLN  13          HE22      GLN  13  -5.902   2.762  11.843
  Start of MODEL    5
 2896    H    GLN  13           HN       GLN  13  -5.415   0.269   6.520
  Start of MODEL    5
 2897    HA   LEU  14           HA       LEU  14  -0.739  -0.576   6.650
  Start of MODEL    5
 2898    HB3  LEU  14           HB2      LEU  14   1.277   1.004   7.013
  Start of MODEL    5
 2899    HB2  LEU  14           HB3      LEU  14   0.103   2.073   7.759
  Start of MODEL    5
 2900    HG   LEU  14           HG       LEU  14  -1.223   1.912   5.575
  Start of MODEL    5
 2901   HD11  LEU  14          HD11      LEU  14   1.561   3.030   5.502
  Start of MODEL    5
 2902   HD13  LEU  14          HD12      LEU  14   0.123   3.886   6.079
  Start of MODEL    5
 2903   HD12  LEU  14          HD13      LEU  14   0.277   3.433   4.373
  Start of MODEL    5
 2904   HD21  LEU  14          HD21      LEU  14  -0.132  -0.127   4.785
  Start of MODEL    5
 2905   HD23  LEU  14          HD22      LEU  14   1.382   0.779   4.632
  Start of MODEL    5
 2906   HD22  LEU  14          HD23      LEU  14  -0.005   1.204   3.634
  Start of MODEL    5
 2907    H    LEU  14           HN       LEU  14  -1.936   1.211   8.591
  Start of MODEL    5
 2908    HA   HIS  15           HA       HIS  15   1.622  -2.154   9.971
  Start of MODEL    5
 2909    HB3  HIS  15           HB2      HIS  15   2.260  -4.479   9.151
  Start of MODEL    5
 2910    HB2  HIS  15           HB3      HIS  15   1.565  -4.036   7.604
  Start of MODEL    5
 2911    HD1  HIS  15           HD1      HIS  15   0.717  -5.963  10.339
  Start of MODEL    5
 2912    HD2  HIS  15           HD2      HIS  15  -1.350  -3.104   8.145
  Start of MODEL    5
 2913    HE1  HIS  15           HE1      HIS  15  -1.710  -6.429  10.741
  Start of MODEL    5
 2914    HE2  HIS  15           HE2      HIS  15  -2.948  -4.767   9.371
  Start of MODEL    5
 2915    H    HIS  15           HN       HIS  15   1.313  -1.527   7.133
  Start of MODEL    5
 2916    HA   THR  16           HA       THR  16   5.752  -1.260   9.011
  Start of MODEL    5
 2917    HB   THR  16           HB       THR  16   5.838  -3.004  11.488
  Start of MODEL    5
 2918    HG1  THR  16           HG1      THR  16   6.142  -0.211  11.476
  Start of MODEL    5
 2919   HG22  THR  16          HG21      THR  16   8.025  -1.880  11.905
  Start of MODEL    5
 2920   HG21  THR  16          HG22      THR  16   7.896  -1.115  10.319
  Start of MODEL    5
 2921   HG23  THR  16          HG23      THR  16   8.042  -2.866  10.443
  Start of MODEL    5
 2922    H    THR  16           HN       THR  16   3.716  -2.439  10.555
  Start of MODEL    5
 2923    HA   ALA  17           HA       ALA  17   6.847  -4.447   6.272
  Start of MODEL    5
 2924    HB3  ALA  17           HB1      ALA  17   8.465  -2.687   5.726
  Start of MODEL    5
 2925    HB2  ALA  17           HB2      ALA  17   9.159  -4.301   5.580
  Start of MODEL    5
 2926    HB1  ALA  17           HB3      ALA  17   9.535  -3.303   6.987
  Start of MODEL    5
 2927    H    ALA  17           HN       ALA  17   7.274  -2.212   7.765
  Start of MODEL    5
 2928    HA   VAL  18           HA       VAL  18   7.906  -7.583   8.959
  Start of MODEL    5
 2929    HB   VAL  18           HB       VAL  18   7.150  -9.767   8.034
  Start of MODEL    5
 2930    H    VAL  18           HN       VAL  18   7.367  -6.524   6.317
  Start of MODEL    5
 2931    HA   GLU  19           HA       GLU  19  11.975  -8.483   8.257
  Start of MODEL    5
 2932    HB3  GLU  19           HB2      GLU  19  11.156 -10.284  10.534
  Start of MODEL    5
 2933    HB2  GLU  19           HB3      GLU  19  11.607  -8.598  10.670
  Start of MODEL    5
 2934    HG2  GLU  19           HG2      GLU  19  13.388 -10.121  11.380
  Start of MODEL    5
 2935    HG3  GLU  19           HG3      GLU  19  13.449 -10.783   9.753
  Start of MODEL    5
 2936    H    GLU  19           HN       GLU  19   9.480  -8.875   9.491
  Start of MODEL    5
 2937    HA   MET  20           HA       MET  20  12.783 -12.066   6.229
  Start of MODEL    5
 2938    HB3  MET  20           HB2      MET  20  10.428 -12.557   5.828
  Start of MODEL    5
 2939    HB2  MET  20           HB3      MET  20  11.349 -12.858   4.369
  Start of MODEL    5
 2940    HG2  MET  20           HG2      MET  20   9.663 -10.436   4.877
  Start of MODEL    5
 2941    HG3  MET  20           HG3      MET  20  10.561 -10.793   3.399
  Start of MODEL    5
 2942    HE1  MET  20           HE1      MET  20   8.408 -10.566   1.895
  Start of MODEL    5
 2943    HE3  MET  20           HE2      MET  20   7.487 -10.147   3.340
  Start of MODEL    5
 2944    HE2  MET  20           HE3      MET  20   6.882 -11.384   2.243
  Start of MODEL    5
 2945    H    MET  20           HN       MET  20  11.811  -9.403   6.229
  Start of MODEL    5
 2946    HA   HIS  21           HA       HIS  21  15.391 -10.548   3.370
  Start of MODEL    5
 2947    HB3  HIS  21           HB2      HIS  21  14.567 -12.484   1.198
  Start of MODEL    5
 2948    HB2  HIS  21           HB3      HIS  21  15.527 -12.964   2.591
  Start of MODEL    5
 2949    HD1  HIS  21           HD1      HIS  21  16.318 -12.765  -0.647
  Start of MODEL    5
 2950    HD2  HIS  21           HD2      HIS  21  17.696 -10.490   2.558
  Start of MODEL    5
 2951    HE1  HIS  21           HE1      HIS  21  18.546 -11.878  -1.344
  Start of MODEL    5
 2952    HE2  HIS  21           HE2      HIS  21  19.271 -10.379   0.549
  Start of MODEL    5
 2953    H    HIS  21           HN       HIS  21  13.315 -12.461   3.594
  Start of MODEL    5
 2954    HA   HIS  22           HA       HIS  22  12.973  -8.496   0.124
  Start of MODEL    5
 2955    HB3  HIS  22           HB2      HIS  22  10.856  -9.039  -1.153
  Start of MODEL    5
 2956    HB2  HIS  22           HB3      HIS  22  10.811 -10.580  -0.300
  Start of MODEL    5
 2957    HD1  HIS  22           HD1      HIS  22  12.023 -12.458  -1.428
  Start of MODEL    5
 2958    HD2  HIS  22           HD2      HIS  22  13.350  -8.734  -2.709
  Start of MODEL    5
 2959    HE1  HIS  22           HE1      HIS  22  13.685 -12.918  -3.245
  Start of MODEL    5
 2960    HE2  HIS  22           HE2      HIS  22  14.557 -10.664  -3.927
  Start of MODEL    5
 2961    H    HIS  22           HN       HIS  22  12.465 -11.038   1.452
  Start of MODEL    5
 2962    HA   TRP  23           HA       TRP  23  10.625  -6.786   3.174
  Start of MODEL    5
 2963    HB3  TRP  23           HB2      TRP  23  10.843  -4.313   3.156
  Start of MODEL    5
 2964    HB2  TRP  23           HB3      TRP  23  11.614  -4.436   1.572
  Start of MODEL    5
 2965    HD1  TRP  23           HD1      TRP  23  14.171  -4.915   1.571
  Start of MODEL    5
 2966    HE1  TRP  23           HE1      TRP  23  15.905  -5.537   3.378
  Start of MODEL    5
 2967    HE3  TRP  23           HE3      TRP  23  11.013  -5.694   5.512
  Start of MODEL    5
 2968    HZ2  TRP  23           HZ2      TRP  23  15.931  -6.251   6.085
  Start of MODEL    5
 2969    HZ3  TRP  23           HZ3      TRP  23  11.972  -6.348   7.677
  Start of MODEL    5
 2970    HH2  TRP  23           HH2      TRP  23  14.376  -6.624   7.959
  Start of MODEL    5
 2971    H    TRP  23           HN       TRP  23  11.961  -6.661   0.649
  Start of MODEL    5
 2972    HA   CYS  24           HA       CYS  24   6.766  -5.928   1.427
  Start of MODEL    5
 2973    HB3  CYS  24           HB2      CYS  24   6.684  -8.216   3.392
  Start of MODEL    5
 2974    HB2  CYS  24           HB3      CYS  24   6.838  -8.342   1.651
  Start of MODEL    5
 2975    H    CYS  24           HN       CYS  24   8.658  -6.769   3.511
  Start of MODEL    5
 2976    HA   ILE  25           HA       ILE  25   5.115  -3.757   4.924
  Start of MODEL    5
 2977    HB   ILE  25           HB       ILE  25   4.723  -1.905   2.539
  Start of MODEL    5
 2978   HD12  ILE  25          HD11      ILE  25   7.808   0.053   3.530
  Start of MODEL    5
 2979   HD11  ILE  25          HD12      ILE  25   6.160   0.471   4.004
  Start of MODEL    5
 2980   HD13  ILE  25          HD13      ILE  25   6.506   0.007   2.340
  Start of MODEL    5
 2981    H    ILE  25           HN       ILE  25   5.642  -4.201   2.069
  Start of MODEL    5
 2982    HA   PRO  26           HA       PRO  26   1.165  -5.606   3.489
  Start of MODEL    5
 2983    HB3  PRO  26           HB2      PRO  26   0.727  -7.147   5.119
  Start of MODEL    5
 2984    HB2  PRO  26           HB3      PRO  26   0.648  -5.901   6.364
  Start of MODEL    5
 2985    HG2  PRO  26           HG2      PRO  26   2.631  -6.907   6.999
  Start of MODEL    5
 2986    HG3  PRO  26           HG3      PRO  26   3.004  -7.427   5.348
  Start of MODEL    5
 2987    HD2  PRO  26           HD2      PRO  26   3.369  -4.730   6.607
  Start of MODEL    5
 2988    HD3  PRO  26           HD3      PRO  26   4.450  -5.633   5.517
  Start of MODEL    5
 2989    HA   PHE  27           HA       PHE  27  -1.415  -2.496   5.115
  Start of MODEL    5
 2990    HB3  PHE  27           HB2      PHE  27  -0.443  -1.324   3.195
  Start of MODEL    5
 2991    HB2  PHE  27           HB3      PHE  27  -2.144  -0.943   3.363
  Start of MODEL    5
 2992    HD1  PHE  27           HD1      PHE  27  -3.783  -1.732   1.717
  Start of MODEL    5
 2993    HD2  PHE  27           HD2      PHE  27   0.386  -2.447   1.261
  Start of MODEL    5
 2994    HE1  PHE  27           HE1      PHE  27  -4.136  -2.252  -0.643
  Start of MODEL    5
 2995    HE2  PHE  27           HE2      PHE  27   0.031  -2.967  -1.111
  Start of MODEL    5
 2996    HZ   PHE  27           HZ       PHE  27  -2.232  -2.872  -2.065
  Start of MODEL    5
 2997    H    PHE  27           HN       PHE  27  -0.703  -4.551   3.181
  Start of MODEL    5
 2998    HA   SER  28           HA       SER  28  -5.393  -3.935   4.099
  Start of MODEL    5
 2999    HB3  SER  28           HB2      SER  28  -6.486  -4.267   6.259
  Start of MODEL    5
 3000    HB2  SER  28           HB3      SER  28  -5.313  -3.199   7.035
  Start of MODEL    5
 3001    HG   SER  28           HG       SER  28  -4.016  -5.052   5.645
  Start of MODEL    5
 3002    H    SER  28           HN       SER  28  -3.557  -2.090   5.396
  Start of MODEL    5
 3003    HA   VAL  29           HA       VAL  29  -7.553  -0.158   4.156
  Start of MODEL    5
 3004    HB   VAL  29           HB       VAL  29  -6.287   0.480   2.179
  Start of MODEL    5
 3005    H    VAL  29           HN       VAL  29  -6.697  -2.681   2.974
  Start of MODEL    5
 3006    HA   ASP  30           HA       ASP  30 -11.455  -2.086   3.849
  Start of MODEL    5
 3007    HB3  ASP  30           HB2      ASP  30 -11.771   0.106   5.890
  Start of MODEL    5
 3008    HB2  ASP  30           HB3      ASP  30 -10.948  -1.394   6.281
  Start of MODEL    5
 3009    H    ASP  30           HN       ASP  30  -9.554   0.070   4.558
  Start of MODEL    5
 3010    HA2  GLY  31           HA2      GLY  31 -14.800   0.628   2.693
  Start of MODEL    5
 3011    H    GLY  31           HN       GLY  31 -13.323  -1.582   2.822
  Start of MODEL    5
 3012    HA3  GLY  31           HA1      GLY  31 -13.515   1.004   1.547
  Start of MODEL    5
 3013    HA   GLN  32           HA       GLN  32 -16.129  -1.697  -0.713
  Start of MODEL    5
 3014    HB3  GLN  32           HB2      GLN  32 -18.604  -1.242  -1.233
  Start of MODEL    5
 3015    HB2  GLN  32           HB3      GLN  32 -18.538  -0.051   0.061
  Start of MODEL    5
 3016    HG2  GLN  32           HG2      GLN  32 -17.789  -1.835   1.596
  Start of MODEL    5
 3017    HG3  GLN  32           HG3      GLN  32 -19.405  -2.098   0.932
  Start of MODEL    5
 3018   HE21  GLN  32          HE21      GLN  32 -16.051  -3.153   0.842
  Start of MODEL    5
 3019   HE22  GLN  32          HE22      GLN  32 -16.397  -4.661   0.075
  Start of MODEL    5
 3020    H    GLN  32           HN       GLN  32 -16.248   0.735   0.901
  Start of MODEL    5
 3021    HA   PRO  33           HA       PRO  33 -16.634   1.727  -4.095
  Start of MODEL    5
 3022    HB3  PRO  33           HB2      PRO  33 -17.480   3.796  -3.470
  Start of MODEL    5
 3023    HB2  PRO  33           HB3      PRO  33 -15.817   4.183  -3.026
  Start of MODEL    5
 3024    HG2  PRO  33           HG2      PRO  33 -16.163   3.754  -0.797
  Start of MODEL    5
 3025    HG3  PRO  33           HG3      PRO  33 -17.820   4.216  -1.226
  Start of MODEL    5
 3026    HD2  PRO  33           HD2      PRO  33 -17.299   1.871  -0.084
  Start of MODEL    5
 3027    HD3  PRO  33           HD3      PRO  33 -18.531   2.014  -1.352
  Start of MODEL    5
 3028    HA   ALA  34           HA       ALA  34 -12.400   0.698  -3.753
  Start of MODEL    5
 3029    HB2  ALA  34           HB1      ALA  34 -11.379   0.565  -5.968
  Start of MODEL    5
 3030    HB1  ALA  34           HB2      ALA  34 -12.802   1.359  -6.662
  Start of MODEL    5
 3031    HB3  ALA  34           HB3      ALA  34 -12.952  -0.225  -5.902
  Start of MODEL    5
 3032    H    ALA  34           HN       ALA  34 -14.751   1.373  -5.107
  Start of MODEL    5
 3033    HA   PRO  35           HA       PRO  35 -10.830   4.849  -3.438
  Start of MODEL    5
 3034    HB3  PRO  35           HB2      PRO  35 -10.709   4.417  -1.147
  Start of MODEL    5
 3035    HB2  PRO  35           HB3      PRO  35  -8.997   4.389  -1.593
  Start of MODEL    5
 3036    HG2  PRO  35           HG2      PRO  35  -8.897   2.091  -1.590
  Start of MODEL    5
 3037    HG3  PRO  35           HG3      PRO  35 -10.139   2.301  -0.348
  Start of MODEL    5
 3038    HD2  PRO  35           HD2      PRO  35 -10.470   0.864  -2.702
  Start of MODEL    5
 3039    HD3  PRO  35           HD3      PRO  35 -11.805   1.576  -1.767
  Start of MODEL    5
 3040    HA   SER  36           HA       SER  36  -7.419   4.190  -6.024
  Start of MODEL    5
 3041    HB3  SER  36           HB2      SER  36  -6.716   6.323  -6.872
  Start of MODEL    5
 3042    HB2  SER  36           HB3      SER  36  -7.370   7.150  -5.449
  Start of MODEL    5
 3043    HG   SER  36           HG       SER  36  -8.873   5.659  -7.336
  Start of MODEL    5
 3044    H    SER  36           HN       SER  36  -9.200   5.764  -4.479
  Start of MODEL    5
 3045    HA   LEU  37           HA       LEU  37  -4.728   4.167  -2.502
  Start of MODEL    5
 3046    HB3  LEU  37           HB2      LEU  37  -3.346   2.136  -2.554
  Start of MODEL    5
 3047    HB2  LEU  37           HB3      LEU  37  -4.011   1.722  -4.122
  Start of MODEL    5
 3048    HG   LEU  37           HG       LEU  37  -6.253   1.498  -3.072
  Start of MODEL    5
 3049   HD12  LEU  37          HD11      LEU  37  -5.795  -0.586  -1.912
  Start of MODEL    5
 3050   HD11  LEU  37          HD12      LEU  37  -4.105  -0.143  -1.736
  Start of MODEL    5
 3051   HD13  LEU  37          HD13      LEU  37  -4.776  -0.444  -3.340
  Start of MODEL    5
 3052   HD21  LEU  37          HD21      LEU  37  -5.981   3.013  -1.199
  Start of MODEL    5
 3053   HD23  LEU  37          HD22      LEU  37  -4.701   1.988  -0.549
  Start of MODEL    5
 3054   HD22  LEU  37          HD23      LEU  37  -6.359   1.392  -0.598
  Start of MODEL    5
 3055    H    LEU  37           HN       LEU  37  -5.876   3.125  -4.909
  Start of MODEL    5
 3056    HA   ARG  38           HA       ARG  38  -1.233   5.655  -4.600
  Start of MODEL    5
 3057    HB3  ARG  38           HB2      ARG  38  -2.700   7.950  -3.284
  Start of MODEL    5
 3058    HB2  ARG  38           HB3      ARG  38  -2.859   7.422  -4.935
  Start of MODEL    5
 3059    HG2  ARG  38           HG2      ARG  38  -1.558   9.444  -4.912
  Start of MODEL    5
 3060    HG3  ARG  38           HG3      ARG  38  -0.463   8.778  -3.709
  Start of MODEL    5
 3061    HD2  ARG  38           HD2      ARG  38   0.212   8.905  -6.160
  Start of MODEL    5
 3062    HD3  ARG  38           HD3      ARG  38   0.592   7.447  -5.259
  Start of MODEL    5
 3063    HE   ARG  38           HE       ARG  38  -1.884   7.602  -6.826
  Start of MODEL    5
 3064   HH11  ARG  38          HH11      ARG  38   1.449   6.215  -6.664
  Start of MODEL    5
 3065   HH12  ARG  38          HH12      ARG  38   1.089   4.984  -7.776
  Start of MODEL    5
 3066   HH21  ARG  38          HH21      ARG  38  -2.278   5.879  -8.354
  Start of MODEL    5
 3067   HH22  ARG  38          HH22      ARG  38  -1.023   4.814  -8.790
  Start of MODEL    5
 3068    H    ARG  38           HN       ARG  38  -3.213   5.510  -2.440
  Start of MODEL    5
 3069    HA   TRP  39           HA       TRP  39   1.199   5.958  -1.028
  Start of MODEL    5
 3070    HB3  TRP  39           HB2      TRP  39   3.426   4.979  -1.501
  Start of MODEL    5
 3071    HB2  TRP  39           HB3      TRP  39   2.958   4.807  -3.189
  Start of MODEL    5
 3072    HD1  TRP  39           HD1      TRP  39   1.206   2.932  -3.799
  Start of MODEL    5
 3073    HE1  TRP  39           HE1      TRP  39   0.486   0.815  -2.575
  Start of MODEL    5
 3074    HE3  TRP  39           HE3      TRP  39   3.001   4.059   0.846
  Start of MODEL    5
 3075    HZ2  TRP  39           HZ2      TRP  39   0.641  -0.260   0.040
  Start of MODEL    5
 3076    HZ3  TRP  39           HZ3      TRP  39   2.673   2.428   2.657
  Start of MODEL    5
 3077    HH2  TRP  39           HH2      TRP  39   1.518   0.315   2.257
  Start of MODEL    5
 3078    H    TRP  39           HN       TRP  39   0.782   5.660  -3.885
  Start of MODEL    5
 3079    HA   LEU  40           HA       LEU  40   3.672   9.329  -2.188
  Start of MODEL    5
 3080    HB3  LEU  40           HB2      LEU  40   2.753   9.989   0.611
  Start of MODEL    5
 3081    HB2  LEU  40           HB3      LEU  40   1.679  10.107  -0.773
  Start of MODEL    5
 3082    HG   LEU  40           HG       LEU  40   4.219  11.681  -0.540
  Start of MODEL    5
 3083   HD12  LEU  40          HD11      LEU  40   3.143  12.988  -2.322
  Start of MODEL    5
 3084   HD11  LEU  40          HD12      LEU  40   1.849  11.774  -2.387
  Start of MODEL    5
 3085   HD13  LEU  40          HD13      LEU  40   3.506  11.331  -2.789
  Start of MODEL    5
 3086   HD21  LEU  40          HD21      LEU  40   2.634  12.280   1.237
  Start of MODEL    5
 3087   HD23  LEU  40          HD22      LEU  40   1.374  12.488   0.022
  Start of MODEL    5
 3088   HD22  LEU  40          HD23      LEU  40   2.778  13.554   0.025
  Start of MODEL    5
 3089    H    LEU  40           HN       LEU  40   2.462   7.473  -0.270
  Start of MODEL    5
 3090    HA   PHE  41           HA       PHE  41   6.994   8.302   0.460
  Start of MODEL    5
 3091    HB3  PHE  41           HB2      PHE  41   7.898   8.024  -2.414
  Start of MODEL    5
 3092    HB2  PHE  41           HB3      PHE  41   7.349   6.744  -1.338
  Start of MODEL    5
 3093    HD1  PHE  41           HD1      PHE  41  10.170   8.300  -2.695
  Start of MODEL    5
 3094    HD2  PHE  41           HD2      PHE  41   8.755   6.489   0.884
  Start of MODEL    5
 3095    HE1  PHE  41           HE1      PHE  41  12.486   7.870  -1.997
  Start of MODEL    5
 3096    HE2  PHE  41           HE2      PHE  41  11.071   6.059   1.585
  Start of MODEL    5
 3097    HZ   PHE  41           HZ       PHE  41  12.942   6.792   0.154
  Start of MODEL    5
 3098    H    PHE  41           HN       PHE  41   5.824   9.492  -1.935
  Start of MODEL    5
 3099    HA   ASN  42           HA       ASN  42   8.994  11.672   2.244
  Start of MODEL    5
 3100    HB3  ASN  42           HB2      ASN  42  10.444  11.318  -0.405
  Start of MODEL    5
 3101    HB2  ASN  42           HB3      ASN  42  10.754  10.329   1.006
  Start of MODEL    5
 3102   HD21  ASN  42          HD21      ASN  42  10.622  12.473   2.953
  Start of MODEL    5
 3103   HD22  ASN  42          HD22      ASN  42  12.049  13.382   2.711
  Start of MODEL    5
 3104    H    ASN  42           HN       ASN  42   7.730   9.882   1.555
  Start of MODEL    5
 3105    HA2  GLY  43           HA2      GLY  43   5.391  14.030   0.254
  Start of MODEL    5
 3106    H    GLY  43           HN       GLY  43   6.571  12.046   0.721
  Start of MODEL    5
 3107    HA3  GLY  43           HA1      GLY  43   6.923  14.844  -0.036
  Start of MODEL    5
 3108    HA   SER  44           HA       SER  44   6.550  13.515  -4.251
  Start of MODEL    5
 3109    HB3  SER  44           HB2      SER  44   8.579  11.316  -3.752
  Start of MODEL    5
 3110    HB2  SER  44           HB3      SER  44   9.007  13.020  -3.832
  Start of MODEL    5
 3111    HG   SER  44           HG       SER  44   8.772  13.029  -5.894
  Start of MODEL    5
 3112    H    SER  44           HN       SER  44   7.491  12.290  -1.749
  Start of MODEL    5
 3113    HA   VAL  45           HA       VAL  45   3.607  10.501  -4.705
  Start of MODEL    5
 3114    HB   VAL  45           HB       VAL  45   3.974  11.719  -7.456
  Start of MODEL    5
 3115    H    VAL  45           HN       VAL  45   5.364  12.488  -5.673
  Start of MODEL    5
 3116    HA   LEU  46           HA       LEU  46   6.304   7.343  -5.831
  Start of MODEL    5
 3117    HB3  LEU  46           HB2      LEU  46   4.513   6.219  -3.676
  Start of MODEL    5
 3118    HB2  LEU  46           HB3      LEU  46   6.071   6.969  -3.418
  Start of MODEL    5
 3119    HG   LEU  46           HG       LEU  46   5.622   4.390  -4.926
  Start of MODEL    5
 3120   HD13  LEU  46          HD11      LEU  46   7.579   5.572  -5.731
  Start of MODEL    5
 3121   HD12  LEU  46          HD12      LEU  46   8.055   4.153  -4.795
  Start of MODEL    5
 3122   HD11  LEU  46          HD13      LEU  46   8.167   5.759  -4.079
  Start of MODEL    5
 3123   HD21  LEU  46          HD21      LEU  46   5.159   4.136  -2.546
  Start of MODEL    5
 3124   HD23  LEU  46          HD22      LEU  46   6.718   4.862  -2.156
  Start of MODEL    5
 3125   HD22  LEU  46          HD23      LEU  46   6.648   3.312  -2.992
  Start of MODEL    5
 3126    H    LEU  46           HN       LEU  46   4.122   8.514  -4.395
  Start of MODEL    5
 3127    HA   ASN  47           HA       ASN  47   3.275   5.638  -8.499
  Start of MODEL    5
 3128    HB3  ASN  47           HB2      ASN  47   5.614   6.605 -10.183
  Start of MODEL    5
 3129    HB2  ASN  47           HB3      ASN  47   4.049   7.387 -10.025
  Start of MODEL    5
 3130   HD21  ASN  47          HD21      ASN  47   5.848   4.946 -11.610
  Start of MODEL    5
 3131   HD22  ASN  47          HD22      ASN  47   4.596   4.416 -12.672
  Start of MODEL    5
 3132    H    ASN  47           HN       ASN  47   5.686   7.058  -7.822
  Start of MODEL    5
 3133    HA   GLU  48           HA       GLU  48   5.155   1.868  -7.646
  Start of MODEL    5
 3134    HB3  GLU  48           HB2      GLU  48   3.743   0.062  -8.054
  Start of MODEL    5
 3135    HB2  GLU  48           HB3      GLU  48   3.042   0.787  -9.486
  Start of MODEL    5
 3136    HG2  GLU  48           HG2      GLU  48   1.628   0.584  -7.344
  Start of MODEL    5
 3137    HG3  GLU  48           HG3      GLU  48   2.546   1.989  -6.802
  Start of MODEL    5
 3138    H    GLU  48           HN       GLU  48   3.174   3.513  -8.720
  Start of MODEL    5
 3139    HA   THR  49           HA       THR  49   7.237   1.147 -11.405
  Start of MODEL    5
 3140    HB   THR  49           HB       THR  49   9.697   1.090 -10.858
  Start of MODEL    5
 3141    HG1  THR  49           HG1      THR  49  10.006   1.957  -8.578
  Start of MODEL    5
 3142   HG21  THR  49          HG21      THR  49   8.154   3.417  -9.712
  Start of MODEL    5
 3143   HG23  THR  49          HG22      THR  49   8.576   3.204 -11.412
  Start of MODEL    5
 3144   HG22  THR  49          HG23      THR  49   9.844   3.458 -10.213
  Start of MODEL    5
 3145    H    THR  49           HN       THR  49   6.920   1.099  -8.502
  Start of MODEL    5
 3146    HA   SER  50           HA       SER  50   8.184  -3.109 -11.084
  Start of MODEL    5
 3147    HB3  SER  50           HB2      SER  50  10.880  -2.450 -12.312
  Start of MODEL    5
 3148    HB2  SER  50           HB3      SER  50   9.389  -2.599 -13.233
  Start of MODEL    5
 3149    HG   SER  50           HG       SER  50   9.258  -4.771 -12.542
  Start of MODEL    5
 3150    H    SER  50           HN       SER  50   9.340  -0.563 -11.691
  Start of MODEL    5
 3151    HA   PHE  51           HA       PHE  51  11.747  -2.920  -8.005
  Start of MODEL    5
 3152    HB3  PHE  51           HB2      PHE  51  12.809  -0.913  -6.950
  Start of MODEL    5
 3153    HB2  PHE  51           HB3      PHE  51  11.809   0.101  -7.979
  Start of MODEL    5
 3154    HD1  PHE  51           HD1      PHE  51  14.850  -1.765  -7.742
  Start of MODEL    5
 3155    HD2  PHE  51           HD2      PHE  51  12.055  -0.077 -10.460
  Start of MODEL    5
 3156    HE1  PHE  51           HE1      PHE  51  16.536  -1.853  -9.527
  Start of MODEL    5
 3157    HE2  PHE  51           HE2      PHE  51  13.723  -0.156 -12.239
  Start of MODEL    5
 3158    HZ   PHE  51           HZ       PHE  51  16.016  -1.049 -11.743
  Start of MODEL    5
 3159    H    PHE  51           HN       PHE  51  10.271  -0.919  -9.536
  Start of MODEL    5
 3160    HA   ILE  52           HA       ILE  52   8.734  -1.459  -4.883
  Start of MODEL    5
 3161    HB   ILE  52           HB       ILE  52   8.282   1.407  -5.785
  Start of MODEL    5
 3162   HD13  ILE  52          HD11      ILE  52  10.065   3.164  -5.231
  Start of MODEL    5
 3163   HD12  ILE  52          HD12      ILE  52  11.497   2.666  -4.319
  Start of MODEL    5
 3164   HD11  ILE  52          HD13      ILE  52   9.912   2.680  -3.543
  Start of MODEL    5
 3165    H    ILE  52           HN       ILE  52   9.340  -0.381  -7.564
  Start of MODEL    5
 3166    HA   PHE  53           HA       PHE  53   4.881  -1.196  -6.960
  Start of MODEL    5
 3167    HB3  PHE  53           HB2      PHE  53   5.580  -4.139  -7.173
  Start of MODEL    5
 3168    HB2  PHE  53           HB3      PHE  53   5.992  -2.893  -8.346
  Start of MODEL    5
 3169    HD1  PHE  53           HD1      PHE  53   3.905  -1.516  -9.209
  Start of MODEL    5
 3170    HD2  PHE  53           HD2      PHE  53   3.748  -5.450  -7.646
  Start of MODEL    5
 3171    HE1  PHE  53           HE1      PHE  53   1.820  -1.920 -10.456
  Start of MODEL    5
 3172    HE2  PHE  53           HE2      PHE  53   1.672  -5.872  -8.889
  Start of MODEL    5
 3173    HZ   PHE  53           HZ       PHE  53   0.626  -4.064 -10.169
  Start of MODEL    5
 3174    H    PHE  53           HN       PHE  53   6.810  -2.592  -5.283
  Start of MODEL    5
 3175    HA   THR  54           HA       THR  54   2.213  -2.305  -3.728
  Start of MODEL    5
 3176    HB   THR  54           HB       THR  54   0.392  -1.113  -5.834
  Start of MODEL    5
 3177    HG1  THR  54           HG1      THR  54   2.416  -0.068  -4.470
  Start of MODEL    5
 3178   HG23  THR  54          HG21      THR  54  -0.773  -2.249  -3.984
  Start of MODEL    5
 3179   HG22  THR  54          HG22      THR  54  -1.011  -0.501  -3.904
  Start of MODEL    5
 3180   HG21  THR  54          HG23      THR  54   0.140  -1.288  -2.824
  Start of MODEL    5
 3181    H    THR  54           HN       THR  54   2.771  -1.403  -6.402
  Start of MODEL    5
 3182    HA   GLU  55           HA       GLU  55   0.457  -5.786  -5.644
  Start of MODEL    5
 3183    HB3  GLU  55           HB2      GLU  55   1.471  -7.867  -4.759
  Start of MODEL    5
 3184    HB2  GLU  55           HB3      GLU  55   2.370  -6.896  -3.598
  Start of MODEL    5
 3185    HG2  GLU  55           HG2      GLU  55   2.515  -6.609  -6.571
  Start of MODEL    5
 3186    HG3  GLU  55           HG3      GLU  55   3.487  -5.739  -5.385
  Start of MODEL    5
 3187    H    GLU  55           HN       GLU  55   1.847  -4.440  -3.487
  Start of MODEL    5
 3188    HA   PHE  56           HA       PHE  56  -2.224  -6.908  -2.427
  Start of MODEL    5
 3189    HB3  PHE  56           HB2      PHE  56  -4.409  -7.319  -3.534
  Start of MODEL    5
 3190    HB2  PHE  56           HB3      PHE  56  -3.591  -7.434  -5.086
  Start of MODEL    5
 3191    HD1  PHE  56           HD1      PHE  56  -4.787  -5.166  -2.488
  Start of MODEL    5
 3192    HD2  PHE  56           HD2      PHE  56  -2.669  -5.438  -6.175
  Start of MODEL    5
 3193    HE1  PHE  56           HE1      PHE  56  -5.045  -2.741  -2.814
  Start of MODEL    5
 3194    HE2  PHE  56           HE2      PHE  56  -2.918  -3.025  -6.497
  Start of MODEL    5
 3195    HZ   PHE  56           HZ       PHE  56  -4.058  -1.655  -4.790
  Start of MODEL    5
 3196    H    PHE  56           HN       PHE  56  -1.011  -7.380  -5.042
  Start of MODEL    5
 3197    HA   LEU  57           HA       LEU  57  -2.257 -11.250  -2.711
  Start of MODEL    5
 3198    HB3  LEU  57           HB2      LEU  57  -1.167 -10.907  -0.545
  Start of MODEL    5
 3199    HB2  LEU  57           HB3      LEU  57  -2.329 -12.212  -0.418
  Start of MODEL    5
 3200    HG   LEU  57           HG       LEU  57  -3.114  -9.507   0.532
  Start of MODEL    5
 3201   HD11  LEU  57          HD11      LEU  57  -3.857 -12.303   1.327
  Start of MODEL    5
 3202   HD13  LEU  57          HD12      LEU  57  -4.843 -11.174   0.398
  Start of MODEL    5
 3203   HD12  LEU  57          HD13      LEU  57  -4.464 -10.834   2.089
  Start of MODEL    5
 3204   HD21  LEU  57          HD21      LEU  57  -0.963  -9.918   1.575
  Start of MODEL    5
 3205   HD23  LEU  57          HD22      LEU  57  -1.495 -11.521   2.077
  Start of MODEL    5
 3206   HD22  LEU  57          HD23      LEU  57  -2.266 -10.083   2.754
  Start of MODEL    5
 3207    H    LEU  57           HN       LEU  57  -3.185  -8.763  -1.518
  Start of MODEL    5
 3208    HA   GLU  58           HA       GLU  58  -6.262 -12.639  -3.321
  Start of MODEL    5
 3209    HB3  GLU  58           HB2      GLU  58  -6.976 -14.799  -2.218
  Start of MODEL    5
 3210    HB2  GLU  58           HB3      GLU  58  -5.461 -14.772  -1.337
  Start of MODEL    5
 3211    HG2  GLU  58           HG2      GLU  58  -5.405 -16.268  -3.269
  Start of MODEL    5
 3212    HG3  GLU  58           HG3      GLU  58  -5.732 -14.912  -4.328
  Start of MODEL    5
 3213    H    GLU  58           HN       GLU  58  -3.811 -13.088  -2.168
  Start of MODEL    5
 3214    HA   PRO  59           HA       PRO  59  -7.919 -10.504   0.280
  Start of MODEL    5
 3215    HB3  PRO  59           HB2      PRO  59  -7.851  -8.564  -0.896
  Start of MODEL    5
 3216    HB2  PRO  59           HB3      PRO  59  -9.581  -8.844  -1.093
  Start of MODEL    5
 3217    HG2  PRO  59           HG2      PRO  59  -9.317  -9.285  -3.297
  Start of MODEL    5
 3218    HG3  PRO  59           HG3      PRO  59  -7.637  -8.757  -3.140
  Start of MODEL    5
 3219    HD2  PRO  59           HD2      PRO  59  -8.680 -11.484  -3.452
  Start of MODEL    5
 3220    HD3  PRO  59           HD3      PRO  59  -7.018 -10.879  -3.563
  Start of MODEL    5
 3221    HA   ALA  60           HA       ALA  60 -11.576 -12.839   0.759
  Start of MODEL    5
 3222    HB2  ALA  60           HB1      ALA  60 -12.346 -12.514   3.097
  Start of MODEL    5
 3223    HB1  ALA  60           HB2      ALA  60 -11.050 -11.339   3.322
  Start of MODEL    5
 3224    HB3  ALA  60           HB3      ALA  60 -10.668 -13.024   2.975
  Start of MODEL    5
 3225    H    ALA  60           HN       ALA  60  -9.431 -11.227   1.552
  Start of MODEL    5
 3226    HA   ALA  61           HA       ALA  61 -14.179  -9.420  -0.155
  Start of MODEL    5
 3227    HB3  ALA  61           HB1      ALA  61 -14.295 -10.707  -2.230
  Start of MODEL    5
 3228    HB2  ALA  61           HB2      ALA  61 -15.889 -10.116  -1.729
  Start of MODEL    5
 3229    HB1  ALA  61           HB3      ALA  61 -15.448 -11.803  -1.456
  Start of MODEL    5
 3230    H    ALA  61           HN       ALA  61 -13.384 -12.202  -0.180
  Start of MODEL    5
 3231    HA   ASN  62           HA       ASN  62 -17.294 -11.817   2.661
  Start of MODEL    5
 3232    HB3  ASN  62           HB2      ASN  62 -14.778 -12.667   4.138
  Start of MODEL    5
 3233    HB2  ASN  62           HB3      ASN  62 -15.816 -13.734   3.213
  Start of MODEL    5
 3234   HD21  ASN  62          HD21      ASN  62 -16.206 -15.090   4.894
  Start of MODEL    5
 3235   HD22  ASN  62          HD22      ASN  62 -17.191 -14.679   6.239
  Start of MODEL    5
 3236    H    ASN  62           HN       ASN  62 -14.627 -12.060   1.742
  Start of MODEL    5
 3237    HA   GLU  63           HA       GLU  63 -15.621  -8.478   5.316
  Start of MODEL    5
 3238    HB3  GLU  63           HB2      GLU  63 -13.669  -9.758   6.028
  Start of MODEL    5
 3239    HB2  GLU  63           HB3      GLU  63 -13.367  -8.019   6.148
  Start of MODEL    5
 3240    HG2  GLU  63           HG2      GLU  63 -12.400  -9.865   3.982
  Start of MODEL    5
 3241    HG3  GLU  63           HG3      GLU  63 -12.058  -8.140   4.094
  Start of MODEL    5
 3242    H    GLU  63           HN       GLU  63 -14.295 -10.226   3.401
  Start of MODEL    5
 3243    HA   THR  64           HA       THR  64 -14.983  -5.417   2.334
  Start of MODEL    5
 3244    HB   THR  64           HB       THR  64 -15.538  -3.149   3.231
  Start of MODEL    5
 3245    HG1  THR  64           HG1      THR  64 -14.900  -2.885   5.236
  Start of MODEL    5
 3246   HG21  THR  64          HG21      THR  64 -17.223  -5.429   4.285
  Start of MODEL    5
 3247   HG23  THR  64          HG22      THR  64 -17.318  -4.732   2.668
  Start of MODEL    5
 3248   HG22  THR  64          HG23      THR  64 -17.769  -3.767   4.075
  Start of MODEL    5
 3249    H    THR  64           HN       THR  64 -14.894  -6.154   5.136
  Start of MODEL    5
 3250    HA   VAL  65           HA       VAL  65 -10.874  -3.912   3.471
  Start of MODEL    5
 3251    HB   VAL  65           HB       VAL  65 -10.162  -6.371   5.074
  Start of MODEL    5
 3252    H    VAL  65           HN       VAL  65 -12.496  -6.358   3.658
  Start of MODEL    5
 3253    HA   ARG  66           HA       ARG  66  -8.811  -6.314   0.467
  Start of MODEL    5
 3254    HB3  ARG  66           HB2      ARG  66  -7.681  -4.853  -1.105
  Start of MODEL    5
 3255    HB2  ARG  66           HB3      ARG  66  -7.771  -3.506   0.012
  Start of MODEL    5
 3256    HG2  ARG  66           HG2      ARG  66 -10.142  -4.830  -1.276
  Start of MODEL    5
 3257    HG3  ARG  66           HG3      ARG  66 -10.164  -3.404  -0.237
  Start of MODEL    5
 3258    HD2  ARG  66           HD2      ARG  66  -8.717  -2.249  -1.889
  Start of MODEL    5
 3259    HD3  ARG  66           HD3      ARG  66  -8.863  -3.657  -2.945
  Start of MODEL    5
 3260    HE   ARG  66           HE       ARG  66 -11.088  -1.959  -2.075
  Start of MODEL    5
 3261   HH11  ARG  66          HH11      ARG  66  -9.575  -4.014  -4.588
  Start of MODEL    5
 3262   HH12  ARG  66          HH12      ARG  66 -10.800  -3.800  -5.711
  Start of MODEL    5
 3263   HH21  ARG  66          HH21      ARG  66 -12.827  -1.745  -3.589
  Start of MODEL    5
 3264   HH22  ARG  66          HH22      ARG  66 -12.751  -2.478  -5.127
  Start of MODEL    5
 3265    H    ARG  66           HN       ARG  66  -9.390  -3.895   2.010
  Start of MODEL    5
 3266    HA   HIS  67           HA       HIS  67  -5.009  -6.137   2.564
  Start of MODEL    5
 3267    HB3  HIS  67           HB2      HIS  67  -4.291  -8.484   3.102
  Start of MODEL    5
 3268    HB2  HIS  67           HB3      HIS  67  -5.617  -9.068   2.105
  Start of MODEL    5
 3269    HD1  HIS  67           HD1      HIS  67  -4.847  -7.897   5.500
  Start of MODEL    5
 3270    HD2  HIS  67           HD2      HIS  67  -8.216  -8.508   3.155
  Start of MODEL    5
 3271    HE1  HIS  67           HE1      HIS  67  -6.785  -7.838   7.075
  Start of MODEL    5
 3272    HE2  HIS  67           HE2      HIS  67  -8.825  -8.271   5.647
  Start of MODEL    5
 3273    H    HIS  67           HN       HIS  67  -6.893  -7.339   0.673
  Start of MODEL    5
 3274    HA2  GLY  68           HA2      GLY  68  -1.997  -7.293  -0.338
  Start of MODEL    5
 3275    H    GLY  68           HN       GLY  68  -3.038  -5.772   1.863
  Start of MODEL    5
 3276    HA3  GLY  68           HA1      GLY  68  -2.267  -5.576  -0.646
  Start of MODEL    5
 3277    HA   CYS  69           HA       CYS  69   1.443  -4.951   1.415
  Start of MODEL    5
 3278    HB3  CYS  69           HB2      CYS  69   2.220  -7.363  -0.210
  Start of MODEL    5
 3279    HB2  CYS  69           HB3      CYS  69   1.882  -7.289   1.518
  Start of MODEL    5
 3280    H    CYS  69           HN       CYS  69   0.078  -5.729  -0.990
  Start of MODEL    5
 3281    HA   LEU  70           HA       LEU  70   3.456  -2.792  -1.831
  Start of MODEL    5
 3282    HB3  LEU  70           HB2      LEU  70   4.395  -1.424   0.709
  Start of MODEL    5
 3283    HB2  LEU  70           HB3      LEU  70   3.011  -0.903  -0.228
  Start of MODEL    5
 3284    HG   LEU  70           HG       LEU  70   5.826  -0.995  -1.307
  Start of MODEL    5
 3285   HD12  LEU  70          HD11      LEU  70   4.930   0.536  -2.998
  Start of MODEL    5
 3286   HD11  LEU  70          HD12      LEU  70   3.320   0.302  -2.322
  Start of MODEL    5
 3287   HD13  LEU  70          HD13      LEU  70   4.183  -1.061  -3.044
  Start of MODEL    5
 3288   HD23  LEU  70          HD21      LEU  70   4.321   1.337  -0.150
  Start of MODEL    5
 3289   HD22  LEU  70          HD22      LEU  70   5.849   1.430  -1.019
  Start of MODEL    5
 3290   HD21  LEU  70          HD23      LEU  70   5.769   0.583   0.530
  Start of MODEL    5
 3291    H    LEU  70           HN       LEU  70   2.778  -3.328   0.940
  Start of MODEL    5
 3292    HA   ARG  71           HA       ARG  71   6.832  -5.222  -0.587
  Start of MODEL    5
 3293    HB3  ARG  71           HB2      ARG  71   5.649  -6.714  -2.925
  Start of MODEL    5
 3294    HB2  ARG  71           HB3      ARG  71   5.441  -7.087  -1.224
  Start of MODEL    5
 3295    HG2  ARG  71           HG2      ARG  71   7.939  -7.368  -2.874
  Start of MODEL    5
 3296    HG3  ARG  71           HG3      ARG  71   7.926  -7.479  -1.112
  Start of MODEL    5
 3297    HD2  ARG  71           HD2      ARG  71   7.807  -9.688  -2.232
  Start of MODEL    5
 3298    HD3  ARG  71           HD3      ARG  71   6.431  -9.357  -1.190
  Start of MODEL    5
 3299    HE   ARG  71           HE       ARG  71   5.807  -8.560  -3.823
  Start of MODEL    5
 3300   HH11  ARG  71          HH11      ARG  71   6.349 -11.538  -2.002
  Start of MODEL    5
 3301   HH12  ARG  71          HH12      ARG  71   5.290 -12.467  -2.946
  Start of MODEL    5
 3302   HH21  ARG  71          HH21      ARG  71   4.377  -9.779  -5.068
  Start of MODEL    5
 3303   HH22  ARG  71          HH22      ARG  71   4.076 -11.425  -4.726
  Start of MODEL    5
 3304    H    ARG  71           HN       ARG  71   4.668  -4.528  -2.367
  Start of MODEL    5
 3305    HA   LEU  72           HA       LEU  72   9.253  -3.295  -3.451
  Start of MODEL    5
 3306    HB3  LEU  72           HB2      LEU  72  11.345  -2.531  -2.415
  Start of MODEL    5
 3307    HB2  LEU  72           HB3      LEU  72  11.024  -3.522  -1.004
  Start of MODEL    5
 3308    HG   LEU  72           HG       LEU  72   8.982  -1.518  -1.752
  Start of MODEL    5
 3309   HD13  LEU  72          HD11      LEU  72   8.529  -2.882   0.138
  Start of MODEL    5
 3310   HD12  LEU  72          HD12      LEU  72   8.742  -1.206   0.641
  Start of MODEL    5
 3311   HD11  LEU  72          HD13      LEU  72  10.033  -2.377   0.913
  Start of MODEL    5
 3312   HD23  LEU  72          HD21      LEU  72  11.612  -0.721  -0.535
  Start of MODEL    5
 3313   HD22  LEU  72          HD22      LEU  72  10.156   0.282  -0.571
  Start of MODEL    5
 3314   HD21  LEU  72          HD23      LEU  72  10.925  -0.193  -2.078
  Start of MODEL    5
 3315    H    LEU  72           HN       LEU  72   8.710  -4.544  -0.928
  Start of MODEL    5
 3316    HA   ASN  73           HA       ASN  73  10.456  -7.185  -4.758
  Start of MODEL    5
 3317    HB3  ASN  73           HB2      ASN  73  10.614  -5.339  -7.152
  Start of MODEL    5
 3318    HB2  ASN  73           HB3      ASN  73   9.182  -6.212  -6.633
  Start of MODEL    5
 3319   HD21  ASN  73          HD21      ASN  73   9.072  -8.438  -6.933
  Start of MODEL    5
 3320   HD22  ASN  73          HD22      ASN  73  10.115  -9.255  -8.033
  Start of MODEL    5
 3321    H    ASN  73           HN       ASN  73   9.780  -4.461  -4.955
  Start of MODEL    5
 3322    HA   GLN  74           HA       GLN  74  14.756  -5.846  -4.971
  Start of MODEL    5
 3323    HB3  GLN  74           HB2      GLN  74  15.921  -4.360  -6.577
  Start of MODEL    5
 3324    HB2  GLN  74           HB3      GLN  74  14.384  -3.595  -6.951
  Start of MODEL    5
 3325    HG2  GLN  74           HG2      GLN  74  13.535  -5.644  -7.902
  Start of MODEL    5
 3326    HG3  GLN  74           HG3      GLN  74  15.040  -5.173  -8.683
  Start of MODEL    5
 3327   HE21  GLN  74          HE21      GLN  74  16.664  -6.152  -6.423
  Start of MODEL    5
 3328   HE22  GLN  74          HE22      GLN  74  16.618  -7.870  -6.545
  Start of MODEL    5
 3329    H    GLN  74           HN       GLN  74  12.320  -4.293  -5.424
  Start of MODEL    5
 3330    HA   PRO  75           HA       PRO  75  14.615  -2.515  -1.881
  Start of MODEL    5
 3331    HB3  PRO  75           HB2      PRO  75  14.953  -3.656   0.054
  Start of MODEL    5
 3332    HB2  PRO  75           HB3      PRO  75  16.566  -4.157  -0.459
  Start of MODEL    5
 3333    HG2  PRO  75           HG2      PRO  75  15.527  -6.220  -0.581
  Start of MODEL    5
 3334    HG3  PRO  75           HG3      PRO  75  13.938  -5.502  -0.900
  Start of MODEL    5
 3335    HD2  PRO  75           HD2      PRO  75  16.224  -5.952  -2.787
  Start of MODEL    5
 3336    HD3  PRO  75           HD3      PRO  75  14.482  -6.230  -3.026
  Start of MODEL    5
 3337    HA   THR  76           HA       THR  76  18.718  -0.923  -2.252
  Start of MODEL    5
 3338    HB   THR  76           HB       THR  76  18.431   1.128  -3.822
  Start of MODEL    5
 3339    HG1  THR  76           HG1      THR  76  15.819   0.128  -3.691
  Start of MODEL    5
 3340   HG21  THR  76          HG21      THR  76  17.626  -1.602  -4.849
  Start of MODEL    5
 3341   HG23  THR  76          HG22      THR  76  19.278  -1.023  -4.644
  Start of MODEL    5
 3342   HG22  THR  76          HG23      THR  76  18.221  -0.272  -5.841
  Start of MODEL    5
 3343    H    THR  76           HN       THR  76  15.817  -0.789  -1.967
  Start of MODEL    5
 3344    HA   HIS  77           HA       HIS  77  18.403   2.052   0.808
  Start of MODEL    5
 3345    HB3  HIS  77           HB2      HIS  77  20.864   1.761   0.645
  Start of MODEL    5
 3346    HB2  HIS  77           HB3      HIS  77  20.382   3.281   1.363
  Start of MODEL    5
 3347    HD1  HIS  77           HD1      HIS  77  22.442   1.895  -1.327
  Start of MODEL    5
 3348    HD2  HIS  77           HD2      HIS  77  20.870   5.571  -0.225
  Start of MODEL    5
 3349    HE1  HIS  77           HE1      HIS  77  23.714   3.597  -2.641
  Start of MODEL    5
 3350    HE2  HIS  77           HE2      HIS  77  22.653   5.798  -2.069
  Start of MODEL    5
 3351    H    HIS  77           HN       HIS  77  19.627   1.349  -1.713
  Start of MODEL    5
 3352    HA   VAL  78           HA       VAL  78  17.184   5.866  -1.330
  Start of MODEL    5
 3353    HB   VAL  78           HB       VAL  78  16.008   6.050  -3.549
  Start of MODEL    5
 3354    H    VAL  78           HN       VAL  78  17.918   3.209  -2.192
  Start of MODEL    5
 3355    HA   ASN  79           HA       ASN  79  13.069   3.582  -1.010
  Start of MODEL    5
 3356    HB3  ASN  79           HB2      ASN  79  12.640   1.221  -0.542
  Start of MODEL    5
 3357    HB2  ASN  79           HB3      ASN  79  14.356   0.929  -0.314
  Start of MODEL    5
 3358   HD21  ASN  79          HD21      ASN  79  13.084   2.952  -2.875
  Start of MODEL    5
 3359   HD22  ASN  79          HD22      ASN  79  13.539   1.887  -4.154
  Start of MODEL    5
 3360    H    ASN  79           HN       ASN  79  15.894   2.818  -0.922
  Start of MODEL    5
 3361    HA   ASN  80           HA       ASN  80  13.806   3.672   3.422
  Start of MODEL    5
 3362    HB3  ASN  80           HB2      ASN  80  16.538   4.728   2.714
  Start of MODEL    5
 3363    HB2  ASN  80           HB3      ASN  80  16.140   3.151   3.360
  Start of MODEL    5
 3364   HD21  ASN  80          HD21      ASN  80  18.060   4.808   4.329
  Start of MODEL    5
 3365   HD22  ASN  80          HD22      ASN  80  17.690   5.244   5.954
  Start of MODEL    5
 3366    H    ASN  80           HN       ASN  80  14.944   4.653   0.903
  Start of MODEL    5
 3367    HA2  GLY  81           HA2      GLY  81  12.788   7.729   4.721
  Start of MODEL    5
 3368    H    GLY  81           HN       GLY  81  12.376   5.094   4.168
  Start of MODEL    5
 3369    HA3  GLY  81           HA1      GLY  81  12.245   7.714   3.055
  Start of MODEL    5
 3370    HA   ASN  82           HA       ASN  82   8.575   7.679   5.594
  Start of MODEL    5
 3371    HB3  ASN  82           HB2      ASN  82   7.278   9.756   5.289
  Start of MODEL    5
 3372    HB2  ASN  82           HB3      ASN  82   8.455  10.304   4.109
  Start of MODEL    5
 3373   HD21  ASN  82          HD21      ASN  82   7.846   9.709   7.456
  Start of MODEL    5
 3374   HD22  ASN  82          HD22      ASN  82   9.207  10.588   8.062
  Start of MODEL    5
 3375    H    ASN  82           HN       ASN  82  10.465   8.907   3.778
  Start of MODEL    5
 3376    HA   TYR  83           HA       TYR  83   6.078   6.556   2.163
  Start of MODEL    5
 3377    HB3  TYR  83           HB2      TYR  83   5.237   4.169   2.666
  Start of MODEL    5
 3378    HB2  TYR  83           HB3      TYR  83   6.252   4.240   4.114
  Start of MODEL    5
 3379    HD1  TYR  83           HD1      TYR  83   6.213   3.563   0.596
  Start of MODEL    5
 3380    HD2  TYR  83           HD2      TYR  83   8.734   4.528   3.882
  Start of MODEL    5
 3381    HE1  TYR  83           HE1      TYR  83   8.155   2.765  -0.667
  Start of MODEL    5
 3382    HE2  TYR  83           HE2      TYR  83  10.688   3.730   2.610
  Start of MODEL    5
 3383    HH   TYR  83           HH       TYR  83  11.214   2.320   0.814
  Start of MODEL    5
 3384    H    TYR  83           HN       TYR  83   7.112   6.286   4.878
  Start of MODEL    5
 3385    HA   THR  84           HA       THR  84   2.179   6.858   4.300
  Start of MODEL    5
 3386    HB   THR  84           HB       THR  84   2.189   9.138   2.294
  Start of MODEL    5
 3387    HG1  THR  84           HG1      THR  84   4.031   9.391   3.449
  Start of MODEL    5
 3388   HG21  THR  84          HG21      THR  84   0.827   8.848   4.990
  Start of MODEL    5
 3389   HG23  THR  84          HG22      THR  84   0.030   8.771   3.422
  Start of MODEL    5
 3390   HG22  THR  84          HG23      THR  84   0.767  10.279   3.960
  Start of MODEL    5
 3391    H    THR  84           HN       THR  84   3.908   6.965   1.928
  Start of MODEL    5
 3392    HA   LEU  85           HA       LEU  85  -0.333   5.453   0.966
  Start of MODEL    5
 3393    HB3  LEU  85           HB2      LEU  85  -1.420   3.951   3.367
  Start of MODEL    5
 3394    HB2  LEU  85           HB3      LEU  85  -0.148   3.387   2.299
  Start of MODEL    5
 3395    HG   LEU  85           HG       LEU  85  -3.053   3.795   1.539
  Start of MODEL    5
 3396   HD11  LEU  85          HD11      LEU  85  -0.719   2.757   0.022
  Start of MODEL    5
 3397   HD13  LEU  85          HD12      LEU  85  -1.586   4.271  -0.309
  Start of MODEL    5
 3398   HD12  LEU  85          HD13      LEU  85  -2.391   2.702  -0.551
  Start of MODEL    5
 3399   HD22  LEU  85          HD21      LEU  85  -3.167   1.412   1.381
  Start of MODEL    5
 3400   HD21  LEU  85          HD22      LEU  85  -2.585   1.861   2.992
  Start of MODEL    5
 3401   HD23  LEU  85          HD23      LEU  85  -1.452   1.262   1.781
  Start of MODEL    5
 3402    H    LEU  85           HN       LEU  85   0.184   5.960   3.809
  Start of MODEL    5
 3403    HA   LEU  86           HA       LEU  86  -3.884   7.871   1.659
  Start of MODEL    5
 3404    HB3  LEU  86           HB2      LEU  86  -4.180   9.301  -0.368
  Start of MODEL    5
 3405    HB2  LEU  86           HB3      LEU  86  -2.833   8.491  -1.117
  Start of MODEL    5
 3406    HG   LEU  86           HG       LEU  86  -2.341  10.758  -0.292
  Start of MODEL    5
 3407   HD12  LEU  86          HD11      LEU  86  -1.987  11.162   2.066
  Start of MODEL    5
 3408   HD11  LEU  86          HD12      LEU  86  -2.673   9.581   2.424
  Start of MODEL    5
 3409   HD13  LEU  86          HD13      LEU  86  -3.674  10.825   1.669
  Start of MODEL    5
 3410   HD23  LEU  86          HD21      LEU  86  -0.703   8.577   1.000
  Start of MODEL    5
 3411   HD22  LEU  86          HD22      LEU  86  -0.176  10.236   0.744
  Start of MODEL    5
 3412   HD21  LEU  86          HD23      LEU  86  -0.506   9.197  -0.639
  Start of MODEL    5
 3413    H    LEU  86           HN       LEU  86  -1.808   6.567   0.066
  Start of MODEL    5
 3414    HA   ALA  87           HA       ALA  87  -6.542   5.802  -1.169
  Start of MODEL    5
 3415    HB2  ALA  87           HB1      ALA  87  -8.098   4.361   0.133
  Start of MODEL    5
 3416    HB1  ALA  87           HB2      ALA  87  -7.575   5.172   1.602
  Start of MODEL    5
 3417    HB3  ALA  87           HB3      ALA  87  -6.433   4.194   0.687
  Start of MODEL    5
 3418    H    ALA  87           HN       ALA  87  -5.908   7.243   1.313
  Start of MODEL    5
 3419    HA   ALA  88           HA       ALA  88  -9.878   8.609  -0.709
  Start of MODEL    5
 3420    HB2  ALA  88           HB1      ALA  88  -9.801  10.255  -2.509
  Start of MODEL    5
 3421    HB1  ALA  88           HB2      ALA  88  -8.642   9.251  -3.384
  Start of MODEL    5
 3422    HB3  ALA  88           HB3      ALA  88  -8.188   9.978  -1.845
  Start of MODEL    5
 3423    H    ALA  88           HN       ALA  88  -8.030   6.917  -2.250
  Start of MODEL    5
 3424    HA   ASN  89           HA       ASN  89 -12.843   7.347  -3.682
  Start of MODEL    5
 3425    HB3  ASN  89           HB2      ASN  89 -12.455   5.274  -2.301
  Start of MODEL    5
 3426    HB2  ASN  89           HB3      ASN  89 -14.112   5.421  -2.794
  Start of MODEL    5
 3427   HD21  ASN  89          HD21      ASN  89 -13.167   3.784  -0.777
  Start of MODEL    5
 3428   HD22  ASN  89          HD22      ASN  89 -13.838   4.284   0.732
  Start of MODEL    5
 3429    H    ASN  89           HN       ASN  89 -11.967   8.374  -1.150
  Start of MODEL    5
 3430    HA   PRO  90           HA       PRO  90 -16.561   9.872  -3.313
  Start of MODEL    5
 3431    HB3  PRO  90           HB2      PRO  90 -18.576   8.717  -3.518
  Start of MODEL    5
 3432    HB2  PRO  90           HB3      PRO  90 -18.041   7.412  -2.450
  Start of MODEL    5
 3433    HG2  PRO  90           HG2      PRO  90 -17.689   6.489  -4.584
  Start of MODEL    5
 3434    HG3  PRO  90           HG3      PRO  90 -17.170   8.047  -5.254
  Start of MODEL    5
 3435    HD2  PRO  90           HD2      PRO  90 -15.679   6.098  -3.607
  Start of MODEL    5
 3436    HD3  PRO  90           HD3      PRO  90 -15.067   7.205  -4.852
  Start of MODEL    5
 3437    HA   CYS  91           HA       CYS  91 -17.732   9.429   1.106
  Start of MODEL    5
 3438    HB3  CYS  91           HB2      CYS  91 -16.022   7.098   1.996
  Start of MODEL    5
 3439    HB2  CYS  91           HB3      CYS  91 -17.716   6.994   1.524
  Start of MODEL    5
 3440    H    CYS  91           HN       CYS  91 -16.040   7.737  -0.511
  Start of MODEL    5
 3441    HA2  GLY  92           HA2      GLY  92 -13.589  11.512   1.398
  Start of MODEL    5
 3442    H    GLY  92           HN       GLY  92 -14.262   9.018   0.571
  Start of MODEL    5
 3443    HA3  GLY  92           HA1      GLY  92 -13.552  10.550   2.867
  Start of MODEL    5
 3444    HA   GLN  93           HA       GLN  93  -9.668   9.379   1.246
  Start of MODEL    5
 3445    HB3  GLN  93           HB2      GLN  93  -8.996  12.180   2.180
  Start of MODEL    5
 3446    HB2  GLN  93           HB3      GLN  93  -9.488  11.773   0.548
  Start of MODEL    5
 3447    HG2  GLN  93           HG2      GLN  93  -7.012  10.698   1.881
  Start of MODEL    5
 3448    HG3  GLN  93           HG3      GLN  93  -7.481  10.482   0.197
  Start of MODEL    5
 3449   HE21  GLN  93          HE21      GLN  93  -5.628  11.495  -0.641
  Start of MODEL    5
 3450   HE22  GLN  93          HE22      GLN  93  -5.385  13.182  -0.487
  Start of MODEL    5
 3451    H    GLN  93           HN       GLN  93 -11.333  11.127   2.908
  Start of MODEL    5
 3452    HA   ALA  94           HA       ALA  94  -7.987   8.784   5.282
  Start of MODEL    5
 3453    HB1  ALA  94           HB1      ALA  94  -7.941   6.141   3.850
  Start of MODEL    5
 3454    HB3  ALA  94           HB2      ALA  94  -9.196   6.690   4.968
  Start of MODEL    5
 3455    HB2  ALA  94           HB3      ALA  94  -7.559   6.358   5.547
  Start of MODEL    5
 3456    H    ALA  94           HN       ALA  94  -8.332   8.180   2.414
  Start of MODEL    5
 3457    HA   SER  95           HA       SER  95  -3.768   7.878   4.265
  Start of MODEL    5
 3458    HB3  SER  95           HB2      SER  95  -3.954  10.219   4.022
  Start of MODEL    5
 3459    HB2  SER  95           HB3      SER  95  -2.613   9.972   5.138
  Start of MODEL    5
 3460    HG   SER  95           HG       SER  95  -4.852  10.101   6.556
  Start of MODEL    5
 3461    H    SER  95           HN       SER  95  -5.901   8.312   6.145
  Start of MODEL    5
 3462    HA   ALA  96           HA       ALA  96  -1.955   6.746   8.080
  Start of MODEL    5
 3463    HB3  ALA  96           HB1      ALA  96  -3.243   4.706   7.620
  Start of MODEL    5
 3464    HB2  ALA  96           HB2      ALA  96  -1.598   4.290   8.107
  Start of MODEL    5
 3465    HB1  ALA  96           HB3      ALA  96  -2.058   4.221   6.408
  Start of MODEL    5
 3466    H    ALA  96           HN       ALA  96  -2.394   6.567   5.183
  Start of MODEL    5
 3467    HA   SER  97           HA       SER  97   2.013   6.612   6.387
  Start of MODEL    5
 3468    HB3  SER  97           HB2      SER  97   1.924   8.717   7.440
  Start of MODEL    5
 3469    HB2  SER  97           HB3      SER  97   3.445   8.007   7.963
  Start of MODEL    5
 3470    HG   SER  97           HG       SER  97   2.740   8.376   9.882
  Start of MODEL    5
 3471    H    SER  97           HN       SER  97   0.262   6.304   8.682
  Start of MODEL    5
 3472    HA   ILE  98           HA       ILE  98   4.791   3.981   8.596
  Start of MODEL    5
 3473    HB   ILE  98           HB       ILE  98   3.803   2.245   7.344
  Start of MODEL    5
 3474   HD11  ILE  98          HD11      ILE  98   5.751   1.122   8.660
  Start of MODEL    5
 3475   HD13  ILE  98          HD12      ILE  98   6.827   2.521   8.312
  Start of MODEL    5
 3476   HD12  ILE  98          HD13      ILE  98   7.292   0.911   7.776
  Start of MODEL    5
 3477    H    ILE  98           HN       ILE  98   4.014   5.695   6.421
  Start of MODEL    5
 3478    HA   MET  99           HA       MET  99   8.391   5.766   6.997
  Start of MODEL    5
 3479    HB3  MET  99           HB2      MET  99   9.117   5.709   9.932
  Start of MODEL    5
 3480    HB2  MET  99           HB3      MET  99   7.944   6.870   9.335
  Start of MODEL    5
 3481    HG2  MET  99           HG2      MET  99   9.632   7.787   7.809
  Start of MODEL    5
 3482    HG3  MET  99           HG3      MET  99  10.085   7.920   9.499
  Start of MODEL    5
 3483    HE2  MET  99           HE1      MET  99  13.453   7.538   7.506
  Start of MODEL    5
 3484    HE1  MET  99           HE2      MET  99  12.519   8.559   8.599
  Start of MODEL    5
 3485    HE3  MET  99           HE3      MET  99  11.978   8.318   6.938
  Start of MODEL    5
 3486    H    MET  99           HN       MET  99   6.792   4.473   9.071
  Start of MODEL    5
 3487    HA   ALA 100           HA       ALA 100  10.309   1.913   7.488
  Start of MODEL    5
 3488    HB1  ALA 100           HB1      ALA 100   9.878   2.150   4.515
  Start of MODEL    5
 3489    HB3  ALA 100           HB2      ALA 100   8.762   1.424   5.667
  Start of MODEL    5
 3490    HB2  ALA 100           HB3      ALA 100  10.344   0.692   5.388
  Start of MODEL    5
 3491    H    ALA 100           HN       ALA 100   9.439   4.227   5.951
  Start of MODEL    5
 3492    HA   ALA 101           HA       ALA 101  14.280   3.271   6.415
  Start of MODEL    5
 3493    HB2  ALA 101           HB1      ALA 101  15.636   3.272   8.462
  Start of MODEL    5
 3494    HB1  ALA 101           HB2      ALA 101  14.336   2.450   9.325
  Start of MODEL    5
 3495    HB3  ALA 101           HB3      ALA 101  14.095   4.088   8.715
  Start of MODEL    5
 3496    H    ALA 101           HN       ALA 101  12.256   1.936   8.046
  Start of MODEL    5
 3497    HA   PHE 102           HA       PHE 102  15.564  -0.886   6.129
  Start of MODEL    5
 3498    HB3  PHE 102           HB2      PHE 102  15.719  -1.703   3.805
  Start of MODEL    5
 3499    HB2  PHE 102           HB3      PHE 102  15.451  -0.073   3.213
  Start of MODEL    5
 3500    HD1  PHE 102           HD1      PHE 102  13.781  -2.347   5.660
  Start of MODEL    5
 3501    HD2  PHE 102           HD2      PHE 102  13.385   0.295   2.356
  Start of MODEL    5
 3502    HE1  PHE 102           HE1      PHE 102  11.359  -2.745   5.636
  Start of MODEL    5
 3503    HE2  PHE 102           HE2      PHE 102  10.962  -0.093   2.327
  Start of MODEL    5
 3504    HZ   PHE 102           HZ       PHE 102   9.942  -1.614   3.971
  Start of MODEL    5
 3505    H    PHE 102           HN       PHE 102  15.034   1.783   5.045
  Start of MODEL    5
 3506    HA   MET 103           HA       MET 103  19.716  -0.015   4.680
  Start of MODEL    5
 3507    HB3  MET 103           HB2      MET 103  20.665   0.153   2.396
  Start of MODEL    5
 3508    HB2  MET 103           HB3      MET 103  19.069   0.532   1.770
  Start of MODEL    5
 3509    HG2  MET 103           HG2      MET 103  19.914  -2.054   3.017
  Start of MODEL    5
 3510    HG3  MET 103           HG3      MET 103  18.275  -1.668   2.482
  Start of MODEL    5
 3511    HE2  MET 103           HE1      MET 103  19.399  -4.209  -0.247
  Start of MODEL    5
 3512    HE1  MET 103           HE2      MET 103  18.173  -3.778   0.946
  Start of MODEL    5
 3513    HE3  MET 103           HE3      MET 103  19.784  -4.250   1.472
  Start of MODEL    5
 3514    H    MET 103           HN       MET 103  17.175   0.610   3.376
  Start of MODEL    5
 3515    HA   ASP 104           HA       ASP 104  20.172   4.206   5.196
  Start of MODEL    5
 3516    HB3  ASP 104           HB2      ASP 104  21.694   3.140   6.883
  Start of MODEL    5
 3517    HB2  ASP 104           HB3      ASP 104  22.204   4.733   6.359
  Start of MODEL    5
 3518    H    ASP 104           HN       ASP 104  21.223   1.550   4.921
  Start of MODEL    5
 3519    HA   ASN 105           HA       ASN 105  22.012   5.654   1.550
  Start of MODEL    5
 3520    HB3  ASN 105           HB2      ASN 105  20.765   8.089   2.873
  Start of MODEL    5
 3521    HB2  ASN 105           HB3      ASN 105  19.918   6.954   1.835
  Start of MODEL    5
 3522   HD21  ASN 105          HD21      ASN 105  22.109   9.658   1.908
  Start of MODEL    5
 3523   HD22  ASN 105          HD22      ASN 105  22.117   9.941   0.214
  Start of MODEL    5
 3524    H    ASN 105           HN       ASN 105  21.020   6.051   4.281
  Start of MODEL    5
 3525    HA   PRO 106           HA       PRO 106  25.931   7.030   3.466
  Start of MODEL    5
 3526    HB3  PRO 106           HB2      PRO 106  27.524   5.987   2.238
  Start of MODEL    5
 3527    HB2  PRO 106           HB3      PRO 106  26.809   6.481   0.702
  Start of MODEL    5
 3528    HG2  PRO 106           HG2      PRO 106  26.221   4.206   0.749
  Start of MODEL    5
 3529    HG3  PRO 106           HG3      PRO 106  25.954   4.234   2.504
  Start of MODEL    5
 3530    HD2  PRO 106           HD2      PRO 106  24.249   5.397   0.327
  Start of MODEL    5
 3531    HD3  PRO 106           HD3      PRO 106  23.771   4.445   1.748
  Start of MODEL    5
 3532    HA   PHE 107           HA       PHE 107  27.177  10.867   1.954
  Start of MODEL    5
 3533    HB3  PHE 107           HB2      PHE 107  24.187  11.267   1.615
  Start of MODEL    5
 3534    HB2  PHE 107           HB3      PHE 107  25.233  10.451   0.451
  Start of MODEL    5
 3535    HD1  PHE 107           HD1      PHE 107  23.918  13.607   1.488
  Start of MODEL    5
 3536    HD2  PHE 107           HD2      PHE 107  27.271  11.809  -0.399
  Start of MODEL    5
 3537    HE1  PHE 107           HE1      PHE 107  24.547  15.781   0.532
  Start of MODEL    5
 3538    HE2  PHE 107           HE2      PHE 107  27.897  13.977  -1.368
  Start of MODEL    5
 3539    HZ   PHE 107           HZ       PHE 107  26.534  15.970  -0.899
  Start of MODEL    5
 3540    H    PHE 107           HN       PHE 107  25.953   9.171   3.621
  Start of MODEL    6
 3541    H1   ASP   1           H        ASP   1 -25.913   0.411  -7.051
  Start of MODEL    6
 3542    H2   ASP   1           H2       ASP   1 -25.333  -1.163  -6.854
  Start of MODEL    6
 3543    H3   ASP   1           H3       ASP   1 -24.232   0.110  -6.948
  Start of MODEL    6
 3544    HA   ASP   1           HA       ASP   1 -24.525  -0.765  -4.746
  Start of MODEL    6
 3545    HB3  ASP   1           HB2      ASP   1 -24.016   1.693  -5.031
  Start of MODEL    6
 3546    HB2  ASP   1           HB3      ASP   1 -24.844   1.307  -3.537
  Start of MODEL    6
 3547    HA   ASP   2           HA       ASP   2 -28.577  -1.054  -3.036
  Start of MODEL    6
 3548    HB3  ASP   2           HB2      ASP   2 -28.699  -2.572  -4.919
  Start of MODEL    6
 3549    HB2  ASP   2           HB3      ASP   2 -29.244  -3.444  -3.501
  Start of MODEL    6
 3550    H    ASP   2           HN       ASP   2 -25.773  -1.367  -3.116
  Start of MODEL    6
 3551    HA   ASP   3           HA       ASP   3 -27.174  -3.661   0.510
  Start of MODEL    6
 3552    HB3  ASP   3           HB2      ASP   3 -24.975  -5.233  -0.902
  Start of MODEL    6
 3553    HB2  ASP   3           HB3      ASP   3 -26.634  -5.777  -0.732
  Start of MODEL    6
 3554    H    ASP   3           HN       ASP   3 -26.264  -3.627  -2.253
  Start of MODEL    6
 3555    HA   ASP   4           HA       ASP   4 -23.674  -0.884   1.067
  Start of MODEL    6
 3556    HB3  ASP   4           HB2      ASP   4 -23.626   1.204  -0.313
  Start of MODEL    6
 3557    HB2  ASP   4           HB3      ASP   4 -25.168   0.742  -1.019
  Start of MODEL    6
 3558    H    ASP   4           HN       ASP   4 -26.437  -1.307   0.099
  Start of MODEL    6
 3559    HA   ASP   5           HA       ASP   5 -27.391   1.240   3.166
  Start of MODEL    6
 3560    HB3  ASP   5           HB2      ASP   5 -28.152   0.131   5.146
  Start of MODEL    6
 3561    HB2  ASP   5           HB3      ASP   5 -26.784  -0.967   5.145
  Start of MODEL    6
 3562    H    ASP   5           HN       ASP   5 -25.993  -1.144   2.583
  Start of MODEL    6
 3563    HA   VAL   6           HA       VAL   6 -23.992   2.181   5.983
  Start of MODEL    6
 3564    HB   VAL   6           HB       VAL   6 -22.280   0.672   7.265
  Start of MODEL    6
 3565    H    VAL   6           HN       VAL   6 -24.697  -0.349   4.765
  Start of MODEL    6
 3566    HA   SER   7           HA       SER   7 -21.164   2.040   2.713
  Start of MODEL    6
 3567    HB3  SER   7           HB2      SER   7 -21.494   4.983   3.347
  Start of MODEL    6
 3568    HB2  SER   7           HB3      SER   7 -22.567   4.086   2.277
  Start of MODEL    6
 3569    HG   SER   7           HG       SER   7 -21.205   4.337   0.786
  Start of MODEL    6
 3570    H    SER   7           HN       SER   7 -22.857   3.301   4.634
  Start of MODEL    6
 3571    HA   PHE   8           HA       PHE   8 -17.991   2.390   5.796
  Start of MODEL    6
 3572    HB3  PHE   8           HB2      PHE   8 -16.431   0.546   5.584
  Start of MODEL    6
 3573    HB2  PHE   8           HB3      PHE   8 -17.083   0.112   4.014
  Start of MODEL    6
 3574    HD1  PHE   8           HD1      PHE   8 -18.211  -1.923   4.042
  Start of MODEL    6
 3575    HD2  PHE   8           HD2      PHE   8 -18.548   0.714   7.379
  Start of MODEL    6
 3576    HE1  PHE   8           HE1      PHE   8 -19.770  -3.470   5.119
  Start of MODEL    6
 3577    HE2  PHE   8           HE2      PHE   8 -20.097  -0.852   8.456
  Start of MODEL    6
 3578    HZ   PHE   8           HZ       PHE   8 -20.614  -3.061   7.278
  Start of MODEL    6
 3579    H    PHE   8           HN       PHE   8 -19.490   1.100   3.732
  Start of MODEL    6
 3580    HA   CYS   9           HA       CYS   9 -15.882   4.672   2.730
  Start of MODEL    6
 3581    HB3  CYS   9           HB2      CYS   9 -14.971   6.693   3.769
  Start of MODEL    6
 3582    HB2  CYS   9           HB3      CYS   9 -15.136   5.960   5.365
  Start of MODEL    6
 3583    H    CYS   9           HN       CYS   9 -16.591   3.965   5.442
  Start of MODEL    6
 3584    HA   ALA  10           HA       ALA  10 -12.017   2.996   2.971
  Start of MODEL    6
 3585    HB2  ALA  10           HB1      ALA  10 -10.208   4.056   1.771
  Start of MODEL    6
 3586    HB1  ALA  10           HB2      ALA  10 -10.960   5.631   1.992
  Start of MODEL    6
 3587    HB3  ALA  10           HB3      ALA  10 -11.751   4.412   0.975
  Start of MODEL    6
 3588    H    ALA  10           HN       ALA  10 -13.240   5.636   2.987
  Start of MODEL    6
 3589    HA   SER  11           HA       SER  11  -9.672   4.391   6.266
  Start of MODEL    6
 3590    HB3  SER  11           HB2      SER  11 -10.097   2.940   8.162
  Start of MODEL    6
 3591    HB2  SER  11           HB3      SER  11 -10.735   1.680   7.093
  Start of MODEL    6
 3592    HG   SER  11           HG       SER  11 -12.076   3.706   6.436
  Start of MODEL    6
 3593    H    SER  11           HN       SER  11 -10.991   2.389   4.620
  Start of MODEL    6
 3594    HA   VAL  12           HA       VAL  12  -6.256   1.836   5.161
  Start of MODEL    6
 3595    HB   VAL  12           HB       VAL  12  -5.274   4.696   5.402
  Start of MODEL    6
 3596    H    VAL  12           HN       VAL  12  -7.501   4.095   6.581
  Start of MODEL    6
 3597    HA   GLN  13           HA       GLN  13  -3.814   1.701   8.783
  Start of MODEL    6
 3598    HB3  GLN  13           HB2      GLN  13  -3.798  -0.606   9.748
  Start of MODEL    6
 3599    HB2  GLN  13           HB3      GLN  13  -4.867  -1.104   8.450
  Start of MODEL    6
 3600    HG2  GLN  13           HG2      GLN  13  -5.469   0.938  10.555
  Start of MODEL    6
 3601    HG3  GLN  13           HG3      GLN  13  -6.524   0.493   9.213
  Start of MODEL    6
 3602   HE21  GLN  13          HE21      GLN  13  -4.551  -1.822  10.962
  Start of MODEL    6
 3603   HE22  GLN  13          HE22      GLN  13  -5.863  -2.619  11.727
  Start of MODEL    6
 3604    H    GLN  13           HN       GLN  13  -5.246   0.515   6.531
  Start of MODEL    6
 3605    HA   LEU  14           HA       LEU  14  -0.567  -0.140   6.627
  Start of MODEL    6
 3606    HB3  LEU  14           HB2      LEU  14   1.504   1.412   6.924
  Start of MODEL    6
 3607    HB2  LEU  14           HB3      LEU  14   0.351   2.553   7.597
  Start of MODEL    6
 3608    HG   LEU  14           HG       LEU  14  -0.964   2.253   5.399
  Start of MODEL    6
 3609   HD13  LEU  14          HD11      LEU  14   0.384   4.250   5.837
  Start of MODEL    6
 3610   HD12  LEU  14          HD12      LEU  14   0.454   3.744   4.148
  Start of MODEL    6
 3611   HD11  LEU  14          HD13      LEU  14   1.815   3.408   5.222
  Start of MODEL    6
 3612   HD22  LEU  14          HD21      LEU  14   0.279   1.419   3.516
  Start of MODEL    6
 3613   HD21  LEU  14          HD22      LEU  14   0.161   0.175   4.776
  Start of MODEL    6
 3614   HD23  LEU  14          HD23      LEU  14   1.658   1.072   4.558
  Start of MODEL    6
 3615    H    LEU  14           HN       LEU  14  -1.726   1.743   8.500
  Start of MODEL    6
 3616    HA   HIS  15           HA       HIS  15   1.583  -1.764  10.050
  Start of MODEL    6
 3617    HB3  HIS  15           HB2      HIS  15   1.942  -4.149   9.386
  Start of MODEL    6
 3618    HB2  HIS  15           HB3      HIS  15   1.615  -3.712   7.723
  Start of MODEL    6
 3619    HD1  HIS  15           HD1      HIS  15  -0.014  -5.164  10.512
  Start of MODEL    6
 3620    HD2  HIS  15           HD2      HIS  15  -1.179  -2.610   7.458
  Start of MODEL    6
 3621    HE1  HIS  15           HE1      HIS  15  -2.499  -5.406  10.344
  Start of MODEL    6
 3622    HE2  HIS  15           HE2      HIS  15  -3.095  -4.125   8.264
  Start of MODEL    6
 3623    H    HIS  15           HN       HIS  15   1.488  -1.126   7.183
  Start of MODEL    6
 3624    HA   THR  16           HA       THR  16   5.823  -1.186   9.447
  Start of MODEL    6
 3625    HB   THR  16           HB       THR  16   5.877  -3.377  11.534
  Start of MODEL    6
 3626    HG1  THR  16           HG1      THR  16   5.626  -0.541  11.901
  Start of MODEL    6
 3627   HG22  THR  16          HG21      THR  16   7.952  -2.277  12.238
  Start of MODEL    6
 3628   HG21  THR  16          HG22      THR  16   7.718  -1.034  11.010
  Start of MODEL    6
 3629   HG23  THR  16          HG23      THR  16   8.044  -2.693  10.521
  Start of MODEL    6
 3630    H    THR  16           HN       THR  16   3.641  -2.294  10.747
  Start of MODEL    6
 3631    HA   ALA  17           HA       ALA  17   6.662  -4.048   6.272
  Start of MODEL    6
 3632    HB2  ALA  17           HB1      ALA  17   9.385  -2.930   6.914
  Start of MODEL    6
 3633    HB1  ALA  17           HB2      ALA  17   8.210  -2.167   5.855
  Start of MODEL    6
 3634    HB3  ALA  17           HB3      ALA  17   8.900  -3.733   5.417
  Start of MODEL    6
 3635    H    ALA  17           HN       ALA  17   7.202  -1.986   8.015
  Start of MODEL    6
 3636    HA   VAL  18           HA       VAL  18   8.119  -7.373   8.547
  Start of MODEL    6
 3637    HB   VAL  18           HB       VAL  18   7.430  -9.538   7.496
  Start of MODEL    6
 3638    H    VAL  18           HN       VAL  18   7.250  -6.124   6.074
  Start of MODEL    6
 3639    HA   GLU  19           HA       GLU  19  12.039  -7.905   7.180
  Start of MODEL    6
 3640    HB3  GLU  19           HB2      GLU  19  13.313  -8.985   8.961
  Start of MODEL    6
 3641    HB2  GLU  19           HB3      GLU  19  11.824  -9.623   9.645
  Start of MODEL    6
 3642    HG2  GLU  19           HG2      GLU  19  12.563  -6.721   9.362
  Start of MODEL    6
 3643    HG3  GLU  19           HG3      GLU  19  11.033  -7.319   9.992
  Start of MODEL    6
 3644    H    GLU  19           HN       GLU  19   9.772  -8.742   8.722
  Start of MODEL    6
 3645    HA   MET  20           HA       MET  20  12.812 -11.747   5.322
  Start of MODEL    6
 3646    HB3  MET  20           HB2      MET  20  11.507 -12.052   3.206
  Start of MODEL    6
 3647    HB2  MET  20           HB3      MET  20  10.871 -10.431   3.386
  Start of MODEL    6
 3648    HG2  MET  20           HG2      MET  20  10.384 -12.693   5.309
  Start of MODEL    6
 3649    HG3  MET  20           HG3      MET  20   9.689 -11.076   5.395
  Start of MODEL    6
 3650    HE1  MET  20           HE1      MET  20   9.030 -10.507   2.298
  Start of MODEL    6
 3651    HE3  MET  20           HE2      MET  20   7.903 -10.145   3.606
  Start of MODEL    6
 3652    HE2  MET  20           HE3      MET  20   7.367 -11.083   2.215
  Start of MODEL    6
 3653    H    MET  20           HN       MET  20  12.231  -8.909   5.337
  Start of MODEL    6
 3654    HA   HIS  21           HA       HIS  21  15.603 -10.151   2.324
  Start of MODEL    6
 3655    HB3  HIS  21           HB2      HIS  21  14.506 -12.065   0.232
  Start of MODEL    6
 3656    HB2  HIS  21           HB3      HIS  21  15.584 -12.572   1.517
  Start of MODEL    6
 3657    HD1  HIS  21           HD1      HIS  21  17.911 -12.806   0.740
  Start of MODEL    6
 3658    HD2  HIS  21           HD2      HIS  21  15.929  -9.771  -1.294
  Start of MODEL    6
 3659    HE1  HIS  21           HE1      HIS  21  19.567 -11.894  -0.880
  Start of MODEL    6
 3660    HE2  HIS  21           HE2      HIS  21  18.430  -9.920  -1.918
  Start of MODEL    6
 3661    H    HIS  21           HN       HIS  21  13.363 -11.950   2.578
  Start of MODEL    6
 3662    HA   HIS  22           HA       HIS  22  12.735  -8.130  -0.568
  Start of MODEL    6
 3663    HB3  HIS  22           HB2      HIS  22  11.910  -9.837  -2.139
  Start of MODEL    6
 3664    HB2  HIS  22           HB3      HIS  22  10.633  -8.703  -1.783
  Start of MODEL    6
 3665    HD1  HIS  22           HD1      HIS  22  11.591 -12.292  -1.139
  Start of MODEL    6
 3666    HD2  HIS  22           HD2      HIS  22   8.306  -9.781  -0.697
  Start of MODEL    6
 3667    HE1  HIS  22           HE1      HIS  22   9.667 -13.795  -0.605
  Start of MODEL    6
 3668    HE2  HIS  22           HE2      HIS  22   7.677 -12.309  -0.706
  Start of MODEL    6
 3669    H    HIS  22           HN       HIS  22  12.609 -10.795   0.584
  Start of MODEL    6
 3670    HA   TRP  23           HA       TRP  23  10.557  -6.958   2.881
  Start of MODEL    6
 3671    HB3  TRP  23           HB2      TRP  23  10.726  -4.458   3.132
  Start of MODEL    6
 3672    HB2  TRP  23           HB3      TRP  23  11.570  -4.436   1.586
  Start of MODEL    6
 3673    HD1  TRP  23           HD1      TRP  23  14.005  -5.628   1.520
  Start of MODEL    6
 3674    HE1  TRP  23           HE1      TRP  23  15.736  -6.040   3.387
  Start of MODEL    6
 3675    HE3  TRP  23           HE3      TRP  23  10.991  -4.944   5.575
  Start of MODEL    6
 3676    HZ2  TRP  23           HZ2      TRP  23  15.805  -6.060   6.206
  Start of MODEL    6
 3677    HZ3  TRP  23           HZ3      TRP  23  11.953  -5.172   7.812
  Start of MODEL    6
 3678    HH2  TRP  23           HH2      TRP  23  14.316  -5.720   8.128
  Start of MODEL    6
 3679    H    TRP  23           HN       TRP  23  11.887  -6.485   0.384
  Start of MODEL    6
 3680    HA   CYS  24           HA       CYS  24   6.775  -5.585   1.269
  Start of MODEL    6
 3681    HB3  CYS  24           HB2      CYS  24   6.479  -8.010   3.030
  Start of MODEL    6
 3682    HB2  CYS  24           HB3      CYS  24   6.465  -7.930   1.276
  Start of MODEL    6
 3683    H    CYS  24           HN       CYS  24   8.552  -6.573   3.375
  Start of MODEL    6
 3684    HA   ILE  25           HA       ILE  25   5.159  -3.467   4.730
  Start of MODEL    6
 3685    HB   ILE  25           HB       ILE  25   4.720  -1.643   2.334
  Start of MODEL    6
 3686   HD13  ILE  25          HD11      ILE  25   6.564   0.172   2.024
  Start of MODEL    6
 3687   HD12  ILE  25          HD12      ILE  25   7.897   0.217   3.177
  Start of MODEL    6
 3688   HD11  ILE  25          HD13      ILE  25   6.278   0.708   3.678
  Start of MODEL    6
 3689    H    ILE  25           HN       ILE  25   5.648  -3.945   1.884
  Start of MODEL    6
 3690    HA   PRO  26           HA       PRO  26   1.175  -5.243   3.449
  Start of MODEL    6
 3691    HB3  PRO  26           HB2      PRO  26   0.865  -6.808   5.067
  Start of MODEL    6
 3692    HB2  PRO  26           HB3      PRO  26   0.670  -5.558   6.298
  Start of MODEL    6
 3693    HG2  PRO  26           HG2      PRO  26   2.695  -6.373   7.036
  Start of MODEL    6
 3694    HG3  PRO  26           HG3      PRO  26   3.125  -6.998   5.433
  Start of MODEL    6
 3695    HD2  PRO  26           HD2      PRO  26   3.372  -4.213   6.515
  Start of MODEL    6
 3696    HD3  PRO  26           HD3      PRO  26   4.495  -5.159   5.510
  Start of MODEL    6
 3697    HA   PHE  27           HA       PHE  27  -1.362  -2.163   5.206
  Start of MODEL    6
 3698    HB3  PHE  27           HB2      PHE  27  -0.426  -0.960   3.339
  Start of MODEL    6
 3699    HB2  PHE  27           HB3      PHE  27  -2.147  -0.629   3.428
  Start of MODEL    6
 3700    HD1  PHE  27           HD1      PHE  27  -3.681  -1.552   1.736
  Start of MODEL    6
 3701    HD2  PHE  27           HD2      PHE  27   0.541  -1.988   1.453
  Start of MODEL    6
 3702    HE1  PHE  27           HE1      PHE  27  -3.900  -2.078  -0.640
  Start of MODEL    6
 3703    HE2  PHE  27           HE2      PHE  27   0.326  -2.517  -0.929
  Start of MODEL    6
 3704    HZ   PHE  27           HZ       PHE  27  -1.900  -2.563  -1.983
  Start of MODEL    6
 3705    H    PHE  27           HN       PHE  27  -0.754  -4.231   3.270
  Start of MODEL    6
 3706    HA   SER  28           HA       SER  28  -5.317  -3.769   4.459
  Start of MODEL    6
 3707    HB3  SER  28           HB2      SER  28  -6.284  -4.017   6.626
  Start of MODEL    6
 3708    HB2  SER  28           HB3      SER  28  -5.388  -2.633   7.259
  Start of MODEL    6
 3709    HG   SER  28           HG       SER  28  -4.136  -4.920   6.204
  Start of MODEL    6
 3710    H    SER  28           HN       SER  28  -3.463  -1.816   5.617
  Start of MODEL    6
 3711    HA   VAL  29           HA       VAL  29  -7.568  -0.040   4.177
  Start of MODEL    6
 3712    HB   VAL  29           HB       VAL  29  -6.209   0.612   2.199
  Start of MODEL    6
 3713    H    VAL  29           HN       VAL  29  -6.481  -2.520   3.094
  Start of MODEL    6
 3714    HA   ASP  30           HA       ASP  30 -11.213  -2.111   3.210
  Start of MODEL    6
 3715    HB3  ASP  30           HB2      ASP  30 -10.810  -2.710   5.647
  Start of MODEL    6
 3716    HB2  ASP  30           HB3      ASP  30 -12.487  -2.649   5.148
  Start of MODEL    6
 3717    H    ASP  30           HN       ASP  30  -9.611  -0.143   4.668
  Start of MODEL    6
 3718    HA2  GLY  31           HA2      GLY  31 -14.865   0.537   3.537
  Start of MODEL    6
 3719    H    GLY  31           HN       GLY  31 -13.406  -1.624   2.998
  Start of MODEL    6
 3720    HA3  GLY  31           HA1      GLY  31 -13.797   1.124   2.257
  Start of MODEL    6
 3721    HA   GLN  32           HA       GLN  32 -16.717  -1.746   0.521
  Start of MODEL    6
 3722    HB3  GLN  32           HB2      GLN  32 -19.209  -0.102   0.923
  Start of MODEL    6
 3723    HB2  GLN  32           HB3      GLN  32 -18.623  -1.181   2.183
  Start of MODEL    6
 3724    HG2  GLN  32           HG2      GLN  32 -19.367  -1.916  -0.638
  Start of MODEL    6
 3725    HG3  GLN  32           HG3      GLN  32 -18.664  -3.027   0.532
  Start of MODEL    6
 3726   HE21  GLN  32          HE21      GLN  32 -21.462  -1.356  -0.475
  Start of MODEL    6
 3727   HE22  GLN  32          HE22      GLN  32 -22.554  -2.194   0.580
  Start of MODEL    6
 3728    H    GLN  32           HN       GLN  32 -16.684   0.669   2.101
  Start of MODEL    6
 3729    HA   PRO  33           HA       PRO  33 -17.519   1.416  -2.990
  Start of MODEL    6
 3730    HB3  PRO  33           HB2      PRO  33 -18.351   3.516  -2.460
  Start of MODEL    6
 3731    HB2  PRO  33           HB3      PRO  33 -16.655   3.981  -2.310
  Start of MODEL    6
 3732    HG2  PRO  33           HG2      PRO  33 -16.666   3.768  -0.007
  Start of MODEL    6
 3733    HG3  PRO  33           HG3      PRO  33 -18.368   4.197  -0.246
  Start of MODEL    6
 3734    HD2  PRO  33           HD2      PRO  33 -17.652   1.969   1.044
  Start of MODEL    6
 3735    HD3  PRO  33           HD3      PRO  33 -19.081   2.013  -0.010
  Start of MODEL    6
 3736    HA   ALA  34           HA       ALA  34 -13.366   0.259  -2.738
  Start of MODEL    6
 3737    HB1  ALA  34           HB1      ALA  34 -14.307  -1.057  -4.551
  Start of MODEL    6
 3738    HB3  ALA  34           HB2      ALA  34 -12.628  -0.600  -4.874
  Start of MODEL    6
 3739    HB2  ALA  34           HB3      ALA  34 -13.956   0.241  -5.687
  Start of MODEL    6
 3740    H    ALA  34           HN       ALA  34 -15.775   0.863  -4.065
  Start of MODEL    6
 3741    HA   PRO  35           HA       PRO  35 -11.473   4.243  -3.496
  Start of MODEL    6
 3742    HB3  PRO  35           HB2      PRO  35 -11.178   4.157  -1.177
  Start of MODEL    6
 3743    HB2  PRO  35           HB3      PRO  35  -9.509   4.068  -1.751
  Start of MODEL    6
 3744    HG2  PRO  35           HG2      PRO  35  -9.396   1.778  -1.460
  Start of MODEL    6
 3745    HG3  PRO  35           HG3      PRO  35 -10.428   2.198  -0.099
  Start of MODEL    6
 3746    HD2  PRO  35           HD2      PRO  35 -11.169   0.414  -2.088
  Start of MODEL    6
 3747    HD3  PRO  35           HD3      PRO  35 -12.335   1.352  -1.130
  Start of MODEL    6
 3748    HA   SER  36           HA       SER  36  -7.936   3.026  -5.781
  Start of MODEL    6
 3749    HB3  SER  36           HB2      SER  36  -8.819   4.719  -7.183
  Start of MODEL    6
 3750    HB2  SER  36           HB3      SER  36  -7.133   5.169  -6.925
  Start of MODEL    6
 3751    HG   SER  36           HG       SER  36  -7.747   6.872  -5.859
  Start of MODEL    6
 3752    H    SER  36           HN       SER  36  -9.538   4.999  -4.400
  Start of MODEL    6
 3753    HA   LEU  37           HA       LEU  37  -4.886   4.073  -2.851
  Start of MODEL    6
 3754    HB3  LEU  37           HB2      LEU  37  -3.237   2.189  -2.802
  Start of MODEL    6
 3755    HB2  LEU  37           HB3      LEU  37  -3.936   1.607  -4.294
  Start of MODEL    6
 3756    HG   LEU  37           HG       LEU  37  -6.103   1.303  -3.099
  Start of MODEL    6
 3757   HD13  LEU  37          HD11      LEU  37  -4.550  -0.537  -3.381
  Start of MODEL    6
 3758   HD12  LEU  37          HD12      LEU  37  -5.388  -0.652  -1.836
  Start of MODEL    6
 3759   HD11  LEU  37          HD13      LEU  37  -3.719  -0.083  -1.894
  Start of MODEL    6
 3760   HD22  LEU  37          HD21      LEU  37  -6.069   1.357  -0.622
  Start of MODEL    6
 3761   HD21  LEU  37          HD22      LEU  37  -5.807   2.941  -1.338
  Start of MODEL    6
 3762   HD23  LEU  37          HD23      LEU  37  -4.439   2.028  -0.698
  Start of MODEL    6
 3763    H    LEU  37           HN       LEU  37  -5.741   2.857  -5.364
  Start of MODEL    6
 3764    HA   ARG  38           HA       ARG  38  -1.350   5.603  -4.954
  Start of MODEL    6
 3765    HB3  ARG  38           HB2      ARG  38  -3.006   7.792  -3.676
  Start of MODEL    6
 3766    HB2  ARG  38           HB3      ARG  38  -2.850   7.372  -5.356
  Start of MODEL    6
 3767    HG2  ARG  38           HG2      ARG  38  -1.779   9.459  -5.023
  Start of MODEL    6
 3768    HG3  ARG  38           HG3      ARG  38  -0.813   8.838  -3.694
  Start of MODEL    6
 3769    HD2  ARG  38           HD2      ARG  38   0.309   9.119  -5.947
  Start of MODEL    6
 3770    HD3  ARG  38           HD3      ARG  38   0.540   7.568  -5.140
  Start of MODEL    6
 3771    HE   ARG  38           HE       ARG  38  -1.607   7.830  -7.073
  Start of MODEL    6
 3772   HH11  ARG  38          HH11      ARG  38   1.782   6.735  -6.506
  Start of MODEL    6
 3773   HH12  ARG  38          HH12      ARG  38   1.636   5.501  -7.678
  Start of MODEL    6
 3774   HH21  ARG  38          HH21      ARG  38  -1.640   6.086  -8.674
  Start of MODEL    6
 3775   HH22  ARG  38          HH22      ARG  38  -0.254   5.089  -8.840
  Start of MODEL    6
 3776    H    ARG  38           HN       ARG  38  -3.192   5.322  -2.707
  Start of MODEL    6
 3777    HA   TRP  39           HA       TRP  39   1.286   5.813  -1.507
  Start of MODEL    6
 3778    HB3  TRP  39           HB2      TRP  39   3.543   5.029  -2.207
  Start of MODEL    6
 3779    HB2  TRP  39           HB3      TRP  39   2.947   4.908  -3.857
  Start of MODEL    6
 3780    HD1  TRP  39           HD1      TRP  39   1.598   2.768  -4.499
  Start of MODEL    6
 3781    HE1  TRP  39           HE1      TRP  39   0.975   0.625  -3.249
  Start of MODEL    6
 3782    HE3  TRP  39           HE3      TRP  39   2.882   4.221   0.233
  Start of MODEL    6
 3783    HZ2  TRP  39           HZ2      TRP  39   1.004  -0.327  -0.571
  Start of MODEL    6
 3784    HZ3  TRP  39           HZ3      TRP  39   2.549   2.634   2.087
  Start of MODEL    6
 3785    HH2  TRP  39           HH2      TRP  39   1.635   0.409   1.691
  Start of MODEL    6
 3786    H    TRP  39           HN       TRP  39   0.695   5.677  -4.346
  Start of MODEL    6
 3787    HA   LEU  40           HA       LEU  40   3.715   9.367  -2.358
  Start of MODEL    6
 3788    HB3  LEU  40           HB2      LEU  40   2.287   9.780   0.281
  Start of MODEL    6
 3789    HB2  LEU  40           HB3      LEU  40   1.552  10.071  -1.275
  Start of MODEL    6
 3790    HG   LEU  40           HG       LEU  40   4.001  11.558  -0.423
  Start of MODEL    6
 3791   HD13  LEU  40          HD11      LEU  40   3.533  11.574  -2.764
  Start of MODEL    6
 3792   HD12  LEU  40          HD12      LEU  40   3.182  13.161  -2.077
  Start of MODEL    6
 3793   HD11  LEU  40          HD13      LEU  40   1.862  12.044  -2.465
  Start of MODEL    6
 3794   HD22  LEU  40          HD21      LEU  40   2.519  13.367   0.274
  Start of MODEL    6
 3795   HD21  LEU  40          HD22      LEU  40   2.273  11.928   1.262
  Start of MODEL    6
 3796   HD23  LEU  40          HD23      LEU  40   1.117  12.332  -0.005
  Start of MODEL    6
 3797    H    LEU  40           HN       LEU  40   2.483   7.331  -0.646
  Start of MODEL    6
 3798    HA   PHE  41           HA       PHE  41   6.657   8.561   0.855
  Start of MODEL    6
 3799    HB3  PHE  41           HB2      PHE  41   8.053   8.411  -1.830
  Start of MODEL    6
 3800    HB2  PHE  41           HB3      PHE  41   7.302   7.073  -0.967
  Start of MODEL    6
 3801    HD1  PHE  41           HD1      PHE  41  10.254   9.148  -1.278
  Start of MODEL    6
 3802    HD2  PHE  41           HD2      PHE  41   8.315   6.201   1.092
  Start of MODEL    6
 3803    HE1  PHE  41           HE1      PHE  41  12.377   8.670  -0.140
  Start of MODEL    6
 3804    HE2  PHE  41           HE2      PHE  41  10.438   5.719   2.226
  Start of MODEL    6
 3805    HZ   PHE  41           HZ       PHE  41  12.468   6.957   1.612
  Start of MODEL    6
 3806    H    PHE  41           HN       PHE  41   5.792   9.844  -1.632
  Start of MODEL    6
 3807    HA   ASN  42           HA       ASN  42   8.559  11.895   2.919
  Start of MODEL    6
 3808    HB3  ASN  42           HB2      ASN  42  10.203  11.675   0.358
  Start of MODEL    6
 3809    HB2  ASN  42           HB3      ASN  42  10.503  10.733   1.802
  Start of MODEL    6
 3810   HD21  ASN  42          HD21      ASN  42  11.409  11.740   3.625
  Start of MODEL    6
 3811   HD22  ASN  42          HD22      ASN  42  12.241  13.243   3.501
  Start of MODEL    6
 3812    H    ASN  42           HN       ASN  42   7.452  10.068   2.102
  Start of MODEL    6
 3813    HA2  GLY  43           HA2      GLY  43   4.971  14.200   0.834
  Start of MODEL    6
 3814    H    GLY  43           HN       GLY  43   6.226  12.250   1.192
  Start of MODEL    6
 3815    HA3  GLY  43           HA1      GLY  43   6.458  15.140   0.860
  Start of MODEL    6
 3816    HA   SER  44           HA       SER  44   6.341  14.134  -3.504
  Start of MODEL    6
 3817    HB3  SER  44           HB2      SER  44   8.703  14.345  -3.345
  Start of MODEL    6
 3818    HB2  SER  44           HB3      SER  44   8.445  13.017  -4.471
  Start of MODEL    6
 3819    HG   SER  44           HG       SER  44   8.568  11.826  -2.180
  Start of MODEL    6
 3820    H    SER  44           HN       SER  44   7.224  12.732  -1.068
  Start of MODEL    6
 3821    HA   VAL  45           HA       VAL  45   4.062  10.881  -4.673
  Start of MODEL    6
 3822    HB   VAL  45           HB       VAL  45   4.879  12.039  -7.347
  Start of MODEL    6
 3823    H    VAL  45           HN       VAL  45   5.878  12.957  -5.306
  Start of MODEL    6
 3824    HA   LEU  46           HA       LEU  46   6.892   7.720  -5.627
  Start of MODEL    6
 3825    HB3  LEU  46           HB2      LEU  46   4.975   6.609  -3.563
  Start of MODEL    6
 3826    HB2  LEU  46           HB3      LEU  46   6.570   7.252  -3.239
  Start of MODEL    6
 3827    HG   LEU  46           HG       LEU  46   5.989   4.750  -4.838
  Start of MODEL    6
 3828   HD12  LEU  46          HD11      LEU  46   8.403   4.359  -4.696
  Start of MODEL    6
 3829   HD11  LEU  46          HD12      LEU  46   8.611   5.938  -3.934
  Start of MODEL    6
 3830   HD13  LEU  46          HD13      LEU  46   8.020   5.827  -5.593
  Start of MODEL    6
 3831   HD22  LEU  46          HD21      LEU  46   6.951   3.561  -2.923
  Start of MODEL    6
 3832   HD21  LEU  46          HD22      LEU  46   5.489   4.438  -2.477
  Start of MODEL    6
 3833   HD23  LEU  46          HD23      LEU  46   7.072   5.081  -2.039
  Start of MODEL    6
 3834    H    LEU  46           HN       LEU  46   4.575   8.877  -4.337
  Start of MODEL    6
 3835    HA   ASN  47           HA       ASN  47   3.977   5.926  -8.246
  Start of MODEL    6
 3836    HB3  ASN  47           HB2      ASN  47   5.075   5.640 -10.546
  Start of MODEL    6
 3837    HB2  ASN  47           HB3      ASN  47   6.474   6.447  -9.848
  Start of MODEL    6
 3838   HD21  ASN  47          HD21      ASN  47   3.196   6.793 -10.856
  Start of MODEL    6
 3839   HD22  ASN  47          HD22      ASN  47   3.150   8.518 -10.858
  Start of MODEL    6
 3840    H    ASN  47           HN       ASN  47   6.662   6.677  -7.443
  Start of MODEL    6
 3841    HA   GLU  48           HA       GLU  48   4.951   1.726  -7.671
  Start of MODEL    6
 3842    HB3  GLU  48           HB2      GLU  48   3.192   0.341  -8.528
  Start of MODEL    6
 3843    HB2  GLU  48           HB3      GLU  48   2.769   1.510  -9.763
  Start of MODEL    6
 3844    HG2  GLU  48           HG2      GLU  48   1.257   1.163  -7.635
  Start of MODEL    6
 3845    HG3  GLU  48           HG3      GLU  48   2.422   2.276  -6.916
  Start of MODEL    6
 3846    H    GLU  48           HN       GLU  48   3.446   3.885  -8.642
  Start of MODEL    6
 3847    HA   THR  49           HA       THR  49   6.847   1.075 -11.530
  Start of MODEL    6
 3848    HB   THR  49           HB       THR  49   7.997   2.984 -10.479
  Start of MODEL    6
 3849    HG1  THR  49           HG1      THR  49   8.837   2.236 -12.392
  Start of MODEL    6
 3850   HG23  THR  49          HG21      THR  49   8.623   1.963  -8.351
  Start of MODEL    6
 3851   HG22  THR  49          HG22      THR  49  10.051   2.633  -9.144
  Start of MODEL    6
 3852   HG21  THR  49          HG23      THR  49   9.753   0.892  -9.182
  Start of MODEL    6
 3853    H    THR  49           HN       THR  49   6.599   0.703  -8.677
  Start of MODEL    6
 3854    HA   SER  50           HA       SER  50   8.889  -2.700 -11.888
  Start of MODEL    6
 3855    HB3  SER  50           HB2      SER  50  11.087  -2.916 -12.735
  Start of MODEL    6
 3856    HB2  SER  50           HB3      SER  50  11.629  -1.463 -11.888
  Start of MODEL    6
 3857    HG   SER  50           HG       SER  50   9.536  -1.366 -13.774
  Start of MODEL    6
 3858    H    SER  50           HN       SER  50   9.477   0.036 -11.705
  Start of MODEL    6
 3859    HA   PHE  51           HA       PHE  51  11.698  -3.463  -8.295
  Start of MODEL    6
 3860    HB3  PHE  51           HB2      PHE  51  13.231  -2.132  -6.913
  Start of MODEL    6
 3861    HB2  PHE  51           HB3      PHE  51  12.587  -0.656  -7.617
  Start of MODEL    6
 3862    HD1  PHE  51           HD1      PHE  51  14.404  -3.778  -8.460
  Start of MODEL    6
 3863    HD2  PHE  51           HD2      PHE  51  13.447   0.203  -9.604
  Start of MODEL    6
 3864    HE1  PHE  51           HE1      PHE  51  16.068  -3.899 -10.267
  Start of MODEL    6
 3865    HE2  PHE  51           HE2      PHE  51  15.103   0.089 -11.412
  Start of MODEL    6
 3866    HZ   PHE  51           HZ       PHE  51  16.418  -1.963 -11.748
  Start of MODEL    6
 3867    H    PHE  51           HN       PHE  51  11.048  -0.966  -9.612
  Start of MODEL    6
 3868    HA   ILE  52           HA       ILE  52   8.927  -1.734  -5.038
  Start of MODEL    6
 3869    HB   ILE  52           HB       ILE  52   8.389   1.030  -6.155
  Start of MODEL    6
 3870   HD12  ILE  52          HD11      ILE  52  11.478   2.572  -4.803
  Start of MODEL    6
 3871   HD11  ILE  52          HD12      ILE  52   9.902   2.546  -4.003
  Start of MODEL    6
 3872   HD13  ILE  52          HD13      ILE  52  10.011   2.888  -5.731
  Start of MODEL    6
 3873    H    ILE  52           HN       ILE  52   9.688  -0.729  -7.715
  Start of MODEL    6
 3874    HA   PHE  53           HA       PHE  53   5.039  -1.619  -7.079
  Start of MODEL    6
 3875    HB3  PHE  53           HB2      PHE  53   6.143  -3.093  -8.657
  Start of MODEL    6
 3876    HB2  PHE  53           HB3      PHE  53   4.518  -3.675  -8.328
  Start of MODEL    6
 3877    HD1  PHE  53           HD1      PHE  53   8.085  -4.331  -7.789
  Start of MODEL    6
 3878    HD2  PHE  53           HD2      PHE  53   4.120  -5.801  -7.336
  Start of MODEL    6
 3879    HE1  PHE  53           HE1      PHE  53   8.979  -6.554  -7.257
  Start of MODEL    6
 3880    HE2  PHE  53           HE2      PHE  53   4.999  -8.027  -6.801
  Start of MODEL    6
 3881    HZ   PHE  53           HZ       PHE  53   7.412  -8.441  -6.850
  Start of MODEL    6
 3882    H    PHE  53           HN       PHE  53   7.061  -2.963  -5.478
  Start of MODEL    6
 3883    HA   THR  54           HA       THR  54   2.535  -3.304  -4.055
  Start of MODEL    6
 3884    HB   THR  54           HB       THR  54   0.575  -2.092  -6.026
  Start of MODEL    6
 3885    HG1  THR  54           HG1      THR  54   2.546  -0.949  -4.807
  Start of MODEL    6
 3886   HG23  THR  54          HG21      THR  54  -0.496  -3.445  -4.269
  Start of MODEL    6
 3887   HG22  THR  54          HG22      THR  54  -0.819  -1.727  -4.028
  Start of MODEL    6
 3888   HG21  THR  54          HG23      THR  54   0.393  -2.547  -3.041
  Start of MODEL    6
 3889    H    THR  54           HN       THR  54   2.930  -2.379  -6.778
  Start of MODEL    6
 3890    HA   GLU  55           HA       GLU  55   0.584  -6.793  -5.896
  Start of MODEL    6
 3891    HB3  GLU  55           HB2      GLU  55   2.266  -7.899  -3.634
  Start of MODEL    6
 3892    HB2  GLU  55           HB3      GLU  55   2.896  -7.571  -5.238
  Start of MODEL    6
 3893    HG2  GLU  55           HG2      GLU  55   2.407  -9.934  -4.913
  Start of MODEL    6
 3894    HG3  GLU  55           HG3      GLU  55   0.711  -9.550  -4.595
  Start of MODEL    6
 3895    H    GLU  55           HN       GLU  55   1.767  -5.297  -3.671
  Start of MODEL    6
 3896    HA   PHE  56           HA       PHE  56  -2.300  -7.074  -2.690
  Start of MODEL    6
 3897    HB3  PHE  56           HB2      PHE  56  -4.587  -7.323  -3.667
  Start of MODEL    6
 3898    HB2  PHE  56           HB3      PHE  56  -3.844  -7.525  -5.252
  Start of MODEL    6
 3899    HD1  PHE  56           HD1      PHE  56  -4.481  -5.149  -2.505
  Start of MODEL    6
 3900    HD2  PHE  56           HD2      PHE  56  -2.942  -5.660  -6.439
  Start of MODEL    6
 3901    HE1  PHE  56           HE1      PHE  56  -4.473  -2.708  -2.818
  Start of MODEL    6
 3902    HE2  PHE  56           HE2      PHE  56  -2.922  -3.232  -6.748
  Start of MODEL    6
 3903    HZ   PHE  56           HZ       PHE  56  -3.616  -1.736  -4.853
  Start of MODEL    6
 3904    H    PHE  56           HN       PHE  56  -1.399  -7.530  -5.403
  Start of MODEL    6
 3905    HA   LEU  57           HA       LEU  57  -2.082 -11.353  -2.333
  Start of MODEL    6
 3906    HB3  LEU  57           HB2      LEU  57  -0.997 -10.410  -0.231
  Start of MODEL    6
 3907    HB2  LEU  57           HB3      LEU  57  -1.746 -11.973  -0.047
  Start of MODEL    6
 3908    HG   LEU  57           HG       LEU  57  -3.285  -9.572   0.768
  Start of MODEL    6
 3909   HD12  LEU  57          HD11      LEU  57  -3.111 -12.390   1.827
  Start of MODEL    6
 3910   HD11  LEU  57          HD12      LEU  57  -4.327 -11.803   0.716
  Start of MODEL    6
 3911   HD13  LEU  57          HD13      LEU  57  -4.255 -11.151   2.363
  Start of MODEL    6
 3912   HD21  LEU  57          HD21      LEU  57  -1.104  -9.236   1.779
  Start of MODEL    6
 3913   HD23  LEU  57          HD22      LEU  57  -1.105 -10.901   2.365
  Start of MODEL    6
 3914   HD22  LEU  57          HD23      LEU  57  -2.270  -9.740   3.006
  Start of MODEL    6
 3915    H    LEU  57           HN       LEU  57  -2.527  -8.675  -1.358
  Start of MODEL    6
 3916    HA   GLU  58           HA       GLU  58  -5.915 -12.859  -3.032
  Start of MODEL    6
 3917    HB3  GLU  58           HB2      GLU  58  -5.323 -14.752  -0.810
  Start of MODEL    6
 3918    HB2  GLU  58           HB3      GLU  58  -4.545 -14.837  -2.371
  Start of MODEL    6
 3919    HG2  GLU  58           HG2      GLU  58  -7.531 -14.969  -1.908
  Start of MODEL    6
 3920    HG3  GLU  58           HG3      GLU  58  -6.698 -15.226  -3.439
  Start of MODEL    6
 3921    H    GLU  58           HN       GLU  58  -3.514 -13.030  -1.776
  Start of MODEL    6
 3922    HA   PRO  59           HA       PRO  59  -8.458 -11.240   0.379
  Start of MODEL    6
 3923    HB3  PRO  59           HB2      PRO  59  -8.408  -9.130  -0.613
  Start of MODEL    6
 3924    HB2  PRO  59           HB3      PRO  59 -10.033  -9.632  -1.088
  Start of MODEL    6
 3925    HG2  PRO  59           HG2      PRO  59  -9.407 -10.027  -3.260
  Start of MODEL    6
 3926    HG3  PRO  59           HG3      PRO  59  -8.094  -8.904  -2.873
  Start of MODEL    6
 3927    HD2  PRO  59           HD2      PRO  59  -7.836 -11.630  -3.588
  Start of MODEL    6
 3928    HD3  PRO  59           HD3      PRO  59  -6.563 -10.568  -2.976
  Start of MODEL    6
 3929    HA   ALA  60           HA       ALA  60 -11.658 -13.947  -0.793
  Start of MODEL    6
 3930    HB3  ALA  60           HB1      ALA  60 -11.427 -14.513   1.567
  Start of MODEL    6
 3931    HB2  ALA  60           HB2      ALA  60 -13.140 -14.435   1.147
  Start of MODEL    6
 3932    HB1  ALA  60           HB3      ALA  60 -12.382 -13.106   2.017
  Start of MODEL    6
 3933    H    ALA  60           HN       ALA  60 -10.490 -12.011   0.981
  Start of MODEL    6
 3934    HA   ALA  61           HA       ALA  61 -14.551 -11.407  -2.476
  Start of MODEL    6
 3935    HB1  ALA  61           HB1      ALA  61 -16.194 -13.923  -2.343
  Start of MODEL    6
 3936    HB3  ALA  61           HB2      ALA  61 -15.013 -13.503  -3.586
  Start of MODEL    6
 3937    HB2  ALA  61           HB3      ALA  61 -16.484 -12.553  -3.410
  Start of MODEL    6
 3938    H    ALA  61           HN       ALA  61 -13.975 -13.890  -1.198
  Start of MODEL    6
 3939    HA   ASN  62           HA       ASN  62 -17.690 -10.940   0.668
  Start of MODEL    6
 3940    HB3  ASN  62           HB2      ASN  62 -18.224 -12.113   2.852
  Start of MODEL    6
 3941    HB2  ASN  62           HB3      ASN  62 -17.031 -13.321   2.392
  Start of MODEL    6
 3942   HD21  ASN  62          HD21      ASN  62 -20.126 -11.916   1.606
  Start of MODEL    6
 3943   HD22  ASN  62          HD22      ASN  62 -20.672 -13.211   0.614
  Start of MODEL    6
 3944    H    ASN  62           HN       ASN  62 -15.530 -12.873   0.447
  Start of MODEL    6
 3945    HA   GLU  63           HA       GLU  63 -14.669  -9.409   3.784
  Start of MODEL    6
 3946    HB3  GLU  63           HB2      GLU  63 -12.255  -8.873   3.331
  Start of MODEL    6
 3947    HB2  GLU  63           HB3      GLU  63 -12.367  -9.852   1.883
  Start of MODEL    6
 3948    HG2  GLU  63           HG2      GLU  63 -12.715 -10.793   4.690
  Start of MODEL    6
 3949    HG3  GLU  63           HG3      GLU  63 -12.886 -11.808   3.265
  Start of MODEL    6
 3950    H    GLU  63           HN       GLU  63 -14.491 -10.889   1.299
  Start of MODEL    6
 3951    HA   THR  64           HA       THR  64 -14.802  -5.783   1.444
  Start of MODEL    6
 3952    HB   THR  64           HB       THR  64 -15.801  -4.857   4.173
  Start of MODEL    6
 3953    HG1  THR  64           HG1      THR  64 -17.389  -6.239   3.857
  Start of MODEL    6
 3954   HG22  THR  64          HG21      THR  64 -17.207  -3.365   2.824
  Start of MODEL    6
 3955   HG21  THR  64          HG22      THR  64 -16.513  -4.034   1.347
  Start of MODEL    6
 3956   HG23  THR  64          HG23      THR  64 -15.503  -3.105   2.457
  Start of MODEL    6
 3957    H    THR  64           HN       THR  64 -14.772  -7.252   3.946
  Start of MODEL    6
 3958    HA   VAL  65           HA       VAL  65 -11.018  -4.275   3.365
  Start of MODEL    6
 3959    HB   VAL  65           HB       VAL  65 -10.220  -7.010   4.378
  Start of MODEL    6
 3960    H    VAL  65           HN       VAL  65 -12.465  -6.777   2.824
  Start of MODEL    6
 3961    HA   ARG  66           HA       ARG  66  -8.752  -6.032   0.057
  Start of MODEL    6
 3962    HB3  ARG  66           HB2      ARG  66  -7.978  -3.127   0.195
  Start of MODEL    6
 3963    HB2  ARG  66           HB3      ARG  66  -9.350  -3.725  -0.722
  Start of MODEL    6
 3964    HG2  ARG  66           HG2      ARG  66  -6.453  -4.380  -1.241
  Start of MODEL    6
 3965    HG3  ARG  66           HG3      ARG  66  -7.829  -4.980  -2.169
  Start of MODEL    6
 3966    HD2  ARG  66           HD2      ARG  66  -7.037  -2.083  -1.845
  Start of MODEL    6
 3967    HD3  ARG  66           HD3      ARG  66  -6.763  -3.065  -3.284
  Start of MODEL    6
 3968    HE   ARG  66           HE       ARG  66  -9.490  -3.106  -2.652
  Start of MODEL    6
 3969   HH11  ARG  66          HH11      ARG  66  -7.103  -0.738  -3.882
  Start of MODEL    6
 3970   HH12  ARG  66          HH12      ARG  66  -8.265   0.122  -4.748
  Start of MODEL    6
 3971   HH21  ARG  66          HH21      ARG  66 -11.008  -1.910  -3.897
  Start of MODEL    6
 3972   HH22  ARG  66          HH22      ARG  66 -10.477  -0.545  -4.802
  Start of MODEL    6
 3973    H    ARG  66           HN       ARG  66  -9.419  -3.944   1.981
  Start of MODEL    6
 3974    HA   HIS  67           HA       HIS  67  -5.159  -6.337   2.560
  Start of MODEL    6
 3975    HB3  HIS  67           HB2      HIS  67  -4.422  -8.699   2.598
  Start of MODEL    6
 3976    HB2  HIS  67           HB3      HIS  67  -5.523  -9.075   1.288
  Start of MODEL    6
 3977    HD1  HIS  67           HD1      HIS  67  -5.375  -8.722   4.954
  Start of MODEL    6
 3978    HD2  HIS  67           HD2      HIS  67  -8.284  -9.144   2.025
  Start of MODEL    6
 3979    HE1  HIS  67           HE1      HIS  67  -7.462  -9.370   6.171
  Start of MODEL    6
 3980    HE2  HIS  67           HE2      HIS  67  -9.035 -10.014   4.326
  Start of MODEL    6
 3981    H    HIS  67           HN       HIS  67  -7.006  -7.203   0.447
  Start of MODEL    6
 3982    HA2  GLY  68           HA2      GLY  68  -2.268  -6.431  -0.687
  Start of MODEL    6
 3983    H    GLY  68           HN       GLY  68  -3.315  -5.404   1.842
  Start of MODEL    6
 3984    HA3  GLY  68           HA1      GLY  68  -2.450  -4.702  -0.439
  Start of MODEL    6
 3985    HA   CYS  69           HA       CYS  69   1.546  -5.224   1.229
  Start of MODEL    6
 3986    HB3  CYS  69           HB2      CYS  69   1.640  -7.565  -0.657
  Start of MODEL    6
 3987    HB2  CYS  69           HB3      CYS  69   1.646  -7.575   1.099
  Start of MODEL    6
 3988    H    CYS  69           HN       CYS  69  -0.087  -5.746  -1.127
  Start of MODEL    6
 3989    HA   LEU  70           HA       LEU  70   3.622  -3.167  -2.075
  Start of MODEL    6
 3990    HB3  LEU  70           HB2      LEU  70   4.561  -1.727   0.418
  Start of MODEL    6
 3991    HB2  LEU  70           HB3      LEU  70   3.158  -1.240  -0.511
  Start of MODEL    6
 3992    HG   LEU  70           HG       LEU  70   5.985  -1.295  -1.577
  Start of MODEL    6
 3993   HD11  LEU  70          HD11      LEU  70   3.437  -0.187  -2.701
  Start of MODEL    6
 3994   HD13  LEU  70          HD12      LEU  70   4.397  -1.525  -3.357
  Start of MODEL    6
 3995   HD12  LEU  70          HD13      LEU  70   5.035   0.122  -3.353
  Start of MODEL    6
 3996   HD21  LEU  70          HD21      LEU  70   5.786   0.379   0.174
  Start of MODEL    6
 3997   HD23  LEU  70          HD22      LEU  70   4.344   1.036  -0.605
  Start of MODEL    6
 3998   HD22  LEU  70          HD23      LEU  70   5.909   1.143  -1.412
  Start of MODEL    6
 3999    H    LEU  70           HN       LEU  70   3.022  -3.696   0.737
  Start of MODEL    6
 4000    HA   ARG  71           HA       ARG  71   7.155  -5.330  -0.864
  Start of MODEL    6
 4001    HB3  ARG  71           HB2      ARG  71   5.915  -7.291  -1.355
  Start of MODEL    6
 4002    HB2  ARG  71           HB3      ARG  71   7.457  -7.430  -2.177
  Start of MODEL    6
 4003    HG2  ARG  71           HG2      ARG  71   4.840  -6.691  -3.455
  Start of MODEL    6
 4004    HG3  ARG  71           HG3      ARG  71   6.395  -6.783  -4.279
  Start of MODEL    6
 4005    HD2  ARG  71           HD2      ARG  71   5.092  -8.821  -4.621
  Start of MODEL    6
 4006    HD3  ARG  71           HD3      ARG  71   6.569  -9.149  -3.720
  Start of MODEL    6
 4007    HE   ARG  71           HE       ARG  71   4.657  -8.737  -1.818
  Start of MODEL    6
 4008   HH11  ARG  71          HH11      ARG  71   5.027 -10.982  -4.543
  Start of MODEL    6
 4009   HH12  ARG  71          HH12      ARG  71   4.192 -12.254  -3.794
  Start of MODEL    6
 4010   HH21  ARG  71          HH21      ARG  71   3.438 -10.508  -0.807
  Start of MODEL    6
 4011   HH22  ARG  71          HH22      ARG  71   3.249 -11.969  -1.641
  Start of MODEL    6
 4012    H    ARG  71           HN       ARG  71   5.100  -4.588  -2.779
  Start of MODEL    6
 4013    HA   LEU  72           HA       LEU  72   9.800  -3.812  -3.797
  Start of MODEL    6
 4014    HB3  LEU  72           HB2      LEU  72  11.759  -2.828  -2.603
  Start of MODEL    6
 4015    HB2  LEU  72           HB3      LEU  72  11.132  -3.473  -1.103
  Start of MODEL    6
 4016    HG   LEU  72           HG       LEU  72   9.541  -1.563  -2.772
  Start of MODEL    6
 4017   HD12  LEU  72          HD11      LEU  72   8.448  -0.983  -0.661
  Start of MODEL    6
 4018   HD11  LEU  72          HD12      LEU  72   9.431  -2.182   0.172
  Start of MODEL    6
 4019   HD13  LEU  72          HD13      LEU  72   8.273  -2.691  -1.056
  Start of MODEL    6
 4020   HD23  LEU  72          HD21      LEU  72  11.481  -0.807  -0.607
  Start of MODEL    6
 4021   HD22  LEU  72          HD22      LEU  72  10.364   0.272  -1.481
  Start of MODEL    6
 4022   HD21  LEU  72          HD23      LEU  72  11.680  -0.519  -2.339
  Start of MODEL    6
 4023    H    LEU  72           HN       LEU  72   9.086  -4.920  -1.209
  Start of MODEL    6
 4024    HA   ASN  73           HA       ASN  73  11.792  -7.668  -4.264
  Start of MODEL    6
 4025    HB3  ASN  73           HB2      ASN  73  11.867  -6.200  -6.913
  Start of MODEL    6
 4026    HB2  ASN  73           HB3      ASN  73  10.651  -7.369  -6.414
  Start of MODEL    6
 4027   HD21  ASN  73          HD21      ASN  73  12.290  -7.427  -8.722
  Start of MODEL    6
 4028   HD22  ASN  73          HD22      ASN  73  13.200  -8.889  -8.688
  Start of MODEL    6
 4029    H    ASN  73           HN       ASN  73  10.586  -5.212  -5.023
  Start of MODEL    6
 4030    HA   GLN  74           HA       GLN  74  15.636  -5.340  -4.039
  Start of MODEL    6
 4031    HB3  GLN  74           HB2      GLN  74  15.269  -3.634  -6.516
  Start of MODEL    6
 4032    HB2  GLN  74           HB3      GLN  74  15.849  -5.292  -6.525
  Start of MODEL    6
 4033    HG2  GLN  74           HG2      GLN  74  17.232  -2.978  -5.172
  Start of MODEL    6
 4034    HG3  GLN  74           HG3      GLN  74  17.825  -4.631  -5.276
  Start of MODEL    6
 4035   HE21  GLN  74          HE21      GLN  74  17.269  -1.674  -6.998
  Start of MODEL    6
 4036   HE22  GLN  74          HE22      GLN  74  18.240  -2.050  -8.362
  Start of MODEL    6
 4037    H    GLN  74           HN       GLN  74  13.074  -4.526  -5.160
  Start of MODEL    6
 4038    HA   PRO  75           HA       PRO  75  14.246  -1.531  -1.978
  Start of MODEL    6
 4039    HB3  PRO  75           HB2      PRO  75  14.164  -2.215   0.198
  Start of MODEL    6
 4040    HB2  PRO  75           HB3      PRO  75  15.916  -2.383   0.242
  Start of MODEL    6
 4041    HG2  PRO  75           HG2      PRO  75  15.436  -4.614   0.387
  Start of MODEL    6
 4042    HG3  PRO  75           HG3      PRO  75  13.835  -4.412  -0.355
  Start of MODEL    6
 4043    HD2  PRO  75           HD2      PRO  75  16.516  -4.684  -1.647
  Start of MODEL    6
 4044    HD3  PRO  75           HD3      PRO  75  14.951  -5.392  -2.121
  Start of MODEL    6
 4045    HA   THR  76           HA       THR  76  18.224   0.236  -2.346
  Start of MODEL    6
 4046    HB   THR  76           HB       THR  76  17.926   2.231  -3.924
  Start of MODEL    6
 4047    HG1  THR  76           HG1      THR  76  15.252   1.316  -3.707
  Start of MODEL    6
 4048   HG23  THR  76          HG21      THR  76  18.524  -0.004  -4.744
  Start of MODEL    6
 4049   HG22  THR  76          HG22      THR  76  17.472   0.837  -5.872
  Start of MODEL    6
 4050   HG21  THR  76          HG23      THR  76  16.811  -0.426  -4.828
  Start of MODEL    6
 4051    H    THR  76           HN       THR  76  15.299   0.303  -2.196
  Start of MODEL    6
 4052    HA   HIS  77           HA       HIS  77  18.206   3.232   0.673
  Start of MODEL    6
 4053    HB3  HIS  77           HB2      HIS  77  20.647   3.123   0.236
  Start of MODEL    6
 4054    HB2  HIS  77           HB3      HIS  77  20.153   4.638   0.961
  Start of MODEL    6
 4055    HD1  HIS  77           HD1      HIS  77  21.836   3.258  -2.032
  Start of MODEL    6
 4056    HD2  HIS  77           HD2      HIS  77  20.408   6.911  -0.676
  Start of MODEL    6
 4057    HE1  HIS  77           HE1      HIS  77  22.816   4.969  -3.552
  Start of MODEL    6
 4058    HE2  HIS  77           HE2      HIS  77  21.732   7.116  -2.895
  Start of MODEL    6
 4059    H    HIS  77           HN       HIS  77  19.134   2.571  -1.958
  Start of MODEL    6
 4060    HA   VAL  78           HA       VAL  78  16.457   6.925  -1.308
  Start of MODEL    6
 4061    HB   VAL  78           HB       VAL  78  15.103   7.091  -3.416
  Start of MODEL    6
 4062    H    VAL  78           HN       VAL  78  17.322   4.355  -2.288
  Start of MODEL    6
 4063    HA   ASN  79           HA       ASN  79  12.623   4.362  -0.565
  Start of MODEL    6
 4064    HB3  ASN  79           HB2      ASN  79  12.370   1.949  -0.307
  Start of MODEL    6
 4065    HB2  ASN  79           HB3      ASN  79  14.111   1.735  -0.272
  Start of MODEL    6
 4066   HD21  ASN  79          HD21      ASN  79  12.556   3.905  -2.530
  Start of MODEL    6
 4067   HD22  ASN  79          HD22      ASN  79  12.913   2.938  -3.918
  Start of MODEL    6
 4068    H    ASN  79           HN       ASN  79  15.503   3.813  -0.816
  Start of MODEL    6
 4069    HA   ASN  80           HA       ASN  80  13.972   3.897   3.717
  Start of MODEL    6
 4070    HB3  ASN  80           HB2      ASN  80  16.307   5.764   3.257
  Start of MODEL    6
 4071    HB2  ASN  80           HB3      ASN  80  16.404   4.019   3.128
  Start of MODEL    6
 4072   HD21  ASN  80          HD21      ASN  80  17.946   3.923   4.679
  Start of MODEL    6
 4073   HD22  ASN  80          HD22      ASN  80  17.617   4.150   6.369
  Start of MODEL    6
 4074    H    ASN  80           HN       ASN  80  14.671   5.404   1.281
  Start of MODEL    6
 4075    HA2  GLY  81           HA2      GLY  81  12.267   7.340   5.697
  Start of MODEL    6
 4076    H    GLY  81           HN       GLY  81  12.126   4.946   4.398
  Start of MODEL    6
 4077    HA3  GLY  81           HA1      GLY  81  11.860   7.755   4.042
  Start of MODEL    6
 4078    HA   ASN  82           HA       ASN  82   7.992   6.897   6.082
  Start of MODEL    6
 4079    HB3  ASN  82           HB2      ASN  82   8.005   9.848   5.462
  Start of MODEL    6
 4080    HB2  ASN  82           HB3      ASN  82   8.295   9.098   7.025
  Start of MODEL    6
 4081   HD21  ASN  82          HD21      ASN  82   6.375  11.061   6.292
  Start of MODEL    6
 4082   HD22  ASN  82          HD22      ASN  82   4.817  10.440   6.679
  Start of MODEL    6
 4083    H    ASN  82           HN       ASN  82   9.968   8.621   4.830
  Start of MODEL    6
 4084    HA   TYR  83           HA       TYR  83   5.872   6.498   2.251
  Start of MODEL    6
 4085    HB3  TYR  83           HB2      TYR  83   4.881   4.177   2.268
  Start of MODEL    6
 4086    HB2  TYR  83           HB3      TYR  83   5.579   3.943   3.859
  Start of MODEL    6
 4087    HD1  TYR  83           HD1      TYR  83   6.182   3.752   0.327
  Start of MODEL    6
 4088    HD2  TYR  83           HD2      TYR  83   8.083   4.040   4.123
  Start of MODEL    6
 4089    HE1  TYR  83           HE1      TYR  83   8.288   2.951  -0.664
  Start of MODEL    6
 4090    HE2  TYR  83           HE2      TYR  83  10.177   3.235   3.141
  Start of MODEL    6
 4091    HH   TYR  83           HH       TYR  83  10.590   2.934  -0.255
  Start of MODEL    6
 4092    H    TYR  83           HN       TYR  83   6.637   5.786   4.983
  Start of MODEL    6
 4093    HA   THR  84           HA       THR  84   1.944   7.062   4.118
  Start of MODEL    6
 4094    HB   THR  84           HB       THR  84   2.280   9.280   2.092
  Start of MODEL    6
 4095    HG1  THR  84           HG1      THR  84   3.639   8.726   4.271
  Start of MODEL    6
 4096   HG21  THR  84          HG21      THR  84   0.555   9.084   4.578
  Start of MODEL    6
 4097   HG23  THR  84          HG22      THR  84  -0.032   9.057   2.910
  Start of MODEL    6
 4098   HG22  THR  84          HG23      THR  84   0.717  10.515   3.563
  Start of MODEL    6
 4099    H    THR  84           HN       THR  84   3.902   7.304   1.953
  Start of MODEL    6
 4100    HA   LEU  85           HA       LEU  85  -0.284   5.488   0.702
  Start of MODEL    6
 4101    HB3  LEU  85           HB2      LEU  85  -1.391   4.052   3.123
  Start of MODEL    6
 4102    HB2  LEU  85           HB3      LEU  85  -0.074   3.499   2.107
  Start of MODEL    6
 4103    HG   LEU  85           HG       LEU  85  -2.955   3.775   1.244
  Start of MODEL    6
 4104   HD11  LEU  85          HD11      LEU  85  -0.524   2.747  -0.136
  Start of MODEL    6
 4105   HD13  LEU  85          HD12      LEU  85  -1.442   4.203  -0.574
  Start of MODEL    6
 4106   HD12  LEU  85          HD13      LEU  85  -2.174   2.592  -0.758
  Start of MODEL    6
 4107   HD22  LEU  85          HD21      LEU  85  -2.965   1.390   1.185
  Start of MODEL    6
 4108   HD21  LEU  85          HD22      LEU  85  -2.506   1.940   2.804
  Start of MODEL    6
 4109   HD23  LEU  85          HD23      LEU  85  -1.277   1.328   1.694
  Start of MODEL    6
 4110    H    LEU  85           HN       LEU  85   0.132   6.042   3.545
  Start of MODEL    6
 4111    HA   LEU  86           HA       LEU  86  -3.958   7.795   1.201
  Start of MODEL    6
 4112    HB3  LEU  86           HB2      LEU  86  -4.306   9.046  -0.941
  Start of MODEL    6
 4113    HB2  LEU  86           HB3      LEU  86  -2.925   8.219  -1.615
  Start of MODEL    6
 4114    HG   LEU  86           HG       LEU  86  -2.487  10.563  -0.992
  Start of MODEL    6
 4115   HD13  LEU  86          HD11      LEU  86  -3.862  10.746   0.952
  Start of MODEL    6
 4116   HD12  LEU  86          HD12      LEU  86  -2.185  11.171   1.327
  Start of MODEL    6
 4117   HD11  LEU  86          HD13      LEU  86  -2.823   9.597   1.798
  Start of MODEL    6
 4118   HD21  LEU  86          HD21      LEU  86  -0.618   9.000  -1.149
  Start of MODEL    6
 4119   HD23  LEU  86          HD22      LEU  86  -0.835   8.563   0.551
  Start of MODEL    6
 4120   HD22  LEU  86          HD23      LEU  86  -0.343  10.196   0.117
  Start of MODEL    6
 4121    H    LEU  86           HN       LEU  86  -1.849   6.419  -0.299
  Start of MODEL    6
 4122    HA   ALA  87           HA       ALA  87  -6.579   5.422  -1.412
  Start of MODEL    6
 4123    HB3  ALA  87           HB1      ALA  87  -6.510   3.913   0.537
  Start of MODEL    6
 4124    HB2  ALA  87           HB2      ALA  87  -8.154   4.070  -0.070
  Start of MODEL    6
 4125    HB1  ALA  87           HB3      ALA  87  -7.658   4.950   1.378
  Start of MODEL    6
 4126    H    ALA  87           HN       ALA  87  -5.927   6.975   1.009
  Start of MODEL    6
 4127    HA   ALA  88           HA       ALA  88  -9.705   8.410  -1.154
  Start of MODEL    6
 4128    HB3  ALA  88           HB1      ALA  88  -9.671   9.747  -3.167
  Start of MODEL    6
 4129    HB2  ALA  88           HB2      ALA  88  -8.725   8.509  -3.992
  Start of MODEL    6
 4130    HB1  ALA  88           HB3      ALA  88  -8.027   9.390  -2.636
  Start of MODEL    6
 4131    H    ALA  88           HN       ALA  88  -8.092   6.386  -2.546
  Start of MODEL    6
 4132    HA   ASN  89           HA       ASN  89 -13.046   7.265  -3.595
  Start of MODEL    6
 4133    HB3  ASN  89           HB2      ASN  89 -13.096   5.171  -2.260
  Start of MODEL    6
 4134    HB2  ASN  89           HB3      ASN  89 -14.717   5.798  -2.409
  Start of MODEL    6
 4135   HD21  ASN  89          HD21      ASN  89 -13.948   3.890  -0.585
  Start of MODEL    6
 4136   HD22  ASN  89          HD22      ASN  89 -14.142   4.521   1.004
  Start of MODEL    6
 4137    H    ASN  89           HN       ASN  89 -11.803   8.168  -1.188
  Start of MODEL    6
 4138    HA   PRO  90           HA       PRO  90 -15.691  10.734  -3.184
  Start of MODEL    6
 4139    HB3  PRO  90           HB2      PRO  90 -17.917  10.334  -3.706
  Start of MODEL    6
 4140    HB2  PRO  90           HB3      PRO  90 -18.025   8.952  -2.608
  Start of MODEL    6
 4141    HG2  PRO  90           HG2      PRO  90 -17.789   7.890  -4.682
  Start of MODEL    6
 4142    HG3  PRO  90           HG3      PRO  90 -16.680   9.136  -5.285
  Start of MODEL    6
 4143    HD2  PRO  90           HD2      PRO  90 -16.148   6.858  -3.434
  Start of MODEL    6
 4144    HD3  PRO  90           HD3      PRO  90 -15.097   7.569  -4.674
  Start of MODEL    6
 4145    HA   CYS  91           HA       CYS  91 -17.365  10.197   1.186
  Start of MODEL    6
 4146    HB3  CYS  91           HB2      CYS  91 -15.984   7.578   1.813
  Start of MODEL    6
 4147    HB2  CYS  91           HB3      CYS  91 -17.705   7.792   1.482
  Start of MODEL    6
 4148    H    CYS  91           HN       CYS  91 -16.122   8.366  -0.604
  Start of MODEL    6
 4149    HA2  GLY  92           HA2      GLY  92 -12.992  11.743   1.481
  Start of MODEL    6
 4150    H    GLY  92           HN       GLY  92 -14.006   9.463   0.451
  Start of MODEL    6
 4151    HA3  GLY  92           HA1      GLY  92 -13.040  10.660   2.857
  Start of MODEL    6
 4152    HA   GLN  93           HA       GLN  93  -9.385   9.381   0.671
  Start of MODEL    6
 4153    HB3  GLN  93           HB2      GLN  93  -8.372  12.212   1.086
  Start of MODEL    6
 4154    HB2  GLN  93           HB3      GLN  93  -9.029  11.594  -0.420
  Start of MODEL    6
 4155    HG2  GLN  93           HG2      GLN  93  -6.590  10.456   0.938
  Start of MODEL    6
 4156    HG3  GLN  93           HG3      GLN  93  -7.196  10.068  -0.670
  Start of MODEL    6
 4157   HE21  GLN  93          HE21      GLN  93  -5.571  12.383   1.277
  Start of MODEL    6
 4158   HE22  GLN  93          HE22      GLN  93  -4.930  13.356   0.020
  Start of MODEL    6
 4159    H    GLN  93           HN       GLN  93 -10.690  11.660   1.972
  Start of MODEL    6
 4160    HA   ALA  94           HA       ALA  94  -7.770   9.044   4.730
  Start of MODEL    6
 4161    HB3  ALA  94           HB1      ALA  94  -9.065   6.982   4.544
  Start of MODEL    6
 4162    HB2  ALA  94           HB2      ALA  94  -7.452   6.624   5.193
  Start of MODEL    6
 4163    HB1  ALA  94           HB3      ALA  94  -7.812   6.295   3.514
  Start of MODEL    6
 4164    H    ALA  94           HN       ALA  94  -8.295   8.129   1.984
  Start of MODEL    6
 4165    HA   SER  95           HA       SER  95  -3.626   7.974   3.830
  Start of MODEL    6
 4166    HB3  SER  95           HB2      SER  95  -3.648  10.333   3.413
  Start of MODEL    6
 4167    HB2  SER  95           HB3      SER  95  -2.275  10.001   4.464
  Start of MODEL    6
 4168    HG   SER  95           HG       SER  95  -3.066  11.511   5.549
  Start of MODEL    6
 4169    H    SER  95           HN       SER  95  -5.717   8.880   5.587
  Start of MODEL    6
 4170    HA   ALA  96           HA       ALA  96  -1.830   7.195   7.769
  Start of MODEL    6
 4171    HB2  ALA  96           HB1      ALA  96  -1.562   4.744   7.925
  Start of MODEL    6
 4172    HB1  ALA  96           HB2      ALA  96  -1.960   4.602   6.212
  Start of MODEL    6
 4173    HB3  ALA  96           HB3      ALA  96  -3.174   5.183   7.354
  Start of MODEL    6
 4174    H    ALA  96           HN       ALA  96  -2.032   6.987   4.866
  Start of MODEL    6
 4175    HA   SER  97           HA       SER  97   2.242   6.576   6.268
  Start of MODEL    6
 4176    HB3  SER  97           HB2      SER  97   2.202   8.798   7.127
  Start of MODEL    6
 4177    HB2  SER  97           HB3      SER  97   3.669   8.040   7.744
  Start of MODEL    6
 4178    HG   SER  97           HG       SER  97   1.730   7.555   9.490
  Start of MODEL    6
 4179    H    SER  97           HN       SER  97   0.321   6.518   8.469
  Start of MODEL    6
 4180    HA   ILE  98           HA       ILE  98   4.604   4.049   9.015
  Start of MODEL    6
 4181    HB   ILE  98           HB       ILE  98   3.208   2.456   7.666
  Start of MODEL    6
 4182   HD11  ILE  98          HD11      ILE  98   7.044   2.087   7.815
  Start of MODEL    6
 4183   HD13  ILE  98          HD12      ILE  98   6.488   0.960   6.575
  Start of MODEL    6
 4184   HD12  ILE  98          HD13      ILE  98   6.931   0.363   8.171
  Start of MODEL    6
 4185    H    ILE  98           HN       ILE  98   4.042   5.365   6.498
  Start of MODEL    6
 4186    HA   MET  99           HA       MET  99   8.317   5.224   7.143
  Start of MODEL    6
 4187    HB3  MET  99           HB2      MET  99   9.028   5.474  10.050
  Start of MODEL    6
 4188    HB2  MET  99           HB3      MET  99   7.871   6.563   9.296
  Start of MODEL    6
 4189    HG2  MET  99           HG2      MET  99  10.747   6.182   8.553
  Start of MODEL    6
 4190    HG3  MET  99           HG3      MET  99   9.606   7.156   7.633
  Start of MODEL    6
 4191    HE3  MET  99           HE1      MET  99  12.094   8.581   8.333
  Start of MODEL    6
 4192    HE2  MET  99           HE2      MET  99  11.526  10.054   9.125
  Start of MODEL    6
 4193    HE1  MET  99           HE3      MET  99  10.657   9.420   7.730
  Start of MODEL    6
 4194    H    MET  99           HN       MET  99   6.814   4.026   9.351
  Start of MODEL    6
 4195    HA   ALA 100           HA       ALA 100  10.589   1.622   7.939
  Start of MODEL    6
 4196    HB3  ALA 100           HB1      ALA 100   8.911   0.810   6.363
  Start of MODEL    6
 4197    HB2  ALA 100           HB2      ALA 100  10.507   0.141   6.015
  Start of MODEL    6
 4198    HB1  ALA 100           HB3      ALA 100   9.860   1.444   5.021
  Start of MODEL    6
 4199    H    ALA 100           HN       ALA 100   9.528   3.753   6.236
  Start of MODEL    6
 4200    HA   ALA 101           HA       ALA 101  14.367   2.954   6.266
  Start of MODEL    6
 4201    HB3  ALA 101           HB1      ALA 101  14.662   3.387   8.661
  Start of MODEL    6
 4202    HB2  ALA 101           HB2      ALA 101  16.096   2.624   7.978
  Start of MODEL    6
 4203    HB1  ALA 101           HB3      ALA 101  14.961   1.670   8.937
  Start of MODEL    6
 4204    H    ALA 101           HN       ALA 101  12.659   1.468   8.098
  Start of MODEL    6
 4205    HA   PHE 102           HA       PHE 102  15.334  -1.123   5.008
  Start of MODEL    6
 4206    HB3  PHE 102           HB2      PHE 102  15.275  -1.407   2.548
  Start of MODEL    6
 4207    HB2  PHE 102           HB3      PHE 102  14.982   0.315   2.360
  Start of MODEL    6
 4208    HD1  PHE 102           HD1      PHE 102  13.487  -2.187   4.694
  Start of MODEL    6
 4209    HD2  PHE 102           HD2      PHE 102  12.847   0.572   1.525
  Start of MODEL    6
 4210    HE1  PHE 102           HE1      PHE 102  11.074  -2.592   4.829
  Start of MODEL    6
 4211    HE2  PHE 102           HE2      PHE 102  10.427   0.167   1.659
  Start of MODEL    6
 4212    HZ   PHE 102           HZ       PHE 102   9.538  -1.416   3.314
  Start of MODEL    6
 4213    H    PHE 102           HN       PHE 102  14.693   1.678   4.547
  Start of MODEL    6
 4214    HA   MET 103           HA       MET 103  19.414   0.118   3.627
  Start of MODEL    6
 4215    HB3  MET 103           HB2      MET 103  20.323   0.658   1.421
  Start of MODEL    6
 4216    HB2  MET 103           HB3      MET 103  18.782   1.326   0.920
  Start of MODEL    6
 4217    HG2  MET 103           HG2      MET 103  17.756  -0.860   1.034
  Start of MODEL    6
 4218    HG3  MET 103           HG3      MET 103  19.140  -0.855  -0.051
  Start of MODEL    6
 4219    HE3  MET 103           HE1      MET 103  17.725  -3.495   1.063
  Start of MODEL    6
 4220    HE2  MET 103           HE2      MET 103  19.137  -4.486   1.428
  Start of MODEL    6
 4221    HE1  MET 103           HE3      MET 103  19.099  -3.512  -0.043
  Start of MODEL    6
 4222    H    MET 103           HN       MET 103  16.836   1.098   2.633
  Start of MODEL    6
 4223    HA   ASP 104           HA       ASP 104  19.795   4.238   5.002
  Start of MODEL    6
 4224    HB3  ASP 104           HB2      ASP 104  22.503   3.043   5.640
  Start of MODEL    6
 4225    HB2  ASP 104           HB3      ASP 104  21.075   2.837   6.641
  Start of MODEL    6
 4226    H    ASP 104           HN       ASP 104  20.749   1.572   4.490
  Start of MODEL    6
 4227    HA   ASN 105           HA       ASN 105  21.791   6.089   1.627
  Start of MODEL    6
 4228    HB3  ASN 105           HB2      ASN 105  21.000   8.432   3.385
  Start of MODEL    6
 4229    HB2  ASN 105           HB3      ASN 105  20.034   7.730   2.095
  Start of MODEL    6
 4230   HD21  ASN 105          HD21      ASN 105  22.637   9.864   2.855
  Start of MODEL    6
 4231   HD22  ASN 105          HD22      ASN 105  22.884  10.453   1.257
  Start of MODEL    6
 4232    H    ASN 105           HN       ASN 105  20.557   6.157   4.205
  Start of MODEL    6
 4233    HA   PRO 106           HA       PRO 106  25.960   6.197   3.264
  Start of MODEL    6
 4234    HB3  PRO 106           HB2      PRO 106  26.634   4.996   1.437
  Start of MODEL    6
 4235    HB2  PRO 106           HB3      PRO 106  27.232   6.560   0.887
  Start of MODEL    6
 4236    HG2  PRO 106           HG2      PRO 106  25.405   6.942  -0.473
  Start of MODEL    6
 4237    HG3  PRO 106           HG3      PRO 106  25.493   5.177  -0.592
  Start of MODEL    6
 4238    HD2  PRO 106           HD2      PRO 106  23.259   6.454   0.197
  Start of MODEL    6
 4239    HD3  PRO 106           HD3      PRO 106  23.710   4.866   0.849
  Start of MODEL    6
 4240    HA   PHE 107           HA       PHE 107  28.150   9.689   4.457
  Start of MODEL    6
 4241    HB3  PHE 107           HB2      PHE 107  28.904  11.106   2.533
  Start of MODEL    6
 4242    HB2  PHE 107           HB3      PHE 107  27.912  10.088   1.478
  Start of MODEL    6
 4243    HD1  PHE 107           HD1      PHE 107  30.764   9.887   3.840
  Start of MODEL    6
 4244    HD2  PHE 107           HD2      PHE 107  28.760   8.199   0.490
  Start of MODEL    6
 4245    HE1  PHE 107           HE1      PHE 107  32.626   8.315   3.525
  Start of MODEL    6
 4246    HE2  PHE 107           HE2      PHE 107  30.614   6.619   0.168
  Start of MODEL    6
 4247    HZ   PHE 107           HZ       PHE 107  32.551   6.675   1.685
  Start of MODEL    6
 4248    H    PHE 107           HN       PHE 107  27.272   7.704   3.929
  Start of MODEL    7
 4249    H1   ASP   1           H        ASP   1 -22.607  -8.375   6.488
  Start of MODEL    7
 4250    H2   ASP   1           H2       ASP   1 -22.238  -6.798   5.951
  Start of MODEL    7
 4251    H3   ASP   1           H3       ASP   1 -22.886  -7.921   4.895
  Start of MODEL    7
 4252    HA   ASP   1           HA       ASP   1 -24.942  -7.955   6.037
  Start of MODEL    7
 4253    HB3  ASP   1           HB2      ASP   1 -23.728  -5.812   7.807
  Start of MODEL    7
 4254    HB2  ASP   1           HB3      ASP   1 -23.998  -7.477   8.312
  Start of MODEL    7
 4255    HA   ASP   2           HA       ASP   2 -26.109  -6.058   2.313
  Start of MODEL    7
 4256    HB3  ASP   2           HB2      ASP   2 -26.436  -3.718   4.176
  Start of MODEL    7
 4257    HB2  ASP   2           HB3      ASP   2 -27.500  -5.114   4.307
  Start of MODEL    7
 4258    H    ASP   2           HN       ASP   2 -25.370  -7.331   3.995
  Start of MODEL    7
 4259    HA   ASP   3           HA       ASP   3 -22.135  -3.976   1.852
  Start of MODEL    7
 4260    HB3  ASP   3           HB2      ASP   3 -20.927  -4.990  -0.129
  Start of MODEL    7
 4261    HB2  ASP   3           HB3      ASP   3 -22.227  -6.162  -0.250
  Start of MODEL    7
 4262    H    ASP   3           HN       ASP   3 -24.034  -6.095   1.405
  Start of MODEL    7
 4263    HA   ASP   4           HA       ASP   4 -23.775  -1.238  -1.063
  Start of MODEL    7
 4264    HB3  ASP   4           HB2      ASP   4 -26.440  -2.575  -0.631
  Start of MODEL    7
 4265    HB2  ASP   4           HB3      ASP   4 -25.287  -2.985  -1.892
  Start of MODEL    7
 4266    H    ASP   4           HN       ASP   4 -24.275  -2.709   1.362
  Start of MODEL    7
 4267    HA   ASP   5           HA       ASP   5 -27.000   0.912   1.703
  Start of MODEL    7
 4268    HB3  ASP   5           HB2      ASP   5 -27.098  -1.155   3.910
  Start of MODEL    7
 4269    HB2  ASP   5           HB3      ASP   5 -28.333  -0.964   2.673
  Start of MODEL    7
 4270    H    ASP   5           HN       ASP   5 -26.187  -1.790   1.536
  Start of MODEL    7
 4271    HA   VAL   6           HA       VAL   6 -23.817   1.506   4.791
  Start of MODEL    7
 4272    HB   VAL   6           HB       VAL   6 -22.187  -0.002   6.070
  Start of MODEL    7
 4273    H    VAL   6           HN       VAL   6 -24.733  -0.966   3.667
  Start of MODEL    7
 4274    HA   SER   7           HA       SER   7 -20.816   1.238   1.762
  Start of MODEL    7
 4275    HB3  SER   7           HB2      SER   7 -22.182   2.864   0.617
  Start of MODEL    7
 4276    HB2  SER   7           HB3      SER   7 -20.541   3.513   0.710
  Start of MODEL    7
 4277    HG   SER   7           HG       SER   7 -21.744   4.344   2.869
  Start of MODEL    7
 4278    H    SER   7           HN       SER   7 -22.793   2.587   3.351
  Start of MODEL    7
 4279    HA   PHE   8           HA       PHE   8 -18.291   2.194   5.228
  Start of MODEL    7
 4280    HB3  PHE   8           HB2      PHE   8 -16.422   0.604   5.269
  Start of MODEL    7
 4281    HB2  PHE   8           HB3      PHE   8 -16.875   0.002   3.682
  Start of MODEL    7
 4282    HD1  PHE   8           HD1      PHE   8 -18.107  -1.955   3.573
  Start of MODEL    7
 4283    HD2  PHE   8           HD2      PHE   8 -18.367   0.476   7.060
  Start of MODEL    7
 4284    HE1  PHE   8           HE1      PHE   8 -19.581  -3.612   4.617
  Start of MODEL    7
 4285    HE2  PHE   8           HE2      PHE   8 -19.833  -1.184   8.113
  Start of MODEL    7
 4286    HZ   PHE   8           HZ       PHE   8 -20.358  -3.311   6.886
  Start of MODEL    7
 4287    H    PHE   8           HN       PHE   8 -19.252   0.665   3.069
  Start of MODEL    7
 4288    HA   CYS   9           HA       CYS   9 -16.063   4.926   2.797
  Start of MODEL    7
 4289    HB3  CYS   9           HB2      CYS   9 -15.187   5.737   5.563
  Start of MODEL    7
 4290    HB2  CYS   9           HB3      CYS   9 -16.841   6.004   5.030
  Start of MODEL    7
 4291    H    CYS   9           HN       CYS   9 -16.726   3.636   5.293
  Start of MODEL    7
 4292    HA   ALA  10           HA       ALA  10 -12.045   3.409   2.916
  Start of MODEL    7
 4293    HB3  ALA  10           HB1      ALA  10 -11.809   5.055   1.108
  Start of MODEL    7
 4294    HB2  ALA  10           HB2      ALA  10 -10.274   4.779   1.959
  Start of MODEL    7
 4295    HB1  ALA  10           HB3      ALA  10 -11.205   6.232   2.285
  Start of MODEL    7
 4296    H    ALA  10           HN       ALA  10 -13.507   5.917   3.219
  Start of MODEL    7
 4297    HA   SER  11           HA       SER  11  -9.766   4.538   6.395
  Start of MODEL    7
 4298    HB3  SER  11           HB2      SER  11 -10.183   2.890   8.116
  Start of MODEL    7
 4299    HB2  SER  11           HB3      SER  11 -10.768   1.728   6.921
  Start of MODEL    7
 4300    HG   SER  11           HG       SER  11 -12.569   2.921   6.629
  Start of MODEL    7
 4301    H    SER  11           HN       SER  11 -10.929   2.687   4.465
  Start of MODEL    7
 4302    HA   VAL  12           HA       VAL  12  -6.372   1.965   5.197
  Start of MODEL    7
 4303    HB   VAL  12           HB       VAL  12  -5.245   4.764   5.572
  Start of MODEL    7
 4304    H    VAL  12           HN       VAL  12  -7.575   4.122   6.811
  Start of MODEL    7
 4305    HA   GLN  13           HA       GLN  13  -3.938   1.579   8.788
  Start of MODEL    7
 4306    HB3  GLN  13           HB2      GLN  13  -4.161  -0.651   9.787
  Start of MODEL    7
 4307    HB2  GLN  13           HB3      GLN  13  -5.047  -1.199   8.376
  Start of MODEL    7
 4308    HG2  GLN  13           HG2      GLN  13  -5.994   0.979  10.207
  Start of MODEL    7
 4309    HG3  GLN  13           HG3      GLN  13  -6.886   0.238   8.880
  Start of MODEL    7
 4310   HE21  GLN  13          HE21      GLN  13  -8.533  -0.453  10.178
  Start of MODEL    7
 4311   HE22  GLN  13          HE22      GLN  13  -8.392  -1.721  11.319
  Start of MODEL    7
 4312    H    GLN  13           HN       GLN  13  -5.378   0.543   6.471
  Start of MODEL    7
 4313    HA   LEU  14           HA       LEU  14  -0.750  -0.385   6.567
  Start of MODEL    7
 4314    HB3  LEU  14           HB2      LEU  14   1.367   1.095   6.874
  Start of MODEL    7
 4315    HB2  LEU  14           HB3      LEU  14   0.249   2.277   7.536
  Start of MODEL    7
 4316    HG   LEU  14           HG       LEU  14  -1.053   2.034   5.328
  Start of MODEL    7
 4317   HD11  LEU  14          HD11      LEU  14   1.763   3.110   5.238
  Start of MODEL    7
 4318   HD13  LEU  14          HD12      LEU  14   0.320   3.977   5.802
  Start of MODEL    7
 4319   HD12  LEU  14          HD13      LEU  14   0.451   3.487   4.118
  Start of MODEL    7
 4320   HD22  LEU  14          HD21      LEU  14   0.223   1.215   3.453
  Start of MODEL    7
 4321   HD21  LEU  14          HD22      LEU  14  -0.014  -0.060   4.655
  Start of MODEL    7
 4322   HD23  LEU  14          HD23      LEU  14   1.543   0.767   4.534
  Start of MODEL    7
 4323    H    LEU  14           HN       LEU  14  -1.837   1.593   8.392
  Start of MODEL    7
 4324    HA   HIS  15           HA       HIS  15   1.327  -1.962  10.072
  Start of MODEL    7
 4325    HB3  HIS  15           HB2      HIS  15   1.613  -4.372   9.546
  Start of MODEL    7
 4326    HB2  HIS  15           HB3      HIS  15   1.371  -4.029   7.847
  Start of MODEL    7
 4327    HD1  HIS  15           HD1      HIS  15  -0.458  -4.939  10.866
  Start of MODEL    7
 4328    HD2  HIS  15           HD2      HIS  15  -1.347  -3.210   7.195
  Start of MODEL    7
 4329    HE1  HIS  15           HE1      HIS  15  -2.932  -5.209  10.575
  Start of MODEL    7
 4330    HE2  HIS  15           HE2      HIS  15  -3.339  -4.488   8.197
  Start of MODEL    7
 4331    H    HIS  15           HN       HIS  15   1.284  -1.435   7.188
  Start of MODEL    7
 4332    HA   THR  16           HA       THR  16   5.560  -1.536   9.770
  Start of MODEL    7
 4333    HB   THR  16           HB       THR  16   5.421  -4.014  11.477
  Start of MODEL    7
 4334    HG1  THR  16           HG1      THR  16   5.514  -1.806  12.927
  Start of MODEL    7
 4335   HG22  THR  16          HG21      THR  16   7.411  -3.039  12.549
  Start of MODEL    7
 4336   HG21  THR  16          HG22      THR  16   7.323  -1.654  11.456
  Start of MODEL    7
 4337   HG23  THR  16          HG23      THR  16   7.678  -3.255  10.815
  Start of MODEL    7
 4338    H    THR  16           HN       THR  16   3.332  -2.799  10.757
  Start of MODEL    7
 4339    HA   ALA  17           HA       ALA  17   6.607  -4.233   6.509
  Start of MODEL    7
 4340    HB1  ALA  17           HB1      ALA  17   7.691  -2.080   5.919
  Start of MODEL    7
 4341    HB3  ALA  17           HB2      ALA  17   8.634  -3.488   5.436
  Start of MODEL    7
 4342    HB2  ALA  17           HB3      ALA  17   9.103  -2.560   6.857
  Start of MODEL    7
 4343    H    ALA  17           HN       ALA  17   7.091  -2.134   8.362
  Start of MODEL    7
 4344    HA   VAL  18           HA       VAL  18   8.992  -7.056   8.650
  Start of MODEL    7
 4345    HB   VAL  18           HB       VAL  18   9.065  -9.267   7.408
  Start of MODEL    7
 4346    H    VAL  18           HN       VAL  18   7.953  -6.000   6.158
  Start of MODEL    7
 4347    HA   GLU  19           HA       GLU  19  13.022  -6.142   7.482
  Start of MODEL    7
 4348    HB3  GLU  19           HB2      GLU  19  14.512  -6.744   9.288
  Start of MODEL    7
 4349    HB2  GLU  19           HB3      GLU  19  13.322  -7.844   9.952
  Start of MODEL    7
 4350    HG2  GLU  19           HG2      GLU  19  11.841  -5.906  10.390
  Start of MODEL    7
 4351    HG3  GLU  19           HG3      GLU  19  13.344  -5.893  11.303
  Start of MODEL    7
 4352    H    GLU  19           HN       GLU  19  11.003  -7.325   9.092
  Start of MODEL    7
 4353    HA   MET  20           HA       MET  20  14.873  -9.610   5.813
  Start of MODEL    7
 4354    HB3  MET  20           HB2      MET  20  12.777 -10.857   6.013
  Start of MODEL    7
 4355    HB2  MET  20           HB3      MET  20  13.544 -11.226   4.484
  Start of MODEL    7
 4356    HG2  MET  20           HG2      MET  20  11.206  -9.390   4.845
  Start of MODEL    7
 4357    HG3  MET  20           HG3      MET  20  11.991  -9.787   3.314
  Start of MODEL    7
 4358    HE3  MET  20           HE1      MET  20   8.870 -10.191   3.662
  Start of MODEL    7
 4359    HE2  MET  20           HE2      MET  20   8.646 -11.800   2.971
  Start of MODEL    7
 4360    HE1  MET  20           HE3      MET  20   9.739 -10.652   2.202
  Start of MODEL    7
 4361    H    MET  20           HN       MET  20  13.052  -7.431   5.584
  Start of MODEL    7
 4362    HA   HIS  21           HA       HIS  21  16.246  -8.165   2.038
  Start of MODEL    7
 4363    HB3  HIS  21           HB2      HIS  21  16.396  -9.701  -0.057
  Start of MODEL    7
 4364    HB2  HIS  21           HB3      HIS  21  15.811 -10.959   1.024
  Start of MODEL    7
 4365    HD1  HIS  21           HD1      HIS  21  18.821  -8.796   0.385
  Start of MODEL    7
 4366    HD2  HIS  21           HD2      HIS  21  17.695 -11.967   2.826
  Start of MODEL    7
 4367    HE1  HIS  21           HE1      HIS  21  20.915  -9.616   1.451
  Start of MODEL    7
 4368    HE2  HIS  21           HE2      HIS  21  20.206 -11.372   3.048
  Start of MODEL    7
 4369    H    HIS  21           HN       HIS  21  15.139 -10.438   3.302
  Start of MODEL    7
 4370    HA   HIS  22           HA       HIS  22  12.572  -7.843  -0.592
  Start of MODEL    7
 4371    HB3  HIS  22           HB2      HIS  22  10.590  -9.259  -1.038
  Start of MODEL    7
 4372    HB2  HIS  22           HB3      HIS  22  11.065 -10.328   0.280
  Start of MODEL    7
 4373    HD1  HIS  22           HD1      HIS  22  11.792 -12.446  -0.816
  Start of MODEL    7
 4374    HD2  HIS  22           HD2      HIS  22  13.302  -9.078  -2.730
  Start of MODEL    7
 4375    HE1  HIS  22           HE1      HIS  22  13.297 -13.306  -2.611
  Start of MODEL    7
 4376    HE2  HIS  22           HE2      HIS  22  13.864 -11.249  -3.949
  Start of MODEL    7
 4377    H    HIS  22           HN       HIS  22  13.252  -9.850   1.413
  Start of MODEL    7
 4378    HA   TRP  23           HA       TRP  23  10.674  -6.101   2.882
  Start of MODEL    7
 4379    HB3  TRP  23           HB2      TRP  23  10.550  -3.625   2.607
  Start of MODEL    7
 4380    HB2  TRP  23           HB3      TRP  23  11.217  -3.850   0.984
  Start of MODEL    7
 4381    HD1  TRP  23           HD1      TRP  23  13.752  -4.525   0.788
  Start of MODEL    7
 4382    HE1  TRP  23           HE1      TRP  23  15.678  -4.562   2.472
  Start of MODEL    7
 4383    HE3  TRP  23           HE3      TRP  23  11.065  -3.956   5.063
  Start of MODEL    7
 4384    HZ2  TRP  23           HZ2      TRP  23  16.017  -4.334   5.274
  Start of MODEL    7
 4385    HZ3  TRP  23           HZ3      TRP  23  12.255  -3.873   7.196
  Start of MODEL    7
 4386    HH2  TRP  23           HH2      TRP  23  14.678  -4.061   7.302
  Start of MODEL    7
 4387    H    TRP  23           HN       TRP  23  11.772  -6.051   0.228
  Start of MODEL    7
 4388    HA   CYS  24           HA       CYS  24   6.707  -5.968   1.234
  Start of MODEL    7
 4389    HB3  CYS  24           HB2      CYS  24   6.734  -8.136   3.354
  Start of MODEL    7
 4390    HB2  CYS  24           HB3      CYS  24   6.988  -8.386   1.634
  Start of MODEL    7
 4391    H    CYS  24           HN       CYS  24   8.789  -6.736   3.127
  Start of MODEL    7
 4392    HA   ILE  25           HA       ILE  25   5.181  -3.617   4.645
  Start of MODEL    7
 4393    HB   ILE  25           HB       ILE  25   4.620  -1.962   2.163
  Start of MODEL    7
 4394   HD12  ILE  25          HD11      ILE  25   7.830  -0.030   2.665
  Start of MODEL    7
 4395   HD11  ILE  25          HD12      ILE  25   6.244   0.468   3.271
  Start of MODEL    7
 4396   HD13  ILE  25          HD13      ILE  25   6.406  -0.144   1.629
  Start of MODEL    7
 4397    H    ILE  25           HN       ILE  25   5.614  -4.257   1.816
  Start of MODEL    7
 4398    HA   PRO  26           HA       PRO  26   1.196  -5.519   3.479
  Start of MODEL    7
 4399    HB3  PRO  26           HB2      PRO  26   0.922  -7.035   5.151
  Start of MODEL    7
 4400    HB2  PRO  26           HB3      PRO  26   0.704  -5.746   6.336
  Start of MODEL    7
 4401    HG2  PRO  26           HG2      PRO  26   2.741  -6.482   7.106
  Start of MODEL    7
 4402    HG3  PRO  26           HG3      PRO  26   3.174  -7.189   5.543
  Start of MODEL    7
 4403    HD2  PRO  26           HD2      PRO  26   3.424  -4.356   6.476
  Start of MODEL    7
 4404    HD3  PRO  26           HD3      PRO  26   4.536  -5.329   5.488
  Start of MODEL    7
 4405    HA   PHE  27           HA       PHE  27  -1.263  -2.283   5.022
  Start of MODEL    7
 4406    HB3  PHE  27           HB2      PHE  27  -0.407  -1.206   2.983
  Start of MODEL    7
 4407    HB2  PHE  27           HB3      PHE  27  -2.098  -0.827   3.247
  Start of MODEL    7
 4408    HD1  PHE  27           HD1      PHE  27  -3.832  -1.677   1.759
  Start of MODEL    7
 4409    HD2  PHE  27           HD2      PHE  27   0.296  -2.462   1.084
  Start of MODEL    7
 4410    HE1  PHE  27           HE1      PHE  27  -4.340  -2.349  -0.539
  Start of MODEL    7
 4411    HE2  PHE  27           HE2      PHE  27  -0.213  -3.131  -1.216
  Start of MODEL    7
 4412    HZ   PHE  27           HZ       PHE  27  -2.530  -3.074  -2.032
  Start of MODEL    7
 4413    H    PHE  27           HN       PHE  27  -0.581  -4.376   3.099
  Start of MODEL    7
 4414    HA   SER  28           HA       SER  28  -5.330  -3.739   4.185
  Start of MODEL    7
 4415    HB3  SER  28           HB2      SER  28  -6.278  -4.003   6.395
  Start of MODEL    7
 4416    HB2  SER  28           HB3      SER  28  -5.184  -2.781   7.053
  Start of MODEL    7
 4417    HG   SER  28           HG       SER  28  -3.936  -4.809   5.720
  Start of MODEL    7
 4418    H    SER  28           HN       SER  28  -3.460  -1.758   5.214
  Start of MODEL    7
 4419    HA   VAL  29           HA       VAL  29  -7.453   0.072   4.178
  Start of MODEL    7
 4420    HB   VAL  29           HB       VAL  29  -6.182   0.715   2.195
  Start of MODEL    7
 4421    H    VAL  29           HN       VAL  29  -6.537  -2.410   2.942
  Start of MODEL    7
 4422    HA   ASP  30           HA       ASP  30 -11.274  -1.936   3.732
  Start of MODEL    7
 4423    HB3  ASP  30           HB2      ASP  30 -11.328  -0.319   6.275
  Start of MODEL    7
 4424    HB2  ASP  30           HB3      ASP  30 -10.917  -2.016   6.142
  Start of MODEL    7
 4425    H    ASP  30           HN       ASP  30  -9.422   0.115   4.750
  Start of MODEL    7
 4426    HA2  GLY  31           HA2      GLY  31 -14.576   0.862   3.057
  Start of MODEL    7
 4427    H    GLY  31           HN       GLY  31 -13.066  -1.436   2.741
  Start of MODEL    7
 4428    HA3  GLY  31           HA1      GLY  31 -13.497   1.118   1.683
  Start of MODEL    7
 4429    HA   GLN  32           HA       GLN  32 -16.772  -1.758   0.438
  Start of MODEL    7
 4430    HB3  GLN  32           HB2      GLN  32 -18.847   0.474   0.656
  Start of MODEL    7
 4431    HB2  GLN  32           HB3      GLN  32 -18.542  -0.643   1.957
  Start of MODEL    7
 4432    HG2  GLN  32           HG2      GLN  32 -19.265  -2.516   0.501
  Start of MODEL    7
 4433    HG3  GLN  32           HG3      GLN  32 -20.517  -1.343   0.875
  Start of MODEL    7
 4434   HE21  GLN  32          HE21      GLN  32 -18.597  -2.793  -1.590
  Start of MODEL    7
 4435   HE22  GLN  32          HE22      GLN  32 -19.417  -2.105  -2.930
  Start of MODEL    7
 4436    H    GLN  32           HN       GLN  32 -16.397   0.829   1.699
  Start of MODEL    7
 4437    HA   PRO  33           HA       PRO  33 -16.785   0.937  -3.482
  Start of MODEL    7
 4438    HB3  PRO  33           HB2      PRO  33 -17.880   2.990  -3.331
  Start of MODEL    7
 4439    HB2  PRO  33           HB3      PRO  33 -16.231   3.613  -3.249
  Start of MODEL    7
 4440    HG2  PRO  33           HG2      PRO  33 -16.299   3.850  -0.948
  Start of MODEL    7
 4441    HG3  PRO  33           HG3      PRO  33 -18.018   4.095  -1.316
  Start of MODEL    7
 4442    HD2  PRO  33           HD2      PRO  33 -17.138   2.195   0.401
  Start of MODEL    7
 4443    HD3  PRO  33           HD3      PRO  33 -18.613   2.040  -0.580
  Start of MODEL    7
 4444    HA   ALA  34           HA       ALA  34 -12.560   0.215  -2.654
  Start of MODEL    7
 4445    HB1  ALA  34           HB1      ALA  34 -12.791  -0.003  -5.650
  Start of MODEL    7
 4446    HB3  ALA  34           HB2      ALA  34 -12.999  -1.322  -4.496
  Start of MODEL    7
 4447    HB2  ALA  34           HB3      ALA  34 -11.425  -0.547  -4.679
  Start of MODEL    7
 4448    H    ALA  34           HN       ALA  34 -14.869   0.370  -4.235
  Start of MODEL    7
 4449    HA   PRO  35           HA       PRO  35 -11.299   4.457  -3.340
  Start of MODEL    7
 4450    HB3  PRO  35           HB2      PRO  35 -11.210   4.500  -1.007
  Start of MODEL    7
 4451    HB2  PRO  35           HB3      PRO  35  -9.488   4.576  -1.399
  Start of MODEL    7
 4452    HG2  PRO  35           HG2      PRO  35  -9.180   2.302  -1.022
  Start of MODEL    7
 4453    HG3  PRO  35           HG3      PRO  35 -10.385   2.651   0.222
  Start of MODEL    7
 4454    HD2  PRO  35           HD2      PRO  35 -10.719   0.747  -1.689
  Start of MODEL    7
 4455    HD3  PRO  35           HD3      PRO  35 -12.078   1.642  -0.980
  Start of MODEL    7
 4456    HA   SER  36           HA       SER  36  -7.773   3.662  -5.705
  Start of MODEL    7
 4457    HB3  SER  36           HB2      SER  36  -8.638   5.439  -7.049
  Start of MODEL    7
 4458    HB2  SER  36           HB3      SER  36  -6.958   5.844  -6.718
  Start of MODEL    7
 4459    HG   SER  36           HG       SER  36  -8.858   6.823  -4.918
  Start of MODEL    7
 4460    H    SER  36           HN       SER  36  -9.763   5.290  -4.556
  Start of MODEL    7
 4461    HA   LEU  37           HA       LEU  37  -4.821   4.397  -2.601
  Start of MODEL    7
 4462    HB3  LEU  37           HB2      LEU  37  -3.285   2.433  -2.599
  Start of MODEL    7
 4463    HB2  LEU  37           HB3      LEU  37  -3.984   1.935  -4.120
  Start of MODEL    7
 4464    HG   LEU  37           HG       LEU  37  -6.161   1.631  -2.995
  Start of MODEL    7
 4465   HD12  LEU  37          HD11      LEU  37  -5.532  -0.367  -1.767
  Start of MODEL    7
 4466   HD11  LEU  37          HD12      LEU  37  -3.867   0.196  -1.668
  Start of MODEL    7
 4467   HD13  LEU  37          HD13      LEU  37  -4.565  -0.215  -3.234
  Start of MODEL    7
 4468   HD22  LEU  37          HD21      LEU  37  -6.199   1.653  -0.522
  Start of MODEL    7
 4469   HD21  LEU  37          HD22      LEU  37  -5.919   3.245  -1.217
  Start of MODEL    7
 4470   HD23  LEU  37          HD23      LEU  37  -4.568   2.331  -0.545
  Start of MODEL    7
 4471    H    LEU  37           HN       LEU  37  -5.744   3.270  -5.131
  Start of MODEL    7
 4472    HA   ARG  38           HA       ARG  38  -1.276   5.767  -4.736
  Start of MODEL    7
 4473    HB3  ARG  38           HB2      ARG  38  -2.666   8.175  -3.549
  Start of MODEL    7
 4474    HB2  ARG  38           HB3      ARG  38  -2.817   7.576  -5.186
  Start of MODEL    7
 4475    HG2  ARG  38           HG2      ARG  38  -1.466   9.500  -5.355
  Start of MODEL    7
 4476    HG3  ARG  38           HG3      ARG  38  -0.481   9.035  -3.973
  Start of MODEL    7
 4477    HD2  ARG  38           HD2      ARG  38   0.416   8.818  -6.392
  Start of MODEL    7
 4478    HD3  ARG  38           HD3      ARG  38   0.735   7.558  -5.199
  Start of MODEL    7
 4479    HE   ARG  38           HE       ARG  38  -1.608   7.184  -6.870
  Start of MODEL    7
 4480   HH11  ARG  38          HH11      ARG  38   1.932   6.523  -6.715
  Start of MODEL    7
 4481   HH12  ARG  38          HH12      ARG  38   1.753   5.044  -7.519
  Start of MODEL    7
 4482   HH21  ARG  38          HH21      ARG  38  -1.722   5.108  -7.908
  Start of MODEL    7
 4483   HH22  ARG  38          HH22      ARG  38  -0.292   4.181  -8.127
  Start of MODEL    7
 4484    H    ARG  38           HN       ARG  38  -3.212   5.757  -2.551
  Start of MODEL    7
 4485    HA   TRP  39           HA       TRP  39   1.280   5.902  -1.251
  Start of MODEL    7
 4486    HB3  TRP  39           HB2      TRP  39   3.501   4.981  -1.900
  Start of MODEL    7
 4487    HB2  TRP  39           HB3      TRP  39   2.934   4.912  -3.564
  Start of MODEL    7
 4488    HD1  TRP  39           HD1      TRP  39   1.444   2.912  -4.278
  Start of MODEL    7
 4489    HE1  TRP  39           HE1      TRP  39   0.736   0.753  -3.127
  Start of MODEL    7
 4490    HE3  TRP  39           HE3      TRP  39   2.822   4.093   0.497
  Start of MODEL    7
 4491    HZ2  TRP  39           HZ2      TRP  39   0.736  -0.328  -0.485
  Start of MODEL    7
 4492    HZ3  TRP  39           HZ3      TRP  39   2.440   2.444   2.279
  Start of MODEL    7
 4493    HH2  TRP  39           HH2      TRP  39   1.427   0.282   1.800
  Start of MODEL    7
 4494    H    TRP  39           HN       TRP  39   0.712   5.680  -4.084
  Start of MODEL    7
 4495    HA   LEU  40           HA       LEU  40   3.634   9.439  -2.203
  Start of MODEL    7
 4496    HB3  LEU  40           HB2      LEU  40   2.347  10.057   0.461
  Start of MODEL    7
 4497    HB2  LEU  40           HB3      LEU  40   1.510  10.248  -1.070
  Start of MODEL    7
 4498    HG   LEU  40           HG       LEU  40   4.037  11.731  -0.424
  Start of MODEL    7
 4499   HD12  LEU  40          HD11      LEU  40   3.249  13.167  -2.245
  Start of MODEL    7
 4500   HD11  LEU  40          HD12      LEU  40   1.916  12.026  -2.520
  Start of MODEL    7
 4501   HD13  LEU  40          HD13      LEU  40   3.581  11.510  -2.754
  Start of MODEL    7
 4502   HD22  LEU  40          HD21      LEU  40   2.588  13.641   0.060
  Start of MODEL    7
 4503   HD21  LEU  40          HD22      LEU  40   2.306  12.328   1.201
  Start of MODEL    7
 4504   HD23  LEU  40          HD23      LEU  40   1.166  12.613  -0.114
  Start of MODEL    7
 4505    H    LEU  40           HN       LEU  40   2.192   7.595  -0.429
  Start of MODEL    7
 4506    HA   PHE  41           HA       PHE  41   6.710   8.390   0.758
  Start of MODEL    7
 4507    HB3  PHE  41           HB2      PHE  41   7.968   8.490  -1.993
  Start of MODEL    7
 4508    HB2  PHE  41           HB3      PHE  41   7.298   7.065  -1.212
  Start of MODEL    7
 4509    HD1  PHE  41           HD1      PHE  41  10.203   9.086  -1.665
  Start of MODEL    7
 4510    HD2  PHE  41           HD2      PHE  41   8.402   6.200   0.889
  Start of MODEL    7
 4511    HE1  PHE  41           HE1      PHE  41  12.395   8.574  -0.697
  Start of MODEL    7
 4512    HE2  PHE  41           HE2      PHE  41  10.597   5.679   1.856
  Start of MODEL    7
 4513    HZ   PHE  41           HZ       PHE  41  12.601   6.840   1.039
  Start of MODEL    7
 4514    H    PHE  41           HN       PHE  41   5.744   9.606  -1.724
  Start of MODEL    7
 4515    HA   ASN  42           HA       ASN  42   7.776  12.025   2.884
  Start of MODEL    7
 4516    HB3  ASN  42           HB2      ASN  42  10.100  12.737   2.193
  Start of MODEL    7
 4517    HB2  ASN  42           HB3      ASN  42  10.085  11.424   1.022
  Start of MODEL    7
 4518   HD21  ASN  42          HD21      ASN  42  10.258  12.263   4.345
  Start of MODEL    7
 4519   HD22  ASN  42          HD22      ASN  42  10.671  10.712   4.962
  Start of MODEL    7
 4520    H    ASN  42           HN       ASN  42   7.022  10.081   2.014
  Start of MODEL    7
 4521    HA2  GLY  43           HA2      GLY  43   4.925  14.380   0.169
  Start of MODEL    7
 4522    H    GLY  43           HN       GLY  43   5.904  12.401   0.971
  Start of MODEL    7
 4523    HA3  GLY  43           HA1      GLY  43   6.498  15.152   0.245
  Start of MODEL    7
 4524    HA   SER  44           HA       SER  44   6.508  13.552  -4.028
  Start of MODEL    7
 4525    HB3  SER  44           HB2      SER  44   8.474  12.348  -4.794
  Start of MODEL    7
 4526    HB2  SER  44           HB3      SER  44   8.679  11.606  -3.206
  Start of MODEL    7
 4527    HG   SER  44           HG       SER  44   8.556  14.367  -3.242
  Start of MODEL    7
 4528    H    SER  44           HN       SER  44   7.058  12.344  -1.374
  Start of MODEL    7
 4529    HA   VAL  45           HA       VAL  45   3.891  10.249  -4.657
  Start of MODEL    7
 4530    HB   VAL  45           HB       VAL  45   4.391  11.479  -7.386
  Start of MODEL    7
 4531    H    VAL  45           HN       VAL  45   5.432  12.451  -5.461
  Start of MODEL    7
 4532    HA   LEU  46           HA       LEU  46   6.923   7.288  -5.615
  Start of MODEL    7
 4533    HB3  LEU  46           HB2      LEU  46   4.768   5.862  -4.040
  Start of MODEL    7
 4534    HB2  LEU  46           HB3      LEU  46   6.172   6.636  -3.345
  Start of MODEL    7
 4535    HG   LEU  46           HG       LEU  46   6.257   4.229  -5.165
  Start of MODEL    7
 4536   HD13  LEU  46          HD11      LEU  46   8.263   5.590  -5.353
  Start of MODEL    7
 4537   HD12  LEU  46          HD12      LEU  46   8.605   4.092  -4.485
  Start of MODEL    7
 4538   HD11  LEU  46          HD13      LEU  46   8.434   5.604  -3.597
  Start of MODEL    7
 4539   HD23  LEU  46          HD21      LEU  46   6.614   4.461  -2.176
  Start of MODEL    7
 4540   HD22  LEU  46          HD22      LEU  46   6.876   3.003  -3.128
  Start of MODEL    7
 4541   HD21  LEU  46          HD23      LEU  46   5.260   3.698  -3.008
  Start of MODEL    7
 4542    H    LEU  46           HN       LEU  46   4.441   8.220  -4.500
  Start of MODEL    7
 4543    HA   ASN  47           HA       ASN  47   4.615   5.594  -8.884
  Start of MODEL    7
 4544    HB3  ASN  47           HB2      ASN  47   7.510   5.838  -9.735
  Start of MODEL    7
 4545    HB2  ASN  47           HB3      ASN  47   6.233   7.012  -9.985
  Start of MODEL    7
 4546   HD21  ASN  47          HD21      ASN  47   4.683   6.632 -11.594
  Start of MODEL    7
 4547   HD22  ASN  47          HD22      ASN  47   4.954   5.528 -12.877
  Start of MODEL    7
 4548    H    ASN  47           HN       ASN  47   7.066   5.886  -7.324
  Start of MODEL    7
 4549    HA   GLU  48           HA       GLU  48   5.356   1.290  -8.145
  Start of MODEL    7
 4550    HB3  GLU  48           HB2      GLU  48   3.487  -0.067  -8.845
  Start of MODEL    7
 4551    HB2  GLU  48           HB3      GLU  48   2.867   1.207  -9.877
  Start of MODEL    7
 4552    HG2  GLU  48           HG2      GLU  48   1.747   0.697  -7.573
  Start of MODEL    7
 4553    HG3  GLU  48           HG3      GLU  48   3.047   1.709  -6.951
  Start of MODEL    7
 4554    H    GLU  48           HN       GLU  48   3.859   3.532  -8.985
  Start of MODEL    7
 4555    HA   THR  49           HA       THR  49   6.658  -0.028 -12.078
  Start of MODEL    7
 4556    HB   THR  49           HB       THR  49   7.767   2.152 -11.806
  Start of MODEL    7
 4557    HG1  THR  49           HG1      THR  49   8.461   1.063 -13.529
  Start of MODEL    7
 4558   HG21  THR  49          HG21      THR  49   9.894   0.681 -10.245
  Start of MODEL    7
 4559   HG23  THR  49          HG22      THR  49   8.730   1.822  -9.588
  Start of MODEL    7
 4560   HG22  THR  49          HG23      THR  49   9.956   2.377 -10.732
  Start of MODEL    7
 4561    H    THR  49           HN       THR  49   6.794   0.207  -9.228
  Start of MODEL    7
 4562    HA   SER  50           HA       SER  50   8.720  -3.723 -11.432
  Start of MODEL    7
 4563    HB3  SER  50           HB2      SER  50  11.012  -2.798 -13.175
  Start of MODEL    7
 4564    HB2  SER  50           HB3      SER  50   9.438  -3.301 -13.785
  Start of MODEL    7
 4565    HG   SER  50           HG       SER  50  11.206  -4.865 -13.745
  Start of MODEL    7
 4566    H    SER  50           HN       SER  50   9.126  -1.149 -12.573
  Start of MODEL    7
 4567    HA   PHE  51           HA       PHE  51  12.175  -2.851  -8.586
  Start of MODEL    7
 4568    HB3  PHE  51           HB2      PHE  51  13.015  -0.707  -7.688
  Start of MODEL    7
 4569    HB2  PHE  51           HB3      PHE  51  11.766   0.149  -8.574
  Start of MODEL    7
 4570    HD1  PHE  51           HD1      PHE  51  14.851  -1.821  -8.943
  Start of MODEL    7
 4571    HD2  PHE  51           HD2      PHE  51  11.999   0.699 -10.853
  Start of MODEL    7
 4572    HE1  PHE  51           HE1      PHE  51  16.357  -1.570 -10.857
  Start of MODEL    7
 4573    HE2  PHE  51           HE2      PHE  51  13.508   0.954 -12.771
  Start of MODEL    7
 4574    HZ   PHE  51           HZ       PHE  51  15.685  -0.178 -12.778
  Start of MODEL    7
 4575    H    PHE  51           HN       PHE  51  10.127  -1.246  -9.986
  Start of MODEL    7
 4576    HA   ILE  52           HA       ILE  52   8.811  -1.872  -5.493
  Start of MODEL    7
 4577    HB   ILE  52           HB       ILE  52   8.563   0.960  -6.582
  Start of MODEL    7
 4578   HD11  ILE  52          HD11      ILE  52   9.882   2.233  -4.018
  Start of MODEL    7
 4579   HD13  ILE  52          HD12      ILE  52  10.315   2.667  -5.669
  Start of MODEL    7
 4580   HD12  ILE  52          HD13      ILE  52  11.554   2.088  -4.558
  Start of MODEL    7
 4581    H    ILE  52           HN       ILE  52   9.135  -1.235  -8.304
  Start of MODEL    7
 4582    HA   PHE  53           HA       PHE  53   4.793  -1.526  -7.144
  Start of MODEL    7
 4583    HB3  PHE  53           HB2      PHE  53   5.343  -2.872  -8.969
  Start of MODEL    7
 4584    HB2  PHE  53           HB3      PHE  53   3.966  -3.692  -8.256
  Start of MODEL    7
 4585    HD1  PHE  53           HD1      PHE  53   7.154  -4.132  -9.584
  Start of MODEL    7
 4586    HD2  PHE  53           HD2      PHE  53   4.578  -5.611  -6.549
  Start of MODEL    7
 4587    HE1  PHE  53           HE1      PHE  53   8.405  -6.241  -9.565
  Start of MODEL    7
 4588    HE2  PHE  53           HE2      PHE  53   5.828  -7.727  -6.522
  Start of MODEL    7
 4589    HZ   PHE  53           HZ       PHE  53   7.742  -8.048  -8.030
  Start of MODEL    7
 4590    H    PHE  53           HN       PHE  53   6.875  -3.003  -5.794
  Start of MODEL    7
 4591    HA   THR  54           HA       THR  54   2.350  -3.007  -3.974
  Start of MODEL    7
 4592    HB   THR  54           HB       THR  54   0.342  -1.697  -5.825
  Start of MODEL    7
 4593    HG1  THR  54           HG1      THR  54   2.542  -0.684  -5.048
  Start of MODEL    7
 4594   HG21  THR  54          HG21      THR  54   0.499  -1.857  -2.812
  Start of MODEL    7
 4595   HG23  THR  54          HG22      THR  54  -0.607  -2.786  -3.829
  Start of MODEL    7
 4596   HG22  THR  54          HG23      THR  54  -0.753  -1.033  -3.743
  Start of MODEL    7
 4597    H    THR  54           HN       THR  54   2.612  -2.283  -6.793
  Start of MODEL    7
 4598    HA   GLU  55           HA       GLU  55   0.414  -6.604  -5.726
  Start of MODEL    7
 4599    HB3  GLU  55           HB2      GLU  55   1.120  -8.560  -4.401
  Start of MODEL    7
 4600    HB2  GLU  55           HB3      GLU  55   1.869  -7.483  -3.233
  Start of MODEL    7
 4601    HG2  GLU  55           HG2      GLU  55   3.365  -6.669  -5.049
  Start of MODEL    7
 4602    HG3  GLU  55           HG3      GLU  55   3.592  -8.350  -4.584
  Start of MODEL    7
 4603    H    GLU  55           HN       GLU  55   1.894  -5.108  -3.699
  Start of MODEL    7
 4604    HA   PHE  56           HA       PHE  56  -2.712  -6.876  -2.602
  Start of MODEL    7
 4605    HB3  PHE  56           HB2      PHE  56  -4.917  -6.912  -3.787
  Start of MODEL    7
 4606    HB2  PHE  56           HB3      PHE  56  -4.068  -7.126  -5.308
  Start of MODEL    7
 4607    HD1  PHE  56           HD1      PHE  56  -5.013  -4.782  -2.715
  Start of MODEL    7
 4608    HD2  PHE  56           HD2      PHE  56  -2.765  -5.291  -6.292
  Start of MODEL    7
 4609    HE1  PHE  56           HE1      PHE  56  -4.877  -2.350  -2.969
  Start of MODEL    7
 4610    HE2  PHE  56           HE2      PHE  56  -2.618  -2.847  -6.553
  Start of MODEL    7
 4611    HZ   PHE  56           HZ       PHE  56  -3.680  -1.366  -4.876
  Start of MODEL    7
 4612    H    PHE  56           HN       PHE  56  -1.529  -7.647  -5.176
  Start of MODEL    7
 4613    HA   LEU  57           HA       LEU  57  -4.127 -11.022  -3.055
  Start of MODEL    7
 4614    HB3  LEU  57           HB2      LEU  57  -2.633 -11.095  -1.080
  Start of MODEL    7
 4615    HB2  LEU  57           HB3      LEU  57  -3.985 -12.185  -0.920
  Start of MODEL    7
 4616    HG   LEU  57           HG       LEU  57  -4.076  -9.533   0.435
  Start of MODEL    7
 4617   HD13  LEU  57          HD11      LEU  57  -6.125 -10.799   0.399
  Start of MODEL    7
 4618   HD12  LEU  57          HD12      LEU  57  -5.464 -10.837   2.042
  Start of MODEL    7
 4619   HD11  LEU  57          HD13      LEU  57  -5.285 -12.231   0.978
  Start of MODEL    7
 4620   HD22  LEU  57          HD21      LEU  57  -3.079 -10.577   2.422
  Start of MODEL    7
 4621   HD21  LEU  57          HD22      LEU  57  -1.938 -10.495   1.080
  Start of MODEL    7
 4622   HD23  LEU  57          HD23      LEU  57  -2.727 -12.022   1.475
  Start of MODEL    7
 4623    H    LEU  57           HN       LEU  57  -4.208  -8.438  -1.740
  Start of MODEL    7
 4624    HA   GLU  58           HA       GLU  58  -8.289 -10.792  -3.017
  Start of MODEL    7
 4625    HB3  GLU  58           HB2      GLU  58  -9.479 -13.006  -2.919
  Start of MODEL    7
 4626    HB2  GLU  58           HB3      GLU  58  -7.924 -13.708  -2.478
  Start of MODEL    7
 4627    HG2  GLU  58           HG2      GLU  58  -6.960 -12.851  -4.563
  Start of MODEL    7
 4628    HG3  GLU  58           HG3      GLU  58  -8.314 -13.942  -4.862
  Start of MODEL    7
 4629    H    GLU  58           HN       GLU  58  -6.025 -12.351  -2.400
  Start of MODEL    7
 4630    HA   PRO  59           HA       PRO  59  -9.751 -10.165   1.222
  Start of MODEL    7
 4631    HB3  PRO  59           HB2      PRO  59 -10.678  -8.094   0.997
  Start of MODEL    7
 4632    HB2  PRO  59           HB3      PRO  59 -11.953  -8.729  -0.041
  Start of MODEL    7
 4633    HG2  PRO  59           HG2      PRO  59 -10.841  -7.502  -1.646
  Start of MODEL    7
 4634    HG3  PRO  59           HG3      PRO  59  -9.304  -7.594  -0.774
  Start of MODEL    7
 4635    HD2  PRO  59           HD2      PRO  59 -10.580  -9.612  -2.577
  Start of MODEL    7
 4636    HD3  PRO  59           HD3      PRO  59  -8.881  -9.089  -2.441
  Start of MODEL    7
 4637    HA   ALA  60           HA       ALA  60 -13.050 -13.039   0.980
  Start of MODEL    7
 4638    HB2  ALA  60           HB1      ALA  60 -13.532 -13.866   3.241
  Start of MODEL    7
 4639    HB1  ALA  60           HB2      ALA  60 -12.600 -12.537   3.926
  Start of MODEL    7
 4640    HB3  ALA  60           HB3      ALA  60 -11.797 -13.772   2.954
  Start of MODEL    7
 4641    H    ALA  60           HN       ALA  60 -11.368 -11.134   2.396
  Start of MODEL    7
 4642    HA   ALA  61           HA       ALA  61 -16.601 -10.705   1.137
  Start of MODEL    7
 4643    HB1  ALA  61           HB1      ALA  61 -17.422 -12.841   0.284
  Start of MODEL    7
 4644    HB3  ALA  61           HB2      ALA  61 -18.666 -11.951   1.163
  Start of MODEL    7
 4645    HB2  ALA  61           HB3      ALA  61 -17.858 -13.319   1.926
  Start of MODEL    7
 4646    H    ALA  61           HN       ALA  61 -15.326 -13.181   1.705
  Start of MODEL    7
 4647    HA   ASN  62           HA       ASN  62 -17.678 -10.706   5.638
  Start of MODEL    7
 4648    HB3  ASN  62           HB2      ASN  62 -15.212 -12.212   6.596
  Start of MODEL    7
 4649    HB2  ASN  62           HB3      ASN  62 -16.752 -12.990   6.274
  Start of MODEL    7
 4650   HD21  ASN  62          HD21      ASN  62 -15.247 -12.808   8.766
  Start of MODEL    7
 4651   HD22  ASN  62          HD22      ASN  62 -16.299 -12.088   9.919
  Start of MODEL    7
 4652    H    ASN  62           HN       ASN  62 -15.644 -12.067   4.036
  Start of MODEL    7
 4653    HA   GLU  63           HA       GLU  63 -14.284  -7.655   5.806
  Start of MODEL    7
 4654    HB3  GLU  63           HB2      GLU  63 -12.120  -7.725   4.834
  Start of MODEL    7
 4655    HB2  GLU  63           HB3      GLU  63 -12.636  -8.810   3.567
  Start of MODEL    7
 4656    HG2  GLU  63           HG2      GLU  63 -12.305  -9.522   6.459
  Start of MODEL    7
 4657    HG3  GLU  63           HG3      GLU  63 -12.884 -10.608   5.193
  Start of MODEL    7
 4658    H    GLU  63           HN       GLU  63 -15.139  -9.738   3.914
  Start of MODEL    7
 4659    HA   THR  64           HA       THR  64 -14.410  -5.528   1.933
  Start of MODEL    7
 4660    HB   THR  64           HB       THR  64 -15.073  -3.026   2.489
  Start of MODEL    7
 4661    HG1  THR  64           HG1      THR  64 -14.791  -3.081   4.701
  Start of MODEL    7
 4662   HG23  THR  64          HG21      THR  64 -16.574  -4.588   1.358
  Start of MODEL    7
 4663   HG22  THR  64          HG22      THR  64 -17.474  -3.650   2.550
  Start of MODEL    7
 4664   HG21  THR  64          HG23      THR  64 -17.005  -5.314   2.904
  Start of MODEL    7
 4665    H    THR  64           HN       THR  64 -14.161  -5.625   4.832
  Start of MODEL    7
 4666    HA   VAL  65           HA       VAL  65 -10.553  -3.701   3.552
  Start of MODEL    7
 4667    HB   VAL  65           HB       VAL  65  -9.857  -6.332   4.820
  Start of MODEL    7
 4668    H    VAL  65           HN       VAL  65 -12.257  -6.067   3.670
  Start of MODEL    7
 4669    HA   ARG  66           HA       ARG  66  -8.621  -5.815   0.283
  Start of MODEL    7
 4670    HB3  ARG  66           HB2      ARG  66  -7.552  -4.190  -1.147
  Start of MODEL    7
 4671    HB2  ARG  66           HB3      ARG  66  -7.605  -2.972   0.106
  Start of MODEL    7
 4672    HG2  ARG  66           HG2      ARG  66  -9.961  -4.119  -1.394
  Start of MODEL    7
 4673    HG3  ARG  66           HG3      ARG  66 -10.085  -2.965  -0.062
  Start of MODEL    7
 4674    HD2  ARG  66           HD2      ARG  66 -10.233  -1.824  -2.220
  Start of MODEL    7
 4675    HD3  ARG  66           HD3      ARG  66  -8.775  -1.339  -1.362
  Start of MODEL    7
 4676    HE   ARG  66           HE       ARG  66  -8.104  -3.477  -2.955
  Start of MODEL    7
 4677   HH11  ARG  66          HH11      ARG  66  -9.068  -0.066  -3.449
  Start of MODEL    7
 4678   HH12  ARG  66          HH12      ARG  66  -8.469  -0.001  -5.025
  Start of MODEL    7
 4679   HH21  ARG  66          HH21      ARG  66  -7.282  -3.347  -5.088
  Start of MODEL    7
 4680   HH22  ARG  66          HH22      ARG  66  -7.430  -1.931  -6.014
  Start of MODEL    7
 4681    H    ARG  66           HN       ARG  66  -9.203  -3.559   2.035
  Start of MODEL    7
 4682    HA   HIS  67           HA       HIS  67  -4.910  -5.919   2.600
  Start of MODEL    7
 4683    HB3  HIS  67           HB2      HIS  67  -4.251  -8.288   2.987
  Start of MODEL    7
 4684    HB2  HIS  67           HB3      HIS  67  -5.552  -8.797   1.930
  Start of MODEL    7
 4685    HD1  HIS  67           HD1      HIS  67  -4.862  -7.919   5.433
  Start of MODEL    7
 4686    HD2  HIS  67           HD2      HIS  67  -8.175  -8.459   2.988
  Start of MODEL    7
 4687    HE1  HIS  67           HE1      HIS  67  -6.801  -8.192   6.979
  Start of MODEL    7
 4688    HE2  HIS  67           HE2      HIS  67  -8.659  -8.932   5.449
  Start of MODEL    7
 4689    H    HIS  67           HN       HIS  67  -6.953  -7.032   0.812
  Start of MODEL    7
 4690    HA2  GLY  68           HA2      GLY  68  -1.939  -7.286  -0.347
  Start of MODEL    7
 4691    H    GLY  68           HN       GLY  68  -2.817  -5.833   1.929
  Start of MODEL    7
 4692    HA3  GLY  68           HA1      GLY  68  -2.198  -5.576  -0.686
  Start of MODEL    7
 4693    HA   CYS  69           HA       CYS  69   1.608  -4.972   1.224
  Start of MODEL    7
 4694    HB3  CYS  69           HB2      CYS  69   2.246  -7.460  -0.341
  Start of MODEL    7
 4695    HB2  CYS  69           HB3      CYS  69   2.018  -7.299   1.396
  Start of MODEL    7
 4696    H    CYS  69           HN       CYS  69   0.135  -5.833  -1.111
  Start of MODEL    7
 4697    HA   LEU  70           HA       LEU  70   3.574  -2.955  -2.156
  Start of MODEL    7
 4698    HB3  LEU  70           HB2      LEU  70   4.326  -1.354   0.312
  Start of MODEL    7
 4699    HB2  LEU  70           HB3      LEU  70   2.997  -0.973  -0.761
  Start of MODEL    7
 4700    HG   LEU  70           HG       LEU  70   5.900  -0.992  -1.588
  Start of MODEL    7
 4701   HD11  LEU  70          HD11      LEU  70   3.439   0.019  -2.971
  Start of MODEL    7
 4702   HD13  LEU  70          HD12      LEU  70   4.445  -1.354  -3.459
  Start of MODEL    7
 4703   HD12  LEU  70          HD13      LEU  70   5.092   0.290  -3.505
  Start of MODEL    7
 4704   HD21  LEU  70          HD21      LEU  70   5.533   0.767   0.053
  Start of MODEL    7
 4705   HD23  LEU  70          HD22      LEU  70   4.139   1.334  -0.867
  Start of MODEL    7
 4706   HD22  LEU  70          HD23      LEU  70   5.755   1.444  -1.564
  Start of MODEL    7
 4707    H    LEU  70           HN       LEU  70   2.927  -3.376   0.660
  Start of MODEL    7
 4708    HA   ARG  71           HA       ARG  71   7.239  -4.711  -0.824
  Start of MODEL    7
 4709    HB3  ARG  71           HB2      ARG  71   6.185  -6.758  -1.344
  Start of MODEL    7
 4710    HB2  ARG  71           HB3      ARG  71   7.788  -6.787  -2.047
  Start of MODEL    7
 4711    HG2  ARG  71           HG2      ARG  71   5.188  -6.392  -3.500
  Start of MODEL    7
 4712    HG3  ARG  71           HG3      ARG  71   6.783  -6.235  -4.248
  Start of MODEL    7
 4713    HD2  ARG  71           HD2      ARG  71   5.789  -8.474  -4.587
  Start of MODEL    7
 4714    HD3  ARG  71           HD3      ARG  71   7.309  -8.526  -3.696
  Start of MODEL    7
 4715    HE   ARG  71           HE       ARG  71   4.686  -8.642  -2.365
  Start of MODEL    7
 4716   HH11  ARG  71          HH11      ARG  71   7.901 -10.032  -2.907
  Start of MODEL    7
 4717   HH12  ARG  71          HH12      ARG  71   7.783 -11.130  -1.605
  Start of MODEL    7
 4718   HH21  ARG  71          HH21      ARG  71   4.537 -10.141  -0.627
  Start of MODEL    7
 4719   HH22  ARG  71          HH22      ARG  71   5.795 -11.215  -0.267
  Start of MODEL    7
 4720    H    ARG  71           HN       ARG  71   5.273  -4.085  -2.863
  Start of MODEL    7
 4721    HA   LEU  72           HA       LEU  72  10.020  -2.930  -3.548
  Start of MODEL    7
 4722    HB3  LEU  72           HB2      LEU  72  11.926  -2.243  -2.274
  Start of MODEL    7
 4723    HB2  LEU  72           HB3      LEU  72  11.616  -3.390  -1.003
  Start of MODEL    7
 4724    HG   LEU  72           HG       LEU  72   9.480  -2.029  -0.523
  Start of MODEL    7
 4725   HD13  LEU  72          HD11      LEU  72  11.426  -1.848   0.883
  Start of MODEL    7
 4726   HD12  LEU  72          HD12      LEU  72  10.638  -0.281   0.683
  Start of MODEL    7
 4727   HD11  LEU  72          HD13      LEU  72  12.132  -0.641  -0.200
  Start of MODEL    7
 4728   HD23  LEU  72          HD21      LEU  72  10.896  -0.078  -2.301
  Start of MODEL    7
 4729   HD22  LEU  72          HD22      LEU  72   9.453   0.257  -1.334
  Start of MODEL    7
 4730   HD21  LEU  72          HD23      LEU  72   9.381  -0.902  -2.667
  Start of MODEL    7
 4731    H    LEU  72           HN       LEU  72   9.168  -4.143  -1.058
  Start of MODEL    7
 4732    HA   ASN  73           HA       ASN  73  11.685  -6.958  -4.156
  Start of MODEL    7
 4733    HB3  ASN  73           HB2      ASN  73  10.075  -7.123  -5.964
  Start of MODEL    7
 4734    HB2  ASN  73           HB3      ASN  73  11.652  -7.619  -6.557
  Start of MODEL    7
 4735   HD21  ASN  73          HD21      ASN  73  12.617  -6.480  -8.204
  Start of MODEL    7
 4736   HD22  ASN  73          HD22      ASN  73  11.791  -5.178  -8.991
  Start of MODEL    7
 4737    H    ASN  73           HN       ASN  73  10.440  -4.505  -4.986
  Start of MODEL    7
 4738    HA   GLN  74           HA       GLN  74  15.452  -4.984  -5.190
  Start of MODEL    7
 4739    HB3  GLN  74           HB2      GLN  74  16.162  -3.184  -6.863
  Start of MODEL    7
 4740    HB2  GLN  74           HB3      GLN  74  14.472  -3.121  -7.343
  Start of MODEL    7
 4741    HG2  GLN  74           HG2      GLN  74  14.532  -5.442  -8.010
  Start of MODEL    7
 4742    HG3  GLN  74           HG3      GLN  74  15.803  -4.536  -8.834
  Start of MODEL    7
 4743   HE21  GLN  74          HE21      GLN  74  15.632  -7.385  -8.310
  Start of MODEL    7
 4744   HE22  GLN  74          HE22      GLN  74  17.034  -7.798  -7.389
  Start of MODEL    7
 4745    H    GLN  74           HN       GLN  74  12.781  -3.999  -5.757
  Start of MODEL    7
 4746    HA   PRO  75           HA       PRO  75  14.753  -1.599  -2.369
  Start of MODEL    7
 4747    HB3  PRO  75           HB2      PRO  75  14.764  -2.778  -0.445
  Start of MODEL    7
 4748    HB2  PRO  75           HB3      PRO  75  16.524  -2.811  -0.501
  Start of MODEL    7
 4749    HG2  PRO  75           HG2      PRO  75  16.332  -5.054  -0.844
  Start of MODEL    7
 4750    HG3  PRO  75           HG3      PRO  75  14.603  -4.913  -1.201
  Start of MODEL    7
 4751    HD2  PRO  75           HD2      PRO  75  16.937  -4.757  -3.040
  Start of MODEL    7
 4752    HD3  PRO  75           HD3      PRO  75  15.297  -5.394  -3.306
  Start of MODEL    7
 4753    HA   THR  76           HA       THR  76  18.867   0.136  -2.480
  Start of MODEL    7
 4754    HB   THR  76           HB       THR  76  18.447   2.387  -3.667
  Start of MODEL    7
 4755    HG1  THR  76           HG1      THR  76  15.844   1.259  -3.759
  Start of MODEL    7
 4756   HG22  THR  76          HG21      THR  76  17.971   1.330  -5.844
  Start of MODEL    7
 4757   HG21  THR  76          HG22      THR  76  17.432  -0.130  -5.017
  Start of MODEL    7
 4758   HG23  THR  76          HG23      THR  76  19.119   0.367  -4.914
  Start of MODEL    7
 4759    H    THR  76           HN       THR  76  15.983   0.155  -1.949
  Start of MODEL    7
 4760    HA   HIS  77           HA       HIS  77  19.127   2.405   1.116
  Start of MODEL    7
 4761    HB3  HIS  77           HB2      HIS  77  21.478   2.655   0.266
  Start of MODEL    7
 4762    HB2  HIS  77           HB3      HIS  77  20.999   3.856   1.448
  Start of MODEL    7
 4763    HD1  HIS  77           HD1      HIS  77  22.004   3.560  -2.163
  Start of MODEL    7
 4764    HD2  HIS  77           HD2      HIS  77  20.992   6.488   0.609
  Start of MODEL    7
 4765    HE1  HIS  77           HE1      HIS  77  22.620   5.734  -3.219
  Start of MODEL    7
 4766    HE2  HIS  77           HE2      HIS  77  21.854   7.500  -1.594
  Start of MODEL    7
 4767    H    HIS  77           HN       HIS  77  19.860   2.148  -1.577
  Start of MODEL    7
 4768    HA   VAL  78           HA       VAL  78  17.088   6.406   0.038
  Start of MODEL    7
 4769    HB   VAL  78           HB       VAL  78  15.647   6.987  -1.868
  Start of MODEL    7
 4770    H    VAL  78           HN       VAL  78  17.667   3.958  -1.380
  Start of MODEL    7
 4771    HA   ASN  79           HA       ASN  79  13.178   3.739   0.381
  Start of MODEL    7
 4772    HB3  ASN  79           HB2      ASN  79  13.136   1.306   1.096
  Start of MODEL    7
 4773    HB2  ASN  79           HB3      ASN  79  14.876   1.293   0.839
  Start of MODEL    7
 4774   HD21  ASN  79          HD21      ASN  79  12.416   2.951  -1.094
  Start of MODEL    7
 4775   HD22  ASN  79          HD22      ASN  79  12.743   2.070  -2.542
  Start of MODEL    7
 4776    H    ASN  79           HN       ASN  79  15.996   3.277   0.147
  Start of MODEL    7
 4777    HA   ASN  80           HA       ASN  80  13.980   3.868   4.894
  Start of MODEL    7
 4778    HB3  ASN  80           HB2      ASN  80  15.629   5.283   6.097
  Start of MODEL    7
 4779    HB2  ASN  80           HB3      ASN  80  16.292   5.838   4.574
  Start of MODEL    7
 4780   HD21  ASN  80          HD21      ASN  80  17.823   4.646   3.525
  Start of MODEL    7
 4781   HD22  ASN  80          HD22      ASN  80  18.533   3.262   4.233
  Start of MODEL    7
 4782    H    ASN  80           HN       ASN  80  15.373   4.697   2.447
  Start of MODEL    7
 4783    HA2  GLY  81           HA2      GLY  81  11.968   7.721   4.913
  Start of MODEL    7
 4784    H    GLY  81           HN       GLY  81  11.947   4.872   4.535
  Start of MODEL    7
 4785    HA3  GLY  81           HA1      GLY  81  11.497   7.249   3.295
  Start of MODEL    7
 4786    HA   ASN  82           HA       ASN  82   7.841   7.171   5.859
  Start of MODEL    7
 4787    HB3  ASN  82           HB2      ASN  82   6.553   9.338   5.598
  Start of MODEL    7
 4788    HB2  ASN  82           HB3      ASN  82   7.918   9.937   4.666
  Start of MODEL    7
 4789   HD21  ASN  82          HD21      ASN  82   6.716   9.256   7.781
  Start of MODEL    7
 4790   HD22  ASN  82          HD22      ASN  82   8.076   9.818   8.684
  Start of MODEL    7
 4791    H    ASN  82           HN       ASN  82   9.654   8.474   3.986
  Start of MODEL    7
 4792    HA   TYR  83           HA       TYR  83   5.686   6.214   2.120
  Start of MODEL    7
 4793    HB3  TYR  83           HB2      TYR  83   4.956   3.826   2.184
  Start of MODEL    7
 4794    HB2  TYR  83           HB3      TYR  83   5.589   3.694   3.817
  Start of MODEL    7
 4795    HD1  TYR  83           HD1      TYR  83   6.382   3.458   0.315
  Start of MODEL    7
 4796    HD2  TYR  83           HD2      TYR  83   8.110   4.004   4.175
  Start of MODEL    7
 4797    HE1  TYR  83           HE1      TYR  83   8.570   2.799  -0.570
  Start of MODEL    7
 4798    HE2  TYR  83           HE2      TYR  83  10.298   3.349   3.284
  Start of MODEL    7
 4799    HH   TYR  83           HH       TYR  83  10.830   3.024  -0.093
  Start of MODEL    7
 4800    H    TYR  83           HN       TYR  83   6.714   5.650   4.775
  Start of MODEL    7
 4801    HA   THR  84           HA       THR  84   1.889   6.898   4.234
  Start of MODEL    7
 4802    HB   THR  84           HB       THR  84   2.223   9.288   2.391
  Start of MODEL    7
 4803    HG1  THR  84           HG1      THR  84   2.822   8.894   5.146
  Start of MODEL    7
 4804   HG23  THR  84          HG21      THR  84  -0.130   8.919   3.059
  Start of MODEL    7
 4805   HG22  THR  84          HG22      THR  84   0.527  10.366   3.825
  Start of MODEL    7
 4806   HG21  THR  84          HG23      THR  84   0.366   8.876   4.751
  Start of MODEL    7
 4807    H    THR  84           HN       THR  84   3.917   7.443   2.208
  Start of MODEL    7
 4808    HA   LEU  85           HA       LEU  85  -0.370   5.489   0.775
  Start of MODEL    7
 4809    HB3  LEU  85           HB2      LEU  85  -1.455   4.019   3.188
  Start of MODEL    7
 4810    HB2  LEU  85           HB3      LEU  85  -0.171   3.463   2.135
  Start of MODEL    7
 4811    HG   LEU  85           HG       LEU  85  -3.063   3.792   1.333
  Start of MODEL    7
 4812   HD11  LEU  85          HD11      LEU  85  -0.677   2.751  -0.116
  Start of MODEL    7
 4813   HD13  LEU  85          HD12      LEU  85  -1.582   4.228  -0.512
  Start of MODEL    7
 4814   HD12  LEU  85          HD13      LEU  85  -2.341   2.632  -0.696
  Start of MODEL    7
 4815   HD23  LEU  85          HD21      LEU  85  -1.406   1.314   1.736
  Start of MODEL    7
 4816   HD22  LEU  85          HD22      LEU  85  -3.106   1.399   1.248
  Start of MODEL    7
 4817   HD21  LEU  85          HD23      LEU  85  -2.615   1.933   2.858
  Start of MODEL    7
 4818    H    LEU  85           HN       LEU  85   0.119   5.904   3.626
  Start of MODEL    7
 4819    HA   LEU  86           HA       LEU  86  -3.897   7.976   1.493
  Start of MODEL    7
 4820    HB3  LEU  86           HB2      LEU  86  -4.276   9.359  -0.574
  Start of MODEL    7
 4821    HB2  LEU  86           HB3      LEU  86  -2.898   8.582  -1.304
  Start of MODEL    7
 4822    HG   LEU  86           HG       LEU  86  -2.468  10.881  -0.527
  Start of MODEL    7
 4823   HD12  LEU  86          HD11      LEU  86  -2.189  11.365   1.824
  Start of MODEL    7
 4824   HD11  LEU  86          HD12      LEU  86  -2.799   9.764   2.224
  Start of MODEL    7
 4825   HD13  LEU  86          HD13      LEU  86  -3.853  10.932   1.425
  Start of MODEL    7
 4826   HD22  LEU  86          HD21      LEU  86  -0.322  10.432   0.577
  Start of MODEL    7
 4827   HD21  LEU  86          HD22      LEU  86  -0.601   9.363  -0.800
  Start of MODEL    7
 4828   HD23  LEU  86          HD23      LEU  86  -0.821   8.759   0.840
  Start of MODEL    7
 4829    H    LEU  86           HN       LEU  86  -1.796   6.736  -0.111
  Start of MODEL    7
 4830    HA   ALA  87           HA       ALA  87  -6.597   5.818  -1.178
  Start of MODEL    7
 4831    HB1  ALA  87           HB1      ALA  87  -7.557   5.231   1.622
  Start of MODEL    7
 4832    HB3  ALA  87           HB2      ALA  87  -6.440   4.234   0.694
  Start of MODEL    7
 4833    HB2  ALA  87           HB3      ALA  87  -8.108   4.418   0.158
  Start of MODEL    7
 4834    H    ALA  87           HN       ALA  87  -5.896   7.288   1.265
  Start of MODEL    7
 4835    HA   ALA  88           HA       ALA  88  -9.938   8.525  -0.631
  Start of MODEL    7
 4836    HB3  ALA  88           HB1      ALA  88  -8.215   9.959  -1.623
  Start of MODEL    7
 4837    HB2  ALA  88           HB2      ALA  88  -9.811  10.275  -2.303
  Start of MODEL    7
 4838    HB1  ALA  88           HB3      ALA  88  -8.633   9.339  -3.223
  Start of MODEL    7
 4839    H    ALA  88           HN       ALA  88  -8.094   6.884  -2.207
  Start of MODEL    7
 4840    HA   ASN  89           HA       ASN  89 -12.771   7.310  -3.698
  Start of MODEL    7
 4841    HB3  ASN  89           HB2      ASN  89 -12.810   5.249  -2.325
  Start of MODEL    7
 4842    HB2  ASN  89           HB3      ASN  89 -14.451   5.708  -2.696
  Start of MODEL    7
 4843   HD21  ASN  89          HD21      ASN  89 -13.750   3.917  -0.721
  Start of MODEL    7
 4844   HD22  ASN  89          HD22      ASN  89 -14.188   4.579   0.809
  Start of MODEL    7
 4845    H    ASN  89           HN       ASN  89 -11.953   8.254  -1.087
  Start of MODEL    7
 4846    HA   PRO  90           HA       PRO  90 -15.902  10.435  -3.656
  Start of MODEL    7
 4847    HB3  PRO  90           HB2      PRO  90 -18.016   9.764  -4.324
  Start of MODEL    7
 4848    HB2  PRO  90           HB3      PRO  90 -18.083   8.460  -3.136
  Start of MODEL    7
 4849    HG2  PRO  90           HG2      PRO  90 -17.592   7.281  -5.106
  Start of MODEL    7
 4850    HG3  PRO  90           HG3      PRO  90 -16.574   8.590  -5.730
  Start of MODEL    7
 4851    HD2  PRO  90           HD2      PRO  90 -15.967   6.523  -3.679
  Start of MODEL    7
 4852    HD3  PRO  90           HD3      PRO  90 -14.895   7.229  -4.912
  Start of MODEL    7
 4853    HA   CYS  91           HA       CYS  91 -17.760   9.829   0.679
  Start of MODEL    7
 4854    HB3  CYS  91           HB2      CYS  91 -16.117   7.359   1.224
  Start of MODEL    7
 4855    HB2  CYS  91           HB3      CYS  91 -17.870   7.490   1.106
  Start of MODEL    7
 4856    H    CYS  91           HN       CYS  91 -16.291   8.117  -1.033
  Start of MODEL    7
 4857    HA2  GLY  92           HA2      GLY  92 -13.482  11.575   1.389
  Start of MODEL    7
 4858    H    GLY  92           HN       GLY  92 -14.242   9.013   0.593
  Start of MODEL    7
 4859    HA3  GLY  92           HA1      GLY  92 -13.616  10.571   2.820
  Start of MODEL    7
 4860    HA   GLN  93           HA       GLN  93  -9.683   9.362   1.305
  Start of MODEL    7
 4861    HB3  GLN  93           HB2      GLN  93  -8.977  12.214   2.008
  Start of MODEL    7
 4862    HB2  GLN  93           HB3      GLN  93  -9.359  11.618   0.400
  Start of MODEL    7
 4863    HG2  GLN  93           HG2      GLN  93  -7.007  10.742   2.060
  Start of MODEL    7
 4864    HG3  GLN  93           HG3      GLN  93  -7.378  10.211   0.424
  Start of MODEL    7
 4865   HE21  GLN  93          HE21      GLN  93  -6.167  12.786   2.393
  Start of MODEL    7
 4866   HE22  GLN  93          HE22      GLN  93  -5.571  13.750   1.096
  Start of MODEL    7
 4867    H    GLN  93           HN       GLN  93 -11.309  11.316   2.765
  Start of MODEL    7
 4868    HA   ALA  94           HA       ALA  94  -7.936   8.935   5.305
  Start of MODEL    7
 4869    HB3  ALA  94           HB1      ALA  94  -9.214   6.884   5.172
  Start of MODEL    7
 4870    HB2  ALA  94           HB2      ALA  94  -7.538   6.467   5.608
  Start of MODEL    7
 4871    HB1  ALA  94           HB3      ALA  94  -8.103   6.265   3.959
  Start of MODEL    7
 4872    H    ALA  94           HN       ALA  94  -8.389   8.206   2.490
  Start of MODEL    7
 4873    HA   SER  95           HA       SER  95  -3.800   7.830   4.111
  Start of MODEL    7
 4874    HB3  SER  95           HB2      SER  95  -3.894  10.228   3.976
  Start of MODEL    7
 4875    HB2  SER  95           HB3      SER  95  -2.459   9.812   4.914
  Start of MODEL    7
 4876    HG   SER  95           HG       SER  95  -4.922  10.348   6.172
  Start of MODEL    7
 4877    H    SER  95           HN       SER  95  -5.816   8.408   6.089
  Start of MODEL    7
 4878    HA   ALA  96           HA       ALA  96  -1.823   6.694   7.898
  Start of MODEL    7
 4879    HB3  ALA  96           HB1      ALA  96  -3.142   4.695   7.355
  Start of MODEL    7
 4880    HB2  ALA  96           HB2      ALA  96  -1.503   4.243   7.833
  Start of MODEL    7
 4881    HB1  ALA  96           HB3      ALA  96  -1.955   4.251   6.130
  Start of MODEL    7
 4882    H    ALA  96           HN       ALA  96  -2.139   6.726   4.988
  Start of MODEL    7
 4883    HA   SER  97           HA       SER  97   2.188   6.162   6.184
  Start of MODEL    7
 4884    HB3  SER  97           HB2      SER  97   3.620   7.784   7.292
  Start of MODEL    7
 4885    HB2  SER  97           HB3      SER  97   2.511   7.848   8.669
  Start of MODEL    7
 4886    HG   SER  97           HG       SER  97   0.910   8.513   7.211
  Start of MODEL    7
 4887    H    SER  97           HN       SER  97   0.387   6.146   8.481
  Start of MODEL    7
 4888    HA   ILE  98           HA       ILE  98   4.641   3.774   8.918
  Start of MODEL    7
 4889    HB   ILE  98           HB       ILE  98   3.236   2.155   7.639
  Start of MODEL    7
 4890   HD11  ILE  98          HD11      ILE  98   7.074   1.806   7.851
  Start of MODEL    7
 4891   HD13  ILE  98          HD12      ILE  98   6.557   0.712   6.564
  Start of MODEL    7
 4892   HD12  ILE  98          HD13      ILE  98   6.947   0.071   8.159
  Start of MODEL    7
 4893    H    ILE  98           HN       ILE  98   3.951   4.955   6.359
  Start of MODEL    7
 4894    HA   MET  99           HA       MET  99   8.337   5.017   6.991
  Start of MODEL    7
 4895    HB3  MET  99           HB2      MET  99   8.969   5.474   9.909
  Start of MODEL    7
 4896    HB2  MET  99           HB3      MET  99   8.036   6.603   8.931
  Start of MODEL    7
 4897    HG2  MET  99           HG2      MET  99  10.889   5.746   8.505
  Start of MODEL    7
 4898    HG3  MET  99           HG3      MET  99   9.969   6.735   7.379
  Start of MODEL    7
 4899    HE2  MET  99           HE1      MET  99  12.386   9.358   8.721
  Start of MODEL    7
 4900    HE1  MET  99           HE2      MET  99  11.591   8.619   7.321
  Start of MODEL    7
 4901    HE3  MET  99           HE3      MET  99  12.688   7.660   8.304
  Start of MODEL    7
 4902    H    MET  99           HN       MET  99   6.773   4.122   9.293
  Start of MODEL    7
 4903    HA   ALA 100           HA       ALA 100  10.245   1.208   7.883
  Start of MODEL    7
 4904    HB1  ALA 100           HB1      ALA 100  10.024   1.283   4.869
  Start of MODEL    7
 4905    HB3  ALA 100           HB2      ALA 100   8.856   0.556   5.968
  Start of MODEL    7
 4906    HB2  ALA 100           HB3      ALA 100  10.482  -0.111   5.847
  Start of MODEL    7
 4907    H    ALA 100           HN       ALA 100   9.221   3.312   6.160
  Start of MODEL    7
 4908    HA   ALA 101           HA       ALA 101  14.289   2.433   6.810
  Start of MODEL    7
 4909    HB2  ALA 101           HB1      ALA 101  15.719   1.728   8.687
  Start of MODEL    7
 4910    HB1  ALA 101           HB2      ALA 101  14.416   0.701   9.290
  Start of MODEL    7
 4911    HB3  ALA 101           HB3      ALA 101  14.218   2.454   9.255
  Start of MODEL    7
 4912    H    ALA 101           HN       ALA 101  12.310   0.602   7.956
  Start of MODEL    7
 4913    HA   PHE 102           HA       PHE 102  15.676  -1.330   5.122
  Start of MODEL    7
 4914    HB3  PHE 102           HB2      PHE 102  16.582   0.970   3.396
  Start of MODEL    7
 4915    HB2  PHE 102           HB3      PHE 102  15.189  -0.076   3.167
  Start of MODEL    7
 4916    HD1  PHE 102           HD1      PHE 102  16.168  -2.737   3.279
  Start of MODEL    7
 4917    HD2  PHE 102           HD2      PHE 102  18.034   0.704   1.668
  Start of MODEL    7
 4918    HE1  PHE 102           HE1      PHE 102  17.481  -4.167   1.770
  Start of MODEL    7
 4919    HE2  PHE 102           HE2      PHE 102  19.343  -0.699   0.161
  Start of MODEL    7
 4920    HZ   PHE 102           HZ       PHE 102  19.076  -3.151   0.206
  Start of MODEL    7
 4921    H    PHE 102           HN       PHE 102  15.975   1.516   5.822
  Start of MODEL    7
 4922    HA   MET 103           HA       MET 103  20.094  -0.914   6.227
  Start of MODEL    7
 4923    HB3  MET 103           HB2      MET 103  21.916  -0.555   4.478
  Start of MODEL    7
 4924    HB2  MET 103           HB3      MET 103  20.645  -0.025   3.395
  Start of MODEL    7
 4925    HG2  MET 103           HG2      MET 103  20.863  -2.736   4.662
  Start of MODEL    7
 4926    HG3  MET 103           HG3      MET 103  19.548  -2.191   3.627
  Start of MODEL    7
 4927    HE2  MET 103           HE1      MET 103  23.907  -2.729   2.156
  Start of MODEL    7
 4928    HE1  MET 103           HE2      MET 103  23.388  -3.041   3.812
  Start of MODEL    7
 4929    HE3  MET 103           HE3      MET 103  23.409  -1.391   3.189
  Start of MODEL    7
 4930    H    MET 103           HN       MET 103  18.473   0.858   4.586
  Start of MODEL    7
 4931    HA   ASP 104           HA       ASP 104  21.911   2.822   7.378
  Start of MODEL    7
 4932    HB3  ASP 104           HB2      ASP 104  24.389   1.106   7.088
  Start of MODEL    7
 4933    HB2  ASP 104           HB3      ASP 104  23.372   1.198   8.518
  Start of MODEL    7
 4934    H    ASP 104           HN       ASP 104  22.324   0.186   6.337
  Start of MODEL    7
 4935    HA   ASN 105           HA       ASN 105  23.407   4.402   3.608
  Start of MODEL    7
 4936    HB3  ASN 105           HB2      ASN 105  22.845   6.912   3.562
  Start of MODEL    7
 4937    HB2  ASN 105           HB3      ASN 105  22.106   6.660   5.139
  Start of MODEL    7
 4938   HD21  ASN 105          HD21      ASN 105  20.800   7.539   2.760
  Start of MODEL    7
 4939   HD22  ASN 105          HD22      ASN 105  19.570   6.383   2.412
  Start of MODEL    7
 4940    H    ASN 105           HN       ASN 105  22.498   4.646   6.364
  Start of MODEL    7
 4941    HA   PRO 106           HA       PRO 106  27.517   5.224   5.180
  Start of MODEL    7
 4942    HB3  PRO 106           HB2      PRO 106  28.838   4.442   3.496
  Start of MODEL    7
 4943    HB2  PRO 106           HB3      PRO 106  28.131   5.546   2.319
  Start of MODEL    7
 4944    HG2  PRO 106           HG2      PRO 106  27.127   3.647   1.535
  Start of MODEL    7
 4945    HG3  PRO 106           HG3      PRO 106  27.288   2.809   3.091
  Start of MODEL    7
 4946    HD2  PRO 106           HD2      PRO 106  25.132   4.571   2.084
  Start of MODEL    7
 4947    HD3  PRO 106           HD3      PRO 106  25.075   3.256   3.273
  Start of MODEL    7
 4948    HA   PHE 107           HA       PHE 107  28.759   9.234   6.035
  Start of MODEL    7
 4949    HB3  PHE 107           HB2      PHE 107  29.210  10.617   3.983
  Start of MODEL    7
 4950    HB2  PHE 107           HB3      PHE 107  28.593   9.290   3.009
  Start of MODEL    7
 4951    HD1  PHE 107           HD1      PHE 107  31.342  10.438   5.106
  Start of MODEL    7
 4952    HD2  PHE 107           HD2      PHE 107  29.852   7.252   2.723
  Start of MODEL    7
 4953    HE1  PHE 107           HE1      PHE 107  33.576   9.412   5.086
  Start of MODEL    7
 4954    HE2  PHE 107           HE2      PHE 107  32.070   6.223   2.694
  Start of MODEL    7
 4955    HZ   PHE 107           HZ       PHE 107  33.945   7.299   3.877
  Start of MODEL    7
 4956    H    PHE 107           HN       PHE 107  28.213   7.120   5.844
  Start of MODEL    8
 4957    H1   ASP   1           H        ASP   1 -28.065  -8.880  -4.058
  Start of MODEL    8
 4958    H2   ASP   1           H2       ASP   1 -27.502 -10.145  -3.123
  Start of MODEL    8
 4959    H3   ASP   1           H3       ASP   1 -26.502  -8.816  -3.454
  Start of MODEL    8
 4960    HA   ASP   1           HA       ASP   1 -29.047  -8.720  -1.954
  Start of MODEL    8
 4961    HB3  ASP   1           HB2      ASP   1 -26.196  -8.550  -0.910
  Start of MODEL    8
 4962    HB2  ASP   1           HB3      ASP   1 -27.327  -9.861  -0.620
  Start of MODEL    8
 4963    HA   ASP   2           HA       ASP   2 -25.681  -4.671  -1.649
  Start of MODEL    8
 4964    HB3  ASP   2           HB2      ASP   2 -26.455  -3.410  -3.770
  Start of MODEL    8
 4965    HB2  ASP   2           HB3      ASP   2 -27.030  -4.984  -4.301
  Start of MODEL    8
 4966    H    ASP   2           HN       ASP   2 -26.071  -6.836  -1.668
  Start of MODEL    8
 4967    HA   ASP   3           HA       ASP   3 -29.693  -3.241  -0.113
  Start of MODEL    8
 4968    HB3  ASP   3           HB2      ASP   3 -28.039  -3.716   2.389
  Start of MODEL    8
 4969    HB2  ASP   3           HB3      ASP   3 -29.247  -4.848   1.802
  Start of MODEL    8
 4970    H    ASP   3           HN       ASP   3 -27.393  -4.903   0.158
  Start of MODEL    8
 4971    HA   ASP   4           HA       ASP   4 -24.830  -1.240   0.709
  Start of MODEL    8
 4972    HB3  ASP   4           HB2      ASP   4 -26.584   0.168  -1.294
  Start of MODEL    8
 4973    HB2  ASP   4           HB3      ASP   4 -25.871  -1.392  -1.655
  Start of MODEL    8
 4974    H    ASP   4           HN       ASP   4 -26.398  -2.837   0.915
  Start of MODEL    8
 4975    HA   ASP   5           HA       ASP   5 -27.466   2.161   2.704
  Start of MODEL    8
 4976    HB3  ASP   5           HB2      ASP   5 -28.421  -0.074   4.506
  Start of MODEL    8
 4977    HB2  ASP   5           HB3      ASP   5 -29.389   0.918   3.428
  Start of MODEL    8
 4978    H    ASP   5           HN       ASP   5 -27.360  -0.689   2.421
  Start of MODEL    8
 4979    HA   VAL   6           HA       VAL   6 -24.482   1.165   6.163
  Start of MODEL    8
 4980    HB   VAL   6           HB       VAL   6 -22.803  -0.797   6.262
  Start of MODEL    8
 4981    H    VAL   6           HN       VAL   6 -25.670  -0.378   4.122
  Start of MODEL    8
 4982    HA   SER   7           HA       SER   7 -21.728   2.760   3.280
  Start of MODEL    8
 4983    HB3  SER   7           HB2      SER   7 -22.301   5.268   3.179
  Start of MODEL    8
 4984    HB2  SER   7           HB3      SER   7 -23.511   4.807   4.437
  Start of MODEL    8
 4985    HG   SER   7           HG       SER   7 -23.791   3.061   2.621
  Start of MODEL    8
 4986    H    SER   7           HN       SER   7 -23.532   2.855   5.552
  Start of MODEL    8
 4987    HA   PHE   8           HA       PHE   8 -18.741   4.251   6.008
  Start of MODEL    8
 4988    HB3  PHE   8           HB2      PHE   8 -19.029   2.336   7.358
  Start of MODEL    8
 4989    HB2  PHE   8           HB3      PHE   8 -17.333   2.316   6.911
  Start of MODEL    8
 4990    HD1  PHE   8           HD1      PHE   8 -20.534   0.614   6.585
  Start of MODEL    8
 4991    HD2  PHE   8           HD2      PHE   8 -16.443   0.605   5.412
  Start of MODEL    8
 4992    HE1  PHE   8           HE1      PHE   8 -20.759  -1.715   5.838
  Start of MODEL    8
 4993    HE2  PHE   8           HE2      PHE   8 -16.667  -1.728   4.656
  Start of MODEL    8
 4994    HZ   PHE   8           HZ       PHE   8 -18.838  -2.887   4.880
  Start of MODEL    8
 4995    H    PHE   8           HN       PHE   8 -19.824   2.362   4.100
  Start of MODEL    8
 4996    HA   CYS   9           HA       CYS   9 -15.965   4.610   2.791
  Start of MODEL    8
 4997    HB3  CYS   9           HB2      CYS   9 -14.511   6.568   3.247
  Start of MODEL    8
 4998    HB2  CYS   9           HB3      CYS   9 -15.052   6.541   4.921
  Start of MODEL    8
 4999    H    CYS   9           HN       CYS   9 -16.802   5.006   5.512
  Start of MODEL    8
 5000    HA   ALA  10           HA       ALA  10 -12.316   2.609   3.614
  Start of MODEL    8
 5001    HB3  ALA  10           HB1      ALA  10 -10.451   3.124   2.204
  Start of MODEL    8
 5002    HB2  ALA  10           HB2      ALA  10 -10.936   4.805   2.118
  Start of MODEL    8
 5003    HB1  ALA  10           HB3      ALA  10 -11.940   3.572   1.349
  Start of MODEL    8
 5004    H    ALA  10           HN       ALA  10 -13.222   5.281   3.004
  Start of MODEL    8
 5005    HA   SER  11           HA       SER  11  -9.584   4.314   6.513
  Start of MODEL    8
 5006    HB3  SER  11           HB2      SER  11 -10.536   1.604   7.519
  Start of MODEL    8
 5007    HB2  SER  11           HB3      SER  11 -11.131   3.175   8.044
  Start of MODEL    8
 5008    HG   SER  11           HG       SER  11  -9.257   1.762   9.091
  Start of MODEL    8
 5009    H    SER  11           HN       SER  11 -11.048   2.181   5.173
  Start of MODEL    8
 5010    HA   VAL  12           HA       VAL  12  -6.276   1.780   5.190
  Start of MODEL    8
 5011    HB   VAL  12           HB       VAL  12  -5.213   4.632   5.295
  Start of MODEL    8
 5012    H    VAL  12           HN       VAL  12  -7.385   4.074   6.646
  Start of MODEL    8
 5013    HA   GLN  13           HA       GLN  13  -3.958   1.611   8.826
  Start of MODEL    8
 5014    HB3  GLN  13           HB2      GLN  13  -4.030  -0.812   9.647
  Start of MODEL    8
 5015    HB2  GLN  13           HB3      GLN  13  -5.174  -1.087   8.346
  Start of MODEL    8
 5016    HG2  GLN  13           HG2      GLN  13  -5.551   0.835  10.618
  Start of MODEL    8
 5017    HG3  GLN  13           HG3      GLN  13  -6.681   0.568   9.291
  Start of MODEL    8
 5018   HE21  GLN  13          HE21      GLN  13  -6.887   0.126  12.216
  Start of MODEL    8
 5019   HE22  GLN  13          HE22      GLN  13  -7.377  -1.518  12.391
  Start of MODEL    8
 5020    H    GLN  13           HN       GLN  13  -5.390   0.470   6.570
  Start of MODEL    8
 5021    HA   LEU  14           HA       LEU  14  -0.630  -0.150   6.688
  Start of MODEL    8
 5022    HB3  LEU  14           HB2      LEU  14   1.380   1.495   7.026
  Start of MODEL    8
 5023    HB2  LEU  14           HB3      LEU  14   0.135   2.603   7.573
  Start of MODEL    8
 5024    HG   LEU  14           HG       LEU  14  -1.026   2.219   5.344
  Start of MODEL    8
 5025   HD12  LEU  14          HD11      LEU  14   0.493   3.622   4.094
  Start of MODEL    8
 5026   HD11  LEU  14          HD12      LEU  14   1.777   3.313   5.265
  Start of MODEL    8
 5027   HD13  LEU  14          HD13      LEU  14   0.331   4.213   5.747
  Start of MODEL    8
 5028   HD22  LEU  14          HD21      LEU  14   0.283   1.273   3.564
  Start of MODEL    8
 5029   HD21  LEU  14          HD22      LEU  14   0.106   0.093   4.873
  Start of MODEL    8
 5030   HD23  LEU  14          HD23      LEU  14   1.616   0.975   4.675
  Start of MODEL    8
 5031    H    LEU  14           HN       LEU  14  -1.897   1.753   8.474
  Start of MODEL    8
 5032    HA   HIS  15           HA       HIS  15   1.511  -1.489  10.186
  Start of MODEL    8
 5033    HB3  HIS  15           HB2      HIS  15   1.787  -3.917   9.768
  Start of MODEL    8
 5034    HB2  HIS  15           HB3      HIS  15   1.416  -3.657   8.076
  Start of MODEL    8
 5035    HD1  HIS  15           HD1      HIS  15  -0.247  -4.004  11.407
  Start of MODEL    8
 5036    HD2  HIS  15           HD2      HIS  15  -1.290  -3.185   7.466
  Start of MODEL    8
 5037    HE1  HIS  15           HE1      HIS  15  -2.727  -4.284  11.293
  Start of MODEL    8
 5038    HE2  HIS  15           HE2      HIS  15  -3.247  -4.122   8.839
  Start of MODEL    8
 5039    H    HIS  15           HN       HIS  15   1.341  -1.131   7.293
  Start of MODEL    8
 5040    HA   THR  16           HA       THR  16   5.732  -0.992   9.748
  Start of MODEL    8
 5041    HB   THR  16           HB       THR  16   5.626  -3.319  11.652
  Start of MODEL    8
 5042    HG1  THR  16           HG1      THR  16   5.167  -0.555  12.256
  Start of MODEL    8
 5043   HG23  THR  16          HG21      THR  16   7.854  -2.436  11.013
  Start of MODEL    8
 5044   HG22  THR  16          HG22      THR  16   7.494  -2.125  12.713
  Start of MODEL    8
 5045   HG21  THR  16          HG23      THR  16   7.351  -0.825  11.527
  Start of MODEL    8
 5046    H    THR  16           HN       THR  16   3.498  -2.078  10.875
  Start of MODEL    8
 5047    HA   ALA  17           HA       ALA  17   6.682  -3.881   6.633
  Start of MODEL    8
 5048    HB2  ALA  17           HB1      ALA  17   9.394  -2.665   7.130
  Start of MODEL    8
 5049    HB1  ALA  17           HB2      ALA  17   8.144  -1.913   6.159
  Start of MODEL    8
 5050    HB3  ALA  17           HB3      ALA  17   8.834  -3.459   5.655
  Start of MODEL    8
 5051    H    ALA  17           HN       ALA  17   7.334  -1.833   8.443
  Start of MODEL    8
 5052    HA   VAL  18           HA       VAL  18   8.427  -7.050   8.904
  Start of MODEL    8
 5053    HB   VAL  18           HB       VAL  18   7.860  -9.253   7.928
  Start of MODEL    8
 5054    H    VAL  18           HN       VAL  18   7.480  -5.903   6.416
  Start of MODEL    8
 5055    HA   GLU  19           HA       GLU  19  12.391  -7.107   7.278
  Start of MODEL    8
 5056    HB3  GLU  19           HB2      GLU  19  12.675  -8.475   9.958
  Start of MODEL    8
 5057    HB2  GLU  19           HB3      GLU  19  12.771  -6.743   9.687
  Start of MODEL    8
 5058    HG2  GLU  19           HG2      GLU  19  14.635  -8.754   8.449
  Start of MODEL    8
 5059    HG3  GLU  19           HG3      GLU  19  14.770  -7.000   8.390
  Start of MODEL    8
 5060    H    GLU  19           HN       GLU  19  10.404  -7.740   9.217
  Start of MODEL    8
 5061    HA   MET  20           HA       MET  20  13.877 -10.895   6.019
  Start of MODEL    8
 5062    HB3  MET  20           HB2      MET  20  11.583 -11.701   6.025
  Start of MODEL    8
 5063    HB2  MET  20           HB3      MET  20  12.312 -12.142   4.499
  Start of MODEL    8
 5064    HG2  MET  20           HG2      MET  20  10.434  -9.842   4.885
  Start of MODEL    8
 5065    HG3  MET  20           HG3      MET  20  11.121 -10.400   3.358
  Start of MODEL    8
 5066    HE3  MET  20           HE1      MET  20   7.963 -10.072   3.759
  Start of MODEL    8
 5067    HE2  MET  20           HE2      MET  20   7.382 -11.559   3.004
  Start of MODEL    8
 5068    HE1  MET  20           HE3      MET  20   8.699 -10.652   2.266
  Start of MODEL    8
 5069    H    MET  20           HN       MET  20  12.877  -8.354   5.683
  Start of MODEL    8
 5070    HA   HIS  21           HA       HIS  21  15.767  -9.602   2.537
  Start of MODEL    8
 5071    HB3  HIS  21           HB2      HIS  21  16.225 -11.094   0.534
  Start of MODEL    8
 5072    HB2  HIS  21           HB3      HIS  21  15.158 -12.272   1.293
  Start of MODEL    8
 5073    HD1  HIS  21           HD1      HIS  21  16.127 -13.666   3.206
  Start of MODEL    8
 5074    HD2  HIS  21           HD2      HIS  21  18.608 -10.567   1.989
  Start of MODEL    8
 5075    HE1  HIS  21           HE1      HIS  21  18.291 -14.037   4.383
  Start of MODEL    8
 5076    HE2  HIS  21           HE2      HIS  21  19.776 -12.149   3.649
  Start of MODEL    8
 5077    H    HIS  21           HN       HIS  21  14.053 -11.710   3.398
  Start of MODEL    8
 5078    HA   HIS  22           HA       HIS  22  12.628  -8.545  -0.473
  Start of MODEL    8
 5079    HB3  HIS  22           HB2      HIS  22  10.447  -9.597  -1.239
  Start of MODEL    8
 5080    HB2  HIS  22           HB3      HIS  22  10.800 -10.954  -0.179
  Start of MODEL    8
 5081    HD1  HIS  22           HD1      HIS  22  11.775 -12.871  -1.431
  Start of MODEL    8
 5082    HD2  HIS  22           HD2      HIS  22  12.813  -9.217  -3.122
  Start of MODEL    8
 5083    HE1  HIS  22           HE1      HIS  22  13.172 -13.424  -3.421
  Start of MODEL    8
 5084    HE2  HIS  22           HE2      HIS  22  13.454 -11.219  -4.593
  Start of MODEL    8
 5085    H    HIS  22           HN       HIS  22  12.722 -10.816   1.373
  Start of MODEL    8
 5086    HA   TRP  23           HA       TRP  23  10.560  -6.906   2.887
  Start of MODEL    8
 5087    HB3  TRP  23           HB2      TRP  23  10.605  -4.394   2.788
  Start of MODEL    8
 5088    HB2  TRP  23           HB3      TRP  23  11.358  -4.556   1.199
  Start of MODEL    8
 5089    HD1  TRP  23           HD1      TRP  23  13.814  -5.527   1.084
  Start of MODEL    8
 5090    HE1  TRP  23           HE1      TRP  23  15.706  -5.607   2.848
  Start of MODEL    8
 5091    HE3  TRP  23           HE3      TRP  23  11.055  -4.580   5.265
  Start of MODEL    8
 5092    HZ2  TRP  23           HZ2      TRP  23  15.975  -5.286   5.638
  Start of MODEL    8
 5093    HZ3  TRP  23           HZ3      TRP  23  12.193  -4.472   7.437
  Start of MODEL    8
 5094    HH2  TRP  23           HH2      TRP  23  14.599  -4.818   7.619
  Start of MODEL    8
 5095    H    TRP  23           HN       TRP  23  11.758  -6.750   0.281
  Start of MODEL    8
 5096    HA   CYS  24           HA       CYS  24   6.614  -5.846   1.438
  Start of MODEL    8
 5097    HB3  CYS  24           HB2      CYS  24   6.572  -8.039   3.525
  Start of MODEL    8
 5098    HB2  CYS  24           HB3      CYS  24   6.585  -8.246   1.787
  Start of MODEL    8
 5099    H    CYS  24           HN       CYS  24   8.617  -6.406   3.481
  Start of MODEL    8
 5100    HA   ILE  25           HA       ILE  25   5.235  -3.494   4.885
  Start of MODEL    8
 5101    HB   ILE  25           HB       ILE  25   4.756  -1.664   2.492
  Start of MODEL    8
 5102   HD11  ILE  25          HD11      ILE  25   6.479   0.615   3.927
  Start of MODEL    8
 5103   HD13  ILE  25          HD12      ILE  25   6.585   0.208   2.218
  Start of MODEL    8
 5104   HD12  ILE  25          HD13      ILE  25   8.025   0.121   3.233
  Start of MODEL    8
 5105    H    ILE  25           HN       ILE  25   5.611  -4.066   2.033
  Start of MODEL    8
 5106    HA   PRO  26           HA       PRO  26   1.242  -5.265   3.682
  Start of MODEL    8
 5107    HB3  PRO  26           HB2      PRO  26   0.981  -6.845   5.292
  Start of MODEL    8
 5108    HB2  PRO  26           HB3      PRO  26   0.744  -5.605   6.523
  Start of MODEL    8
 5109    HG2  PRO  26           HG2      PRO  26   2.782  -6.344   7.283
  Start of MODEL    8
 5110    HG3  PRO  26           HG3      PRO  26   3.231  -6.998   5.700
  Start of MODEL    8
 5111    HD2  PRO  26           HD2      PRO  26   3.447  -4.194   6.722
  Start of MODEL    8
 5112    HD3  PRO  26           HD3      PRO  26   4.574  -5.144   5.721
  Start of MODEL    8
 5113    HA   PHE  27           HA       PHE  27  -1.297  -2.186   5.404
  Start of MODEL    8
 5114    HB3  PHE  27           HB2      PHE  27  -0.495  -1.033   3.409
  Start of MODEL    8
 5115    HB2  PHE  27           HB3      PHE  27  -2.210  -0.739   3.635
  Start of MODEL    8
 5116    HD1  PHE  27           HD1      PHE  27  -3.859  -1.819   2.137
  Start of MODEL    8
 5117    HD2  PHE  27           HD2      PHE  27   0.335  -2.075   1.481
  Start of MODEL    8
 5118    HE1  PHE  27           HE1      PHE  27  -4.270  -2.488  -0.187
  Start of MODEL    8
 5119    HE2  PHE  27           HE2      PHE  27  -0.069  -2.742  -0.834
  Start of MODEL    8
 5120    HZ   PHE  27           HZ       PHE  27  -2.374  -2.949  -1.677
  Start of MODEL    8
 5121    H    PHE  27           HN       PHE  27  -0.627  -4.217   3.432
  Start of MODEL    8
 5122    HA   SER  28           HA       SER  28  -5.260  -3.852   4.532
  Start of MODEL    8
 5123    HB3  SER  28           HB2      SER  28  -6.265  -4.130   6.698
  Start of MODEL    8
 5124    HB2  SER  28           HB3      SER  28  -5.351  -2.778   7.368
  Start of MODEL    8
 5125    HG   SER  28           HG       SER  28  -4.009  -4.947   6.233
  Start of MODEL    8
 5126    H    SER  28           HN       SER  28  -3.512  -1.792   5.636
  Start of MODEL    8
 5127    HA   VAL  29           HA       VAL  29  -7.522  -0.133   4.308
  Start of MODEL    8
 5128    HB   VAL  29           HB       VAL  29  -6.253   0.525   2.315
  Start of MODEL    8
 5129    H    VAL  29           HN       VAL  29  -6.444  -2.581   3.159
  Start of MODEL    8
 5130    HA   ASP  30           HA       ASP  30 -11.243  -2.208   3.648
  Start of MODEL    8
 5131    HB3  ASP  30           HB2      ASP  30 -11.082  -1.293   6.513
  Start of MODEL    8
 5132    HB2  ASP  30           HB3      ASP  30 -10.751  -2.899   5.880
  Start of MODEL    8
 5133    H    ASP  30           HN       ASP  30  -9.503  -0.144   4.814
  Start of MODEL    8
 5134    HA2  GLY  31           HA2      GLY  31 -14.643   0.486   3.788
  Start of MODEL    8
 5135    H    GLY  31           HN       GLY  31 -12.991  -1.531   2.755
  Start of MODEL    8
 5136    HA3  GLY  31           HA1      GLY  31 -13.722   1.090   2.405
  Start of MODEL    8
 5137    HA   GLN  32           HA       GLN  32 -16.895  -1.856   1.017
  Start of MODEL    8
 5138    HB3  GLN  32           HB2      GLN  32 -19.002   0.214   1.705
  Start of MODEL    8
 5139    HB2  GLN  32           HB3      GLN  32 -18.678  -1.229   2.646
  Start of MODEL    8
 5140    HG2  GLN  32           HG2      GLN  32 -19.601  -1.194  -0.210
  Start of MODEL    8
 5141    HG3  GLN  32           HG3      GLN  32 -19.364  -2.626   0.802
  Start of MODEL    8
 5142   HE21  GLN  32          HE21      GLN  32 -21.273   0.125   0.200
  Start of MODEL    8
 5143   HE22  GLN  32          HE22      GLN  32 -22.629  -0.337   1.172
  Start of MODEL    8
 5144    H    GLN  32           HN       GLN  32 -16.604   0.470   2.665
  Start of MODEL    8
 5145    HA   PRO  33           HA       PRO  33 -17.477   1.432  -2.463
  Start of MODEL    8
 5146    HB3  PRO  33           HB2      PRO  33 -18.272   3.523  -1.819
  Start of MODEL    8
 5147    HB2  PRO  33           HB3      PRO  33 -16.565   3.972  -1.798
  Start of MODEL    8
 5148    HG2  PRO  33           HG2      PRO  33 -16.372   3.671   0.476
  Start of MODEL    8
 5149    HG3  PRO  33           HG3      PRO  33 -18.058   4.218   0.380
  Start of MODEL    8
 5150    HD2  PRO  33           HD2      PRO  33 -17.425   1.923   1.575
  Start of MODEL    8
 5151    HD3  PRO  33           HD3      PRO  33 -18.898   2.074   0.594
  Start of MODEL    8
 5152    HA   ALA  34           HA       ALA  34 -13.283   0.271  -2.473
  Start of MODEL    8
 5153    HB3  ALA  34           HB1      ALA  34 -12.700  -0.508  -4.675
  Start of MODEL    8
 5154    HB2  ALA  34           HB2      ALA  34 -14.042   0.411  -5.366
  Start of MODEL    8
 5155    HB1  ALA  34           HB3      ALA  34 -14.379  -0.947  -4.301
  Start of MODEL    8
 5156    H    ALA  34           HN       ALA  34 -15.791   0.904  -3.628
  Start of MODEL    8
 5157    HA   PRO  35           HA       PRO  35 -11.441   4.304  -3.358
  Start of MODEL    8
 5158    HB3  PRO  35           HB2      PRO  35 -11.028   4.218  -1.050
  Start of MODEL    8
 5159    HB2  PRO  35           HB3      PRO  35  -9.392   4.147  -1.718
  Start of MODEL    8
 5160    HG2  PRO  35           HG2      PRO  35  -9.225   1.860  -1.376
  Start of MODEL    8
 5161    HG3  PRO  35           HG3      PRO  35 -10.260   2.285  -0.018
  Start of MODEL    8
 5162    HD2  PRO  35           HD2      PRO  35 -10.967   0.482  -2.030
  Start of MODEL    8
 5163    HD3  PRO  35           HD3      PRO  35 -12.119   1.323  -0.972
  Start of MODEL    8
 5164    HA   SER  36           HA       SER  36  -7.870   3.019  -5.677
  Start of MODEL    8
 5165    HB3  SER  36           HB2      SER  36  -7.220   4.858  -7.135
  Start of MODEL    8
 5166    HB2  SER  36           HB3      SER  36  -7.955   6.028  -6.034
  Start of MODEL    8
 5167    HG   SER  36           HG       SER  36  -9.196   4.112  -7.696
  Start of MODEL    8
 5168    H    SER  36           HN       SER  36  -9.385   5.050  -4.197
  Start of MODEL    8
 5169    HA   LEU  37           HA       LEU  37  -4.816   4.093  -2.732
  Start of MODEL    8
 5170    HB3  LEU  37           HB2      LEU  37  -3.151   2.289  -2.590
  Start of MODEL    8
 5171    HB2  LEU  37           HB3      LEU  37  -3.829   1.558  -4.031
  Start of MODEL    8
 5172    HG   LEU  37           HG       LEU  37  -5.974   1.244  -2.794
  Start of MODEL    8
 5173   HD11  LEU  37          HD11      LEU  37  -3.534   0.043  -1.499
  Start of MODEL    8
 5174   HD13  LEU  37          HD12      LEU  37  -4.306  -0.533  -2.974
  Start of MODEL    8
 5175   HD12  LEU  37          HD13      LEU  37  -5.168  -0.615  -1.441
  Start of MODEL    8
 5176   HD23  LEU  37          HD21      LEU  37  -4.313   2.215  -0.477
  Start of MODEL    8
 5177   HD22  LEU  37          HD22      LEU  37  -5.899   1.464  -0.325
  Start of MODEL    8
 5178   HD21  LEU  37          HD23      LEU  37  -5.732   3.017  -1.148
  Start of MODEL    8
 5179    H    LEU  37           HN       LEU  37  -5.801   2.615  -5.026
  Start of MODEL    8
 5180    HA   ARG  38           HA       ARG  38  -1.186   5.393  -4.935
  Start of MODEL    8
 5181    HB3  ARG  38           HB2      ARG  38  -2.726   7.609  -3.563
  Start of MODEL    8
 5182    HB2  ARG  38           HB3      ARG  38  -2.673   7.217  -5.265
  Start of MODEL    8
 5183    HG2  ARG  38           HG2      ARG  38  -1.478   9.266  -4.818
  Start of MODEL    8
 5184    HG3  ARG  38           HG3      ARG  38  -0.399   8.442  -3.698
  Start of MODEL    8
 5185    HD2  ARG  38           HD2      ARG  38   0.721   8.689  -5.770
  Start of MODEL    8
 5186    HD3  ARG  38           HD3      ARG  38   0.315   6.994  -5.582
  Start of MODEL    8
 5187    HE   ARG  38           HE       ARG  38  -1.727   8.297  -6.989
  Start of MODEL    8
 5188   HH11  ARG  38          HH11      ARG  38   1.573   7.090  -7.462
  Start of MODEL    8
 5189   HH12  ARG  38          HH12      ARG  38   1.441   6.962  -9.154
  Start of MODEL    8
 5190   HH21  ARG  38          HH21      ARG  38  -1.915   8.114  -9.306
  Start of MODEL    8
 5191   HH22  ARG  38          HH22      ARG  38  -0.587   7.595 -10.233
  Start of MODEL    8
 5192    H    ARG  38           HN       ARG  38  -2.930   5.123  -2.614
  Start of MODEL    8
 5193    HA   TRP  39           HA       TRP  39   1.429   5.787  -1.412
  Start of MODEL    8
 5194    HB3  TRP  39           HB2      TRP  39   3.728   5.000  -1.977
  Start of MODEL    8
 5195    HB2  TRP  39           HB3      TRP  39   3.192   4.776  -3.637
  Start of MODEL    8
 5196    HD1  TRP  39           HD1      TRP  39   1.935   2.614  -4.219
  Start of MODEL    8
 5197    HE1  TRP  39           HE1      TRP  39   1.310   0.515  -2.927
  Start of MODEL    8
 5198    HE3  TRP  39           HE3      TRP  39   2.987   4.265   0.496
  Start of MODEL    8
 5199    HZ2  TRP  39           HZ2      TRP  39   1.237  -0.349  -0.219
  Start of MODEL    8
 5200    HZ3  TRP  39           HZ3      TRP  39   2.616   2.737   2.388
  Start of MODEL    8
 5201    HH2  TRP  39           HH2      TRP  39   1.761   0.475   2.035
  Start of MODEL    8
 5202    H    TRP  39           HN       TRP  39   0.947   5.574  -4.283
  Start of MODEL    8
 5203    HA   LEU  40           HA       LEU  40   3.946   9.269  -2.358
  Start of MODEL    8
 5204    HB3  LEU  40           HB2      LEU  40   2.725   9.667   0.363
  Start of MODEL    8
 5205    HB2  LEU  40           HB3      LEU  40   1.838   9.923  -1.124
  Start of MODEL    8
 5206    HG   LEU  40           HG       LEU  40   4.320  11.462  -0.480
  Start of MODEL    8
 5207   HD13  LEU  40          HD11      LEU  40   3.714  11.446  -2.770
  Start of MODEL    8
 5208   HD12  LEU  40          HD12      LEU  40   3.318  13.030  -2.092
  Start of MODEL    8
 5209   HD11  LEU  40          HD13      LEU  40   2.041  11.841  -2.393
  Start of MODEL    8
 5210   HD21  LEU  40          HD21      LEU  40   2.721  11.835   1.316
  Start of MODEL    8
 5211   HD23  LEU  40          HD22      LEU  40   1.454  12.154   0.133
  Start of MODEL    8
 5212   HD22  LEU  40          HD23      LEU  40   2.828  13.253   0.271
  Start of MODEL    8
 5213    H    LEU  40           HN       LEU  40   2.803   7.208  -0.603
  Start of MODEL    8
 5214    HA   PHE  41           HA       PHE  41   7.130   8.178   0.493
  Start of MODEL    8
 5215    HB3  PHE  41           HB2      PHE  41   8.324   8.459  -2.271
  Start of MODEL    8
 5216    HB2  PHE  41           HB3      PHE  41   7.903   6.974  -1.433
  Start of MODEL    8
 5217    HD1  PHE  41           HD1      PHE  41  10.561   9.061  -2.328
  Start of MODEL    8
 5218    HD2  PHE  41           HD2      PHE  41   9.153   6.631   0.875
  Start of MODEL    8
 5219    HE1  PHE  41           HE1      PHE  41  12.856   8.855  -1.471
  Start of MODEL    8
 5220    HE2  PHE  41           HE2      PHE  41  11.442   6.423   1.733
  Start of MODEL    8
 5221    HZ   PHE  41           HZ       PHE  41  13.315   7.594   0.525
  Start of MODEL    8
 5222    H    PHE  41           HN       PHE  41   6.090   9.479  -1.924
  Start of MODEL    8
 5223    HA   ASN  42           HA       ASN  42   8.216  11.585   2.983
  Start of MODEL    8
 5224    HB3  ASN  42           HB2      ASN  42  10.393  12.591   2.159
  Start of MODEL    8
 5225    HB2  ASN  42           HB3      ASN  42  10.330  11.471   0.809
  Start of MODEL    8
 5226   HD21  ASN  42          HD21      ASN  42  12.267  10.516   1.398
  Start of MODEL    8
 5227   HD22  ASN  42          HD22      ASN  42  12.387   9.449   2.740
  Start of MODEL    8
 5228    H    ASN  42           HN       ASN  42   7.483   9.699   1.932
  Start of MODEL    8
 5229    HA2  GLY  43           HA2      GLY  43   5.004  13.934   0.524
  Start of MODEL    8
 5230    H    GLY  43           HN       GLY  43   6.193  11.938   0.966
  Start of MODEL    8
 5231    HA3  GLY  43           HA1      GLY  43   6.522  14.822   0.594
  Start of MODEL    8
 5232    HA   SER  44           HA       SER  44   6.936  13.792  -3.708
  Start of MODEL    8
 5233    HB3  SER  44           HB2      SER  44   8.790  12.469  -4.547
  Start of MODEL    8
 5234    HB2  SER  44           HB3      SER  44   8.842  11.539  -3.048
  Start of MODEL    8
 5235    HG   SER  44           HG       SER  44   8.988  14.062  -2.359
  Start of MODEL    8
 5236    H    SER  44           HN       SER  44   7.539  12.449  -1.189
  Start of MODEL    8
 5237    HA   VAL  45           HA       VAL  45   3.889  10.913  -4.677
  Start of MODEL    8
 5238    HB   VAL  45           HB       VAL  45   4.529  12.507  -7.174
  Start of MODEL    8
 5239    H    VAL  45           HN       VAL  45   5.615  13.063  -5.113
  Start of MODEL    8
 5240    HA   LEU  46           HA       LEU  46   6.584   7.905  -6.141
  Start of MODEL    8
 5241    HB3  LEU  46           HB2      LEU  46   4.818   6.579  -4.091
  Start of MODEL    8
 5242    HB2  LEU  46           HB3      LEU  46   6.372   7.321  -3.776
  Start of MODEL    8
 5243    HG   LEU  46           HG       LEU  46   5.988   4.952  -5.600
  Start of MODEL    8
 5244   HD12  LEU  46          HD11      LEU  46   8.396   4.641  -5.314
  Start of MODEL    8
 5245   HD11  LEU  46          HD12      LEU  46   8.469   6.144  -4.393
  Start of MODEL    8
 5246   HD13  LEU  46          HD13      LEU  46   7.987   6.167  -6.090
  Start of MODEL    8
 5247   HD21  LEU  46          HD21      LEU  46   6.719   5.048  -2.695
  Start of MODEL    8
 5248   HD23  LEU  46          HD22      LEU  46   6.939   3.626  -3.725
  Start of MODEL    8
 5249   HD22  LEU  46          HD23      LEU  46   5.320   4.250  -3.415
  Start of MODEL    8
 5250    H    LEU  46           HN       LEU  46   4.249   8.861  -4.726
  Start of MODEL    8
 5251    HA   ASN  47           HA       ASN  47   3.557   6.170  -8.648
  Start of MODEL    8
 5252    HB3  ASN  47           HB2      ASN  47   4.365   6.133 -11.118
  Start of MODEL    8
 5253    HB2  ASN  47           HB3      ASN  47   5.622   7.245 -10.586
  Start of MODEL    8
 5254   HD21  ASN  47          HD21      ASN  47   5.069   9.346 -10.097
  Start of MODEL    8
 5255   HD22  ASN  47          HD22      ASN  47   3.492  10.000 -10.405
  Start of MODEL    8
 5256    H    ASN  47           HN       ASN  47   5.920   7.677  -8.214
  Start of MODEL    8
 5257    HA   GLU  48           HA       GLU  48   5.503   2.420  -7.833
  Start of MODEL    8
 5258    HB3  GLU  48           HB2      GLU  48   4.188   0.513  -8.690
  Start of MODEL    8
 5259    HB2  GLU  48           HB3      GLU  48   3.249   1.637  -9.661
  Start of MODEL    8
 5260    HG2  GLU  48           HG2      GLU  48   3.406   1.576  -6.659
  Start of MODEL    8
 5261    HG3  GLU  48           HG3      GLU  48   2.521   2.769  -7.613
  Start of MODEL    8
 5262    H    GLU  48           HN       GLU  48   3.522   4.002  -9.007
  Start of MODEL    8
 5263    HA   THR  49           HA       THR  49   7.846   1.578 -11.377
  Start of MODEL    8
 5264    HB   THR  49           HB       THR  49  10.165   1.081 -10.600
  Start of MODEL    8
 5265    HG1  THR  49           HG1      THR  49  10.085   1.460  -8.058
  Start of MODEL    8
 5266   HG23  THR  49          HG21      THR  49   9.418   3.417 -10.708
  Start of MODEL    8
 5267   HG22  THR  49          HG22      THR  49  10.549   3.175  -9.376
  Start of MODEL    8
 5268   HG21  THR  49          HG23      THR  49   8.820   3.300  -9.053
  Start of MODEL    8
 5269    H    THR  49           HN       THR  49   7.079   1.121  -8.597
  Start of MODEL    8
 5270    HA   SER  50           HA       SER  50   7.972  -2.770 -11.635
  Start of MODEL    8
 5271    HB3  SER  50           HB2      SER  50  10.901  -2.603 -12.357
  Start of MODEL    8
 5272    HB2  SER  50           HB3      SER  50   9.605  -2.143 -13.456
  Start of MODEL    8
 5273    HG   SER  50           HG       SER  50   9.027  -4.549 -12.544
  Start of MODEL    8
 5274    H    SER  50           HN       SER  50   9.738  -0.499 -11.530
  Start of MODEL    8
 5275    HA   PHE  51           HA       PHE  51  10.992  -4.102  -8.363
  Start of MODEL    8
 5276    HB3  PHE  51           HB2      PHE  51  12.770  -2.990  -7.076
  Start of MODEL    8
 5277    HB2  PHE  51           HB3      PHE  51  12.395  -1.472  -7.879
  Start of MODEL    8
 5278    HD1  PHE  51           HD1      PHE  51  12.935  -4.970  -9.042
  Start of MODEL    8
 5279    HD2  PHE  51           HD2      PHE  51  14.007  -0.869  -9.379
  Start of MODEL    8
 5280    HE1  PHE  51           HE1      PHE  51  14.518  -5.534 -10.829
  Start of MODEL    8
 5281    HE2  PHE  51           HE2      PHE  51  15.585  -1.425 -11.165
  Start of MODEL    8
 5282    HZ   PHE  51           HZ       PHE  51  15.808  -3.739 -11.937
  Start of MODEL    8
 5283    H    PHE  51           HN       PHE  51  10.724  -1.599  -9.787
  Start of MODEL    8
 5284    HA   ILE  52           HA       ILE  52   8.646  -1.905  -5.176
  Start of MODEL    8
 5285    HB   ILE  52           HB       ILE  52   8.761   0.936  -6.248
  Start of MODEL    8
 5286   HD12  ILE  52          HD11      ILE  52  12.037   1.588  -4.512
  Start of MODEL    8
 5287   HD11  ILE  52          HD12      ILE  52  10.452   1.950  -3.827
  Start of MODEL    8
 5288   HD13  ILE  52          HD13      ILE  52  10.797   2.343  -5.513
  Start of MODEL    8
 5289    H    ILE  52           HN       ILE  52   9.454  -1.019  -7.864
  Start of MODEL    8
 5290    HA   PHE  53           HA       PHE  53   4.676  -1.176  -6.907
  Start of MODEL    8
 5291    HB3  PHE  53           HB2      PHE  53   5.582  -2.658  -8.632
  Start of MODEL    8
 5292    HB2  PHE  53           HB3      PHE  53   3.923  -3.100  -8.252
  Start of MODEL    8
 5293    HD1  PHE  53           HD1      PHE  53   7.452  -4.109  -7.783
  Start of MODEL    8
 5294    HD2  PHE  53           HD2      PHE  53   3.365  -5.258  -7.464
  Start of MODEL    8
 5295    HE1  PHE  53           HE1      PHE  53   8.137  -6.443  -7.435
  Start of MODEL    8
 5296    HE2  PHE  53           HE2      PHE  53   4.047  -7.596  -7.112
  Start of MODEL    8
 5297    HZ   PHE  53           HZ       PHE  53   6.435  -8.191  -7.097
  Start of MODEL    8
 5298    H    PHE  53           HN       PHE  53   6.641  -2.754  -5.457
  Start of MODEL    8
 5299    HA   THR  54           HA       THR  54   2.180  -2.857  -3.773
  Start of MODEL    8
 5300    HB   THR  54           HB       THR  54   0.051  -1.807  -5.647
  Start of MODEL    8
 5301    HG1  THR  54           HG1      THR  54   1.514  -0.225  -5.493
  Start of MODEL    8
 5302   HG23  THR  54          HG21      THR  54  -0.671  -3.005  -3.621
  Start of MODEL    8
 5303   HG22  THR  54          HG22      THR  54  -1.107  -1.298  -3.565
  Start of MODEL    8
 5304   HG21  THR  54          HG23      THR  54   0.280  -1.884  -2.644
  Start of MODEL    8
 5305    H    THR  54           HN       THR  54   2.553  -1.634  -6.352
  Start of MODEL    8
 5306    HA   GLU  55           HA       GLU  55   0.801  -6.371  -6.041
  Start of MODEL    8
 5307    HB3  GLU  55           HB2      GLU  55   2.291  -7.489  -3.668
  Start of MODEL    8
 5308    HB2  GLU  55           HB3      GLU  55   3.004  -7.164  -5.238
  Start of MODEL    8
 5309    HG2  GLU  55           HG2      GLU  55   0.795  -9.133  -4.699
  Start of MODEL    8
 5310    HG3  GLU  55           HG3      GLU  55   1.581  -8.844  -6.253
  Start of MODEL    8
 5311    H    GLU  55           HN       GLU  55   1.969  -5.027  -3.729
  Start of MODEL    8
 5312    HA   PHE  56           HA       PHE  56  -2.464  -7.157  -3.237
  Start of MODEL    8
 5313    HB3  PHE  56           HB2      PHE  56  -4.600  -7.076  -4.476
  Start of MODEL    8
 5314    HB2  PHE  56           HB3      PHE  56  -3.719  -7.078  -5.995
  Start of MODEL    8
 5315    HD1  PHE  56           HD1      PHE  56  -4.481  -5.082  -2.994
  Start of MODEL    8
 5316    HD2  PHE  56           HD2      PHE  56  -2.796  -5.094  -6.907
  Start of MODEL    8
 5317    HE1  PHE  56           HE1      PHE  56  -4.396  -2.627  -2.967
  Start of MODEL    8
 5318    HE2  PHE  56           HE2      PHE  56  -2.706  -2.655  -6.881
  Start of MODEL    8
 5319    HZ   PHE  56           HZ       PHE  56  -3.556  -1.407  -4.944
  Start of MODEL    8
 5320    H    PHE  56           HN       PHE  56  -1.203  -7.108  -5.880
  Start of MODEL    8
 5321    HA   LEU  57           HA       LEU  57  -2.705 -11.396  -4.202
  Start of MODEL    8
 5322    HB3  LEU  57           HB2      LEU  57  -1.704 -11.520  -1.980
  Start of MODEL    8
 5323    HB2  LEU  57           HB3      LEU  57  -2.978 -12.714  -2.108
  Start of MODEL    8
 5324    HG   LEU  57           HG       LEU  57  -3.517 -10.118  -0.743
  Start of MODEL    8
 5325   HD11  LEU  57          HD11      LEU  57  -4.672 -12.876  -0.485
  Start of MODEL    8
 5326   HD13  LEU  57          HD12      LEU  57  -5.420 -11.510  -1.301
  Start of MODEL    8
 5327   HD12  LEU  57          HD13      LEU  57  -5.177 -11.464   0.452
  Start of MODEL    8
 5328   HD23  LEU  57          HD21      LEU  57  -2.306 -12.588   0.489
  Start of MODEL    8
 5329   HD22  LEU  57          HD22      LEU  57  -2.922 -11.193   1.375
  Start of MODEL    8
 5330   HD21  LEU  57          HD23      LEU  57  -1.524 -11.016   0.318
  Start of MODEL    8
 5331    H    LEU  57           HN       LEU  57  -3.289  -9.069  -2.540
  Start of MODEL    8
 5332    HA   GLU  58           HA       GLU  58  -6.864 -12.083  -4.983
  Start of MODEL    8
 5333    HB3  GLU  58           HB2      GLU  58  -7.619 -14.467  -5.043
  Start of MODEL    8
 5334    HB2  GLU  58           HB3      GLU  58  -6.093 -14.902  -4.281
  Start of MODEL    8
 5335    HG2  GLU  58           HG2      GLU  58  -4.872 -14.019  -6.197
  Start of MODEL    8
 5336    HG3  GLU  58           HG3      GLU  58  -6.013 -15.273  -6.680
  Start of MODEL    8
 5337    H    GLU  58           HN       GLU  58  -4.423 -13.180  -4.027
  Start of MODEL    8
 5338    HA   PRO  59           HA       PRO  59  -8.649 -11.901  -0.831
  Start of MODEL    8
 5339    HB3  PRO  59           HB2      PRO  59  -8.508  -9.597  -1.245
  Start of MODEL    8
 5340    HB2  PRO  59           HB3      PRO  59 -10.259  -9.854  -1.261
  Start of MODEL    8
 5341    HG2  PRO  59           HG2      PRO  59 -10.371  -9.782  -3.574
  Start of MODEL    8
 5342    HG3  PRO  59           HG3      PRO  59  -8.975  -8.721  -3.336
  Start of MODEL    8
 5343    HD2  PRO  59           HD2      PRO  59  -8.983 -11.117  -4.775
  Start of MODEL    8
 5344    HD3  PRO  59           HD3      PRO  59  -7.553 -10.238  -4.198
  Start of MODEL    8
 5345    HA   ALA  60           HA       ALA  60 -12.564 -13.658  -1.819
  Start of MODEL    8
 5346    HB2  ALA  60           HB1      ALA  60 -13.864 -14.052   0.275
  Start of MODEL    8
 5347    HB1  ALA  60           HB2      ALA  60 -12.731 -13.008   1.137
  Start of MODEL    8
 5348    HB3  ALA  60           HB3      ALA  60 -12.174 -14.517   0.434
  Start of MODEL    8
 5349    H    ALA  60           HN       ALA  60 -10.905 -12.055  -0.046
  Start of MODEL    8
 5350    HA   ALA  61           HA       ALA  61 -14.881 -10.188  -2.866
  Start of MODEL    8
 5351    HB3  ALA  61           HB1      ALA  61 -15.653 -11.889  -4.457
  Start of MODEL    8
 5352    HB2  ALA  61           HB2      ALA  61 -16.948 -10.782  -3.994
  Start of MODEL    8
 5353    HB1  ALA  61           HB3      ALA  61 -16.881 -12.401  -3.301
  Start of MODEL    8
 5354    H    ALA  61           HN       ALA  61 -14.550 -12.959  -2.457
  Start of MODEL    8
 5355    HA   ASN  62           HA       ASN  62 -18.013 -10.571   0.590
  Start of MODEL    8
 5356    HB3  ASN  62           HB2      ASN  62 -17.717 -11.888   2.786
  Start of MODEL    8
 5357    HB2  ASN  62           HB3      ASN  62 -16.562 -12.869   1.900
  Start of MODEL    8
 5358   HD21  ASN  62          HD21      ASN  62 -17.300 -14.375   0.424
  Start of MODEL    8
 5359   HD22  ASN  62          HD22      ASN  62 -18.964 -14.738   0.233
  Start of MODEL    8
 5360    H    ASN  62           HN       ASN  62 -15.890 -12.253  -0.363
  Start of MODEL    8
 5361    HA   GLU  63           HA       GLU  63 -14.608  -8.811   3.184
  Start of MODEL    8
 5362    HB3  GLU  63           HB2      GLU  63 -12.208  -8.678   2.822
  Start of MODEL    8
 5363    HB2  GLU  63           HB3      GLU  63 -12.395  -9.345   1.211
  Start of MODEL    8
 5364    HG2  GLU  63           HG2      GLU  63 -12.974 -10.761   3.784
  Start of MODEL    8
 5365    HG3  GLU  63           HG3      GLU  63 -13.209 -11.425   2.171
  Start of MODEL    8
 5366    H    GLU  63           HN       GLU  63 -14.662 -10.242   0.656
  Start of MODEL    8
 5367    HA   THR  64           HA       THR  64 -14.480  -5.095   0.837
  Start of MODEL    8
 5368    HB   THR  64           HB       THR  64 -15.038  -3.184   2.451
  Start of MODEL    8
 5369    HG1  THR  64           HG1      THR  64 -14.495  -4.001   4.433
  Start of MODEL    8
 5370   HG23  THR  64          HG21      THR  64 -16.735  -4.286   1.041
  Start of MODEL    8
 5371   HG22  THR  64          HG22      THR  64 -17.401  -3.825   2.602
  Start of MODEL    8
 5372   HG21  THR  64          HG23      THR  64 -16.968  -5.508   2.290
  Start of MODEL    8
 5373    H    THR  64           HN       THR  64 -14.601  -6.623   3.298
  Start of MODEL    8
 5374    HA   VAL  65           HA       VAL  65 -10.564  -4.193   3.234
  Start of MODEL    8
 5375    HB   VAL  65           HB       VAL  65 -10.043  -7.098   3.858
  Start of MODEL    8
 5376    H    VAL  65           HN       VAL  65 -12.466  -6.363   3.006
  Start of MODEL    8
 5377    HA   ARG  66           HA       ARG  66  -8.705  -5.874  -0.289
  Start of MODEL    8
 5378    HB3  ARG  66           HB2      ARG  66  -7.655  -4.120  -1.618
  Start of MODEL    8
 5379    HB2  ARG  66           HB3      ARG  66  -7.593  -3.049  -0.234
  Start of MODEL    8
 5380    HG2  ARG  66           HG2      ARG  66 -10.086  -4.076  -1.621
  Start of MODEL    8
 5381    HG3  ARG  66           HG3      ARG  66 -10.084  -3.052  -0.192
  Start of MODEL    8
 5382    HD2  ARG  66           HD2      ARG  66 -10.517  -1.703  -2.122
  Start of MODEL    8
 5383    HD3  ARG  66           HD3      ARG  66  -8.917  -1.309  -1.509
  Start of MODEL    8
 5384    HE   ARG  66           HE       ARG  66  -7.958  -2.331  -3.374
  Start of MODEL    8
 5385   HH11  ARG  66          HH11      ARG  66 -11.519  -2.549  -3.556
  Start of MODEL    8
 5386   HH12  ARG  66          HH12      ARG  66 -11.543  -2.749  -5.234
  Start of MODEL    8
 5387   HH21  ARG  66          HH21      ARG  66  -8.040  -2.619  -5.671
  Start of MODEL    8
 5388   HH22  ARG  66          HH22      ARG  66  -9.540  -2.777  -6.474
  Start of MODEL    8
 5389    H    ARG  66           HN       ARG  66  -9.018  -3.892   1.816
  Start of MODEL    8
 5390    HA   HIS  67           HA       HIS  67  -5.106  -6.743   1.912
  Start of MODEL    8
 5391    HB3  HIS  67           HB2      HIS  67  -4.695  -9.164   1.838
  Start of MODEL    8
 5392    HB2  HIS  67           HB3      HIS  67  -5.842  -9.328   0.523
  Start of MODEL    8
 5393    HD1  HIS  67           HD1      HIS  67  -5.733  -8.742   4.250
  Start of MODEL    8
 5394    HD2  HIS  67           HD2      HIS  67  -8.504  -9.451   1.238
  Start of MODEL    8
 5395    HE1  HIS  67           HE1      HIS  67  -7.873  -9.320   5.412
  Start of MODEL    8
 5396    HE2  HIS  67           HE2      HIS  67  -9.355 -10.110   3.566
  Start of MODEL    8
 5397    H    HIS  67           HN       HIS  67  -7.097  -7.192  -0.195
  Start of MODEL    8
 5398    HA2  GLY  68           HA2      GLY  68  -1.908  -7.245  -0.940
  Start of MODEL    8
 5399    H    GLY  68           HN       GLY  68  -3.280  -5.936   1.221
  Start of MODEL    8
 5400    HA3  GLY  68           HA1      GLY  68  -2.316  -5.553  -1.213
  Start of MODEL    8
 5401    HA   CYS  69           HA       CYS  69   1.190  -4.706   1.136
  Start of MODEL    8
 5402    HB3  CYS  69           HB2      CYS  69   2.219  -7.308   0.000
  Start of MODEL    8
 5403    HB2  CYS  69           HB3      CYS  69   1.636  -7.000   1.636
  Start of MODEL    8
 5404    H    CYS  69           HN       CYS  69   0.195  -5.920  -1.299
  Start of MODEL    8
 5405    HA   LEU  70           HA       LEU  70   3.573  -2.825  -2.037
  Start of MODEL    8
 5406    HB3  LEU  70           HB2      LEU  70   4.804  -1.677   0.478
  Start of MODEL    8
 5407    HB2  LEU  70           HB3      LEU  70   3.421  -0.976  -0.335
  Start of MODEL    8
 5408    HG   LEU  70           HG       LEU  70   6.193  -1.240  -1.519
  Start of MODEL    8
 5409   HD13  LEU  70          HD11      LEU  70   4.525  -1.303  -3.253
  Start of MODEL    8
 5410   HD12  LEU  70          HD12      LEU  70   5.319   0.281  -3.246
  Start of MODEL    8
 5411   HD11  LEU  70          HD13      LEU  70   3.716   0.099  -2.551
  Start of MODEL    8
 5412   HD21  LEU  70          HD21      LEU  70   6.169   0.396   0.273
  Start of MODEL    8
 5413   HD23  LEU  70          HD22      LEU  70   4.742   1.165  -0.439
  Start of MODEL    8
 5414   HD22  LEU  70          HD23      LEU  70   6.279   1.196  -1.297
  Start of MODEL    8
 5415    H    LEU  70           HN       LEU  70   2.929  -3.345   0.732
  Start of MODEL    8
 5416    HA   ARG  71           HA       ARG  71   6.753  -5.718  -1.396
  Start of MODEL    8
 5417    HB3  ARG  71           HB2      ARG  71   6.922  -7.112  -3.440
  Start of MODEL    8
 5418    HB2  ARG  71           HB3      ARG  71   5.746  -6.062  -4.214
  Start of MODEL    8
 5419    HG2  ARG  71           HG2      ARG  71   4.094  -6.667  -2.516
  Start of MODEL    8
 5420    HG3  ARG  71           HG3      ARG  71   4.668  -8.066  -3.427
  Start of MODEL    8
 5421    HD2  ARG  71           HD2      ARG  71   6.246  -8.547  -1.587
  Start of MODEL    8
 5422    HD3  ARG  71           HD3      ARG  71   5.555  -7.211  -0.682
  Start of MODEL    8
 5423    HE   ARG  71           HE       ARG  71   3.384  -8.607  -1.120
  Start of MODEL    8
 5424   HH11  ARG  71          HH11      ARG  71   6.575  -9.862  -0.291
  Start of MODEL    8
 5425   HH12  ARG  71          HH12      ARG  71   5.979 -11.113   0.697
  Start of MODEL    8
 5426   HH21  ARG  71          HH21      ARG  71   2.560 -10.292   0.263
  Start of MODEL    8
 5427   HH22  ARG  71          HH22      ARG  71   3.648 -11.353   1.037
  Start of MODEL    8
 5428    H    ARG  71           HN       ARG  71   4.934  -4.120  -3.008
  Start of MODEL    8
 5429    HA   LEU  72           HA       LEU  72   9.920  -3.634  -3.501
  Start of MODEL    8
 5430    HB3  LEU  72           HB2      LEU  72  11.771  -3.330  -1.939
  Start of MODEL    8
 5431    HB2  LEU  72           HB3      LEU  72  11.031  -4.379  -0.769
  Start of MODEL    8
 5432    HG   LEU  72           HG       LEU  72   9.049  -2.631  -0.868
  Start of MODEL    8
 5433   HD12  LEU  72          HD11      LEU  72  10.186  -1.125   0.710
  Start of MODEL    8
 5434   HD11  LEU  72          HD12      LEU  72  11.727  -1.920   0.325
  Start of MODEL    8
 5435   HD13  LEU  72          HD13      LEU  72  10.403  -2.831   1.068
  Start of MODEL    8
 5436   HD21  LEU  72          HD21      LEU  72   9.799  -1.545  -2.863
  Start of MODEL    8
 5437   HD23  LEU  72          HD22      LEU  72  11.313  -1.111  -2.058
  Start of MODEL    8
 5438   HD22  LEU  72          HD23      LEU  72   9.788  -0.403  -1.511
  Start of MODEL    8
 5439    H    LEU  72           HN       LEU  72   8.768  -5.168  -1.316
  Start of MODEL    8
 5440    HA   ASN  73           HA       ASN  73  11.178  -7.674  -4.770
  Start of MODEL    8
 5441    HB3  ASN  73           HB2      ASN  73  11.669  -5.815  -7.110
  Start of MODEL    8
 5442    HB2  ASN  73           HB3      ASN  73  10.189  -6.718  -6.836
  Start of MODEL    8
 5443   HD21  ASN  73          HD21      ASN  73  10.184  -8.924  -7.147
  Start of MODEL    8
 5444   HD22  ASN  73          HD22      ASN  73  11.362  -9.734  -8.094
  Start of MODEL    8
 5445    H    ASN  73           HN       ASN  73  10.561  -4.890  -5.051
  Start of MODEL    8
 5446    HA   GLN  74           HA       GLN  74  15.440  -6.264  -4.726
  Start of MODEL    8
 5447    HB3  GLN  74           HB2      GLN  74  16.733  -4.605  -6.131
  Start of MODEL    8
 5448    HB2  GLN  74           HB3      GLN  74  15.195  -4.099  -6.820
  Start of MODEL    8
 5449    HG2  GLN  74           HG2      GLN  74  14.827  -6.365  -7.673
  Start of MODEL    8
 5450    HG3  GLN  74           HG3      GLN  74  16.327  -5.669  -8.289
  Start of MODEL    8
 5451   HE21  GLN  74          HE21      GLN  74  18.282  -6.520  -7.603
  Start of MODEL    8
 5452   HE22  GLN  74          HE22      GLN  74  18.405  -8.024  -6.775
  Start of MODEL    8
 5453    H    GLN  74           HN       GLN  74  13.085  -4.874  -5.713
  Start of MODEL    8
 5454    HA   PRO  75           HA       PRO  75  14.728  -3.370  -1.383
  Start of MODEL    8
 5455    HB3  PRO  75           HB2      PRO  75  15.643  -4.498   0.393
  Start of MODEL    8
 5456    HB2  PRO  75           HB3      PRO  75  17.220  -4.638  -0.388
  Start of MODEL    8
 5457    HG2  PRO  75           HG2      PRO  75  16.499  -6.829  -0.562
  Start of MODEL    8
 5458    HG3  PRO  75           HG3      PRO  75  14.797  -6.350  -0.674
  Start of MODEL    8
 5459    HD2  PRO  75           HD2      PRO  75  16.913  -6.326  -2.774
  Start of MODEL    8
 5460    HD3  PRO  75           HD3      PRO  75  15.197  -6.793  -2.873
  Start of MODEL    8
 5461    HA   THR  76           HA       THR  76  18.325  -0.782  -1.849
  Start of MODEL    8
 5462    HB   THR  76           HB       THR  76  17.311   1.327  -3.019
  Start of MODEL    8
 5463    HG1  THR  76           HG1      THR  76  15.065   0.002  -2.409
  Start of MODEL    8
 5464   HG21  THR  76          HG21      THR  76  17.112  -1.387  -4.342
  Start of MODEL    8
 5465   HG23  THR  76          HG22      THR  76  18.578  -0.419  -4.208
  Start of MODEL    8
 5466   HG22  THR  76          HG23      THR  76  17.226   0.160  -5.186
  Start of MODEL    8
 5467    H    THR  76           HN       THR  76  15.565  -1.354  -1.102
  Start of MODEL    8
 5468    HA   HIS  77           HA       HIS  77  17.931   1.761   1.658
  Start of MODEL    8
 5469    HB3  HIS  77           HB2      HIS  77  20.379   1.757   1.406
  Start of MODEL    8
 5470    HB2  HIS  77           HB3      HIS  77  19.804   3.257   2.097
  Start of MODEL    8
 5471    HD1  HIS  77           HD1      HIS  77  21.659   1.914  -0.812
  Start of MODEL    8
 5472    HD2  HIS  77           HD2      HIS  77  20.152   5.558   0.489
  Start of MODEL    8
 5473    HE1  HIS  77           HE1      HIS  77  22.827   3.650  -2.183
  Start of MODEL    8
 5474    HE2  HIS  77           HE2      HIS  77  22.131   5.822  -1.140
  Start of MODEL    8
 5475    H    HIS  77           HN       HIS  77  19.059   1.279  -0.960
  Start of MODEL    8
 5476    HA   VAL  78           HA       VAL  78  16.143   5.494  -0.255
  Start of MODEL    8
 5477    HB   VAL  78           HB       VAL  78  14.781   5.655  -2.334
  Start of MODEL    8
 5478    H    VAL  78           HN       VAL  78  17.115   2.984  -1.267
  Start of MODEL    8
 5479    HA   ASN  79           HA       ASN  79  12.369   2.797   0.490
  Start of MODEL    8
 5480    HB3  ASN  79           HB2      ASN  79  12.321   0.411   1.155
  Start of MODEL    8
 5481    HB2  ASN  79           HB3      ASN  79  14.078   0.368   1.118
  Start of MODEL    8
 5482   HD21  ASN  79          HD21      ASN  79  11.991   1.993  -1.204
  Start of MODEL    8
 5483   HD22  ASN  79          HD22      ASN  79  12.423   1.010  -2.551
  Start of MODEL    8
 5484    H    ASN  79           HN       ASN  79  15.235   2.348   0.207
  Start of MODEL    8
 5485    HA   ASN  80           HA       ASN  80  13.743   3.394   4.784
  Start of MODEL    8
 5486    HB3  ASN  80           HB2      ASN  80  16.075   4.992   3.723
  Start of MODEL    8
 5487    HB2  ASN  80           HB3      ASN  80  16.138   3.250   3.893
  Start of MODEL    8
 5488   HD21  ASN  80          HD21      ASN  80  17.721   5.295   5.145
  Start of MODEL    8
 5489   HD22  ASN  80          HD22      ASN  80  17.542   5.019   6.843
  Start of MODEL    8
 5490    H    ASN  80           HN       ASN  80  14.268   4.247   2.010
  Start of MODEL    8
 5491    HA2  GLY  81           HA2      GLY  81  12.090   7.339   5.522
  Start of MODEL    8
 5492    H    GLY  81           HN       GLY  81  11.837   4.681   4.774
  Start of MODEL    8
 5493    HA3  GLY  81           HA1      GLY  81  11.774   7.340   3.793
  Start of MODEL    8
 5494    HA   ASN  82           HA       ASN  82   7.834   6.971   5.907
  Start of MODEL    8
 5495    HB3  ASN  82           HB2      ASN  82   7.814   9.845   4.963
  Start of MODEL    8
 5496    HB2  ASN  82           HB3      ASN  82   8.179   9.302   6.595
  Start of MODEL    8
 5497   HD21  ASN  82          HD21      ASN  82   6.069  11.088   5.615
  Start of MODEL    8
 5498   HD22  ASN  82          HD22      ASN  82   4.584  10.408   6.146
  Start of MODEL    8
 5499    H    ASN  82           HN       ASN  82   9.858   8.529   4.514
  Start of MODEL    8
 5500    HA   TYR  83           HA       TYR  83   5.955   6.416   2.006
  Start of MODEL    8
 5501    HB3  TYR  83           HB2      TYR  83   5.143   3.986   1.885
  Start of MODEL    8
 5502    HB2  TYR  83           HB3      TYR  83   5.999   3.716   3.391
  Start of MODEL    8
 5503    HD1  TYR  83           HD1      TYR  83   6.572   4.765  -0.178
  Start of MODEL    8
 5504    HD2  TYR  83           HD2      TYR  83   8.268   3.190   3.408
  Start of MODEL    8
 5505    HE1  TYR  83           HE1      TYR  83   8.660   4.278  -1.373
  Start of MODEL    8
 5506    HE2  TYR  83           HE2      TYR  83  10.365   2.709   2.182
  Start of MODEL    8
 5507    HH   TYR  83           HH       TYR  83  11.143   2.329  -0.021
  Start of MODEL    8
 5508    H    TYR  83           HN       TYR  83   6.845   5.584   4.643
  Start of MODEL    8
 5509    HA   THR  84           HA       THR  84   2.104   6.769   4.007
  Start of MODEL    8
 5510    HB   THR  84           HB       THR  84   2.352   9.105   2.105
  Start of MODEL    8
 5511    HG1  THR  84           HG1      THR  84   3.767   8.662   4.079
  Start of MODEL    8
 5512   HG21  THR  84          HG21      THR  84   0.432   8.704   4.418
  Start of MODEL    8
 5513   HG23  THR  84          HG22      THR  84  -0.004   8.655   2.712
  Start of MODEL    8
 5514   HG22  THR  84          HG23      THR  84   0.562  10.161   3.429
  Start of MODEL    8
 5515    H    THR  84           HN       THR  84   4.061   7.315   1.900
  Start of MODEL    8
 5516    HA   LEU  85           HA       LEU  85  -0.200   5.239   0.648
  Start of MODEL    8
 5517    HB3  LEU  85           HB2      LEU  85  -1.332   3.865   3.090
  Start of MODEL    8
 5518    HB2  LEU  85           HB3      LEU  85  -0.020   3.259   2.092
  Start of MODEL    8
 5519    HG   LEU  85           HG       LEU  85  -2.881   3.611   1.193
  Start of MODEL    8
 5520   HD11  LEU  85          HD11      LEU  85  -0.460   2.491  -0.139
  Start of MODEL    8
 5521   HD13  LEU  85          HD12      LEU  85  -1.353   3.946  -0.623
  Start of MODEL    8
 5522   HD12  LEU  85          HD13      LEU  85  -2.106   2.344  -0.766
  Start of MODEL    8
 5523   HD22  LEU  85          HD21      LEU  85  -2.986   1.223   1.194
  Start of MODEL    8
 5524   HD21  LEU  85          HD22      LEU  85  -2.509   1.796   2.801
  Start of MODEL    8
 5525   HD23  LEU  85          HD23      LEU  85  -1.303   1.113   1.716
  Start of MODEL    8
 5526    H    LEU  85           HN       LEU  85   0.272   5.797   3.475
  Start of MODEL    8
 5527    HA   LEU  86           HA       LEU  86  -3.722   7.727   1.255
  Start of MODEL    8
 5528    HB3  LEU  86           HB2      LEU  86  -4.049   9.033  -0.826
  Start of MODEL    8
 5529    HB2  LEU  86           HB3      LEU  86  -2.789   8.113  -1.602
  Start of MODEL    8
 5530    HG   LEU  86           HG       LEU  86  -2.163  10.415  -0.998
  Start of MODEL    8
 5531   HD11  LEU  86          HD11      LEU  86  -2.297   9.448   1.817
  Start of MODEL    8
 5532   HD13  LEU  86          HD12      LEU  86  -3.308  10.676   1.054
  Start of MODEL    8
 5533   HD12  LEU  86          HD13      LEU  86  -1.583  10.969   1.281
  Start of MODEL    8
 5534   HD22  LEU  86          HD21      LEU  86   0.046   9.885  -0.080
  Start of MODEL    8
 5535   HD21  LEU  86          HD22      LEU  86  -0.420   8.796  -1.390
  Start of MODEL    8
 5536   HD23  LEU  86          HD23      LEU  86  -0.512   8.253   0.287
  Start of MODEL    8
 5537    H    LEU  86           HN       LEU  86  -1.658   6.332  -0.282
  Start of MODEL    8
 5538    HA   ALA  87           HA       ALA  87  -6.325   5.441  -1.434
  Start of MODEL    8
 5539    HB1  ALA  87           HB1      ALA  87  -7.695   5.286   1.266
  Start of MODEL    8
 5540    HB3  ALA  87           HB2      ALA  87  -6.555   4.102   0.642
  Start of MODEL    8
 5541    HB2  ALA  87           HB3      ALA  87  -8.114   4.316  -0.146
  Start of MODEL    8
 5542    H    ALA  87           HN       ALA  87  -5.777   7.087   0.942
  Start of MODEL    8
 5543    HA   ALA  88           HA       ALA  88  -9.005   8.829  -1.734
  Start of MODEL    8
 5544    HB2  ALA  88           HB1      ALA  88  -9.059   9.628  -4.013
  Start of MODEL    8
 5545    HB1  ALA  88           HB2      ALA  88  -8.239   8.165  -4.570
  Start of MODEL    8
 5546    HB3  ALA  88           HB3      ALA  88  -7.397   9.304  -3.511
  Start of MODEL    8
 5547    H    ALA  88           HN       ALA  88  -7.536   6.523  -2.764
  Start of MODEL    8
 5548    HA   ASN  89           HA       ASN  89 -12.659   7.227  -3.429
  Start of MODEL    8
 5549    HB3  ASN  89           HB2      ASN  89 -12.874   6.977  -0.414
  Start of MODEL    8
 5550    HB2  ASN  89           HB3      ASN  89 -12.192   5.744  -1.474
  Start of MODEL    8
 5551   HD21  ASN  89          HD21      ASN  89 -13.538   4.535  -2.765
  Start of MODEL    8
 5552   HD22  ASN  89          HD22      ASN  89 -15.244   4.563  -2.603
  Start of MODEL    8
 5553    H    ASN  89           HN       ASN  89 -11.083   8.824  -1.639
  Start of MODEL    8
 5554    HA   PRO  90           HA       PRO  90 -15.029  10.938  -3.645
  Start of MODEL    8
 5555    HB3  PRO  90           HB2      PRO  90 -17.085  10.316  -4.505
  Start of MODEL    8
 5556    HB2  PRO  90           HB3      PRO  90 -17.253   8.967  -3.376
  Start of MODEL    8
 5557    HG2  PRO  90           HG2      PRO  90 -16.570   7.820  -5.272
  Start of MODEL    8
 5558    HG3  PRO  90           HG3      PRO  90 -15.582   9.174  -5.845
  Start of MODEL    8
 5559    HD2  PRO  90           HD2      PRO  90 -14.914   7.040  -3.918
  Start of MODEL    8
 5560    HD3  PRO  90           HD3      PRO  90 -13.850   8.026  -4.942
  Start of MODEL    8
 5561    HA   CYS  91           HA       CYS  91 -17.377  10.744   0.251
  Start of MODEL    8
 5562    HB3  CYS  91           HB2      CYS  91 -18.213   8.473   0.031
  Start of MODEL    8
 5563    HB2  CYS  91           HB3      CYS  91 -18.304   9.062   1.700
  Start of MODEL    8
 5564    H    CYS  91           HN       CYS  91 -15.926   8.601  -1.082
  Start of MODEL    8
 5565    HA2  GLY  92           HA2      GLY  92 -13.467  10.844   2.473
  Start of MODEL    8
 5566    H    GLY  92           HN       GLY  92 -14.493   8.920   0.578
  Start of MODEL    8
 5567    HA3  GLY  92           HA1      GLY  92 -13.770   9.265   3.183
  Start of MODEL    8
 5568    HA   GLN  93           HA       GLN  93  -9.905   8.925   0.913
  Start of MODEL    8
 5569    HB3  GLN  93           HB2      GLN  93  -9.335  11.885   1.226
  Start of MODEL    8
 5570    HB2  GLN  93           HB3      GLN  93  -9.805  11.029  -0.237
  Start of MODEL    8
 5571    HG2  GLN  93           HG2      GLN  93  -7.201  10.716   1.223
  Start of MODEL    8
 5572    HG3  GLN  93           HG3      GLN  93  -7.688   9.794  -0.194
  Start of MODEL    8
 5573   HE21  GLN  93          HE21      GLN  93  -5.453  11.595   0.236
  Start of MODEL    8
 5574   HE22  GLN  93          HE22      GLN  93  -5.539  12.793  -0.984
  Start of MODEL    8
 5575    H    GLN  93           HN       GLN  93 -11.381  11.035   2.284
  Start of MODEL    8
 5576    HA   ALA  94           HA       ALA  94  -7.909   8.670   4.757
  Start of MODEL    8
 5577    HB3  ALA  94           HB1      ALA  94  -9.027   6.513   4.530
  Start of MODEL    8
 5578    HB2  ALA  94           HB2      ALA  94  -7.381   6.303   5.145
  Start of MODEL    8
 5579    HB1  ALA  94           HB3      ALA  94  -7.743   5.976   3.452
  Start of MODEL    8
 5580    H    ALA  94           HN       ALA  94  -8.455   7.852   1.990
  Start of MODEL    8
 5581    HA   SER  95           HA       SER  95  -3.674   7.921   3.652
  Start of MODEL    8
 5582    HB3  SER  95           HB2      SER  95  -3.973  10.213   3.151
  Start of MODEL    8
 5583    HB2  SER  95           HB3      SER  95  -2.603  10.158   4.261
  Start of MODEL    8
 5584    HG   SER  95           HG       SER  95  -4.799  10.354   5.711
  Start of MODEL    8
 5585    H    SER  95           HN       SER  95  -5.772   8.440   5.541
  Start of MODEL    8
 5586    HA   ALA  96           HA       ALA  96  -1.883   7.175   7.579
  Start of MODEL    8
 5587    HB3  ALA  96           HB1      ALA  96  -3.103   5.094   7.217
  Start of MODEL    8
 5588    HB2  ALA  96           HB2      ALA  96  -1.465   4.745   7.776
  Start of MODEL    8
 5589    HB1  ALA  96           HB3      ALA  96  -1.875   4.559   6.074
  Start of MODEL    8
 5590    H    ALA  96           HN       ALA  96  -2.258   6.734   4.691
  Start of MODEL    8
 5591    HA   SER  97           HA       SER  97   2.243   7.057   6.104
  Start of MODEL    8
 5592    HB3  SER  97           HB2      SER  97   3.510   8.644   7.417
  Start of MODEL    8
 5593    HB2  SER  97           HB3      SER  97   2.405   8.457   8.780
  Start of MODEL    8
 5594    HG   SER  97           HG       SER  97   0.771   9.146   7.100
  Start of MODEL    8
 5595    H    SER  97           HN       SER  97   0.279   7.049   8.291
  Start of MODEL    8
 5596    HA   ILE  98           HA       ILE  98   4.585   4.570   8.919
  Start of MODEL    8
 5597    HB   ILE  98           HB       ILE  98   3.094   2.949   7.715
  Start of MODEL    8
 5598   HD13  ILE  98          HD11      ILE  98   6.316   1.187   6.845
  Start of MODEL    8
 5599   HD12  ILE  98          HD12      ILE  98   6.670   0.712   8.508
  Start of MODEL    8
 5600   HD11  ILE  98          HD13      ILE  98   6.903   2.382   8.001
  Start of MODEL    8
 5601    H    ILE  98           HN       ILE  98   4.040   5.714   6.325
  Start of MODEL    8
 5602    HA   MET  99           HA       MET  99   8.405   5.412   7.054
  Start of MODEL    8
 5603    HB3  MET  99           HB2      MET  99   8.806   6.065   9.982
  Start of MODEL    8
 5604    HB2  MET  99           HB3      MET  99   8.466   7.203   8.685
  Start of MODEL    8
 5605    HG2  MET  99           HG2      MET  99  10.982   5.597   9.076
  Start of MODEL    8
 5606    HG3  MET  99           HG3      MET  99  10.638   6.562   7.644
  Start of MODEL    8
 5607    HE2  MET  99           HE1      MET  99  10.646  10.206   8.991
  Start of MODEL    8
 5608    HE1  MET  99           HE2      MET  99   9.245   9.173   8.731
  Start of MODEL    8
 5609    HE3  MET  99           HE3      MET  99  10.577   9.162   7.571
  Start of MODEL    8
 5610    H    MET  99           HN       MET  99   6.646   4.991   9.326
  Start of MODEL    8
 5611    HA   ALA 100           HA       ALA 100   9.859   1.501   8.058
  Start of MODEL    8
 5612    HB1  ALA 100           HB1      ALA 100  10.166   1.827   5.071
  Start of MODEL    8
 5613    HB3  ALA 100           HB2      ALA 100   8.796   1.084   5.895
  Start of MODEL    8
 5614    HB2  ALA 100           HB3      ALA 100  10.386   0.324   5.968
  Start of MODEL    8
 5615    H    ALA 100           HN       ALA 100   9.340   3.764   6.327
  Start of MODEL    8
 5616    HA   ALA 101           HA       ALA 101  13.976   2.955   8.016
  Start of MODEL    8
 5617    HB1  ALA 101           HB1      ALA 101  13.610   1.421  10.595
  Start of MODEL    8
 5618    HB3  ALA 101           HB2      ALA 101  13.504   3.177  10.392
  Start of MODEL    8
 5619    HB2  ALA 101           HB3      ALA 101  15.044   2.349  10.142
  Start of MODEL    8
 5620    H    ALA 101           HN       ALA 101  11.693   1.558   9.106
  Start of MODEL    8
 5621    HA   PHE 102           HA       PHE 102  14.650  -0.859   5.988
  Start of MODEL    8
 5622    HB3  PHE 102           HB2      PHE 102  16.342   1.291   4.708
  Start of MODEL    8
 5623    HB2  PHE 102           HB3      PHE 102  14.759   0.761   4.171
  Start of MODEL    8
 5624    HD1  PHE 102           HD1      PHE 102  14.556  -1.725   3.499
  Start of MODEL    8
 5625    HD2  PHE 102           HD2      PHE 102  18.227   0.400   3.713
  Start of MODEL    8
 5626    HE1  PHE 102           HE1      PHE 102  15.577  -3.346   1.988
  Start of MODEL    8
 5627    HE2  PHE 102           HE2      PHE 102  19.268  -1.224   2.193
  Start of MODEL    8
 5628    HZ   PHE 102           HZ       PHE 102  17.943  -3.105   1.323
  Start of MODEL    8
 5629    H    PHE 102           HN       PHE 102  14.785   1.917   6.464
  Start of MODEL    8
 5630    HA   MET 103           HA       MET 103  18.856  -0.682   8.192
  Start of MODEL    8
 5631    HB3  MET 103           HB2      MET 103  20.854  -1.129   6.656
  Start of MODEL    8
 5632    HB2  MET 103           HB3      MET 103  19.864  -0.593   5.312
  Start of MODEL    8
 5633    HG2  MET 103           HG2      MET 103  19.307  -2.991   7.036
  Start of MODEL    8
 5634    HG3  MET 103           HG3      MET 103  18.311  -2.435   5.698
  Start of MODEL    8
 5635    HE1  MET 103           HE1      MET 103  18.382  -4.839   4.646
  Start of MODEL    8
 5636    HE3  MET 103           HE2      MET 103  19.386  -5.407   5.983
  Start of MODEL    8
 5637    HE2  MET 103           HE3      MET 103  19.865  -5.733   4.318
  Start of MODEL    8
 5638    H    MET 103           HN       MET 103  17.621   1.057   6.304
  Start of MODEL    8
 5639    HA   ASP 104           HA       ASP 104  20.999   3.055   8.555
  Start of MODEL    8
 5640    HB3  ASP 104           HB2      ASP 104  22.644   1.701   9.908
  Start of MODEL    8
 5641    HB2  ASP 104           HB3      ASP 104  23.324   3.164   9.210
  Start of MODEL    8
 5642    H    ASP 104           HN       ASP 104  21.347   0.245   8.170
  Start of MODEL    8
 5643    HA   ASN 105           HA       ASN 105  22.123   4.025   4.550
  Start of MODEL    8
 5644    HB3  ASN 105           HB2      ASN 105  21.410   6.666   5.849
  Start of MODEL    8
 5645    HB2  ASN 105           HB3      ASN 105  20.292   5.579   5.040
  Start of MODEL    8
 5646   HD21  ASN 105          HD21      ASN 105  22.578   8.080   4.664
  Start of MODEL    8
 5647   HD22  ASN 105          HD22      ASN 105  22.440   8.270   2.968
  Start of MODEL    8
 5648    H    ASN 105           HN       ASN 105  21.762   4.735   7.339
  Start of MODEL    8
 5649    HA   PRO 106           HA       PRO 106  26.486   4.723   5.193
  Start of MODEL    8
 5650    HB3  PRO 106           HB2      PRO 106  27.434   3.753   3.338
  Start of MODEL    8
 5651    HB2  PRO 106           HB3      PRO 106  26.482   4.741   2.227
  Start of MODEL    8
 5652    HG2  PRO 106           HG2      PRO 106  25.405   2.697   1.980
  Start of MODEL    8
 5653    HG3  PRO 106           HG3      PRO 106  25.719   2.232   3.664
  Start of MODEL    8
 5654    HD2  PRO 106           HD2      PRO 106  23.639   4.079   2.562
  Start of MODEL    8
 5655    HD3  PRO 106           HD3      PRO 106  23.536   2.872   3.865
  Start of MODEL    8
 5656    HA   PHE 107           HA       PHE 107  28.549   8.498   5.060
  Start of MODEL    8
 5657    HB3  PHE 107           HB2      PHE 107  26.905   8.780   2.515
  Start of MODEL    8
 5658    HB2  PHE 107           HB3      PHE 107  28.559   8.195   2.587
  Start of MODEL    8
 5659    HD1  PHE 107           HD1      PHE 107  26.499  11.043   2.179
  Start of MODEL    8
 5660    HD2  PHE 107           HD2      PHE 107  30.333   9.804   3.547
  Start of MODEL    8
 5661    HE1  PHE 107           HE1      PHE 107  27.328  13.345   1.929
  Start of MODEL    8
 5662    HE2  PHE 107           HE2      PHE 107  31.171  12.099   3.294
  Start of MODEL    8
 5663    HZ   PHE 107           HZ       PHE 107  29.698  13.858   2.429
  Start of MODEL    8
 5664    H    PHE 107           HN       PHE 107  27.774   6.429   5.183
  Start of MODEL    9
 5665    H1   ASP   1           H        ASP   1 -33.276  -1.284   3.212
  Start of MODEL    9
 5666    H2   ASP   1           H2       ASP   1 -32.537  -2.745   3.579
  Start of MODEL    9
 5667    H3   ASP   1           H3       ASP   1 -34.219  -2.642   3.611
  Start of MODEL    9
 5668    HA   ASP   1           HA       ASP   1 -33.370  -3.773   1.641
  Start of MODEL    9
 5669    HB3  ASP   1           HB2      ASP   1 -34.445  -2.361  -0.114
  Start of MODEL    9
 5670    HB2  ASP   1           HB3      ASP   1 -34.527  -1.034   1.035
  Start of MODEL    9
 5671    HA   ASP   2           HA       ASP   2 -31.000  -2.189  -2.065
  Start of MODEL    9
 5672    HB3  ASP   2           HB2      ASP   2 -29.572  -0.181  -1.307
  Start of MODEL    9
 5673    HB2  ASP   2           HB3      ASP   2 -30.634  -0.153   0.102
  Start of MODEL    9
 5674    H    ASP   2           HN       ASP   2 -32.619  -2.918  -0.709
  Start of MODEL    9
 5675    HA   ASP   3           HA       ASP   3 -27.597  -4.475  -0.671
  Start of MODEL    9
 5676    HB3  ASP   3           HB2      ASP   3 -27.143  -4.254  -3.661
  Start of MODEL    9
 5677    HB2  ASP   3           HB3      ASP   3 -28.257  -5.406  -2.940
  Start of MODEL    9
 5678    H    ASP   3           HN       ASP   3 -29.143  -2.976  -2.632
  Start of MODEL    9
 5679    HA   ASP   4           HA       ASP   4 -24.578  -1.139  -2.006
  Start of MODEL    9
 5680    HB3  ASP   4           HB2      ASP   4 -26.634   0.465  -3.567
  Start of MODEL    9
 5681    HB2  ASP   4           HB3      ASP   4 -25.396  -0.575  -4.237
  Start of MODEL    9
 5682    H    ASP   4           HN       ASP   4 -27.400  -1.619  -2.586
  Start of MODEL    9
 5683    HA   ASP   5           HA       ASP   5 -27.188   1.679   0.848
  Start of MODEL    9
 5684    HB3  ASP   5           HB2      ASP   5 -28.151  -0.910   2.055
  Start of MODEL    9
 5685    HB2  ASP   5           HB3      ASP   5 -29.106   0.289   1.189
  Start of MODEL    9
 5686    H    ASP   5           HN       ASP   5 -27.183  -0.960  -0.207
  Start of MODEL    9
 5687    HA   VAL   6           HA       VAL   6 -24.198  -0.047   3.882
  Start of MODEL    9
 5688    HB   VAL   6           HB       VAL   6 -22.535  -1.984   3.688
  Start of MODEL    9
 5689    H    VAL   6           HN       VAL   6 -25.218  -1.073   1.441
  Start of MODEL    9
 5690    HA   SER   7           HA       SER   7 -21.268   2.030   1.491
  Start of MODEL    9
 5691    HB3  SER   7           HB2      SER   7 -21.713   4.518   1.944
  Start of MODEL    9
 5692    HB2  SER   7           HB3      SER   7 -23.024   3.866   2.986
  Start of MODEL    9
 5693    HG   SER   7           HG       SER   7 -23.081   2.745   0.559
  Start of MODEL    9
 5694    H    SER   7           HN       SER   7 -23.189   1.715   3.663
  Start of MODEL    9
 5695    HA   PHE   8           HA       PHE   8 -18.663   2.431   5.007
  Start of MODEL    9
 5696    HB3  PHE   8           HB2      PHE   8 -16.779   0.807   4.906
  Start of MODEL    9
 5697    HB2  PHE   8           HB3      PHE   8 -17.404   0.218   3.372
  Start of MODEL    9
 5698    HD1  PHE   8           HD1      PHE   8 -19.189  -1.330   3.283
  Start of MODEL    9
 5699    HD2  PHE   8           HD2      PHE   8 -18.122   0.514   6.962
  Start of MODEL    9
 5700    HE1  PHE   8           HE1      PHE   8 -20.640  -2.880   4.468
  Start of MODEL    9
 5701    HE2  PHE   8           HE2      PHE   8 -19.583  -1.050   8.164
  Start of MODEL    9
 5702    HZ   PHE   8           HZ       PHE   8 -20.843  -2.748   6.917
  Start of MODEL    9
 5703    H    PHE   8           HN       PHE   8 -19.443   1.296   2.444
  Start of MODEL    9
 5704    HA   CYS   9           HA       CYS   9 -16.082   5.169   2.847
  Start of MODEL    9
 5705    HB3  CYS   9           HB2      CYS   9 -15.297   6.806   4.470
  Start of MODEL    9
 5706    HB2  CYS   9           HB3      CYS   9 -15.658   5.698   5.794
  Start of MODEL    9
 5707    H    CYS   9           HN       CYS   9 -17.107   3.842   5.200
  Start of MODEL    9
 5708    HA   ALA  10           HA       ALA  10 -12.247   3.303   3.201
  Start of MODEL    9
 5709    HB2  ALA  10           HB1      ALA  10 -10.414   4.493   2.140
  Start of MODEL    9
 5710    HB1  ALA  10           HB2      ALA  10 -11.251   6.020   2.383
  Start of MODEL    9
 5711    HB3  ALA  10           HB3      ALA  10 -11.935   4.807   1.293
  Start of MODEL    9
 5712    H    ALA  10           HN       ALA  10 -13.564   5.902   3.307
  Start of MODEL    9
 5713    HA   SER  11           HA       SER  11  -9.759   4.602   6.533
  Start of MODEL    9
 5714    HB3  SER  11           HB2      SER  11 -10.073   3.051   8.312
  Start of MODEL    9
 5715    HB2  SER  11           HB3      SER  11 -10.529   1.756   7.201
  Start of MODEL    9
 5716    HG   SER  11           HG       SER  11 -12.465   2.428   7.201
  Start of MODEL    9
 5717    H    SER  11           HN       SER  11 -10.953   2.673   4.671
  Start of MODEL    9
 5718    HA   VAL  12           HA       VAL  12  -6.376   2.002   5.293
  Start of MODEL    9
 5719    HB   VAL  12           HB       VAL  12  -5.263   4.801   5.703
  Start of MODEL    9
 5720    H    VAL  12           HN       VAL  12  -7.525   4.054   7.057
  Start of MODEL    9
 5721    HA   GLN  13           HA       GLN  13  -3.913   1.405   8.882
  Start of MODEL    9
 5722    HB3  GLN  13           HB2      GLN  13  -3.952  -1.042   9.478
  Start of MODEL    9
 5723    HB2  GLN  13           HB3      GLN  13  -5.057  -1.286   8.138
  Start of MODEL    9
 5724    HG2  GLN  13           HG2      GLN  13  -5.558   0.345  10.601
  Start of MODEL    9
 5725    HG3  GLN  13           HG3      GLN  13  -6.640   0.267   9.213
  Start of MODEL    9
 5726   HE21  GLN  13          HE21      GLN  13  -8.262  -0.626  10.468
  Start of MODEL    9
 5727   HE22  GLN  13          HE22      GLN  13  -8.248  -2.270  10.992
  Start of MODEL    9
 5728    H    GLN  13           HN       GLN  13  -5.436   0.534   6.545
  Start of MODEL    9
 5729    HA   LEU  14           HA       LEU  14  -0.647  -0.394   6.646
  Start of MODEL    9
 5730    HB3  LEU  14           HB2      LEU  14   1.404   1.196   6.964
  Start of MODEL    9
 5731    HB2  LEU  14           HB3      LEU  14   0.221   2.304   7.641
  Start of MODEL    9
 5732    HG   LEU  14           HG       LEU  14  -1.067   2.052   5.451
  Start of MODEL    9
 5733   HD12  LEU  14          HD11      LEU  14   0.373   3.542   4.217
  Start of MODEL    9
 5734   HD11  LEU  14          HD12      LEU  14   1.732   3.166   5.278
  Start of MODEL    9
 5735   HD13  LEU  14          HD13      LEU  14   0.315   4.023   5.911
  Start of MODEL    9
 5736   HD23  LEU  14          HD21      LEU  14   1.528   0.794   4.631
  Start of MODEL    9
 5737   HD22  LEU  14          HD22      LEU  14   0.210   1.253   3.549
  Start of MODEL    9
 5738   HD21  LEU  14          HD23      LEU  14  -0.031  -0.025   4.746
  Start of MODEL    9
 5739    H    LEU  14           HN       LEU  14  -1.786   1.320   8.704
  Start of MODEL    9
 5740    HA   HIS  15           HA       HIS  15   1.617  -1.916  10.053
  Start of MODEL    9
 5741    HB3  HIS  15           HB2      HIS  15   2.038  -4.296   9.432
  Start of MODEL    9
 5742    HB2  HIS  15           HB3      HIS  15   1.595  -3.913   7.777
  Start of MODEL    9
 5743    HD1  HIS  15           HD1      HIS  15   0.106  -4.556  11.123
  Start of MODEL    9
 5744    HD2  HIS  15           HD2      HIS  15  -1.156  -3.585   7.292
  Start of MODEL    9
 5745    HE1  HIS  15           HE1      HIS  15  -2.361  -4.970  11.110
  Start of MODEL    9
 5746    HE2  HIS  15           HE2      HIS  15  -2.967  -4.775   8.701
  Start of MODEL    9
 5747    H    HIS  15           HN       HIS  15   1.454  -1.343   7.184
  Start of MODEL    9
 5748    HA   THR  16           HA       THR  16   5.850  -1.184   9.698
  Start of MODEL    9
 5749    HB   THR  16           HB       THR  16   5.759  -3.590  11.536
  Start of MODEL    9
 5750    HG1  THR  16           HG1      THR  16   5.935  -1.135  12.727
  Start of MODEL    9
 5751   HG22  THR  16          HG21      THR  16   7.812  -2.623  12.483
  Start of MODEL    9
 5752   HG21  THR  16          HG22      THR  16   7.710  -1.286  11.339
  Start of MODEL    9
 5753   HG23  THR  16          HG23      THR  16   8.014  -2.920  10.750
  Start of MODEL    9
 5754    H    THR  16           HN       THR  16   3.632  -2.347  10.768
  Start of MODEL    9
 5755    HA   ALA  17           HA       ALA  17   6.904  -3.862   6.446
  Start of MODEL    9
 5756    HB1  ALA  17           HB1      ALA  17   8.125  -1.739   5.988
  Start of MODEL    9
 5757    HB3  ALA  17           HB2      ALA  17   8.953  -3.181   5.437
  Start of MODEL    9
 5758    HB2  ALA  17           HB3      ALA  17   9.489  -2.374   6.918
  Start of MODEL    9
 5759    H    ALA  17           HN       ALA  17   7.383  -1.809   8.310
  Start of MODEL    9
 5760    HA   VAL  18           HA       VAL  18   8.943  -6.845   8.682
  Start of MODEL    9
 5761    HB   VAL  18           HB       VAL  18   8.609  -9.131   7.684
  Start of MODEL    9
 5762    H    VAL  18           HN       VAL  18   7.894  -5.819   6.194
  Start of MODEL    9
 5763    HA   GLU  19           HA       GLU  19  12.954  -6.595   7.318
  Start of MODEL    9
 5764    HB3  GLU  19           HB2      GLU  19  14.502  -7.420   9.029
  Start of MODEL    9
 5765    HB2  GLU  19           HB3      GLU  19  13.176  -8.237   9.829
  Start of MODEL    9
 5766    HG2  GLU  19           HG2      GLU  19  13.304  -5.264   9.440
  Start of MODEL    9
 5767    HG3  GLU  19           HG3      GLU  19  12.149  -6.173  10.414
  Start of MODEL    9
 5768    H    GLU  19           HN       GLU  19  10.882  -7.583   9.014
  Start of MODEL    9
 5769    HA   MET  20           HA       MET  20  14.676 -10.009   5.413
  Start of MODEL    9
 5770    HB3  MET  20           HB2      MET  20  12.485 -11.140   5.737
  Start of MODEL    9
 5771    HB2  MET  20           HB3      MET  20  13.127 -11.456   4.137
  Start of MODEL    9
 5772    HG2  MET  20           HG2      MET  20  10.990  -9.438   4.769
  Start of MODEL    9
 5773    HG3  MET  20           HG3      MET  20  11.612  -9.836   3.167
  Start of MODEL    9
 5774    HE2  MET  20           HE1      MET  20   8.036 -11.409   3.008
  Start of MODEL    9
 5775    HE1  MET  20           HE2      MET  20   9.206 -10.376   2.196
  Start of MODEL    9
 5776    HE3  MET  20           HE3      MET  20   8.517  -9.879   3.738
  Start of MODEL    9
 5777    H    MET  20           HN       MET  20  13.065  -7.704   5.442
  Start of MODEL    9
 5778    HA   HIS  21           HA       HIS  21  16.168  -7.937   2.095
  Start of MODEL    9
 5779    HB3  HIS  21           HB2      HIS  21  17.010  -9.331   0.162
  Start of MODEL    9
 5780    HB2  HIS  21           HB3      HIS  21  16.373 -10.733   1.018
  Start of MODEL    9
 5781    HD1  HIS  21           HD1      HIS  21  17.783 -11.682   2.878
  Start of MODEL    9
 5782    HD2  HIS  21           HD2      HIS  21  19.146  -8.002   1.543
  Start of MODEL    9
 5783    HE1  HIS  21           HE1      HIS  21  20.007 -11.356   3.971
  Start of MODEL    9
 5784    HE2  HIS  21           HE2      HIS  21  20.921  -9.294   2.892
  Start of MODEL    9
 5785    H    HIS  21           HN       HIS  21  15.408 -10.334   3.264
  Start of MODEL    9
 5786    HA   HIS  22           HA       HIS  22  12.833  -8.037  -0.905
  Start of MODEL    9
 5787    HB3  HIS  22           HB2      HIS  22  10.883  -9.631  -1.259
  Start of MODEL    9
 5788    HB2  HIS  22           HB3      HIS  22  11.645 -10.717  -0.109
  Start of MODEL    9
 5789    HD1  HIS  22           HD1      HIS  22  11.188 -10.638  -3.486
  Start of MODEL    9
 5790    HD2  HIS  22           HD2      HIS  22  14.608 -10.955  -1.167
  Start of MODEL    9
 5791    HE1  HIS  22           HE1      HIS  22  12.900 -11.733  -4.950
  Start of MODEL    9
 5792    HE2  HIS  22           HE2      HIS  22  14.731 -12.296  -3.325
  Start of MODEL    9
 5793    H    HIS  22           HN       HIS  22  13.539  -9.946   1.202
  Start of MODEL    9
 5794    HA   TRP  23           HA       TRP  23  10.839  -6.597   2.652
  Start of MODEL    9
 5795    HB3  TRP  23           HB2      TRP  23  10.698  -4.059   2.551
  Start of MODEL    9
 5796    HB2  TRP  23           HB3      TRP  23  11.521  -4.175   0.994
  Start of MODEL    9
 5797    HD1  TRP  23           HD1      TRP  23  14.075  -5.193   1.059
  Start of MODEL    9
 5798    HE1  TRP  23           HE1      TRP  23  15.830  -5.210   2.966
  Start of MODEL    9
 5799    HE3  TRP  23           HE3      TRP  23  11.024  -4.088   4.980
  Start of MODEL    9
 5800    HZ2  TRP  23           HZ2      TRP  23  15.895  -4.782   5.733
  Start of MODEL    9
 5801    HZ3  TRP  23           HZ3      TRP  23  12.002  -3.894   7.231
  Start of MODEL    9
 5802    HH2  TRP  23           HH2      TRP  23  14.383  -4.238   7.597
  Start of MODEL    9
 5803    H    TRP  23           HN       TRP  23  11.987  -6.309   0.041
  Start of MODEL    9
 5804    HA   CYS  24           HA       CYS  24   6.810  -5.748   1.269
  Start of MODEL    9
 5805    HB3  CYS  24           HB2      CYS  24   6.904  -7.958   3.340
  Start of MODEL    9
 5806    HB2  CYS  24           HB3      CYS  24   6.934  -8.150   1.595
  Start of MODEL    9
 5807    H    CYS  24           HN       CYS  24   8.861  -6.137   3.300
  Start of MODEL    9
 5808    HA   ILE  25           HA       ILE  25   5.172  -3.564   4.714
  Start of MODEL    9
 5809    HB   ILE  25           HB       ILE  25   4.669  -1.783   2.303
  Start of MODEL    9
 5810   HD13  ILE  25          HD11      ILE  25   6.463   0.036   1.899
  Start of MODEL    9
 5811   HD12  ILE  25          HD12      ILE  25   7.878   0.077   2.949
  Start of MODEL    9
 5812   HD11  ILE  25          HD13      ILE  25   6.300   0.568   3.570
  Start of MODEL    9
 5813    H    ILE  25           HN       ILE  25   5.559  -4.169   1.861
  Start of MODEL    9
 5814    HA   PRO  26           HA       PRO  26   1.202  -5.406   3.396
  Start of MODEL    9
 5815    HB3  PRO  26           HB2      PRO  26   0.874  -6.981   5.014
  Start of MODEL    9
 5816    HB2  PRO  26           HB3      PRO  26   0.726  -5.742   6.261
  Start of MODEL    9
 5817    HG2  PRO  26           HG2      PRO  26   2.751  -6.621   6.935
  Start of MODEL    9
 5818    HG3  PRO  26           HG3      PRO  26   3.147  -7.189   5.305
  Start of MODEL    9
 5819    HD2  PRO  26           HD2      PRO  26   3.425  -4.442   6.470
  Start of MODEL    9
 5820    HD3  PRO  26           HD3      PRO  26   4.534  -5.353   5.418
  Start of MODEL    9
 5821    HA   PHE  27           HA       PHE  27  -1.315  -2.265   5.099
  Start of MODEL    9
 5822    HB3  PHE  27           HB2      PHE  27  -0.457  -1.153   3.082
  Start of MODEL    9
 5823    HB2  PHE  27           HB3      PHE  27  -2.150  -0.781   3.342
  Start of MODEL    9
 5824    HD1  PHE  27           HD1      PHE  27  -3.877  -1.658   1.841
  Start of MODEL    9
 5825    HD2  PHE  27           HD2      PHE  27   0.263  -2.328   1.133
  Start of MODEL    9
 5826    HE1  PHE  27           HE1      PHE  27  -4.380  -2.265  -0.483
  Start of MODEL    9
 5827    HE2  PHE  27           HE2      PHE  27  -0.237  -2.939  -1.192
  Start of MODEL    9
 5828    HZ   PHE  27           HZ       PHE  27  -2.558  -2.908  -2.004
  Start of MODEL    9
 5829    H    PHE  27           HN       PHE  27  -0.702  -4.356   3.162
  Start of MODEL    9
 5830    HA   SER  28           HA       SER  28  -5.374  -3.670   4.107
  Start of MODEL    9
 5831    HB3  SER  28           HB2      SER  28  -6.360  -4.159   6.299
  Start of MODEL    9
 5832    HB2  SER  28           HB3      SER  28  -5.183  -3.094   7.078
  Start of MODEL    9
 5833    HG   SER  28           HG       SER  28  -4.054  -4.944   5.434
  Start of MODEL    9
 5834    H    SER  28           HN       SER  28  -3.551  -1.738   5.263
  Start of MODEL    9
 5835    HA   VAL  29           HA       VAL  29  -7.570   0.107   4.322
  Start of MODEL    9
 5836    HB   VAL  29           HB       VAL  29  -6.265   0.727   2.350
  Start of MODEL    9
 5837    H    VAL  29           HN       VAL  29  -6.642  -2.356   3.044
  Start of MODEL    9
 5838    HA   ASP  30           HA       ASP  30 -11.382  -1.721   3.297
  Start of MODEL    9
 5839    HB3  ASP  30           HB2      ASP  30 -11.092  -2.261   5.679
  Start of MODEL    9
 5840    HB2  ASP  30           HB3      ASP  30 -12.774  -1.963   5.272
  Start of MODEL    9
 5841    H    ASP  30           HN       ASP  30  -9.737   0.341   4.561
  Start of MODEL    9
 5842    HA2  GLY  31           HA2      GLY  31 -14.950   1.000   3.283
  Start of MODEL    9
 5843    H    GLY  31           HN       GLY  31 -13.456  -1.229   2.783
  Start of MODEL    9
 5844    HA3  GLY  31           HA1      GLY  31 -13.925   1.422   1.906
  Start of MODEL    9
 5845    HA   GLN  32           HA       GLN  32 -16.955  -1.367   0.284
  Start of MODEL    9
 5846    HB3  GLN  32           HB2      GLN  32 -19.072   0.811   0.304
  Start of MODEL    9
 5847    HB2  GLN  32           HB3      GLN  32 -18.850  -0.280   1.645
  Start of MODEL    9
 5848    HG2  GLN  32           HG2      GLN  32 -19.277  -2.176  -0.017
  Start of MODEL    9
 5849    HG3  GLN  32           HG3      GLN  32 -20.640  -1.183   0.462
  Start of MODEL    9
 5850   HE21  GLN  32          HE21      GLN  32 -20.296  -2.853  -1.871
  Start of MODEL    9
 5851   HE22  GLN  32          HE22      GLN  32 -20.509  -1.831  -3.240
  Start of MODEL    9
 5852    H    GLN  32           HN       GLN  32 -16.612   1.295   1.421
  Start of MODEL    9
 5853    HA   PRO  33           HA       PRO  33 -16.739   1.274  -3.650
  Start of MODEL    9
 5854    HB3  PRO  33           HB2      PRO  33 -17.714   3.390  -3.576
  Start of MODEL    9
 5855    HB2  PRO  33           HB3      PRO  33 -16.043   3.922  -3.374
  Start of MODEL    9
 5856    HG2  PRO  33           HG2      PRO  33 -16.263   4.160  -1.087
  Start of MODEL    9
 5857    HG3  PRO  33           HG3      PRO  33 -17.932   4.517  -1.571
  Start of MODEL    9
 5858    HD2  PRO  33           HD2      PRO  33 -17.309   2.567   0.195
  Start of MODEL    9
 5859    HD3  PRO  33           HD3      PRO  33 -18.698   2.464  -0.905
  Start of MODEL    9
 5860    HA   ALA  34           HA       ALA  34 -12.596   0.340  -2.593
  Start of MODEL    9
 5861    HB2  ALA  34           HB1      ALA  34 -11.380  -0.410  -4.587
  Start of MODEL    9
 5862    HB1  ALA  34           HB2      ALA  34 -12.675   0.206  -5.609
  Start of MODEL    9
 5863    HB3  ALA  34           HB3      ALA  34 -12.986  -1.141  -4.514
  Start of MODEL    9
 5864    H    ALA  34           HN       ALA  34 -14.802   0.602  -4.294
  Start of MODEL    9
 5865    HA   PRO  35           HA       PRO  35 -11.273   4.578  -3.110
  Start of MODEL    9
 5866    HB3  PRO  35           HB2      PRO  35 -11.148   4.577  -0.803
  Start of MODEL    9
 5867    HB2  PRO  35           HB3      PRO  35  -9.427   4.604  -1.197
  Start of MODEL    9
 5868    HG2  PRO  35           HG2      PRO  35  -9.189   2.315  -0.843
  Start of MODEL    9
 5869    HG3  PRO  35           HG3      PRO  35 -10.416   2.679   0.380
  Start of MODEL    9
 5870    HD2  PRO  35           HD2      PRO  35 -10.751   0.818  -1.567
  Start of MODEL    9
 5871    HD3  PRO  35           HD3      PRO  35 -12.101   1.732  -0.865
  Start of MODEL    9
 5872    HA   SER  36           HA       SER  36  -7.874   3.909  -5.691
  Start of MODEL    9
 5873    HB3  SER  36           HB2      SER  36  -7.285   5.996  -6.779
  Start of MODEL    9
 5874    HB2  SER  36           HB3      SER  36  -8.067   6.920  -5.491
  Start of MODEL    9
 5875    HG   SER  36           HG       SER  36  -9.652   5.003  -6.643
  Start of MODEL    9
 5876    H    SER  36           HN       SER  36  -9.717   5.520  -4.252
  Start of MODEL    9
 5877    HA   LEU  37           HA       LEU  37  -4.892   4.377  -2.478
  Start of MODEL    9
 5878    HB3  LEU  37           HB2      LEU  37  -3.434   2.420  -2.500
  Start of MODEL    9
 5879    HB2  LEU  37           HB3      LEU  37  -4.147   1.896  -4.012
  Start of MODEL    9
 5880    HG   LEU  37           HG       LEU  37  -6.325   1.634  -2.838
  Start of MODEL    9
 5881   HD13  LEU  37          HD11      LEU  37  -4.750  -0.213  -3.152
  Start of MODEL    9
 5882   HD12  LEU  37          HD12      LEU  37  -5.706  -0.392  -1.683
  Start of MODEL    9
 5883   HD11  LEU  37          HD13      LEU  37  -4.027   0.141  -1.581
  Start of MODEL    9
 5884   HD23  LEU  37          HD21      LEU  37  -4.653   2.257  -0.415
  Start of MODEL    9
 5885   HD22  LEU  37          HD22      LEU  37  -6.306   1.646  -0.383
  Start of MODEL    9
 5886   HD21  LEU  37          HD23      LEU  37  -5.972   3.241  -1.051
  Start of MODEL    9
 5887    H    LEU  37           HN       LEU  37  -6.098   3.144  -4.790
  Start of MODEL    9
 5888    HA   ARG  38           HA       ARG  38  -1.324   5.513  -4.746
  Start of MODEL    9
 5889    HB3  ARG  38           HB2      ARG  38  -2.550   7.992  -3.512
  Start of MODEL    9
 5890    HB2  ARG  38           HB3      ARG  38  -2.832   7.388  -5.132
  Start of MODEL    9
 5891    HG2  ARG  38           HG2      ARG  38  -0.245   8.490  -4.083
  Start of MODEL    9
 5892    HG3  ARG  38           HG3      ARG  38  -0.470   7.832  -5.700
  Start of MODEL    9
 5893    HD2  ARG  38           HD2      ARG  38  -1.929  10.172  -4.492
  Start of MODEL    9
 5894    HD3  ARG  38           HD3      ARG  38  -0.674  10.263  -5.731
  Start of MODEL    9
 5895    HE   ARG  38           HE       ARG  38  -2.325   8.820  -7.055
  Start of MODEL    9
 5896   HH11  ARG  38          HH11      ARG  38  -3.263  11.418  -4.845
  Start of MODEL    9
 5897   HH12  ARG  38          HH12      ARG  38  -4.766  11.705  -5.581
  Start of MODEL    9
 5898   HH21  ARG  38          HH21      ARG  38  -4.351   9.223  -8.093
  Start of MODEL    9
 5899   HH22  ARG  38          HH22      ARG  38  -5.410  10.438  -7.504
  Start of MODEL    9
 5900    H    ARG  38           HN       ARG  38  -3.170   5.570  -2.480
  Start of MODEL    9
 5901    HA   TRP  39           HA       TRP  39   1.261   5.792  -1.238
  Start of MODEL    9
 5902    HB3  TRP  39           HB2      TRP  39   3.503   4.884  -1.843
  Start of MODEL    9
 5903    HB2  TRP  39           HB3      TRP  39   2.962   4.790  -3.512
  Start of MODEL    9
 5904    HD1  TRP  39           HD1      TRP  39   1.544   2.770  -4.253
  Start of MODEL    9
 5905    HE1  TRP  39           HE1      TRP  39   0.896   0.585  -3.135
  Start of MODEL    9
 5906    HE3  TRP  39           HE3      TRP  39   2.817   3.966   0.546
  Start of MODEL    9
 5907    HZ2  TRP  39           HZ2      TRP  39   0.891  -0.517  -0.492
  Start of MODEL    9
 5908    HZ3  TRP  39           HZ3      TRP  39   2.464   2.291   2.313
  Start of MODEL    9
 5909    HH2  TRP  39           HH2      TRP  39   1.528   0.101   1.808
  Start of MODEL    9
 5910    H    TRP  39           HN       TRP  39   0.787   5.652  -4.107
  Start of MODEL    9
 5911    HA   LEU  40           HA       LEU  40   3.537   9.315  -2.344
  Start of MODEL    9
 5912    HB3  LEU  40           HB2      LEU  40   2.352  10.124   0.326
  Start of MODEL    9
 5913    HB2  LEU  40           HB3      LEU  40   1.473  10.275  -1.184
  Start of MODEL    9
 5914    HG   LEU  40           HG       LEU  40   4.074  11.686  -0.673
  Start of MODEL    9
 5915   HD13  LEU  40          HD11      LEU  40   3.600  11.348  -2.984
  Start of MODEL    9
 5916   HD12  LEU  40          HD12      LEU  40   3.300  13.042  -2.581
  Start of MODEL    9
 5917   HD11  LEU  40          HD13      LEU  40   1.949  11.912  -2.767
  Start of MODEL    9
 5918   HD22  LEU  40          HD21      LEU  40   2.710  13.677  -0.310
  Start of MODEL    9
 5919   HD21  LEU  40          HD22      LEU  40   2.375  12.453   0.914
  Start of MODEL    9
 5920   HD23  LEU  40          HD23      LEU  40   1.243  12.705  -0.417
  Start of MODEL    9
 5921    H    LEU  40           HN       LEU  40   1.920   7.679  -0.533
  Start of MODEL    9
 5922    HA   PHE  41           HA       PHE  41   6.549   8.051   0.513
  Start of MODEL    9
 5923    HB3  PHE  41           HB2      PHE  41   7.779   8.155  -2.248
  Start of MODEL    9
 5924    HB2  PHE  41           HB3      PHE  41   7.166   6.740  -1.402
  Start of MODEL    9
 5925    HD1  PHE  41           HD1      PHE  41  10.047   8.554  -2.218
  Start of MODEL    9
 5926    HD2  PHE  41           HD2      PHE  41   8.326   6.218   0.890
  Start of MODEL    9
 5927    HE1  PHE  41           HE1      PHE  41  12.279   8.156  -1.291
  Start of MODEL    9
 5928    HE2  PHE  41           HE2      PHE  41  10.561   5.814   1.822
  Start of MODEL    9
 5929    HZ   PHE  41           HZ       PHE  41  12.537   6.791   0.740
  Start of MODEL    9
 5930    H    PHE  41           HN       PHE  41   5.652   9.374  -1.919
  Start of MODEL    9
 5931    HA   ASN  42           HA       ASN  42   7.756  11.327   2.951
  Start of MODEL    9
 5932    HB3  ASN  42           HB2      ASN  42  10.053  11.237   1.003
  Start of MODEL    9
 5933    HB2  ASN  42           HB3      ASN  42   9.763   9.899   2.105
  Start of MODEL    9
 5934   HD21  ASN  42          HD21      ASN  42  10.832  13.172   1.848
  Start of MODEL    9
 5935   HD22  ASN  42          HD22      ASN  42  11.434  13.290   3.466
  Start of MODEL    9
 5936    H    ASN  42           HN       ASN  42   6.755   9.668   1.813
  Start of MODEL    9
 5937    HA2  GLY  43           HA2      GLY  43   5.292  14.188   0.227
  Start of MODEL    9
 5938    H    GLY  43           HN       GLY  43   6.064  11.941   0.621
  Start of MODEL    9
 5939    HA3  GLY  43           HA1      GLY  43   6.973  14.709   0.222
  Start of MODEL    9
 5940    HA   SER  44           HA       SER  44   6.645  13.393  -4.087
  Start of MODEL    9
 5941    HB3  SER  44           HB2      SER  44   8.880  11.427  -3.452
  Start of MODEL    9
 5942    HB2  SER  44           HB3      SER  44   9.116  13.168  -3.570
  Start of MODEL    9
 5943    HG   SER  44           HG       SER  44   9.096  11.350  -5.505
  Start of MODEL    9
 5944    H    SER  44           HN       SER  44   7.372  12.113  -1.501
  Start of MODEL    9
 5945    HA   VAL  45           HA       VAL  45   4.029  10.121  -4.699
  Start of MODEL    9
 5946    HB   VAL  45           HB       VAL  45   4.526  11.173  -7.510
  Start of MODEL    9
 5947    H    VAL  45           HN       VAL  45   5.660  12.260  -5.590
  Start of MODEL    9
 5948    HA   LEU  46           HA       LEU  46   7.032   7.086  -5.471
  Start of MODEL    9
 5949    HB3  LEU  46           HB2      LEU  46   4.680   5.632  -4.272
  Start of MODEL    9
 5950    HB2  LEU  46           HB3      LEU  46   6.008   6.316  -3.363
  Start of MODEL    9
 5951    HG   LEU  46           HG       LEU  46   6.363   4.143  -5.414
  Start of MODEL    9
 5952   HD11  LEU  46          HD11      LEU  46   8.165   5.124  -3.218
  Start of MODEL    9
 5953   HD13  LEU  46          HD12      LEU  46   8.380   5.374  -4.950
  Start of MODEL    9
 5954   HD12  LEU  46          HD13      LEU  46   8.483   3.748  -4.273
  Start of MODEL    9
 5955   HD23  LEU  46          HD21      LEU  46   5.951   3.883  -2.443
  Start of MODEL    9
 5956   HD22  LEU  46          HD22      LEU  46   6.494   2.580  -3.510
  Start of MODEL    9
 5957   HD21  LEU  46          HD23      LEU  46   4.894   3.284  -3.719
  Start of MODEL    9
 5958    H    LEU  46           HN       LEU  46   4.484   8.038  -4.581
  Start of MODEL    9
 5959    HA   ASN  47           HA       ASN  47   5.099   5.674  -9.067
  Start of MODEL    9
 5960    HB3  ASN  47           HB2      ASN  47   6.740   5.571 -10.933
  Start of MODEL    9
 5961    HB2  ASN  47           HB3      ASN  47   8.033   5.904  -9.795
  Start of MODEL    9
 5962   HD21  ASN  47          HD21      ASN  47   4.910   7.493  -9.591
  Start of MODEL    9
 5963   HD22  ASN  47          HD22      ASN  47   5.492   9.053 -10.023
  Start of MODEL    9
 5964    H    ASN  47           HN       ASN  47   7.376   6.347  -7.433
  Start of MODEL    9
 5965    HA   GLU  48           HA       GLU  48   6.015   1.533  -8.063
  Start of MODEL    9
 5966    HB3  GLU  48           HB2      GLU  48   4.366   0.022  -9.071
  Start of MODEL    9
 5967    HB2  GLU  48           HB3      GLU  48   3.734   1.358 -10.029
  Start of MODEL    9
 5968    HG2  GLU  48           HG2      GLU  48   3.735   1.188  -7.025
  Start of MODEL    9
 5969    HG3  GLU  48           HG3      GLU  48   3.078   2.510  -7.997
  Start of MODEL    9
 5970    H    GLU  48           HN       GLU  48   4.547   3.594  -9.331
  Start of MODEL    9
 5971    HA   THR  49           HA       THR  49   8.237   0.529 -11.644
  Start of MODEL    9
 5972    HB   THR  49           HB       THR  49  10.580   0.069 -10.737
  Start of MODEL    9
 5973    HG1  THR  49           HG1      THR  49  10.074   1.156  -8.359
  Start of MODEL    9
 5974   HG23  THR  49          HG21      THR  49   9.885   2.296 -11.488
  Start of MODEL    9
 5975   HG22  THR  49          HG22      THR  49  10.947   2.400 -10.085
  Start of MODEL    9
 5976   HG21  THR  49          HG23      THR  49   9.206   2.619  -9.893
  Start of MODEL    9
 5977    H    THR  49           HN       THR  49   7.464   0.196  -8.841
  Start of MODEL    9
 5978    HA   SER  50           HA       SER  50   8.744  -3.855 -11.591
  Start of MODEL    9
 5979    HB3  SER  50           HB2      SER  50  10.637  -4.741 -12.787
  Start of MODEL    9
 5980    HB2  SER  50           HB3      SER  50  11.622  -3.335 -12.374
  Start of MODEL    9
 5981    HG   SER  50           HG       SER  50   9.295  -3.376 -13.998
  Start of MODEL    9
 5982    H    SER  50           HN       SER  50  10.168  -1.392 -11.824
  Start of MODEL    9
 5983    HA   PHE  51           HA       PHE  51  11.686  -4.256  -8.048
  Start of MODEL    9
 5984    HB3  PHE  51           HB2      PHE  51  13.189  -2.711  -6.943
  Start of MODEL    9
 5985    HB2  PHE  51           HB3      PHE  51  12.424  -1.345  -7.741
  Start of MODEL    9
 5986    HD1  PHE  51           HD1      PHE  51  14.026  -4.574  -8.697
  Start of MODEL    9
 5987    HD2  PHE  51           HD2      PHE  51  13.548  -0.424  -9.506
  Start of MODEL    9
 5988    HE1  PHE  51           HE1      PHE  51  15.644  -4.752 -10.536
  Start of MODEL    9
 5989    HE2  PHE  51           HE2      PHE  51  15.163  -0.600 -11.353
  Start of MODEL    9
 5990    HZ   PHE  51           HZ       PHE  51  16.179  -2.725 -11.897
  Start of MODEL    9
 5991    H    PHE  51           HN       PHE  51  10.701  -1.953  -9.587
  Start of MODEL    9
 5992    HA   ILE  52           HA       ILE  52   8.946  -2.069  -5.063
  Start of MODEL    9
 5993    HB   ILE  52           HB       ILE  52   8.826   0.705  -6.319
  Start of MODEL    9
 5994   HD13  ILE  52          HD11      ILE  52  10.728   2.364  -5.669
  Start of MODEL    9
 5995   HD12  ILE  52          HD12      ILE  52  12.036   1.774  -4.641
  Start of MODEL    9
 5996   HD11  ILE  52          HD13      ILE  52  10.420   2.002  -3.972
  Start of MODEL    9
 5997    H    ILE  52           HN       ILE  52   9.826  -1.254  -7.757
  Start of MODEL    9
 5998    HA   PHE  53           HA       PHE  53   5.073  -1.764  -7.126
  Start of MODEL    9
 5999    HB3  PHE  53           HB2      PHE  53   5.935  -3.320  -8.654
  Start of MODEL    9
 6000    HB2  PHE  53           HB3      PHE  53   4.447  -4.052  -8.069
  Start of MODEL    9
 6001    HD1  PHE  53           HD1      PHE  53   8.046  -4.360  -8.290
  Start of MODEL    9
 6002    HD2  PHE  53           HD2      PHE  53   4.546  -5.971  -6.489
  Start of MODEL    9
 6003    HE1  PHE  53           HE1      PHE  53   9.289  -6.396  -7.715
  Start of MODEL    9
 6004    HE2  PHE  53           HE2      PHE  53   5.787  -8.012  -5.903
  Start of MODEL    9
 6005    HZ   PHE  53           HZ       PHE  53   8.162  -8.227  -6.514
  Start of MODEL    9
 6006    H    PHE  53           HN       PHE  53   6.995  -3.073  -5.373
  Start of MODEL    9
 6007    HA   THR  54           HA       THR  54   2.448  -2.899  -3.910
  Start of MODEL    9
 6008    HB   THR  54           HB       THR  54   0.410  -1.852  -5.889
  Start of MODEL    9
 6009    HG1  THR  54           HG1      THR  54   1.799  -0.273  -5.891
  Start of MODEL    9
 6010   HG22  THR  54          HG21      THR  54  -0.704  -1.063  -3.857
  Start of MODEL    9
 6011   HG21  THR  54          HG22      THR  54   0.615  -1.709  -2.882
  Start of MODEL    9
 6012   HG23  THR  54          HG23      THR  54  -0.433  -2.806  -3.780
  Start of MODEL    9
 6013    H    THR  54           HN       THR  54   2.929  -2.003  -6.592
  Start of MODEL    9
 6014    HA   GLU  55           HA       GLU  55   0.899  -6.661  -5.603
  Start of MODEL    9
 6015    HB3  GLU  55           HB2      GLU  55   1.161  -8.408  -3.798
  Start of MODEL    9
 6016    HB2  GLU  55           HB3      GLU  55   1.964  -7.174  -2.841
  Start of MODEL    9
 6017    HG2  GLU  55           HG2      GLU  55   3.617  -6.920  -4.667
  Start of MODEL    9
 6018    HG3  GLU  55           HG3      GLU  55   3.606  -8.493  -3.861
  Start of MODEL    9
 6019    H    GLU  55           HN       GLU  55   2.066  -4.988  -3.576
  Start of MODEL    9
 6020    HA   PHE  56           HA       PHE  56  -2.789  -6.712  -3.218
  Start of MODEL    9
 6021    HB3  PHE  56           HB2      PHE  56  -4.693  -6.660  -4.846
  Start of MODEL    9
 6022    HB2  PHE  56           HB3      PHE  56  -3.513  -6.698  -6.149
  Start of MODEL    9
 6023    HD1  PHE  56           HD1      PHE  56  -5.003  -4.643  -3.521
  Start of MODEL    9
 6024    HD2  PHE  56           HD2      PHE  56  -2.156  -4.812  -6.671
  Start of MODEL    9
 6025    HE1  PHE  56           HE1      PHE  56  -4.799  -2.194  -3.461
  Start of MODEL    9
 6026    HE2  PHE  56           HE2      PHE  56  -1.944  -2.382  -6.629
  Start of MODEL    9
 6027    HZ   PHE  56           HZ       PHE  56  -3.414  -1.041  -5.042
  Start of MODEL    9
 6028    H    PHE  56           HN       PHE  56  -1.126  -7.399  -5.535
  Start of MODEL    9
 6029    HA   LEU  57           HA       LEU  57  -4.155 -10.706  -4.147
  Start of MODEL    9
 6030    HB3  LEU  57           HB2      LEU  57  -2.639 -11.189  -2.273
  Start of MODEL    9
 6031    HB2  LEU  57           HB3      LEU  57  -4.098 -12.162  -2.173
  Start of MODEL    9
 6032    HG   LEU  57           HG       LEU  57  -4.005  -9.756  -0.515
  Start of MODEL    9
 6033   HD12  LEU  57          HD11      LEU  57  -5.324 -11.220   0.951
  Start of MODEL    9
 6034   HD11  LEU  57          HD12      LEU  57  -5.129 -12.544  -0.197
  Start of MODEL    9
 6035   HD13  LEU  57          HD13      LEU  57  -6.036 -11.106  -0.658
  Start of MODEL    9
 6036   HD23  LEU  57          HD21      LEU  57  -2.585 -12.340   0.084
  Start of MODEL    9
 6037   HD22  LEU  57          HD22      LEU  57  -2.894 -11.050   1.250
  Start of MODEL    9
 6038   HD21  LEU  57          HD23      LEU  57  -1.836 -10.757  -0.131
  Start of MODEL    9
 6039    H    LEU  57           HN       LEU  57  -4.147  -8.312  -2.536
  Start of MODEL    9
 6040    HA   GLU  58           HA       GLU  58  -8.313 -10.997  -4.308
  Start of MODEL    9
 6041    HB3  GLU  58           HB2      GLU  58  -9.554 -12.919  -3.194
  Start of MODEL    9
 6042    HB2  GLU  58           HB3      GLU  58  -7.984 -13.447  -2.624
  Start of MODEL    9
 6043    HG2  GLU  58           HG2      GLU  58  -8.810 -13.107  -5.489
  Start of MODEL    9
 6044    HG3  GLU  58           HG3      GLU  58  -7.207 -13.594  -4.957
  Start of MODEL    9
 6045    H    GLU  58           HN       GLU  58  -6.032 -12.203  -3.397
  Start of MODEL    9
 6046    HA   PRO  59           HA       PRO  59 -10.040  -9.097  -0.659
  Start of MODEL    9
 6047    HB3  PRO  59           HB2      PRO  59 -10.198  -7.094  -1.831
  Start of MODEL    9
 6048    HB2  PRO  59           HB3      PRO  59 -11.881  -7.593  -1.984
  Start of MODEL    9
 6049    HG2  PRO  59           HG2      PRO  59 -11.638  -8.128  -4.186
  Start of MODEL    9
 6050    HG3  PRO  59           HG3      PRO  59 -10.179  -7.130  -4.110
  Start of MODEL    9
 6051    HD2  PRO  59           HD2      PRO  59 -10.338  -9.941  -4.580
  Start of MODEL    9
 6052    HD3  PRO  59           HD3      PRO  59  -8.875  -8.957  -4.372
  Start of MODEL    9
 6053    HA   ALA  60           HA       ALA  60 -13.440 -11.910  -0.929
  Start of MODEL    9
 6054    HB1  ALA  60           HB1      ALA  60 -12.900 -11.424   2.004
  Start of MODEL    9
 6055    HB3  ALA  60           HB2      ALA  60 -12.308 -12.777   1.032
  Start of MODEL    9
 6056    HB2  ALA  60           HB3      ALA  60 -14.027 -12.623   1.382
  Start of MODEL    9
 6057    H    ALA  60           HN       ALA  60 -11.605 -10.146   0.474
  Start of MODEL    9
 6058    HA   ALA  61           HA       ALA  61 -16.571  -8.903  -0.722
  Start of MODEL    9
 6059    HB3  ALA  61           HB1      ALA  61 -17.403 -10.414  -2.463
  Start of MODEL    9
 6060    HB2  ALA  61           HB2      ALA  61 -18.728  -9.821  -1.459
  Start of MODEL    9
 6061    HB1  ALA  61           HB3      ALA  61 -18.106 -11.453  -1.230
  Start of MODEL    9
 6062    H    ALA  61           HN       ALA  61 -15.641 -11.591  -0.961
  Start of MODEL    9
 6063    HA   ASN  62           HA       ASN  62 -18.310 -10.838   3.278
  Start of MODEL    9
 6064    HB3  ASN  62           HB2      ASN  62 -15.873 -12.626   3.255
  Start of MODEL    9
 6065    HB2  ASN  62           HB3      ASN  62 -17.557 -13.107   3.195
  Start of MODEL    9
 6066   HD21  ASN  62          HD21      ASN  62 -14.906 -12.357   5.219
  Start of MODEL    9
 6067   HD22  ASN  62          HD22      ASN  62 -15.710 -12.629   6.711
  Start of MODEL    9
 6068    H    ASN  62           HN       ASN  62 -16.338 -11.519   1.318
  Start of MODEL    9
 6069    HA   GLU  63           HA       GLU  63 -15.032  -8.122   4.936
  Start of MODEL    9
 6070    HB3  GLU  63           HB2      GLU  63 -12.655  -7.850   4.267
  Start of MODEL    9
 6071    HB2  GLU  63           HB3      GLU  63 -12.954  -8.854   2.861
  Start of MODEL    9
 6072    HG2  GLU  63           HG2      GLU  63 -13.097  -9.730   5.729
  Start of MODEL    9
 6073    HG3  GLU  63           HG3      GLU  63 -13.487 -10.741   4.339
  Start of MODEL    9
 6074    H    GLU  63           HN       GLU  63 -15.342  -9.514   2.374
  Start of MODEL    9
 6075    HA   THR  64           HA       THR  64 -14.890  -4.835   1.972
  Start of MODEL    9
 6076    HB   THR  64           HB       THR  64 -15.032  -2.614   3.338
  Start of MODEL    9
 6077    HG1  THR  64           HG1      THR  64 -14.755  -2.893   5.417
  Start of MODEL    9
 6078   HG22  THR  64          HG21      THR  64 -17.426  -2.986   3.804
  Start of MODEL    9
 6079   HG21  THR  64          HG22      THR  64 -17.187  -4.722   3.604
  Start of MODEL    9
 6080   HG23  THR  64          HG23      THR  64 -16.967  -3.639   2.231
  Start of MODEL    9
 6081    H    THR  64           HN       THR  64 -14.365  -5.884   4.650
  Start of MODEL    9
 6082    HA   VAL  65           HA       VAL  65 -10.630  -3.766   3.431
  Start of MODEL    9
 6083    HB   VAL  65           HB       VAL  65 -10.129  -6.579   4.435
  Start of MODEL    9
 6084    H    VAL  65           HN       VAL  65 -12.521  -5.984   3.548
  Start of MODEL    9
 6085    HA   ARG  66           HA       ARG  66  -8.975  -5.685  -0.147
  Start of MODEL    9
 6086    HB3  ARG  66           HB2      ARG  66  -7.722  -4.014  -1.415
  Start of MODEL    9
 6087    HB2  ARG  66           HB3      ARG  66  -7.674  -2.943  -0.032
  Start of MODEL    9
 6088    HG2  ARG  66           HG2      ARG  66 -10.133  -3.732  -1.594
  Start of MODEL    9
 6089    HG3  ARG  66           HG3      ARG  66 -10.120  -2.687  -0.173
  Start of MODEL    9
 6090    HD2  ARG  66           HD2      ARG  66 -10.206  -1.345  -2.203
  Start of MODEL    9
 6091    HD3  ARG  66           HD3      ARG  66  -8.662  -1.103  -1.383
  Start of MODEL    9
 6092    HE   ARG  66           HE       ARG  66  -8.435  -3.166  -3.254
  Start of MODEL    9
 6093   HH11  ARG  66          HH11      ARG  66  -8.638   0.402  -3.177
  Start of MODEL    9
 6094   HH12  ARG  66          HH12      ARG  66  -7.927   0.575  -4.696
  Start of MODEL    9
 6095   HH21  ARG  66          HH21      ARG  66  -7.483  -2.847  -5.366
  Start of MODEL    9
 6096   HH22  ARG  66          HH22      ARG  66  -7.256  -1.283  -5.962
  Start of MODEL    9
 6097    H    ARG  66           HN       ARG  66  -9.270  -3.593   1.872
  Start of MODEL    9
 6098    HA   HIS  67           HA       HIS  67  -5.246  -6.485   1.976
  Start of MODEL    9
 6099    HB3  HIS  67           HB2      HIS  67  -4.888  -8.855   1.858
  Start of MODEL    9
 6100    HB2  HIS  67           HB3      HIS  67  -5.689  -8.946   0.294
  Start of MODEL    9
 6101    HD1  HIS  67           HD1      HIS  67  -7.964  -9.862   0.339
  Start of MODEL    9
 6102    HD2  HIS  67           HD2      HIS  67  -6.899  -8.086   3.937
  Start of MODEL    9
 6103    HE1  HIS  67           HE1      HIS  67  -9.946 -10.124   1.808
  Start of MODEL    9
 6104    HE2  HIS  67           HE2      HIS  67  -9.280  -9.234   4.017
  Start of MODEL    9
 6105    H    HIS  67           HN       HIS  67  -6.953  -6.687  -0.434
  Start of MODEL    9
 6106    HA2  GLY  68           HA2      GLY  68  -1.867  -7.127  -0.783
  Start of MODEL    9
 6107    H    GLY  68           HN       GLY  68  -3.077  -6.204   1.577
  Start of MODEL    9
 6108    HA3  GLY  68           HA1      GLY  68  -2.228  -5.416  -0.918
  Start of MODEL    9
 6109    HA   CYS  69           HA       CYS  69   1.479  -4.819   1.210
  Start of MODEL    9
 6110    HB3  CYS  69           HB2      CYS  69   2.176  -7.473  -0.031
  Start of MODEL    9
 6111    HB2  CYS  69           HB3      CYS  69   1.946  -7.084   1.670
  Start of MODEL    9
 6112    H    CYS  69           HN       CYS  69   0.199  -5.805  -1.179
  Start of MODEL    9
 6113    HA   LEU  70           HA       LEU  70   3.666  -3.032  -2.147
  Start of MODEL    9
 6114    HB3  LEU  70           HB2      LEU  70   4.714  -1.574   0.291
  Start of MODEL    9
 6115    HB2  LEU  70           HB3      LEU  70   3.315  -1.065  -0.630
  Start of MODEL    9
 6116    HG   LEU  70           HG       LEU  70   6.120  -1.231  -1.734
  Start of MODEL    9
 6117   HD11  LEU  70          HD11      LEU  70   3.602  -0.037  -2.851
  Start of MODEL    9
 6118   HD13  LEU  70          HD12      LEU  70   4.461  -1.454  -3.470
  Start of MODEL    9
 6119   HD12  LEU  70          HD13      LEU  70   5.210   0.144  -3.540
  Start of MODEL    9
 6120   HD21  LEU  70          HD21      LEU  70   6.004   0.482  -0.020
  Start of MODEL    9
 6121   HD23  LEU  70          HD22      LEU  70   4.560   1.156  -0.784
  Start of MODEL    9
 6122   HD22  LEU  70          HD23      LEU  70   6.107   1.204  -1.626
  Start of MODEL    9
 6123    H    LEU  70           HN       LEU  70   3.023  -3.384   0.666
  Start of MODEL    9
 6124    HA   ARG  71           HA       ARG  71   7.184  -5.407  -1.115
  Start of MODEL    9
 6125    HB3  ARG  71           HB2      ARG  71   7.647  -7.082  -2.934
  Start of MODEL    9
 6126    HB2  ARG  71           HB3      ARG  71   6.215  -6.484  -3.745
  Start of MODEL    9
 6127    HG2  ARG  71           HG2      ARG  71   6.183  -7.637  -0.975
  Start of MODEL    9
 6128    HG3  ARG  71           HG3      ARG  71   4.803  -7.220  -1.986
  Start of MODEL    9
 6129    HD2  ARG  71           HD2      ARG  71   5.471  -8.922  -3.631
  Start of MODEL    9
 6130    HD3  ARG  71           HD3      ARG  71   6.878  -9.289  -2.657
  Start of MODEL    9
 6131    HE   ARG  71           HE       ARG  71   5.101  -9.802  -0.867
  Start of MODEL    9
 6132   HH11  ARG  71          HH11      ARG  71   4.841 -10.613  -4.327
  Start of MODEL    9
 6133   HH12  ARG  71          HH12      ARG  71   3.870 -11.978  -4.072
  Start of MODEL    9
 6134   HH21  ARG  71          HH21      ARG  71   3.839 -11.682  -0.528
  Start of MODEL    9
 6135   HH22  ARG  71          HH22      ARG  71   3.290 -12.625  -1.844
  Start of MODEL    9
 6136    H    ARG  71           HN       ARG  71   5.178  -4.355  -2.960
  Start of MODEL    9
 6137    HA   LEU  72           HA       LEU  72  10.086  -3.760  -3.796
  Start of MODEL    9
 6138    HB3  LEU  72           HB2      LEU  72  11.933  -2.725  -2.576
  Start of MODEL    9
 6139    HB2  LEU  72           HB3      LEU  72  11.424  -3.405  -1.064
  Start of MODEL    9
 6140    HG   LEU  72           HG       LEU  72   9.617  -1.611  -2.642
  Start of MODEL    9
 6141   HD12  LEU  72          HD11      LEU  72   8.713  -0.953  -0.468
  Start of MODEL    9
 6142   HD11  LEU  72          HD12      LEU  72   9.824  -2.073   0.319
  Start of MODEL    9
 6143   HD13  LEU  72          HD13      LEU  72   8.578  -2.687  -0.772
  Start of MODEL    9
 6144   HD23  LEU  72          HD21      LEU  72  11.705  -0.601  -0.727
  Start of MODEL    9
 6145   HD22  LEU  72          HD22      LEU  72  10.463   0.350  -1.586
  Start of MODEL    9
 6146   HD21  LEU  72          HD23      LEU  72  11.747  -0.438  -2.486
  Start of MODEL    9
 6147    H    LEU  72           HN       LEU  72   9.189  -4.958  -1.303
  Start of MODEL    9
 6148    HA   ASN  73           HA       ASN  73  11.714  -7.739  -4.332
  Start of MODEL    9
 6149    HB3  ASN  73           HB2      ASN  73  12.508  -6.017  -6.691
  Start of MODEL    9
 6150    HB2  ASN  73           HB3      ASN  73  11.055  -6.999  -6.573
  Start of MODEL    9
 6151   HD21  ASN  73          HD21      ASN  73  13.209  -7.083  -8.530
  Start of MODEL    9
 6152   HD22  ASN  73          HD22      ASN  73  13.812  -8.691  -8.477
  Start of MODEL    9
 6153    H    ASN  73           HN       ASN  73  10.947  -5.113  -4.949
  Start of MODEL    9
 6154    HA   GLN  74           HA       GLN  74  15.837  -6.214  -3.421
  Start of MODEL    9
 6155    HB3  GLN  74           HB2      GLN  74  16.322  -5.767  -5.813
  Start of MODEL    9
 6156    HB2  GLN  74           HB3      GLN  74  17.400  -4.878  -4.752
  Start of MODEL    9
 6157    HG2  GLN  74           HG2      GLN  74  15.026  -3.752  -6.222
  Start of MODEL    9
 6158    HG3  GLN  74           HG3      GLN  74  16.049  -2.850  -5.107
  Start of MODEL    9
 6159   HE21  GLN  74          HE21      GLN  74  16.717  -1.402  -6.672
  Start of MODEL    9
 6160   HE22  GLN  74          HE22      GLN  74  17.797  -1.850  -7.940
  Start of MODEL    9
 6161    H    GLN  74           HN       GLN  74  13.573  -4.803  -4.588
  Start of MODEL    9
 6162    HA   PRO  75           HA       PRO  75  15.242  -2.922  -0.539
  Start of MODEL    9
 6163    HB3  PRO  75           HB2      PRO  75  16.126  -4.304   1.102
  Start of MODEL    9
 6164    HB2  PRO  75           HB3      PRO  75  17.526  -3.244   0.928
  Start of MODEL    9
 6165    HG2  PRO  75           HG2      PRO  75  18.680  -4.758  -0.357
  Start of MODEL    9
 6166    HG3  PRO  75           HG3      PRO  75  17.696  -5.908   0.561
  Start of MODEL    9
 6167    HD2  PRO  75           HD2      PRO  75  17.703  -5.729  -2.182
  Start of MODEL    9
 6168    HD3  PRO  75           HD3      PRO  75  16.345  -6.359  -1.229
  Start of MODEL    9
 6169    HA   THR  76           HA       THR  76  18.223  -0.121  -2.209
  Start of MODEL    9
 6170    HB   THR  76           HB       THR  76  16.917   1.909  -2.944
  Start of MODEL    9
 6171    HG1  THR  76           HG1      THR  76  15.308   1.185  -1.100
  Start of MODEL    9
 6172   HG23  THR  76          HG21      THR  76  17.143  -0.034  -4.449
  Start of MODEL    9
 6173   HG22  THR  76          HG22      THR  76  15.556   0.717  -4.622
  Start of MODEL    9
 6174   HG21  THR  76          HG23      THR  76  15.730  -0.775  -3.700
  Start of MODEL    9
 6175    H    THR  76           HN       THR  76  15.716  -0.822  -0.819
  Start of MODEL    9
 6176    HA   HIS  77           HA       HIS  77  18.997   2.041   1.459
  Start of MODEL    9
 6177    HB3  HIS  77           HB2      HIS  77  21.309   1.631   0.677
  Start of MODEL    9
 6178    HB2  HIS  77           HB3      HIS  77  21.161   3.163   1.516
  Start of MODEL    9
 6179    HD1  HIS  77           HD1      HIS  77  22.426   5.035   0.399
  Start of MODEL    9
 6180    HD2  HIS  77           HD2      HIS  77  21.078   2.187  -2.271
  Start of MODEL    9
 6181    HE1  HIS  77           HE1      HIS  77  23.383   5.707  -1.805
  Start of MODEL    9
 6182    HE2  HIS  77           HE2      HIS  77  22.329   4.124  -3.445
  Start of MODEL    9
 6183    H    HIS  77           HN       HIS  77  19.451   1.454  -1.307
  Start of MODEL    9
 6184    HA   VAL  78           HA       VAL  78  18.167   6.123  -0.086
  Start of MODEL    9
 6185    HB   VAL  78           HB       VAL  78  16.923   7.092  -2.051
  Start of MODEL    9
 6186    H    VAL  78           HN       VAL  78  18.072   3.636  -1.360
  Start of MODEL    9
 6187    HA   ASN  79           HA       ASN  79  13.707   5.311   0.104
  Start of MODEL    9
 6188    HB3  ASN  79           HB2      ASN  79  12.416   3.004   0.486
  Start of MODEL    9
 6189    HB2  ASN  79           HB3      ASN  79  13.894   2.399  -0.249
  Start of MODEL    9
 6190   HD21  ASN  79          HD21      ASN  79  14.275   2.819  -2.387
  Start of MODEL    9
 6191   HD22  ASN  79          HD22      ASN  79  13.116   3.573  -3.437
  Start of MODEL    9
 6192    H    ASN  79           HN       ASN  79  15.994   3.582   0.200
  Start of MODEL    9
 6193    HA   ASN  80           HA       ASN  80  13.837   4.456   4.593
  Start of MODEL    9
 6194    HB3  ASN  80           HB2      ASN  80  15.305   5.860   6.048
  Start of MODEL    9
 6195    HB2  ASN  80           HB3      ASN  80  16.116   6.452   4.614
  Start of MODEL    9
 6196   HD21  ASN  80          HD21      ASN  80  18.009   5.786   5.515
  Start of MODEL    9
 6197   HD22  ASN  80          HD22      ASN  80  18.530   4.148   5.445
  Start of MODEL    9
 6198    H    ASN  80           HN       ASN  80  15.445   5.448   2.381
  Start of MODEL    9
 6199    HA2  GLY  81           HA2      GLY  81  11.679   8.223   4.775
  Start of MODEL    9
 6200    H    GLY  81           HN       GLY  81  11.886   5.481   3.760
  Start of MODEL    9
 6201    HA3  GLY  81           HA1      GLY  81  11.184   7.913   3.116
  Start of MODEL    9
 6202    HA   ASN  82           HA       ASN  82   7.705   6.985   5.764
  Start of MODEL    9
 6203    HB3  ASN  82           HB2      ASN  82   7.150   9.860   5.030
  Start of MODEL    9
 6204    HB2  ASN  82           HB3      ASN  82   7.779   9.291   6.571
  Start of MODEL    9
 6205   HD21  ASN  82          HD21      ASN  82   5.399  10.797   6.045
  Start of MODEL    9
 6206   HD22  ASN  82          HD22      ASN  82   4.071   9.893   6.661
  Start of MODEL    9
 6207    H    ASN  82           HN       ASN  82   9.265   8.897   4.221
  Start of MODEL    9
 6208    HA   TYR  83           HA       TYR  83   5.540   6.233   2.029
  Start of MODEL    9
 6209    HB3  TYR  83           HB2      TYR  83   4.649   3.859   2.134
  Start of MODEL    9
 6210    HB2  TYR  83           HB3      TYR  83   5.494   3.686   3.661
  Start of MODEL    9
 6211    HD1  TYR  83           HD1      TYR  83   5.893   3.987   0.033
  Start of MODEL    9
 6212    HD2  TYR  83           HD2      TYR  83   7.922   3.437   3.738
  Start of MODEL    9
 6213    HE1  TYR  83           HE1      TYR  83   7.913   3.253  -1.173
  Start of MODEL    9
 6214    HE2  TYR  83           HE2      TYR  83   9.942   2.716   2.499
  Start of MODEL    9
 6215    HH   TYR  83           HH       TYR  83  10.387   3.177  -0.731
  Start of MODEL    9
 6216    H    TYR  83           HN       TYR  83   6.593   5.551   4.627
  Start of MODEL    9
 6217    HA   THR  84           HA       THR  84   1.820   7.066   4.157
  Start of MODEL    9
 6218    HB   THR  84           HB       THR  84   2.114   9.244   2.085
  Start of MODEL    9
 6219    HG1  THR  84           HG1      THR  84   3.589   8.701   4.208
  Start of MODEL    9
 6220   HG23  THR  84          HG21      THR  84  -0.139   9.062   3.050
  Start of MODEL    9
 6221   HG22  THR  84          HG22      THR  84   0.665  10.528   3.623
  Start of MODEL    9
 6222   HG21  THR  84          HG23      THR  84   0.544   9.116   4.676
  Start of MODEL    9
 6223    H    THR  84           HN       THR  84   3.809   7.407   2.050
  Start of MODEL    9
 6224    HA   LEU  85           HA       LEU  85  -0.417   5.389   0.786
  Start of MODEL    9
 6225    HB3  LEU  85           HB2      LEU  85  -1.487   3.980   3.244
  Start of MODEL    9
 6226    HB2  LEU  85           HB3      LEU  85  -0.193   3.403   2.212
  Start of MODEL    9
 6227    HG   LEU  85           HG       LEU  85  -3.080   3.715   1.399
  Start of MODEL    9
 6228   HD12  LEU  85          HD11      LEU  85  -2.364   2.512  -0.605
  Start of MODEL    9
 6229   HD11  LEU  85          HD12      LEU  85  -0.683   2.658  -0.036
  Start of MODEL    9
 6230   HD13  LEU  85          HD13      LEU  85  -1.612   4.109  -0.448
  Start of MODEL    9
 6231   HD21  LEU  85          HD21      LEU  85  -2.664   1.896   2.967
  Start of MODEL    9
 6232   HD23  LEU  85          HD22      LEU  85  -1.431   1.246   1.878
  Start of MODEL    9
 6233   HD22  LEU  85          HD23      LEU  85  -3.123   1.324   1.366
  Start of MODEL    9
 6234    H    LEU  85           HN       LEU  85   0.167   5.815   3.605
  Start of MODEL    9
 6235    HA   LEU  86           HA       LEU  86  -3.916   7.906   1.523
  Start of MODEL    9
 6236    HB3  LEU  86           HB2      LEU  86  -4.299   9.290  -0.513
  Start of MODEL    9
 6237    HB2  LEU  86           HB3      LEU  86  -3.018   8.433  -1.324
  Start of MODEL    9
 6238    HG   LEU  86           HG       LEU  86  -2.443  10.721  -0.575
  Start of MODEL    9
 6239   HD12  LEU  86          HD11      LEU  86  -1.917  11.151   1.737
  Start of MODEL    9
 6240   HD11  LEU  86          HD12      LEU  86  -2.550   9.572   2.176
  Start of MODEL    9
 6241   HD13  LEU  86          HD13      LEU  86  -3.630  10.797   1.499
  Start of MODEL    9
 6242   HD22  LEU  86          HD21      LEU  86  -0.231  10.183   0.307
  Start of MODEL    9
 6243   HD21  LEU  86          HD22      LEU  86  -0.672   9.127  -1.040
  Start of MODEL    9
 6244   HD23  LEU  86          HD23      LEU  86  -0.759   8.534   0.619
  Start of MODEL    9
 6245    H    LEU  86           HN       LEU  86  -1.889   6.566  -0.114
  Start of MODEL    9
 6246    HA   ALA  87           HA       ALA  87  -6.761   5.813  -1.094
  Start of MODEL    9
 6247    HB2  ALA  87           HB1      ALA  87  -8.174   4.386   0.316
  Start of MODEL    9
 6248    HB1  ALA  87           HB2      ALA  87  -7.602   5.239   1.743
  Start of MODEL    9
 6249    HB3  ALA  87           HB3      ALA  87  -6.481   4.264   0.797
  Start of MODEL    9
 6250    H    ALA  87           HN       ALA  87  -5.997   7.359   1.272
  Start of MODEL    9
 6251    HA   ALA  88           HA       ALA  88 -10.133   8.502  -0.433
  Start of MODEL    9
 6252    HB1  ALA  88           HB1      ALA  88  -8.986   9.250  -3.122
  Start of MODEL    9
 6253    HB3  ALA  88           HB2      ALA  88  -8.512   9.943  -1.569
  Start of MODEL    9
 6254    HB2  ALA  88           HB3      ALA  88 -10.144  10.193  -2.183
  Start of MODEL    9
 6255    H    ALA  88           HN       ALA  88  -8.336   6.869  -2.073
  Start of MODEL    9
 6256    HA   ASN  89           HA       ASN  89 -13.106   7.248  -3.397
  Start of MODEL    9
 6257    HB3  ASN  89           HB2      ASN  89 -12.911   5.179  -2.026
  Start of MODEL    9
 6258    HB2  ASN  89           HB3      ASN  89 -14.579   5.497  -2.407
  Start of MODEL    9
 6259   HD21  ASN  89          HD21      ASN  89 -13.740   3.782  -0.446
  Start of MODEL    9
 6260   HD22  ASN  89          HD22      ASN  89 -14.247   4.366   1.096
  Start of MODEL    9
 6261    H    ASN  89           HN       ASN  89 -12.220   8.289  -0.864
  Start of MODEL    9
 6262    HA   PRO  90           HA       PRO  90 -16.504  10.088  -3.215
  Start of MODEL    9
 6263    HB3  PRO  90           HB2      PRO  90 -18.626   9.179  -3.553
  Start of MODEL    9
 6264    HB2  PRO  90           HB3      PRO  90 -18.324   7.832  -2.447
  Start of MODEL    9
 6265    HG2  PRO  90           HG2      PRO  90 -17.936   6.868  -4.571
  Start of MODEL    9
 6266    HG3  PRO  90           HG3      PRO  90 -17.153   8.338  -5.177
  Start of MODEL    9
 6267    HD2  PRO  90           HD2      PRO  90 -16.096   6.231  -3.371
  Start of MODEL    9
 6268    HD3  PRO  90           HD3      PRO  90 -15.237   7.177  -4.606
  Start of MODEL    9
 6269    HA   CYS  91           HA       CYS  91 -17.971   9.719   1.198
  Start of MODEL    9
 6270    HB3  CYS  91           HB2      CYS  91 -16.264   7.392   2.124
  Start of MODEL    9
 6271    HB2  CYS  91           HB3      CYS  91 -17.993   7.343   1.781
  Start of MODEL    9
 6272    H    CYS  91           HN       CYS  91 -16.390   7.924  -0.388
  Start of MODEL    9
 6273    HA2  GLY  92           HA2      GLY  92 -13.776  11.627   1.713
  Start of MODEL    9
 6274    H    GLY  92           HN       GLY  92 -14.453   9.019   1.007
  Start of MODEL    9
 6275    HA3  GLY  92           HA1      GLY  92 -13.745  10.634   3.165
  Start of MODEL    9
 6276    HA   GLN  93           HA       GLN  93  -9.939   9.402   1.492
  Start of MODEL    9
 6277    HB3  GLN  93           HB2      GLN  93  -9.211  12.257   2.169
  Start of MODEL    9
 6278    HB2  GLN  93           HB3      GLN  93  -9.656  11.659   0.578
  Start of MODEL    9
 6279    HG2  GLN  93           HG2      GLN  93  -7.219  10.827   2.148
  Start of MODEL    9
 6280    HG3  GLN  93           HG3      GLN  93  -7.665  10.240   0.549
  Start of MODEL    9
 6281   HE21  GLN  93          HE21      GLN  93  -5.288  11.678   1.467
  Start of MODEL    9
 6282   HE22  GLN  93          HE22      GLN  93  -5.185  13.081   0.482
  Start of MODEL    9
 6283    H    GLN  93           HN       GLN  93 -11.474  11.230   3.159
  Start of MODEL    9
 6284    HA   ALA  94           HA       ALA  94  -8.079   8.858   5.407
  Start of MODEL    9
 6285    HB1  ALA  94           HB1      ALA  94  -8.385   6.206   4.041
  Start of MODEL    9
 6286    HB3  ALA  94           HB2      ALA  94  -9.411   6.846   5.339
  Start of MODEL    9
 6287    HB2  ALA  94           HB3      ALA  94  -7.728   6.387   5.649
  Start of MODEL    9
 6288    H    ALA  94           HN       ALA  94  -8.646   8.187   2.603
  Start of MODEL    9
 6289    HA   SER  95           HA       SER  95  -4.094   7.314   4.145
  Start of MODEL    9
 6290    HB3  SER  95           HB2      SER  95  -4.042   9.660   3.709
  Start of MODEL    9
 6291    HB2  SER  95           HB3      SER  95  -2.595   9.268   4.645
  Start of MODEL    9
 6292    HG   SER  95           HG       SER  95  -4.997  10.442   5.523
  Start of MODEL    9
 6293    H    SER  95           HN       SER  95  -5.978   8.147   6.126
  Start of MODEL    9
 6294    HA   ALA  96           HA       ALA  96  -1.891   6.744   7.961
  Start of MODEL    9
 6295    HB2  ALA  96           HB1      ALA  96  -1.332   4.332   8.061
  Start of MODEL    9
 6296    HB1  ALA  96           HB2      ALA  96  -1.800   4.167   6.369
  Start of MODEL    9
 6297    HB3  ALA  96           HB3      ALA  96  -3.009   4.589   7.584
  Start of MODEL    9
 6298    H    ALA  96           HN       ALA  96  -2.189   6.599   5.075
  Start of MODEL    9
 6299    HA   SER  97           HA       SER  97   2.159   6.568   6.243
  Start of MODEL    9
 6300    HB3  SER  97           HB2      SER  97   3.368   8.291   7.483
  Start of MODEL    9
 6301    HB2  SER  97           HB3      SER  97   2.223   8.143   8.821
  Start of MODEL    9
 6302    HG   SER  97           HG       SER  97   0.862   8.449   6.594
  Start of MODEL    9
 6303    H    SER  97           HN       SER  97   0.387   6.206   8.525
  Start of MODEL    9
 6304    HA   ILE  98           HA       ILE  98   4.647   4.135   8.866
  Start of MODEL    9
 6305    HB   ILE  98           HB       ILE  98   3.165   2.465   7.703
  Start of MODEL    9
 6306   HD12  ILE  98          HD11      ILE  98   6.870   0.407   8.340
  Start of MODEL    9
 6307   HD11  ILE  98          HD12      ILE  98   6.999   2.106   7.875
  Start of MODEL    9
 6308   HD13  ILE  98          HD13      ILE  98   6.452   0.907   6.700
  Start of MODEL    9
 6309    H    ILE  98           HN       ILE  98   3.784   5.168   6.288
  Start of MODEL    9
 6310    HA   MET  99           HA       MET  99   8.266   5.227   6.756
  Start of MODEL    9
 6311    HB3  MET  99           HB2      MET  99   8.871   5.894   9.641
  Start of MODEL    9
 6312    HB2  MET  99           HB3      MET  99   8.300   7.015   8.409
  Start of MODEL    9
 6313    HG2  MET  99           HG2      MET  99  10.948   5.568   8.474
  Start of MODEL    9
 6314    HG3  MET  99           HG3      MET  99  10.389   6.542   7.123
  Start of MODEL    9
 6315    HE1  MET  99           HE1      MET  99   8.942   8.986   8.669
  Start of MODEL    9
 6316    HE3  MET  99           HE2      MET  99   9.977   9.111   7.249
  Start of MODEL    9
 6317    HE2  MET  99           HE3      MET  99  10.301  10.117   8.656
  Start of MODEL    9
 6318    H    MET  99           HN       MET  99   6.690   4.682   9.141
  Start of MODEL    9
 6319    HA   ALA 100           HA       ALA 100  10.332   1.629   7.817
  Start of MODEL    9
 6320    HB2  ALA 100           HB1      ALA 100  10.596   0.239   5.816
  Start of MODEL    9
 6321    HB1  ALA 100           HB2      ALA 100  10.054   1.590   4.819
  Start of MODEL    9
 6322    HB3  ALA 100           HB3      ALA 100   8.947   0.846   5.970
  Start of MODEL    9
 6323    H    ALA 100           HN       ALA 100   9.447   3.721   5.996
  Start of MODEL    9
 6324    HA   ALA 101           HA       ALA 101  14.308   2.766   6.443
  Start of MODEL    9
 6325    HB3  ALA 101           HB1      ALA 101  14.139   3.432   8.787
  Start of MODEL    9
 6326    HB2  ALA 101           HB2      ALA 101  15.708   2.706   8.452
  Start of MODEL    9
 6327    HB1  ALA 101           HB3      ALA 101  14.465   1.776   9.294
  Start of MODEL    9
 6328    H    ALA 101           HN       ALA 101  12.427   1.019   7.813
  Start of MODEL    9
 6329    HA   PHE 102           HA       PHE 102  16.656  -0.869   5.997
  Start of MODEL    9
 6330    HB3  PHE 102           HB2      PHE 102  14.729  -1.916   5.105
  Start of MODEL    9
 6331    HB2  PHE 102           HB3      PHE 102  15.908  -1.954   3.792
  Start of MODEL    9
 6332    HD1  PHE 102           HD1      PHE 102  12.877  -0.166   4.900
  Start of MODEL    9
 6333    HD2  PHE 102           HD2      PHE 102  15.507  -1.119   1.697
  Start of MODEL    9
 6334    HE1  PHE 102           HE1      PHE 102  11.264   0.770   3.299
  Start of MODEL    9
 6335    HE2  PHE 102           HE2      PHE 102  13.903  -0.176   0.098
  Start of MODEL    9
 6336    HZ   PHE 102           HZ       PHE 102  11.778   0.772   0.905
  Start of MODEL    9
 6337    H    PHE 102           HN       PHE 102  15.643   1.659   5.265
  Start of MODEL    9
 6338    HA   MET 103           HA       MET 103  19.187   1.123   3.155
  Start of MODEL    9
 6339    HB3  MET 103           HB2      MET 103  19.337   3.133   4.403
  Start of MODEL    9
 6340    HB2  MET 103           HB3      MET 103  20.975   2.610   4.057
  Start of MODEL    9
 6341    HG2  MET 103           HG2      MET 103  19.579   2.231   6.685
  Start of MODEL    9
 6342    HG3  MET 103           HG3      MET 103  21.237   1.766   6.303
  Start of MODEL    9
 6343    HE3  MET 103           HE1      MET 103  20.430   3.525   8.815
  Start of MODEL    9
 6344    HE2  MET 103           HE2      MET 103  21.719   4.726   8.775
  Start of MODEL    9
 6345    HE1  MET 103           HE3      MET 103  22.076   3.040   8.421
  Start of MODEL    9
 6346    H    MET 103           HN       MET 103  18.440   0.585   5.906
  Start of MODEL    9
 6347    HA   ASP 104           HA       ASP 104  22.061  -2.053   3.691
  Start of MODEL    9
 6348    HB3  ASP 104           HB2      ASP 104  20.449  -2.635   1.199
  Start of MODEL    9
 6349    HB2  ASP 104           HB3      ASP 104  20.207  -3.377   2.776
  Start of MODEL    9
 6350    H    ASP 104           HN       ASP 104  19.895  -0.596   2.396
  Start of MODEL    9
 6351    HA   ASN 105           HA       ASN 105  24.449   0.045   0.720
  Start of MODEL    9
 6352    HB3  ASN 105           HB2      ASN 105  26.421  -0.703   2.896
  Start of MODEL    9
 6353    HB2  ASN 105           HB3      ASN 105  25.490   0.790   2.839
  Start of MODEL    9
 6354   HD21  ASN 105          HD21      ASN 105  26.069   2.401   1.359
  Start of MODEL    9
 6355   HD22  ASN 105          HD22      ASN 105  27.587   2.378   0.548
  Start of MODEL    9
 6356    H    ASN 105           HN       ASN 105  24.099  -1.684   3.049
  Start of MODEL    9
 6357    HA   PRO 106           HA       PRO 106  25.495  -3.734  -1.507
  Start of MODEL    9
 6358    HB3  PRO 106           HB2      PRO 106  25.386  -3.061  -3.721
  Start of MODEL    9
 6359    HB2  PRO 106           HB3      PRO 106  26.444  -1.672  -3.441
  Start of MODEL    9
 6360    HG2  PRO 106           HG2      PRO 106  24.369  -0.621  -3.628
  Start of MODEL    9
 6361    HG3  PRO 106           HG3      PRO 106  23.522  -1.979  -2.868
  Start of MODEL    9
 6362    HD2  PRO 106           HD2      PRO 106  25.151   0.181  -1.595
  Start of MODEL    9
 6363    HD3  PRO 106           HD3      PRO 106  23.636  -0.569  -1.053
  Start of MODEL    9
 6364    HA   PHE 107           HA       PHE 107  29.411  -5.507  -1.331
  Start of MODEL    9
 6365    HB3  PHE 107           HB2      PHE 107  31.326  -3.958  -1.894
  Start of MODEL    9
 6366    HB2  PHE 107           HB3      PHE 107  30.154  -2.673  -2.127
  Start of MODEL    9
 6367    HD1  PHE 107           HD1      PHE 107  28.806  -2.554  -4.082
  Start of MODEL    9
 6368    HD2  PHE 107           HD2      PHE 107  31.394  -5.869  -3.456
  Start of MODEL    9
 6369    HE1  PHE 107           HE1      PHE 107  28.490  -3.243  -6.421
  Start of MODEL    9
 6370    HE2  PHE 107           HE2      PHE 107  31.079  -6.561  -5.790
  Start of MODEL    9
 6371    HZ   PHE 107           HZ       PHE 107  29.650  -5.256  -7.276
  Start of MODEL    9
 6372    H    PHE 107           HN       PHE 107  27.308  -4.843  -1.494
  Start of MODEL   10
 6373    H1   ASP   1           H        ASP   1 -32.570   1.184   2.170
  Start of MODEL   10
 6374    H2   ASP   1           H2       ASP   1 -32.899   1.519   0.554
  Start of MODEL   10
 6375    H3   ASP   1           H3       ASP   1 -32.080   2.653   1.509
  Start of MODEL   10
 6376    HA   ASP   1           HA       ASP   1 -30.601   1.424   0.000
  Start of MODEL   10
 6377    HB3  ASP   1           HB2      ASP   1 -28.942   0.839   1.703
  Start of MODEL   10
 6378    HB2  ASP   1           HB3      ASP   1 -30.179   0.897   2.956
  Start of MODEL   10
 6379    HA   ASP   2           HA       ASP   2 -31.332  -2.858   0.270
  Start of MODEL   10
 6380    HB3  ASP   2           HB2      ASP   2 -32.044  -2.013  -2.543
  Start of MODEL   10
 6381    HB2  ASP   2           HB3      ASP   2 -33.148  -2.096  -1.176
  Start of MODEL   10
 6382    H    ASP   2           HN       ASP   2 -30.512  -0.368  -1.084
  Start of MODEL   10
 6383    HA   ASP   3           HA       ASP   3 -28.265  -3.951  -3.223
  Start of MODEL   10
 6384    HB3  ASP   3           HB2      ASP   3 -27.714  -1.069  -3.950
  Start of MODEL   10
 6385    HB2  ASP   3           HB3      ASP   3 -28.629  -2.235  -4.899
  Start of MODEL   10
 6386    H    ASP   3           HN       ASP   3 -29.665  -1.559  -2.572
  Start of MODEL   10
 6387    HA   ASP   4           HA       ASP   4 -25.425  -2.496   0.041
  Start of MODEL   10
 6388    HB3  ASP   4           HB2      ASP   4 -24.819   0.022  -1.540
  Start of MODEL   10
 6389    HB2  ASP   4           HB3      ASP   4 -24.151  -1.573  -1.867
  Start of MODEL   10
 6390    H    ASP   4           HN       ASP   4 -27.472  -1.078  -1.410
  Start of MODEL   10
 6391    HA   ASP   5           HA       ASP   5 -27.124   0.639   2.546
  Start of MODEL   10
 6392    HB3  ASP   5           HB2      ASP   5 -28.304  -1.503   3.245
  Start of MODEL   10
 6393    HB2  ASP   5           HB3      ASP   5 -28.156  -0.271   4.489
  Start of MODEL   10
 6394    H    ASP   5           HN       ASP   5 -25.628  -1.863   2.091
  Start of MODEL   10
 6395    HA   VAL   6           HA       VAL   6 -23.595   0.917   5.174
  Start of MODEL   10
 6396    HB   VAL   6           HB       VAL   6 -21.803  -0.817   5.927
  Start of MODEL   10
 6397    H    VAL   6           HN       VAL   6 -24.286  -1.170   3.317
  Start of MODEL   10
 6398    HA   SER   7           HA       SER   7 -20.815   1.411   1.915
  Start of MODEL   10
 6399    HB3  SER   7           HB2      SER   7 -20.997   3.847   1.247
  Start of MODEL   10
 6400    HB2  SER   7           HB3      SER   7 -22.121   3.976   2.639
  Start of MODEL   10
 6401    HG   SER   7           HG       SER   7 -22.864   1.981   0.947
  Start of MODEL   10
 6402    H    SER   7           HN       SER   7 -22.787   2.281   3.832
  Start of MODEL   10
 6403    HA   PHE   8           HA       PHE   8 -18.356   2.337   5.450
  Start of MODEL   10
 6404    HB3  PHE   8           HB2      PHE   8 -16.387   0.841   5.519
  Start of MODEL   10
 6405    HB2  PHE   8           HB3      PHE   8 -16.837   0.186   3.955
  Start of MODEL   10
 6406    HD1  PHE   8           HD1      PHE   8 -17.788  -1.902   4.038
  Start of MODEL   10
 6407    HD2  PHE   8           HD2      PHE   8 -18.573   0.843   7.189
  Start of MODEL   10
 6408    HE1  PHE   8           HE1      PHE   8 -19.220  -3.565   5.128
  Start of MODEL   10
 6409    HE2  PHE   8           HE2      PHE   8 -20.006  -0.832   8.288
  Start of MODEL   10
 6410    HZ   PHE   8           HZ       PHE   8 -20.250  -3.076   7.291
  Start of MODEL   10
 6411    H    PHE   8           HN       PHE   8 -19.124   0.879   3.140
  Start of MODEL   10
 6412    HA   CYS   9           HA       CYS   9 -15.895   5.252   3.526
  Start of MODEL   10
 6413    HB3  CYS   9           HB2      CYS   9 -15.173   5.444   6.464
  Start of MODEL   10
 6414    HB2  CYS   9           HB3      CYS   9 -16.644   6.124   5.775
  Start of MODEL   10
 6415    H    CYS   9           HN       CYS   9 -16.698   3.618   5.761
  Start of MODEL   10
 6416    HA   ALA  10           HA       ALA  10 -12.040   3.387   3.369
  Start of MODEL   10
 6417    HB3  ALA  10           HB1      ALA  10 -11.926   5.029   1.552
  Start of MODEL   10
 6418    HB2  ALA  10           HB2      ALA  10 -10.330   4.696   2.245
  Start of MODEL   10
 6419    HB1  ALA  10           HB3      ALA  10 -11.173   6.178   2.666
  Start of MODEL   10
 6420    H    ALA  10           HN       ALA  10 -13.385   5.935   3.764
  Start of MODEL   10
 6421    HA   SER  11           HA       SER  11  -9.564   4.488   6.683
  Start of MODEL   10
 6422    HB3  SER  11           HB2      SER  11 -10.529   1.703   7.419
  Start of MODEL   10
 6423    HB2  SER  11           HB3      SER  11 -11.429   3.175   7.787
  Start of MODEL   10
 6424    HG   SER  11           HG       SER  11 -10.162   3.573   9.364
  Start of MODEL   10
 6425    H    SER  11           HN       SER  11 -10.985   2.636   4.950
  Start of MODEL   10
 6426    HA   VAL  12           HA       VAL  12  -6.285   2.050   5.112
  Start of MODEL   10
 6427    HB   VAL  12           HB       VAL  12  -5.151   4.801   5.708
  Start of MODEL   10
 6428    H    VAL  12           HN       VAL  12  -7.398   4.143   6.873
  Start of MODEL   10
 6429    HA   GLN  13           HA       GLN  13  -3.827   1.441   8.680
  Start of MODEL   10
 6430    HB3  GLN  13           HB2      GLN  13  -3.863  -0.896   9.456
  Start of MODEL   10
 6431    HB2  GLN  13           HB3      GLN  13  -4.818  -1.338   8.064
  Start of MODEL   10
 6432    HG2  GLN  13           HG2      GLN  13  -5.733   0.580  10.179
  Start of MODEL   10
 6433    HG3  GLN  13           HG3      GLN  13  -6.688  -0.077   8.848
  Start of MODEL   10
 6434   HE21  GLN  13          HE21      GLN  13  -8.165  -1.032  10.179
  Start of MODEL   10
 6435   HE22  GLN  13          HE22      GLN  13  -7.829  -2.431  11.129
  Start of MODEL   10
 6436    H    GLN  13           HN       GLN  13  -5.320   0.520   6.343
  Start of MODEL   10
 6437    HA   LEU  14           HA       LEU  14  -0.585  -0.314   6.423
  Start of MODEL   10
 6438    HB3  LEU  14           HB2      LEU  14   1.467   1.236   6.781
  Start of MODEL   10
 6439    HB2  LEU  14           HB3      LEU  14   0.303   2.364   7.461
  Start of MODEL   10
 6440    HG   LEU  14           HG       LEU  14  -0.971   2.100   5.231
  Start of MODEL   10
 6441   HD11  LEU  14          HD11      LEU  14   1.785   3.337   5.207
  Start of MODEL   10
 6442   HD13  LEU  14          HD12      LEU  14   0.283   4.118   5.737
  Start of MODEL   10
 6443   HD12  LEU  14          HD13      LEU  14   0.491   3.639   4.052
  Start of MODEL   10
 6444   HD21  LEU  14          HD21      LEU  14   0.164   0.071   4.523
  Start of MODEL   10
 6445   HD23  LEU  14          HD22      LEU  14   1.692   0.954   4.453
  Start of MODEL   10
 6446   HD22  LEU  14          HD23      LEU  14   0.381   1.372   3.349
  Start of MODEL   10
 6447    H    LEU  14           HN       LEU  14  -1.756   1.551   8.306
  Start of MODEL   10
 6448    HA   HIS  15           HA       HIS  15   1.463  -1.900   9.945
  Start of MODEL   10
 6449    HB3  HIS  15           HB2      HIS  15   1.558  -4.319   9.506
  Start of MODEL   10
 6450    HB2  HIS  15           HB3      HIS  15   1.431  -4.039   7.779
  Start of MODEL   10
 6451    HD1  HIS  15           HD1      HIS  15  -0.659  -4.241  10.871
  Start of MODEL   10
 6452    HD2  HIS  15           HD2      HIS  15  -1.165  -3.492   6.819
  Start of MODEL   10
 6453    HE1  HIS  15           HE1      HIS  15  -3.137  -4.390  10.452
  Start of MODEL   10
 6454    HE2  HIS  15           HE2      HIS  15  -3.280  -4.371   7.933
  Start of MODEL   10
 6455    H    HIS  15           HN       HIS  15   1.361  -1.432   7.048
  Start of MODEL   10
 6456    HA   THR  16           HA       THR  16   5.646  -1.394   9.292
  Start of MODEL   10
 6457    HB   THR  16           HB       THR  16   5.711  -3.424  11.540
  Start of MODEL   10
 6458    HG1  THR  16           HG1      THR  16   5.872  -0.635  11.873
  Start of MODEL   10
 6459   HG22  THR  16          HG21      THR  16   7.837  -2.319  12.137
  Start of MODEL   10
 6460   HG21  THR  16          HG22      THR  16   7.674  -1.256  10.740
  Start of MODEL   10
 6461   HG23  THR  16          HG23      THR  16   7.916  -2.984  10.503
  Start of MODEL   10
 6462    H    THR  16           HN       THR  16   3.507  -2.542  10.644
  Start of MODEL   10
 6463    HA   ALA  17           HA       ALA  17   6.667  -4.323   6.293
  Start of MODEL   10
 6464    HB2  ALA  17           HB1      ALA  17   9.292  -2.957   6.855
  Start of MODEL   10
 6465    HB1  ALA  17           HB2      ALA  17   8.057  -2.343   5.770
  Start of MODEL   10
 6466    HB3  ALA  17           HB3      ALA  17   8.869  -3.868   5.403
  Start of MODEL   10
 6467    H    ALA  17           HN       ALA  17   7.095  -2.162   7.948
  Start of MODEL   10
 6468    HA   VAL  18           HA       VAL  18   8.539  -7.331   8.698
  Start of MODEL   10
 6469    HB   VAL  18           HB       VAL  18   8.018  -9.626   7.818
  Start of MODEL   10
 6470    H    VAL  18           HN       VAL  18   7.407  -6.340   6.225
  Start of MODEL   10
 6471    HA   GLU  19           HA       GLU  19  12.392  -7.449   6.948
  Start of MODEL   10
 6472    HB3  GLU  19           HB2      GLU  19  12.736  -8.805   9.620
  Start of MODEL   10
 6473    HB2  GLU  19           HB3      GLU  19  12.860  -7.079   9.308
  Start of MODEL   10
 6474    HG2  GLU  19           HG2      GLU  19  14.640  -9.167   8.065
  Start of MODEL   10
 6475    HG3  GLU  19           HG3      GLU  19  14.801  -7.421   7.931
  Start of MODEL   10
 6476    H    GLU  19           HN       GLU  19  10.467  -8.147   8.926
  Start of MODEL   10
 6477    HA   MET  20           HA       MET  20  13.904 -11.232   5.639
  Start of MODEL   10
 6478    HB3  MET  20           HB2      MET  20  11.578 -11.919   5.581
  Start of MODEL   10
 6479    HB2  MET  20           HB3      MET  20  12.314 -12.344   4.055
  Start of MODEL   10
 6480    HG2  MET  20           HG2      MET  20  10.562  -9.954   4.523
  Start of MODEL   10
 6481    HG3  MET  20           HG3      MET  20  11.248 -10.460   2.979
  Start of MODEL   10
 6482    HE3  MET  20           HE1      MET  20   8.165  -9.909   3.454
  Start of MODEL   10
 6483    HE2  MET  20           HE2      MET  20   7.416 -11.257   2.613
  Start of MODEL   10
 6484    HE1  MET  20           HE3      MET  20   8.804 -10.425   1.897
  Start of MODEL   10
 6485    H    MET  20           HN       MET  20  13.017  -8.642   5.400
  Start of MODEL   10
 6486    HA   HIS  21           HA       HIS  21  15.886  -9.960   2.159
  Start of MODEL   10
 6487    HB3  HIS  21           HB2      HIS  21  16.192 -11.319   0.073
  Start of MODEL   10
 6488    HB2  HIS  21           HB3      HIS  21  14.879 -12.358   0.621
  Start of MODEL   10
 6489    HD1  HIS  21           HD1      HIS  21  15.523 -14.256   2.099
  Start of MODEL   10
 6490    HD2  HIS  21           HD2      HIS  21  18.444 -11.313   1.960
  Start of MODEL   10
 6491    HE1  HIS  21           HE1      HIS  21  17.458 -15.172   3.390
  Start of MODEL   10
 6492    HE2  HIS  21           HE2      HIS  21  19.122 -13.306   3.462
  Start of MODEL   10
 6493    H    HIS  21           HN       HIS  21  13.880 -11.882   2.873
  Start of MODEL   10
 6494    HA   HIS  22           HA       HIS  22  12.893  -8.208  -0.629
  Start of MODEL   10
 6495    HB3  HIS  22           HB2      HIS  22  10.763  -8.933  -1.716
  Start of MODEL   10
 6496    HB2  HIS  22           HB3      HIS  22  10.782 -10.398  -0.744
  Start of MODEL   10
 6497    HD1  HIS  22           HD1      HIS  22  10.917 -11.966  -2.771
  Start of MODEL   10
 6498    HD2  HIS  22           HD2      HIS  22  14.049  -9.241  -2.576
  Start of MODEL   10
 6499    HE1  HIS  22           HE1      HIS  22  12.587 -12.737  -4.454
  Start of MODEL   10
 6500    HE2  HIS  22           HE2      HIS  22  14.565 -11.260  -4.105
  Start of MODEL   10
 6501    H    HIS  22           HN       HIS  22  12.668 -10.656   0.969
  Start of MODEL   10
 6502    HA   TRP  23           HA       TRP  23  10.759  -6.837   2.794
  Start of MODEL   10
 6503    HB3  TRP  23           HB2      TRP  23  10.830  -4.331   2.909
  Start of MODEL   10
 6504    HB2  TRP  23           HB3      TRP  23  11.559  -4.340   1.307
  Start of MODEL   10
 6505    HD1  TRP  23           HD1      TRP  23  14.068  -5.391   1.121
  Start of MODEL   10
 6506    HE1  TRP  23           HE1      TRP  23  15.948  -5.569   2.858
  Start of MODEL   10
 6507    HE3  TRP  23           HE3      TRP  23  11.291  -4.726   5.360
  Start of MODEL   10
 6508    HZ2  TRP  23           HZ2      TRP  23  16.216  -5.454   5.670
  Start of MODEL   10
 6509    HZ3  TRP  23           HZ3      TRP  23  12.441  -4.777   7.534
  Start of MODEL   10
 6510    HH2  TRP  23           HH2      TRP  23  14.846  -5.136   7.681
  Start of MODEL   10
 6511    H    TRP  23           HN       TRP  23  11.949  -6.454   0.205
  Start of MODEL   10
 6512    HA   CYS  24           HA       CYS  24   6.804  -5.967   1.228
  Start of MODEL   10
 6513    HB3  CYS  24           HB2      CYS  24   6.726  -8.118   3.352
  Start of MODEL   10
 6514    HB2  CYS  24           HB3      CYS  24   6.918  -8.383   1.634
  Start of MODEL   10
 6515    H    CYS  24           HN       CYS  24   8.764  -6.646   3.318
  Start of MODEL   10
 6516    HA   ILE  25           HA       ILE  25   5.205  -3.589   4.601
  Start of MODEL   10
 6517    HB   ILE  25           HB       ILE  25   4.786  -1.842   2.143
  Start of MODEL   10
 6518   HD12  ILE  25          HD11      ILE  25   7.931   0.098   2.955
  Start of MODEL   10
 6519   HD11  ILE  25          HD12      ILE  25   6.311   0.553   3.481
  Start of MODEL   10
 6520   HD13  ILE  25          HD13      ILE  25   6.583   0.027   1.823
  Start of MODEL   10
 6521    H    ILE  25           HN       ILE  25   5.771  -4.168   1.780
  Start of MODEL   10
 6522    HA   PRO  26           HA       PRO  26   1.229  -5.369   3.246
  Start of MODEL   10
 6523    HB3  PRO  26           HB2      PRO  26   0.930  -6.951   4.840
  Start of MODEL   10
 6524    HB2  PRO  26           HB3      PRO  26   0.628  -5.711   6.059
  Start of MODEL   10
 6525    HG2  PRO  26           HG2      PRO  26   2.636  -6.437   6.913
  Start of MODEL   10
 6526    HG3  PRO  26           HG3      PRO  26   3.156  -7.098   5.356
  Start of MODEL   10
 6527    HD2  PRO  26           HD2      PRO  26   3.310  -4.285   6.362
  Start of MODEL   10
 6528    HD3  PRO  26           HD3      PRO  26   4.496  -5.235   5.433
  Start of MODEL   10
 6529    HA   PHE  27           HA       PHE  27  -1.349  -2.268   4.932
  Start of MODEL   10
 6530    HB3  PHE  27           HB2      PHE  27  -0.476  -1.110   2.962
  Start of MODEL   10
 6531    HB2  PHE  27           HB3      PHE  27  -2.185  -0.778   3.163
  Start of MODEL   10
 6532    HD1  PHE  27           HD1      PHE  27  -3.847  -1.669   1.580
  Start of MODEL   10
 6533    HD2  PHE  27           HD2      PHE  27   0.340  -2.283   1.044
  Start of MODEL   10
 6534    HE1  PHE  27           HE1      PHE  27  -4.236  -2.300  -0.756
  Start of MODEL   10
 6535    HE2  PHE  27           HE2      PHE  27  -0.055  -2.914  -1.290
  Start of MODEL   10
 6536    HZ   PHE  27           HZ       PHE  27  -2.340  -2.925  -2.194
  Start of MODEL   10
 6537    H    PHE  27           HN       PHE  27  -0.686  -4.343   3.001
  Start of MODEL   10
 6538    HA   SER  28           HA       SER  28  -5.362  -3.782   4.078
  Start of MODEL   10
 6539    HB3  SER  28           HB2      SER  28  -6.305  -4.231   6.238
  Start of MODEL   10
 6540    HB2  SER  28           HB3      SER  28  -5.293  -3.004   7.002
  Start of MODEL   10
 6541    HG   SER  28           HG       SER  28  -3.960  -5.000   5.600
  Start of MODEL   10
 6542    H    SER  28           HN       SER  28  -3.489  -1.889   5.277
  Start of MODEL   10
 6543    HA   VAL  29           HA       VAL  29  -7.428   0.036   4.294
  Start of MODEL   10
 6544    HB   VAL  29           HB       VAL  29  -6.170   0.729   2.298
  Start of MODEL   10
 6545    H    VAL  29           HN       VAL  29  -6.577  -2.390   2.927
  Start of MODEL   10
 6546    HA   ASP  30           HA       ASP  30 -11.307  -1.870   3.889
  Start of MODEL   10
 6547    HB3  ASP  30           HB2      ASP  30 -11.275  -0.330   6.490
  Start of MODEL   10
 6548    HB2  ASP  30           HB3      ASP  30 -10.997  -2.051   6.265
  Start of MODEL   10
 6549    H    ASP  30           HN       ASP  30  -9.413   0.149   4.889
  Start of MODEL   10
 6550    HA2  GLY  31           HA2      GLY  31 -14.723   0.856   3.336
  Start of MODEL   10
 6551    H    GLY  31           HN       GLY  31 -13.185  -1.371   3.089
  Start of MODEL   10
 6552    HA3  GLY  31           HA1      GLY  31 -13.614   1.215   2.011
  Start of MODEL   10
 6553    HA   GLN  32           HA       GLN  32 -16.620  -2.064   0.799
  Start of MODEL   10
 6554    HB3  GLN  32           HB2      GLN  32 -19.035  -0.242   0.823
  Start of MODEL   10
 6555    HB2  GLN  32           HB3      GLN  32 -18.582  -1.051   2.307
  Start of MODEL   10
 6556    HG2  GLN  32           HG2      GLN  32 -18.865  -3.230   1.236
  Start of MODEL   10
 6557    HG3  GLN  32           HG3      GLN  32 -20.336  -2.274   1.155
  Start of MODEL   10
 6558   HE21  GLN  32          HE21      GLN  32 -21.035  -1.575  -0.810
  Start of MODEL   10
 6559   HE22  GLN  32          HE22      GLN  32 -20.434  -2.148  -2.321
  Start of MODEL   10
 6560    H    GLN  32           HN       GLN  32 -16.614   0.392   2.271
  Start of MODEL   10
 6561    HA   PRO  33           HA       PRO  33 -17.093   0.863  -2.992
  Start of MODEL   10
 6562    HB3  PRO  33           HB2      PRO  33 -18.120   2.921  -2.676
  Start of MODEL   10
 6563    HB2  PRO  33           HB3      PRO  33 -16.463   3.504  -2.497
  Start of MODEL   10
 6564    HG2  PRO  33           HG2      PRO  33 -16.571   3.496  -0.187
  Start of MODEL   10
 6565    HG3  PRO  33           HG3      PRO  33 -18.279   3.812  -0.540
  Start of MODEL   10
 6566    HD2  PRO  33           HD2      PRO  33 -17.515   1.734   0.977
  Start of MODEL   10
 6567    HD3  PRO  33           HD3      PRO  33 -18.900   1.632  -0.126
  Start of MODEL   10
 6568    HA   ALA  34           HA       ALA  34 -12.862   0.045  -2.475
  Start of MODEL   10
 6569    HB3  ALA  34           HB1      ALA  34 -13.543  -1.355  -4.330
  Start of MODEL   10
 6570    HB2  ALA  34           HB2      ALA  34 -11.948  -0.648  -4.628
  Start of MODEL   10
 6571    HB1  ALA  34           HB3      ALA  34 -13.380   0.005  -5.436
  Start of MODEL   10
 6572    H    ALA  34           HN       ALA  34 -15.252   0.353  -3.883
  Start of MODEL   10
 6573    HA   PRO  35           HA       PRO  35 -11.478   4.237  -3.160
  Start of MODEL   10
 6574    HB3  PRO  35           HB2      PRO  35 -11.185   4.228  -0.861
  Start of MODEL   10
 6575    HB2  PRO  35           HB3      PRO  35  -9.503   4.246  -1.392
  Start of MODEL   10
 6576    HG2  PRO  35           HG2      PRO  35  -9.202   2.008  -0.949
  Start of MODEL   10
 6577    HG3  PRO  35           HG3      PRO  35 -10.468   2.334   0.248
  Start of MODEL   10
 6578    HD2  PRO  35           HD2      PRO  35 -10.641   0.494  -1.849
  Start of MODEL   10
 6579    HD3  PRO  35           HD3      PRO  35 -12.010   1.149  -0.924
  Start of MODEL   10
 6580    HA   SER  36           HA       SER  36  -7.989   3.598  -5.703
  Start of MODEL   10
 6581    HB3  SER  36           HB2      SER  36  -8.319   6.617  -5.622
  Start of MODEL   10
 6582    HB2  SER  36           HB3      SER  36  -9.172   5.560  -6.749
  Start of MODEL   10
 6583    HG   SER  36           HG       SER  36  -7.043   6.670  -7.332
  Start of MODEL   10
 6584    H    SER  36           HN       SER  36  -9.881   5.222  -4.258
  Start of MODEL   10
 6585    HA   LEU  37           HA       LEU  37  -5.065   4.640  -2.637
  Start of MODEL   10
 6586    HB3  LEU  37           HB2      LEU  37  -3.391   2.835  -2.555
  Start of MODEL   10
 6587    HB2  LEU  37           HB3      LEU  37  -4.021   2.204  -4.061
  Start of MODEL   10
 6588    HG   LEU  37           HG       LEU  37  -6.229   1.861  -2.876
  Start of MODEL   10
 6589   HD13  LEU  37          HD11      LEU  37  -4.708   0.085  -3.283
  Start of MODEL   10
 6590   HD12  LEU  37          HD12      LEU  37  -5.456  -0.135  -1.695
  Start of MODEL   10
 6591   HD11  LEU  37          HD13      LEU  37  -3.790   0.454  -1.821
  Start of MODEL   10
 6592   HD21  LEU  37          HD21      LEU  37  -5.911   3.414  -1.040
  Start of MODEL   10
 6593   HD23  LEU  37          HD22      LEU  37  -4.529   2.478  -0.469
  Start of MODEL   10
 6594   HD22  LEU  37          HD23      LEU  37  -6.142   1.782  -0.407
  Start of MODEL   10
 6595    H    LEU  37           HN       LEU  37  -5.862   3.400  -5.161
  Start of MODEL   10
 6596    HA   ARG  38           HA       ARG  38  -1.410   5.952  -4.784
  Start of MODEL   10
 6597    HB3  ARG  38           HB2      ARG  38  -2.323   8.210  -3.029
  Start of MODEL   10
 6598    HB2  ARG  38           HB3      ARG  38  -2.974   7.936  -4.624
  Start of MODEL   10
 6599    HG2  ARG  38           HG2      ARG  38  -1.250   9.750  -4.457
  Start of MODEL   10
 6600    HG3  ARG  38           HG3      ARG  38  -0.070   8.516  -4.041
  Start of MODEL   10
 6601    HD2  ARG  38           HD2      ARG  38  -1.600   8.742  -6.646
  Start of MODEL   10
 6602    HD3  ARG  38           HD3      ARG  38   0.101   9.107  -6.394
  Start of MODEL   10
 6603    HE   ARG  38           HE       ARG  38  -1.145   6.474  -6.519
  Start of MODEL   10
 6604   HH11  ARG  38          HH11      ARG  38   1.866   8.329  -6.135
  Start of MODEL   10
 6605   HH12  ARG  38          HH12      ARG  38   2.854   7.035  -6.659
  Start of MODEL   10
 6606   HH21  ARG  38          HH21      ARG  38   0.248   4.774  -7.194
  Start of MODEL   10
 6607   HH22  ARG  38          HH22      ARG  38   1.909   4.967  -7.323
  Start of MODEL   10
 6608    H    ARG  38           HN       ARG  38  -3.101   5.604  -2.418
  Start of MODEL   10
 6609    HA   TRP  39           HA       TRP  39   1.399   5.952  -1.425
  Start of MODEL   10
 6610    HB3  TRP  39           HB2      TRP  39   3.578   5.019  -2.188
  Start of MODEL   10
 6611    HB2  TRP  39           HB3      TRP  39   2.959   4.981  -3.830
  Start of MODEL   10
 6612    HD1  TRP  39           HD1      TRP  39   1.302   3.031  -4.463
  Start of MODEL   10
 6613    HE1  TRP  39           HE1      TRP  39   0.607   0.879  -3.269
  Start of MODEL   10
 6614    HE3  TRP  39           HE3      TRP  39   3.105   4.088   0.202
  Start of MODEL   10
 6615    HZ2  TRP  39           HZ2      TRP  39   0.789  -0.243  -0.664
  Start of MODEL   10
 6616    HZ3  TRP  39           HZ3      TRP  39   2.802   2.427   1.989
  Start of MODEL   10
 6617    HH2  TRP  39           HH2      TRP  39   1.670   0.312   1.569
  Start of MODEL   10
 6618    H    TRP  39           HN       TRP  39   0.750   6.072  -4.265
  Start of MODEL   10
 6619    HA   LEU  40           HA       LEU  40   3.789   9.482  -2.278
  Start of MODEL   10
 6620    HB3  LEU  40           HB2      LEU  40   2.262  10.062   0.278
  Start of MODEL   10
 6621    HB2  LEU  40           HB3      LEU  40   1.600  10.261  -1.328
  Start of MODEL   10
 6622    HG   LEU  40           HG       LEU  40   4.024  11.764  -0.426
  Start of MODEL   10
 6623   HD12  LEU  40          HD11      LEU  40   3.354  13.236  -2.270
  Start of MODEL   10
 6624   HD11  LEU  40          HD12      LEU  40   2.082  12.073  -2.691
  Start of MODEL   10
 6625   HD13  LEU  40          HD13      LEU  40   3.778  11.607  -2.788
  Start of MODEL   10
 6626   HD23  LEU  40          HD21      LEU  40   1.124  12.580  -0.314
  Start of MODEL   10
 6627   HD22  LEU  40          HD22      LEU  40   2.494  13.650  -0.028
  Start of MODEL   10
 6628   HD21  LEU  40          HD23      LEU  40   2.176  12.308   1.074
  Start of MODEL   10
 6629    H    LEU  40           HN       LEU  40   2.369   7.569  -0.569
  Start of MODEL   10
 6630    HA   PHE  41           HA       PHE  41   6.730   8.581   0.872
  Start of MODEL   10
 6631    HB3  PHE  41           HB2      PHE  41   8.188   8.707  -1.783
  Start of MODEL   10
 6632    HB2  PHE  41           HB3      PHE  41   7.461   7.267  -1.085
  Start of MODEL   10
 6633    HD1  PHE  41           HD1      PHE  41  10.331   9.475  -1.065
  Start of MODEL   10
 6634    HD2  PHE  41           HD2      PHE  41   8.423   6.239   0.921
  Start of MODEL   10
 6635    HE1  PHE  41           HE1      PHE  41  12.423   8.967   0.111
  Start of MODEL   10
 6636    HE2  PHE  41           HE2      PHE  41  10.515   5.733   2.096
  Start of MODEL   10
 6637    HZ   PHE  41           HZ       PHE  41  12.514   7.095   1.693
  Start of MODEL   10
 6638    H    PHE  41           HN       PHE  41   5.852   9.777  -1.664
  Start of MODEL   10
 6639    HA   ASN  42           HA       ASN  42   7.746  12.203   3.053
  Start of MODEL   10
 6640    HB3  ASN  42           HB2      ASN  42   9.952  13.158   2.276
  Start of MODEL   10
 6641    HB2  ASN  42           HB3      ASN  42   9.977  11.941   1.013
  Start of MODEL   10
 6642   HD21  ASN  42          HD21      ASN  42  11.936  11.225   1.831
  Start of MODEL   10
 6643   HD22  ASN  42          HD22      ASN  42  12.043  10.247   3.245
  Start of MODEL   10
 6644    H    ASN  42           HN       ASN  42   7.048  10.247   2.153
  Start of MODEL   10
 6645    HA2  GLY  43           HA2      GLY  43   4.604  14.180   0.182
  Start of MODEL   10
 6646    H    GLY  43           HN       GLY  43   5.809  12.349   1.019
  Start of MODEL   10
 6647    HA3  GLY  43           HA1      GLY  43   6.026  15.181   0.409
  Start of MODEL   10
 6648    HA   SER  44           HA       SER  44   6.826  13.755  -3.860
  Start of MODEL   10
 6649    HB3  SER  44           HB2      SER  44   8.923  12.642  -4.339
  Start of MODEL   10
 6650    HB2  SER  44           HB3      SER  44   8.854  11.759  -2.812
  Start of MODEL   10
 6651    HG   SER  44           HG       SER  44   8.707  14.091  -1.978
  Start of MODEL   10
 6652    H    SER  44           HN       SER  44   7.067  12.493  -1.184
  Start of MODEL   10
 6653    HA   VAL  45           HA       VAL  45   4.426  10.497  -4.984
  Start of MODEL   10
 6654    HB   VAL  45           HB       VAL  45   5.558  11.383  -7.651
  Start of MODEL   10
 6655    H    VAL  45           HN       VAL  45   6.443  12.425  -5.603
  Start of MODEL   10
 6656    HA   LEU  46           HA       LEU  46   7.303   7.231  -5.404
  Start of MODEL   10
 6657    HB3  LEU  46           HB2      LEU  46   4.935   6.016  -3.959
  Start of MODEL   10
 6658    HB2  LEU  46           HB3      LEU  46   6.264   6.817  -3.153
  Start of MODEL   10
 6659    HG   LEU  46           HG       LEU  46   6.564   4.331  -4.835
  Start of MODEL   10
 6660   HD13  LEU  46          HD11      LEU  46   8.593   5.658  -4.677
  Start of MODEL   10
 6661   HD12  LEU  46          HD12      LEU  46   8.742   4.158  -3.759
  Start of MODEL   10
 6662   HD11  LEU  46          HD13      LEU  46   8.447   5.681  -2.919
  Start of MODEL   10
 6663   HD23  LEU  46          HD21      LEU  46   6.371   4.615  -1.838
  Start of MODEL   10
 6664   HD22  LEU  46          HD22      LEU  46   6.815   3.142  -2.697
  Start of MODEL   10
 6665   HD21  LEU  46          HD23      LEU  46   5.201   3.821  -2.896
  Start of MODEL   10
 6666    H    LEU  46           HN       LEU  46   4.785   8.419  -4.614
  Start of MODEL   10
 6667    HA   ASN  47           HA       ASN  47   5.094   5.504  -8.722
  Start of MODEL   10
 6668    HB3  ASN  47           HB2      ASN  47   7.996   5.695  -9.537
  Start of MODEL   10
 6669    HB2  ASN  47           HB3      ASN  47   6.675   6.766  -9.976
  Start of MODEL   10
 6670   HD21  ASN  47          HD21      ASN  47   5.200   6.102 -11.567
  Start of MODEL   10
 6671   HD22  ASN  47          HD22      ASN  47   5.549   4.820 -12.660
  Start of MODEL   10
 6672    H    ASN  47           HN       ASN  47   7.503   5.990  -7.179
  Start of MODEL   10
 6673    HA   GLU  48           HA       GLU  48   5.950   1.275  -7.776
  Start of MODEL   10
 6674    HB3  GLU  48           HB2      GLU  48   4.114  -0.157  -8.333
  Start of MODEL   10
 6675    HB2  GLU  48           HB3      GLU  48   3.465   1.009  -9.473
  Start of MODEL   10
 6676    HG2  GLU  48           HG2      GLU  48   2.405   0.673  -7.094
  Start of MODEL   10
 6677    HG3  GLU  48           HG3      GLU  48   3.672   1.806  -6.630
  Start of MODEL   10
 6678    H    GLU  48           HN       GLU  48   4.377   3.420  -8.761
  Start of MODEL   10
 6679    HA   THR  49           HA       THR  49   7.443   0.244 -11.737
  Start of MODEL   10
 6680    HB   THR  49           HB       THR  49   8.816   2.111 -10.902
  Start of MODEL   10
 6681    HG1  THR  49           HG1      THR  49  10.248   1.710 -12.346
  Start of MODEL   10
 6682   HG23  THR  49          HG21      THR  49   9.363   1.280  -8.688
  Start of MODEL   10
 6683   HG22  THR  49          HG22      THR  49  10.858   1.654  -9.556
  Start of MODEL   10
 6684   HG21  THR  49          HG23      THR  49  10.329  -0.018  -9.387
  Start of MODEL   10
 6685    H    THR  49           HN       THR  49   7.333   0.110  -8.832
  Start of MODEL   10
 6686    HA   SER  50           HA       SER  50   9.294  -3.711 -11.832
  Start of MODEL   10
 6687    HB3  SER  50           HB2      SER  50  11.983  -2.355 -12.092
  Start of MODEL   10
 6688    HB2  SER  50           HB3      SER  50  10.883  -2.705 -13.417
  Start of MODEL   10
 6689    HG   SER  50           HG       SER  50  11.094  -4.963 -12.728
  Start of MODEL   10
 6690    H    SER  50           HN       SER  50   9.895  -0.985 -11.956
  Start of MODEL   10
 6691    HA   PHE  51           HA       PHE  51  11.904  -4.132  -8.101
  Start of MODEL   10
 6692    HB3  PHE  51           HB2      PHE  51  13.511  -2.738  -6.884
  Start of MODEL   10
 6693    HB2  PHE  51           HB3      PHE  51  12.962  -1.327  -7.781
  Start of MODEL   10
 6694    HD1  PHE  51           HD1      PHE  51  14.362  -4.737  -8.337
  Start of MODEL   10
 6695    HD2  PHE  51           HD2      PHE  51  14.069  -0.720  -9.717
  Start of MODEL   10
 6696    HE1  PHE  51           HE1      PHE  51  16.009  -5.221 -10.095
  Start of MODEL   10
 6697    HE2  PHE  51           HE2      PHE  51  15.711  -1.200 -11.478
  Start of MODEL   10
 6698    HZ   PHE  51           HZ       PHE  51  16.639  -3.472 -11.706
  Start of MODEL   10
 6699    H    PHE  51           HN       PHE  51  11.319  -1.748  -9.656
  Start of MODEL   10
 6700    HA   ILE  52           HA       ILE  52   9.103  -2.081  -5.117
  Start of MODEL   10
 6701    HB   ILE  52           HB       ILE  52   8.847   0.629  -6.475
  Start of MODEL   10
 6702   HD12  ILE  52          HD11      ILE  52  11.966   1.940  -4.883
  Start of MODEL   10
 6703   HD11  ILE  52          HD12      ILE  52  10.338   2.110  -4.210
  Start of MODEL   10
 6704   HD13  ILE  52          HD13      ILE  52  10.615   2.381  -5.931
  Start of MODEL   10
 6705    H    ILE  52           HN       ILE  52   9.814  -1.432  -7.922
  Start of MODEL   10
 6706    HA   PHE  53           HA       PHE  53   5.274  -2.000  -7.306
  Start of MODEL   10
 6707    HB3  PHE  53           HB2      PHE  53   6.185  -3.720  -8.636
  Start of MODEL   10
 6708    HB2  PHE  53           HB3      PHE  53   4.662  -4.366  -8.040
  Start of MODEL   10
 6709    HD1  PHE  53           HD1      PHE  53   8.279  -4.713  -7.974
  Start of MODEL   10
 6710    HD2  PHE  53           HD2      PHE  53   4.617  -6.111  -6.339
  Start of MODEL   10
 6711    HE1  PHE  53           HE1      PHE  53   9.430  -6.707  -7.104
  Start of MODEL   10
 6712    HE2  PHE  53           HE2      PHE  53   5.755  -8.102  -5.468
  Start of MODEL   10
 6713    HZ   PHE  53           HZ       PHE  53   8.220  -8.365  -5.841
  Start of MODEL   10
 6714    H    PHE  53           HN       PHE  53   7.156  -3.205  -5.427
  Start of MODEL   10
 6715    HA   THR  54           HA       THR  54   2.535  -3.107  -4.135
  Start of MODEL   10
 6716    HB   THR  54           HB       THR  54   0.626  -1.731  -6.046
  Start of MODEL   10
 6717    HG1  THR  54           HG1      THR  54   2.921  -0.791  -4.982
  Start of MODEL   10
 6718   HG22  THR  54          HG21      THR  54  -0.367  -0.924  -3.960
  Start of MODEL   10
 6719   HG21  THR  54          HG22      THR  54   0.890  -1.749  -3.039
  Start of MODEL   10
 6720   HG23  THR  54          HG23      THR  54  -0.281  -2.685  -3.968
  Start of MODEL   10
 6721    H    THR  54           HN       THR  54   3.079  -2.368  -6.916
  Start of MODEL   10
 6722    HA   GLU  55           HA       GLU  55   0.505  -6.375  -6.226
  Start of MODEL   10
 6723    HB3  GLU  55           HB2      GLU  55   0.720  -8.486  -5.002
  Start of MODEL   10
 6724    HB2  GLU  55           HB3      GLU  55   1.420  -7.614  -3.644
  Start of MODEL   10
 6725    HG2  GLU  55           HG2      GLU  55   2.609  -7.678  -6.398
  Start of MODEL   10
 6726    HG3  GLU  55           HG3      GLU  55   3.318  -7.001  -4.927
  Start of MODEL   10
 6727    H    GLU  55           HN       GLU  55   1.764  -5.157  -3.907
  Start of MODEL   10
 6728    HA   PHE  56           HA       PHE  56  -3.191  -6.114  -3.988
  Start of MODEL   10
 6729    HB3  PHE  56           HB2      PHE  56  -5.012  -5.512  -5.536
  Start of MODEL   10
 6730    HB2  PHE  56           HB3      PHE  56  -3.916  -5.701  -6.896
  Start of MODEL   10
 6731    HD1  PHE  56           HD1      PHE  56  -4.190  -3.881  -3.692
  Start of MODEL   10
 6732    HD2  PHE  56           HD2      PHE  56  -2.848  -3.830  -7.719
  Start of MODEL   10
 6733    HE1  PHE  56           HE1      PHE  56  -3.527  -1.564  -3.427
  Start of MODEL   10
 6734    HE2  PHE  56           HE2      PHE  56  -2.185  -1.477  -7.473
  Start of MODEL   10
 6735    HZ   PHE  56           HZ       PHE  56  -2.532  -0.332  -5.306
  Start of MODEL   10
 6736    H    PHE  56           HN       PHE  56  -1.581  -6.411  -6.392
  Start of MODEL   10
 6737    HA   LEU  57           HA       LEU  57  -4.122 -10.245  -4.905
  Start of MODEL   10
 6738    HB3  LEU  57           HB2      LEU  57  -3.081 -10.626  -2.763
  Start of MODEL   10
 6739    HB2  LEU  57           HB3      LEU  57  -4.636 -11.430  -2.775
  Start of MODEL   10
 6740    HG   LEU  57           HG       LEU  57  -4.323  -8.773  -1.441
  Start of MODEL   10
 6741   HD13  LEU  57          HD11      LEU  57  -6.580  -9.461  -1.810
  Start of MODEL   10
 6742   HD12  LEU  57          HD12      LEU  57  -6.222  -9.628  -0.083
  Start of MODEL   10
 6743   HD11  LEU  57          HD13      LEU  57  -6.244 -11.046  -1.141
  Start of MODEL   10
 6744   HD23  LEU  57          HD21      LEU  57  -3.830 -11.480  -0.214
  Start of MODEL   10
 6745   HD22  LEU  57          HD22      LEU  57  -3.953  -9.956   0.663
  Start of MODEL   10
 6746   HD21  LEU  57          HD23      LEU  57  -2.629 -10.213  -0.472
  Start of MODEL   10
 6747    H    LEU  57           HN       LEU  57  -3.861  -7.930  -3.216
  Start of MODEL   10
 6748    HA   GLU  58           HA       GLU  58  -8.374  -9.978  -5.422
  Start of MODEL   10
 6749    HB3  GLU  58           HB2      GLU  58  -9.536 -12.169  -5.417
  Start of MODEL   10
 6750    HB2  GLU  58           HB3      GLU  58  -8.094 -12.874  -4.703
  Start of MODEL   10
 6751    HG2  GLU  58           HG2      GLU  58  -8.373 -11.674  -7.432
  Start of MODEL   10
 6752    HG3  GLU  58           HG3      GLU  58  -6.828 -12.159  -6.783
  Start of MODEL   10
 6753    H    GLU  58           HN       GLU  58  -6.122 -11.546  -4.624
  Start of MODEL   10
 6754    HA   PRO  59           HA       PRO  59  -9.520  -9.419  -1.094
  Start of MODEL   10
 6755    HB3  PRO  59           HB2      PRO  59 -10.544  -7.383  -1.135
  Start of MODEL   10
 6756    HB2  PRO  59           HB3      PRO  59 -11.871  -8.007  -2.116
  Start of MODEL   10
 6757    HG2  PRO  59           HG2      PRO  59 -10.898  -6.696  -3.728
  Start of MODEL   10
 6758    HG3  PRO  59           HG3      PRO  59  -9.299  -6.788  -2.966
  Start of MODEL   10
 6759    HD2  PRO  59           HD2      PRO  59 -10.653  -8.746  -4.777
  Start of MODEL   10
 6760    HD3  PRO  59           HD3      PRO  59  -8.948  -8.233  -4.714
  Start of MODEL   10
 6761    HA   ALA  60           HA       ALA  60 -12.470 -12.613  -1.010
  Start of MODEL   10
 6762    HB1  ALA  60           HB1      ALA  60 -12.011 -11.789   1.865
  Start of MODEL   10
 6763    HB3  ALA  60           HB2      ALA  60 -11.191 -13.098   1.018
  Start of MODEL   10
 6764    HB2  ALA  60           HB3      ALA  60 -12.920 -13.212   1.358
  Start of MODEL   10
 6765    H    ALA  60           HN       ALA  60 -10.697 -10.713   0.105
  Start of MODEL   10
 6766    HA   ALA  61           HA       ALA  61 -15.794  -9.912  -1.546
  Start of MODEL   10
 6767    HB3  ALA  61           HB1      ALA  61 -17.777 -11.114  -2.244
  Start of MODEL   10
 6768    HB2  ALA  61           HB2      ALA  61 -17.103 -12.620  -1.622
  Start of MODEL   10
 6769    HB1  ALA  61           HB3      ALA  61 -16.337 -11.809  -2.984
  Start of MODEL   10
 6770    H    ALA  61           HN       ALA  61 -14.527 -12.361  -1.449
  Start of MODEL   10
 6771    HA   ASN  62           HA       ASN  62 -18.058 -11.087   2.419
  Start of MODEL   10
 6772    HB3  ASN  62           HB2      ASN  62 -17.224 -12.368   4.385
  Start of MODEL   10
 6773    HB2  ASN  62           HB3      ASN  62 -15.799 -12.795   3.446
  Start of MODEL   10
 6774   HD21  ASN  62          HD21      ASN  62 -16.220 -14.931   3.613
  Start of MODEL   10
 6775   HD22  ASN  62          HD22      ASN  62 -17.468 -15.713   2.709
  Start of MODEL   10
 6776    H    ASN  62           HN       ASN  62 -15.740 -12.145   1.063
  Start of MODEL   10
 6777    HA   GLU  63           HA       GLU  63 -14.829  -8.658   4.666
  Start of MODEL   10
 6778    HB3  GLU  63           HB2      GLU  63 -12.446  -8.386   4.355
  Start of MODEL   10
 6779    HB2  GLU  63           HB3      GLU  63 -12.526  -9.067   2.742
  Start of MODEL   10
 6780    HG2  GLU  63           HG2      GLU  63 -13.119 -11.237   3.681
  Start of MODEL   10
 6781    HG3  GLU  63           HG3      GLU  63 -11.552 -10.667   4.247
  Start of MODEL   10
 6782    H    GLU  63           HN       GLU  63 -14.742 -10.205   2.188
  Start of MODEL   10
 6783    HA   THR  64           HA       THR  64 -14.839  -5.271   1.865
  Start of MODEL   10
 6784    HB   THR  64           HB       THR  64 -15.471  -3.173   3.192
  Start of MODEL   10
 6785    HG1  THR  64           HG1      THR  64 -14.778  -3.545   5.209
  Start of MODEL   10
 6786   HG22  THR  64          HG21      THR  64 -17.751  -4.005   3.645
  Start of MODEL   10
 6787   HG21  THR  64          HG22      THR  64 -17.165  -5.661   3.509
  Start of MODEL   10
 6788   HG23  THR  64          HG23      THR  64 -17.138  -4.600   2.102
  Start of MODEL   10
 6789    H    THR  64           HN       THR  64 -14.432  -6.379   4.536
  Start of MODEL   10
 6790    HA   VAL  65           HA       VAL  65 -10.860  -3.741   3.382
  Start of MODEL   10
 6791    HB   VAL  65           HB       VAL  65  -9.935  -6.370   4.495
  Start of MODEL   10
 6792    H    VAL  65           HN       VAL  65 -12.412  -6.228   3.309
  Start of MODEL   10
 6793    HA   ARG  66           HA       ARG  66  -8.791  -5.634   0.039
  Start of MODEL   10
 6794    HB3  ARG  66           HB2      ARG  66  -8.236  -2.670   0.048
  Start of MODEL   10
 6795    HB2  ARG  66           HB3      ARG  66  -9.333  -3.529  -1.019
  Start of MODEL   10
 6796    HG2  ARG  66           HG2      ARG  66  -6.342  -3.892  -1.014
  Start of MODEL   10
 6797    HG3  ARG  66           HG3      ARG  66  -7.490  -4.577  -2.162
  Start of MODEL   10
 6798    HD2  ARG  66           HD2      ARG  66  -7.066  -1.628  -1.737
  Start of MODEL   10
 6799    HD3  ARG  66           HD3      ARG  66  -6.264  -2.543  -3.003
  Start of MODEL   10
 6800    HE   ARG  66           HE       ARG  66  -9.145  -2.713  -2.956
  Start of MODEL   10
 6801   HH11  ARG  66          HH11      ARG  66  -6.389  -0.893  -4.287
  Start of MODEL   10
 6802   HH12  ARG  66          HH12      ARG  66  -7.241  -0.448  -5.696
  Start of MODEL   10
 6803   HH21  ARG  66          HH21      ARG  66 -10.246  -2.074  -4.829
  Start of MODEL   10
 6804   HH22  ARG  66          HH22      ARG  66  -9.469  -1.125  -6.030
  Start of MODEL   10
 6805    H    ARG  66           HN       ARG  66  -9.470  -3.473   1.870
  Start of MODEL   10
 6806    HA   HIS  67           HA       HIS  67  -5.025  -5.694   2.247
  Start of MODEL   10
 6807    HB3  HIS  67           HB2      HIS  67  -4.311  -8.078   2.557
  Start of MODEL   10
 6808    HB2  HIS  67           HB3      HIS  67  -5.699  -8.584   1.610
  Start of MODEL   10
 6809    HD1  HIS  67           HD1      HIS  67  -4.701  -7.534   5.002
  Start of MODEL   10
 6810    HD2  HIS  67           HD2      HIS  67  -8.218  -8.284   2.920
  Start of MODEL   10
 6811    HE1  HIS  67           HE1      HIS  67  -6.489  -7.731   6.748
  Start of MODEL   10
 6812    HE2  HIS  67           HE2      HIS  67  -8.488  -8.543   5.466
  Start of MODEL   10
 6813    H    HIS  67           HN       HIS  67  -7.096  -6.803   0.495
  Start of MODEL   10
 6814    HA2  GLY  68           HA2      GLY  68  -2.013  -7.296  -0.654
  Start of MODEL   10
 6815    H    GLY  68           HN       GLY  68  -2.838  -5.972   1.636
  Start of MODEL   10
 6816    HA3  GLY  68           HA1      GLY  68  -2.306  -5.604  -1.056
  Start of MODEL   10
 6817    HA   CYS  69           HA       CYS  69   1.414  -4.907   0.927
  Start of MODEL   10
 6818    HB3  CYS  69           HB2      CYS  69   2.346  -7.519  -0.275
  Start of MODEL   10
 6819    HB2  CYS  69           HB3      CYS  69   1.816  -7.235   1.382
  Start of MODEL   10
 6820    H    CYS  69           HN       CYS  69   0.149  -6.098  -1.387
  Start of MODEL   10
 6821    HA   LEU  70           HA       LEU  70   3.756  -3.207  -2.354
  Start of MODEL   10
 6822    HB3  LEU  70           HB2      LEU  70   4.612  -1.705   0.139
  Start of MODEL   10
 6823    HB2  LEU  70           HB3      LEU  70   3.266  -1.228  -0.879
  Start of MODEL   10
 6824    HG   LEU  70           HG       LEU  70   6.119  -1.372  -1.850
  Start of MODEL   10
 6825   HD11  LEU  70          HD11      LEU  70   3.650  -0.141  -3.004
  Start of MODEL   10
 6826   HD13  LEU  70          HD12      LEU  70   4.551  -1.521  -3.644
  Start of MODEL   10
 6827   HD12  LEU  70          HD13      LEU  70   5.276   0.094  -3.627
  Start of MODEL   10
 6828   HD21  LEU  70          HD21      LEU  70   5.960   0.304  -0.082
  Start of MODEL   10
 6829   HD23  LEU  70          HD22      LEU  70   4.588   1.045  -0.918
  Start of MODEL   10
 6830   HD22  LEU  70          HD23      LEU  70   6.185   1.041  -1.670
  Start of MODEL   10
 6831    H    LEU  70           HN       LEU  70   3.047  -3.596   0.447
  Start of MODEL   10
 6832    HA   ARG  71           HA       ARG  71   7.240  -5.448  -0.979
  Start of MODEL   10
 6833    HB3  ARG  71           HB2      ARG  71   7.709  -7.406  -2.576
  Start of MODEL   10
 6834    HB2  ARG  71           HB3      ARG  71   6.153  -7.026  -3.294
  Start of MODEL   10
 6835    HG2  ARG  71           HG2      ARG  71   6.609  -7.736  -0.410
  Start of MODEL   10
 6836    HG3  ARG  71           HG3      ARG  71   5.053  -7.393  -1.162
  Start of MODEL   10
 6837    HD2  ARG  71           HD2      ARG  71   5.298  -9.321  -2.610
  Start of MODEL   10
 6838    HD3  ARG  71           HD3      ARG  71   6.910  -9.620  -1.970
  Start of MODEL   10
 6839    HE   ARG  71           HE       ARG  71   5.955 -10.267   0.087
  Start of MODEL   10
 6840   HH11  ARG  71          HH11      ARG  71   3.562  -9.869  -2.503
  Start of MODEL   10
 6841   HH12  ARG  71          HH12      ARG  71   2.373 -10.843  -1.762
  Start of MODEL   10
 6842   HH21  ARG  71          HH21      ARG  71   4.292 -11.618   1.122
  Start of MODEL   10
 6843   HH22  ARG  71          HH22      ARG  71   2.798 -11.839   0.337
  Start of MODEL   10
 6844    H    ARG  71           HN       ARG  71   5.159  -4.794  -2.898
  Start of MODEL   10
 6845    HA   LEU  72           HA       LEU  72   9.965  -3.896  -3.859
  Start of MODEL   10
 6846    HB3  LEU  72           HB2      LEU  72  11.712  -2.658  -2.745
  Start of MODEL   10
 6847    HB2  LEU  72           HB3      LEU  72  11.378  -3.364  -1.201
  Start of MODEL   10
 6848    HG   LEU  72           HG       LEU  72   9.370  -1.667  -2.668
  Start of MODEL   10
 6849   HD12  LEU  72          HD11      LEU  72   8.439  -1.216  -0.460
  Start of MODEL   10
 6850   HD11  LEU  72          HD12      LEU  72   9.632  -2.297   0.261
  Start of MODEL   10
 6851   HD13  LEU  72          HD13      LEU  72   8.423  -2.934  -0.857
  Start of MODEL   10
 6852   HD22  LEU  72          HD21      LEU  72  10.114   0.254  -1.437
  Start of MODEL   10
 6853   HD21  LEU  72          HD22      LEU  72  11.423  -0.378  -2.432
  Start of MODEL   10
 6854   HD23  LEU  72          HD23      LEU  72  11.409  -0.683  -0.689
  Start of MODEL   10
 6855    H    LEU  72           HN       LEU  72   9.204  -5.012  -1.276
  Start of MODEL   10
 6856    HA   ASN  73           HA       ASN  73  12.169  -7.675  -4.008
  Start of MODEL   10
 6857    HB3  ASN  73           HB2      ASN  73  12.408  -6.353  -6.735
  Start of MODEL   10
 6858    HB2  ASN  73           HB3      ASN  73  11.202  -7.553  -6.283
  Start of MODEL   10
 6859   HD21  ASN  73          HD21      ASN  73  11.783  -9.704  -6.123
  Start of MODEL   10
 6860   HD22  ASN  73          HD22      ASN  73  13.274 -10.319  -6.714
  Start of MODEL   10
 6861    H    ASN  73           HN       ASN  73  10.874  -5.326  -4.969
  Start of MODEL   10
 6862    HA   GLN  74           HA       GLN  74  15.797  -4.994  -3.805
  Start of MODEL   10
 6863    HB3  GLN  74           HB2      GLN  74  16.806  -3.498  -5.669
  Start of MODEL   10
 6864    HB2  GLN  74           HB3      GLN  74  15.455  -4.054  -6.638
  Start of MODEL   10
 6865    HG2  GLN  74           HG2      GLN  74  16.209  -6.402  -6.145
  Start of MODEL   10
 6866    HG3  GLN  74           HG3      GLN  74  17.261  -5.446  -7.189
  Start of MODEL   10
 6867   HE21  GLN  74          HE21      GLN  74  19.081  -6.601  -6.719
  Start of MODEL   10
 6868   HE22  GLN  74          HE22      GLN  74  19.880  -6.564  -5.193
  Start of MODEL   10
 6869    H    GLN  74           HN       GLN  74  13.328  -4.607  -5.286
  Start of MODEL   10
 6870    HA   PRO  75           HA       PRO  75  14.173  -1.011  -2.525
  Start of MODEL   10
 6871    HB3  PRO  75           HB2      PRO  75  13.651  -1.488  -0.356
  Start of MODEL   10
 6872    HB2  PRO  75           HB3      PRO  75  15.367  -1.480   0.043
  Start of MODEL   10
 6873    HG2  PRO  75           HG2      PRO  75  15.123  -3.702   0.408
  Start of MODEL   10
 6874    HG3  PRO  75           HG3      PRO  75  13.574  -3.752  -0.448
  Start of MODEL   10
 6875    HD2  PRO  75           HD2      PRO  75  16.341  -4.083  -1.498
  Start of MODEL   10
 6876    HD3  PRO  75           HD3      PRO  75  14.824  -4.866  -2.005
  Start of MODEL   10
 6877    HA   THR  76           HA       THR  76  18.367   0.320  -1.991
  Start of MODEL   10
 6878    HB   THR  76           HB       THR  76  18.684   2.464  -3.386
  Start of MODEL   10
 6879    HG1  THR  76           HG1      THR  76  15.900   2.058  -3.671
  Start of MODEL   10
 6880   HG23  THR  76          HG21      THR  76  19.084   0.237  -4.331
  Start of MODEL   10
 6881   HG22  THR  76          HG22      THR  76  18.357   1.303  -5.531
  Start of MODEL   10
 6882   HG21  THR  76          HG23      THR  76  17.370   0.087  -4.717
  Start of MODEL   10
 6883    H    THR  76           HN       THR  76  15.518   0.899  -2.084
  Start of MODEL   10
 6884    HA   HIS  77           HA       HIS  77  18.595   3.172   1.207
  Start of MODEL   10
 6885    HB3  HIS  77           HB2      HIS  77  20.970   3.598   0.483
  Start of MODEL   10
 6886    HB2  HIS  77           HB3      HIS  77  20.239   4.883   1.433
  Start of MODEL   10
 6887    HD1  HIS  77           HD1      HIS  77  20.211   7.262   0.424
  Start of MODEL   10
 6888    HD2  HIS  77           HD2      HIS  77  21.211   4.288  -2.283
  Start of MODEL   10
 6889    HE1  HIS  77           HE1      HIS  77  21.028   8.457  -1.583
  Start of MODEL   10
 6890    HE2  HIS  77           HE2      HIS  77  21.840   6.654  -3.124
  Start of MODEL   10
 6891    H    HIS  77           HN       HIS  77  19.478   2.711  -1.461
  Start of MODEL   10
 6892    HA   VAL  78           HA       VAL  78  16.772   6.906  -0.827
  Start of MODEL   10
 6893    HB   VAL  78           HB       VAL  78  15.467   7.248  -2.863
  Start of MODEL   10
 6894    H    VAL  78           HN       VAL  78  17.511   4.409  -1.753
  Start of MODEL   10
 6895    HA   ASN  79           HA       ASN  79  12.784   4.409  -0.144
  Start of MODEL   10
 6896    HB3  ASN  79           HB2      ASN  79  12.610   1.954   0.322
  Start of MODEL   10
 6897    HB2  ASN  79           HB3      ASN  79  14.356   1.868   0.101
  Start of MODEL   10
 6898   HD21  ASN  79          HD21      ASN  79  11.363   2.663  -1.394
  Start of MODEL   10
 6899   HD22  ASN  79          HD22      ASN  79  11.926   2.489  -3.024
  Start of MODEL   10
 6900    H    ASN  79           HN       ASN  79  15.632   3.852  -0.189
  Start of MODEL   10
 6901    HA   ASN  80           HA       ASN  80  13.533   4.191   4.248
  Start of MODEL   10
 6902    HB3  ASN  80           HB2      ASN  80  15.434   5.311   5.465
  Start of MODEL   10
 6903    HB2  ASN  80           HB3      ASN  80  16.111   5.758   3.911
  Start of MODEL   10
 6904   HD21  ASN  80          HD21      ASN  80  17.274   4.178   5.993
  Start of MODEL   10
 6905   HD22  ASN  80          HD22      ASN  80  17.717   2.694   5.237
  Start of MODEL   10
 6906    H    ASN  80           HN       ASN  80  14.644   5.475   1.846
  Start of MODEL   10
 6907    HA2  GLY  81           HA2      GLY  81  11.842   7.961   5.549
  Start of MODEL   10
 6908    H    GLY  81           HN       GLY  81  11.705   5.365   4.567
  Start of MODEL   10
 6909    HA3  GLY  81           HA1      GLY  81  11.445   8.070   3.840
  Start of MODEL   10
 6910    HA   ASN  82           HA       ASN  82   7.690   7.416   6.123
  Start of MODEL   10
 6911    HB3  ASN  82           HB2      ASN  82   6.026   9.305   5.680
  Start of MODEL   10
 6912    HB2  ASN  82           HB3      ASN  82   7.317  10.127   4.831
  Start of MODEL   10
 6913   HD21  ASN  82          HD21      ASN  82   9.361   9.249   6.768
  Start of MODEL   10
 6914   HD22  ASN  82          HD22      ASN  82   9.105  10.246   8.147
  Start of MODEL   10
 6915    H    ASN  82           HN       ASN  82   9.449   9.025   4.543
  Start of MODEL   10
 6916    HA   TYR  83           HA       TYR  83   5.725   6.247   2.312
  Start of MODEL   10
 6917    HB3  TYR  83           HB2      TYR  83   4.856   3.841   2.573
  Start of MODEL   10
 6918    HB2  TYR  83           HB3      TYR  83   5.693   3.828   4.118
  Start of MODEL   10
 6919    HD1  TYR  83           HD1      TYR  83   6.051   3.383   0.571
  Start of MODEL   10
 6920    HD2  TYR  83           HD2      TYR  83   8.186   4.224   4.155
  Start of MODEL   10
 6921    HE1  TYR  83           HE1      TYR  83   8.164   2.725  -0.522
  Start of MODEL   10
 6922    HE2  TYR  83           HE2      TYR  83  10.281   3.568   3.073
  Start of MODEL   10
 6923    HH   TYR  83           HH       TYR  83  10.422   3.023  -0.319
  Start of MODEL   10
 6924    H    TYR  83           HN       TYR  83   6.491   5.848   5.097
  Start of MODEL   10
 6925    HA   THR  84           HA       THR  84   1.820   7.146   4.055
  Start of MODEL   10
 6926    HB   THR  84           HB       THR  84   2.413   9.249   1.974
  Start of MODEL   10
 6927    HG1  THR  84           HG1      THR  84   2.624   9.355   4.808
  Start of MODEL   10
 6928   HG23  THR  84          HG21      THR  84   0.003   9.106   2.412
  Start of MODEL   10
 6929   HG22  THR  84          HG22      THR  84   0.658  10.584   3.113
  Start of MODEL   10
 6930   HG21  THR  84          HG23      THR  84   0.299   9.197   4.148
  Start of MODEL   10
 6931    H    THR  84           HN       THR  84   3.987   7.431   2.137
  Start of MODEL   10
 6932    HA   LEU  85           HA       LEU  85  -0.402   5.524   0.640
  Start of MODEL   10
 6933    HB3  LEU  85           HB2      LEU  85  -1.392   4.077   3.109
  Start of MODEL   10
 6934    HB2  LEU  85           HB3      LEU  85  -0.115   3.531   2.038
  Start of MODEL   10
 6935    HG   LEU  85           HG       LEU  85  -3.026   3.789   1.285
  Start of MODEL   10
 6936   HD12  LEU  85          HD11      LEU  85  -2.323   2.571  -0.717
  Start of MODEL   10
 6937   HD11  LEU  85          HD12      LEU  85  -0.639   2.762  -0.174
  Start of MODEL   10
 6938   HD13  LEU  85          HD13      LEU  85  -1.604   4.184  -0.586
  Start of MODEL   10
 6939   HD23  LEU  85          HD21      LEU  85  -1.347   1.337   1.757
  Start of MODEL   10
 6940   HD22  LEU  85          HD22      LEU  85  -3.051   1.391   1.271
  Start of MODEL   10
 6941   HD21  LEU  85          HD23      LEU  85  -2.560   1.983   2.859
  Start of MODEL   10
 6942    H    LEU  85           HN       LEU  85   0.082   6.074   3.475
  Start of MODEL   10
 6943    HA   LEU  86           HA       LEU  86  -4.037   7.863   1.446
  Start of MODEL   10
 6944    HB3  LEU  86           HB2      LEU  86  -4.567   9.243  -0.496
  Start of MODEL   10
 6945    HB2  LEU  86           HB3      LEU  86  -3.429   8.373  -1.474
  Start of MODEL   10
 6946    HG   LEU  86           HG       LEU  86  -2.754  10.675  -0.828
  Start of MODEL   10
 6947   HD11  LEU  86          HD11      LEU  86  -2.490   9.544   1.924
  Start of MODEL   10
 6948   HD13  LEU  86          HD12      LEU  86  -3.596  10.806   1.379
  Start of MODEL   10
 6949   HD12  LEU  86          HD13      LEU  86  -1.858  11.097   1.385
  Start of MODEL   10
 6950   HD23  LEU  86          HD21      LEU  86  -0.879   8.503   0.098
  Start of MODEL   10
 6951   HD22  LEU  86          HD22      LEU  86  -0.416  10.148  -0.346
  Start of MODEL   10
 6952   HD21  LEU  86          HD23      LEU  86  -1.095   9.057  -1.562
  Start of MODEL   10
 6953    H    LEU  86           HN       LEU  86  -2.004   6.562  -0.245
  Start of MODEL   10
 6954    HA   ALA  87           HA       ALA  87  -6.831   5.598  -1.153
  Start of MODEL   10
 6955    HB1  ALA  87           HB1      ALA  87  -7.789   5.232   1.687
  Start of MODEL   10
 6956    HB3  ALA  87           HB2      ALA  87  -6.633   4.199   0.855
  Start of MODEL   10
 6957    HB2  ALA  87           HB3      ALA  87  -8.304   4.276   0.298
  Start of MODEL   10
 6958    H    ALA  87           HN       ALA  87  -6.163   7.374   1.099
  Start of MODEL   10
 6959    HA   ALA  88           HA       ALA  88 -10.237   8.333  -0.868
  Start of MODEL   10
 6960    HB1  ALA  88           HB1      ALA  88  -8.640   9.576  -2.267
  Start of MODEL   10
 6961    HB3  ALA  88           HB2      ALA  88 -10.309   9.781  -2.790
  Start of MODEL   10
 6962    HB2  ALA  88           HB3      ALA  88  -9.233   8.700  -3.680
  Start of MODEL   10
 6963    H    ALA  88           HN       ALA  88  -8.385   6.532  -2.298
  Start of MODEL   10
 6964    HA   ASN  89           HA       ASN  89 -13.395   6.642  -3.349
  Start of MODEL   10
 6965    HB3  ASN  89           HB2      ASN  89 -12.990   4.684  -1.826
  Start of MODEL   10
 6966    HB2  ASN  89           HB3      ASN  89 -14.681   4.898  -2.123
  Start of MODEL   10
 6967   HD21  ASN  89          HD21      ASN  89 -13.713   3.375  -0.092
  Start of MODEL   10
 6968   HD22  ASN  89          HD22      ASN  89 -14.123   4.075   1.432
  Start of MODEL   10
 6969    H    ASN  89           HN       ASN  89 -12.262   7.822  -0.951
  Start of MODEL   10
 6970    HA   PRO  90           HA       PRO  90 -16.992   9.330  -2.891
  Start of MODEL   10
 6971    HB3  PRO  90           HB2      PRO  90 -19.082   8.319  -2.656
  Start of MODEL   10
 6972    HB2  PRO  90           HB3      PRO  90 -18.472   7.140  -1.484
  Start of MODEL   10
 6973    HG2  PRO  90           HG2      PRO  90 -18.468   5.913  -3.504
  Start of MODEL   10
 6974    HG3  PRO  90           HG3      PRO  90 -17.933   7.323  -4.439
  Start of MODEL   10
 6975    HD2  PRO  90           HD2      PRO  90 -16.387   5.512  -2.681
  Start of MODEL   10
 6976    HD3  PRO  90           HD3      PRO  90 -15.862   6.348  -4.163
  Start of MODEL   10
 6977    HA   CYS  91           HA       CYS  91 -17.462   9.519   1.767
  Start of MODEL   10
 6978    HB3  CYS  91           HB2      CYS  91 -15.365   7.438   2.401
  Start of MODEL   10
 6979    HB2  CYS  91           HB3      CYS  91 -17.104   7.261   2.582
  Start of MODEL   10
 6980    H    CYS  91           HN       CYS  91 -16.069   7.654   0.078
  Start of MODEL   10
 6981    HA2  GLY  92           HA2      GLY  92 -13.330  11.660   0.420
  Start of MODEL   10
 6982    H    GLY  92           HN       GLY  92 -14.219   9.222   0.434
  Start of MODEL   10
 6983    HA3  GLY  92           HA1      GLY  92 -13.247  11.355   2.153
  Start of MODEL   10
 6984    HA   GLN  93           HA       GLN  93  -9.550   9.397   0.715
  Start of MODEL   10
 6985    HB3  GLN  93           HB2      GLN  93  -8.602  12.253   0.827
  Start of MODEL   10
 6986    HB2  GLN  93           HB3      GLN  93  -9.189  11.455  -0.621
  Start of MODEL   10
 6987    HG2  GLN  93           HG2      GLN  93  -6.743  10.660   0.940
  Start of MODEL   10
 6988    HG3  GLN  93           HG3      GLN  93  -7.320   9.896  -0.540
  Start of MODEL   10
 6989   HE21  GLN  93          HE21      GLN  93  -5.510  10.380  -1.740
  Start of MODEL   10
 6990   HE22  GLN  93          HE22      GLN  93  -5.100  11.985  -2.207
  Start of MODEL   10
 6991    H    GLN  93           HN       GLN  93 -10.949  11.786   1.691
  Start of MODEL   10
 6992    HA   ALA  94           HA       ALA  94  -7.911   9.492   4.791
  Start of MODEL   10
 6993    HB3  ALA  94           HB1      ALA  94  -9.138   7.353   4.766
  Start of MODEL   10
 6994    HB2  ALA  94           HB2      ALA  94  -7.521   7.160   5.473
  Start of MODEL   10
 6995    HB1  ALA  94           HB3      ALA  94  -7.819   6.644   3.831
  Start of MODEL   10
 6996    H    ALA  94           HN       ALA  94  -8.450   8.342   2.137
  Start of MODEL   10
 6997    HA   SER  95           HA       SER  95  -3.710   8.288   3.857
  Start of MODEL   10
 6998    HB3  SER  95           HB2      SER  95  -3.771  10.704   3.735
  Start of MODEL   10
 6999    HB2  SER  95           HB3      SER  95  -2.358  10.235   4.676
  Start of MODEL   10
 7000    HG   SER  95           HG       SER  95  -3.314  10.879   6.500
  Start of MODEL   10
 7001    H    SER  95           HN       SER  95  -5.793   8.954   5.743
  Start of MODEL   10
 7002    HA   ALA  96           HA       ALA  96  -1.874   7.149   7.708
  Start of MODEL   10
 7003    HB2  ALA  96           HB1      ALA  96  -1.598   4.692   7.724
  Start of MODEL   10
 7004    HB1  ALA  96           HB2      ALA  96  -2.040   4.645   6.020
  Start of MODEL   10
 7005    HB3  ALA  96           HB3      ALA  96  -3.225   5.151   7.225
  Start of MODEL   10
 7006    H    ALA  96           HN       ALA  96  -2.194   7.069   4.797
  Start of MODEL   10
 7007    HA   SER  97           HA       SER  97   2.151   6.366   6.060
  Start of MODEL   10
 7008    HB3  SER  97           HB2      SER  97   3.580   8.129   7.006
  Start of MODEL   10
 7009    HB2  SER  97           HB3      SER  97   2.396   8.393   8.293
  Start of MODEL   10
 7010    HG   SER  97           HG       SER  97   1.000   8.498   6.182
  Start of MODEL   10
 7011    H    SER  97           HN       SER  97   0.316   6.463   8.310
  Start of MODEL   10
 7012    HA   ILE  98           HA       ILE  98   4.214   3.987   9.032
  Start of MODEL   10
 7013    HB   ILE  98           HB       ILE  98   3.057   2.294   7.647
  Start of MODEL   10
 7014   HD13  ILE  98          HD11      ILE  98   6.416   0.834   6.839
  Start of MODEL   10
 7015   HD12  ILE  98          HD12      ILE  98   6.828   0.409   8.505
  Start of MODEL   10
 7016   HD11  ILE  98          HD13      ILE  98   6.863   2.090   7.984
  Start of MODEL   10
 7017    H    ILE  98           HN       ILE  98   3.639   4.919   6.327
  Start of MODEL   10
 7018    HA   MET  99           HA       MET  99   8.118   5.461   7.883
  Start of MODEL   10
 7019    HB3  MET  99           HB2      MET  99   8.459   4.856  10.828
  Start of MODEL   10
 7020    HB2  MET  99           HB3      MET  99   7.787   6.354  10.186
  Start of MODEL   10
 7021    HG2  MET  99           HG2      MET  99  10.116   6.659  10.768
  Start of MODEL   10
 7022    HG3  MET  99           HG3      MET  99  10.574   5.303   9.732
  Start of MODEL   10
 7023    HE1  MET  99           HE1      MET  99  12.315   6.813   8.384
  Start of MODEL   10
 7024    HE3  MET  99           HE2      MET  99  11.920   8.188   9.434
  Start of MODEL   10
 7025    HE2  MET  99           HE3      MET  99  11.857   8.364   7.672
  Start of MODEL   10
 7026    H    MET  99           HN       MET  99   6.277   4.136   9.695
  Start of MODEL   10
 7027    HA   ALA 100           HA       ALA 100  10.282   1.701   7.824
  Start of MODEL   10
 7028    HB2  ALA 100           HB1      ALA 100  10.113   0.643   5.619
  Start of MODEL   10
 7029    HB1  ALA 100           HB2      ALA 100   9.360   2.106   4.979
  Start of MODEL   10
 7030    HB3  ALA 100           HB3      ALA 100   8.544   1.163   6.222
  Start of MODEL   10
 7031    H    ALA 100           HN       ALA 100   9.244   4.158   6.628
  Start of MODEL   10
 7032    HA   ALA 101           HA       ALA 101  13.996   2.889   5.826
  Start of MODEL   10
 7033    HB2  ALA 101           HB1      ALA 101  15.646   3.148   7.650
  Start of MODEL   10
 7034    HB1  ALA 101           HB2      ALA 101  14.481   2.457   8.781
  Start of MODEL   10
 7035    HB3  ALA 101           HB3      ALA 101  14.143   4.003   7.995
  Start of MODEL   10
 7036    H    ALA 101           HN       ALA 101  12.324   1.378   7.686
  Start of MODEL   10
 7037    HA   PHE 102           HA       PHE 102  15.160  -1.284   5.741
  Start of MODEL   10
 7038    HB3  PHE 102           HB2      PHE 102  15.447  -2.077   3.463
  Start of MODEL   10
 7039    HB2  PHE 102           HB3      PHE 102  15.610  -0.425   2.877
  Start of MODEL   10
 7040    HD1  PHE 102           HD1      PHE 102  13.177  -2.167   5.105
  Start of MODEL   10
 7041    HD2  PHE 102           HD2      PHE 102  13.784   0.226   1.646
  Start of MODEL   10
 7042    HE1  PHE 102           HE1      PHE 102  10.743  -2.066   4.749
  Start of MODEL   10
 7043    HE2  PHE 102           HE2      PHE 102  11.355   0.333   1.287
  Start of MODEL   10
 7044    HZ   PHE 102           HZ       PHE 102   9.833  -0.754   2.853
  Start of MODEL   10
 7045    H    PHE 102           HN       PHE 102  15.113   1.438   4.683
  Start of MODEL   10
 7046    HA   MET 103           HA       MET 103  19.529  -0.999   4.988
  Start of MODEL   10
 7047    HB3  MET 103           HB2      MET 103  19.398  -2.024   2.818
  Start of MODEL   10
 7048    HB2  MET 103           HB3      MET 103  20.863  -1.063   2.897
  Start of MODEL   10
 7049    HG2  MET 103           HG2      MET 103  18.337  -0.115   1.583
  Start of MODEL   10
 7050    HG3  MET 103           HG3      MET 103  19.933   0.633   1.526
  Start of MODEL   10
 7051    HE3  MET 103           HE1      MET 103  19.136  -3.262   1.266
  Start of MODEL   10
 7052    HE2  MET 103           HE2      MET 103  18.858  -3.399  -0.467
  Start of MODEL   10
 7053    HE1  MET 103           HE3      MET 103  17.764  -2.442   0.525
  Start of MODEL   10
 7054    H    MET 103           HN       MET 103  17.389   0.142   3.370
  Start of MODEL   10
 7055    HA   ASP 104           HA       ASP 104  21.333   2.602   6.079
  Start of MODEL   10
 7056    HB3  ASP 104           HB2      ASP 104  23.783   2.812   5.915
  Start of MODEL   10
 7057    HB2  ASP 104           HB3      ASP 104  23.803   1.438   4.823
  Start of MODEL   10
 7058    H    ASP 104           HN       ASP 104  21.595   0.122   4.831
  Start of MODEL   10
 7059    HA   ASN 105           HA       ASN 105  21.839   5.126   2.600
  Start of MODEL   10
 7060    HB3  ASN 105           HB2      ASN 105  19.455   5.550   3.427
  Start of MODEL   10
 7061    HB2  ASN 105           HB3      ASN 105  20.219   6.893   2.602
  Start of MODEL   10
 7062   HD21  ASN 105          HD21      ASN 105  19.126   5.731   5.711
  Start of MODEL   10
 7063   HD22  ASN 105          HD22      ASN 105  19.122   7.280   6.460
  Start of MODEL   10
 7064    H    ASN 105           HN       ASN 105  21.315   4.620   5.433
  Start of MODEL   10
 7065    HA   PRO 106           HA       PRO 106  25.227   7.664   4.065
  Start of MODEL   10
 7066    HB3  PRO 106           HB2      PRO 106  26.439   7.951   2.150
  Start of MODEL   10
 7067    HB2  PRO 106           HB3      PRO 106  25.196   8.986   1.452
  Start of MODEL   10
 7068    HG2  PRO 106           HG2      PRO 106  24.903   7.168   0.071
  Start of MODEL   10
 7069    HG3  PRO 106           HG3      PRO 106  25.520   6.036   1.285
  Start of MODEL   10
 7070    HD2  PRO 106           HD2      PRO 106  22.793   7.231   1.020
  Start of MODEL   10
 7071    HD3  PRO 106           HD3      PRO 106  23.282   5.574   1.447
  Start of MODEL   10
 7072    HA   PHE 107           HA       PHE 107  25.436  12.198   4.360
  Start of MODEL   10
 7073    HB3  PHE 107           HB2      PHE 107  22.628  11.894   3.210
  Start of MODEL   10
 7074    HB2  PHE 107           HB3      PHE 107  24.035  12.233   2.219
  Start of MODEL   10
 7075    HD1  PHE 107           HD1      PHE 107  21.820  13.602   4.818
  Start of MODEL   10
 7076    HD2  PHE 107           HD2      PHE 107  24.951  14.422   2.064
  Start of MODEL   10
 7077    HE1  PHE 107           HE1      PHE 107  21.501  16.016   5.173
  Start of MODEL   10
 7078    HE2  PHE 107           HE2      PHE 107  24.634  16.832   2.415
  Start of MODEL   10
 7079    HZ   PHE 107           HZ       PHE 107  22.935  17.637   3.951
  Start of MODEL   10
 7080    H    PHE 107           HN       PHE 107  25.824  10.087   3.797
  Start of MODEL   11
 7081    H1   ASP   1           H        ASP   1 -22.240   0.114  -9.901
  Start of MODEL   11
 7082    H2   ASP   1           H2       ASP   1 -23.311   1.278  -9.344
  Start of MODEL   11
 7083    H3   ASP   1           H3       ASP   1 -23.252  -0.209  -8.597
  Start of MODEL   11
 7084    HA   ASP   1           HA       ASP   1 -21.003   0.197  -7.818
  Start of MODEL   11
 7085    HB3  ASP   1           HB2      ASP   1 -20.104   2.473  -7.887
  Start of MODEL   11
 7086    HB2  ASP   1           HB3      ASP   1 -21.501   3.030  -8.796
  Start of MODEL   11
 7087    HA   ASP   2           HA       ASP   2 -23.270   2.963  -4.876
  Start of MODEL   11
 7088    HB3  ASP   2           HB2      ASP   2 -22.816   5.127  -5.912
  Start of MODEL   11
 7089    HB2  ASP   2           HB3      ASP   2 -24.408   5.161  -5.160
  Start of MODEL   11
 7090    H    ASP   2           HN       ASP   2 -23.033   3.115  -7.755
  Start of MODEL   11
 7091    HA   ASP   3           HA       ASP   3 -27.388   1.541  -6.430
  Start of MODEL   11
 7092    HB3  ASP   3           HB2      ASP   3 -26.417   0.695  -8.561
  Start of MODEL   11
 7093    HB2  ASP   3           HB3      ASP   3 -27.649  -0.372  -7.902
  Start of MODEL   11
 7094    H    ASP   3           HN       ASP   3 -24.540   1.008  -6.657
  Start of MODEL   11
 7095    HA   ASP   4           HA       ASP   4 -26.720  -1.797  -3.396
  Start of MODEL   11
 7096    HB3  ASP   4           HB2      ASP   4 -23.691  -1.718  -3.221
  Start of MODEL   11
 7097    HB2  ASP   4           HB3      ASP   4 -24.585  -2.743  -4.338
  Start of MODEL   11
 7098    H    ASP   4           HN       ASP   4 -24.888   0.059  -4.749
  Start of MODEL   11
 7099    HA   ASP   5           HA       ASP   5 -27.059   0.889  -0.133
  Start of MODEL   11
 7100    HB3  ASP   5           HB2      ASP   5 -27.553  -1.810   1.095
  Start of MODEL   11
 7101    HB2  ASP   5           HB3      ASP   5 -28.740  -0.763   0.332
  Start of MODEL   11
 7102    H    ASP   5           HN       ASP   5 -27.011  -1.644  -1.289
  Start of MODEL   11
 7103    HA   VAL   6           HA       VAL   6 -23.838  -0.427   2.692
  Start of MODEL   11
 7104    HB   VAL   6           HB       VAL   6 -22.073  -2.140   2.874
  Start of MODEL   11
 7105    H    VAL   6           HN       VAL   6 -24.691  -1.755   0.331
  Start of MODEL   11
 7106    HA   SER   7           HA       SER   7 -20.715   1.610   0.651
  Start of MODEL   11
 7107    HB3  SER   7           HB2      SER   7 -22.360   3.653   2.163
  Start of MODEL   11
 7108    HB2  SER   7           HB3      SER   7 -22.471   3.290   0.444
  Start of MODEL   11
 7109    HG   SER   7           HG       SER   7 -20.562   4.717   1.865
  Start of MODEL   11
 7110    H    SER   7           HN       SER   7 -22.873   1.305   2.584
  Start of MODEL   11
 7111    HA   PHE   8           HA       PHE   8 -18.511   1.626   4.437
  Start of MODEL   11
 7112    HB3  PHE   8           HB2      PHE   8 -16.579   0.031   4.301
  Start of MODEL   11
 7113    HB2  PHE   8           HB3      PHE   8 -17.179  -0.474   2.729
  Start of MODEL   11
 7114    HD1  PHE   8           HD1      PHE   8 -19.296  -1.693   2.542
  Start of MODEL   11
 7115    HD2  PHE   8           HD2      PHE   8 -17.611  -0.680   6.305
  Start of MODEL   11
 7116    HE1  PHE   8           HE1      PHE   8 -20.727  -3.361   3.630
  Start of MODEL   11
 7117    HE2  PHE   8           HE2      PHE   8 -19.048  -2.343   7.391
  Start of MODEL   11
 7118    HZ   PHE   8           HZ       PHE   8 -20.612  -3.679   6.032
  Start of MODEL   11
 7119    H    PHE   8           HN       PHE   8 -19.112   0.633   1.793
  Start of MODEL   11
 7120    HA   CYS   9           HA       CYS   9 -15.859   4.527   2.693
  Start of MODEL   11
 7121    HB3  CYS   9           HB2      CYS   9 -15.357   6.118   4.477
  Start of MODEL   11
 7122    HB2  CYS   9           HB3      CYS   9 -15.885   4.943   5.682
  Start of MODEL   11
 7123    H    CYS   9           HN       CYS   9 -17.097   3.074   4.838
  Start of MODEL   11
 7124    HA   ALA  10           HA       ALA  10 -12.058   2.755   3.354
  Start of MODEL   11
 7125    HB3  ALA  10           HB1      ALA  10 -10.295   3.887   2.171
  Start of MODEL   11
 7126    HB2  ALA  10           HB2      ALA  10 -11.115   5.427   2.343
  Start of MODEL   11
 7127    HB1  ALA  10           HB3      ALA  10 -11.816   4.178   1.317
  Start of MODEL   11
 7128    H    ALA  10           HN       ALA  10 -13.494   5.275   3.200
  Start of MODEL   11
 7129    HA   SER  11           HA       SER  11  -9.720   4.497   6.600
  Start of MODEL   11
 7130    HB3  SER  11           HB2      SER  11  -9.974   3.222   8.562
  Start of MODEL   11
 7131    HB2  SER  11           HB3      SER  11 -10.067   1.704   7.667
  Start of MODEL   11
 7132    HG   SER  11           HG       SER  11 -12.049   1.945   7.337
  Start of MODEL   11
 7133    H    SER  11           HN       SER  11 -10.890   2.294   5.042
  Start of MODEL   11
 7134    HA   VAL  12           HA       VAL  12  -6.257   2.118   5.335
  Start of MODEL   11
 7135    HB   VAL  12           HB       VAL  12  -5.320   5.008   5.514
  Start of MODEL   11
 7136    H    VAL  12           HN       VAL  12  -7.471   4.346   6.806
  Start of MODEL   11
 7137    HA   GLN  13           HA       GLN  13  -3.795   1.940   8.903
  Start of MODEL   11
 7138    HB3  GLN  13           HB2      GLN  13  -3.989  -0.322   9.952
  Start of MODEL   11
 7139    HB2  GLN  13           HB3      GLN  13  -5.058  -0.791   8.646
  Start of MODEL   11
 7140    HG2  GLN  13           HG2      GLN  13  -6.708   0.836   9.350
  Start of MODEL   11
 7141    HG3  GLN  13           HG3      GLN  13  -6.295  -0.265  10.665
  Start of MODEL   11
 7142   HE21  GLN  13          HE21      GLN  13  -5.011   0.540  12.396
  Start of MODEL   11
 7143   HE22  GLN  13          HE22      GLN  13  -4.875   2.226  12.681
  Start of MODEL   11
 7144    H    GLN  13           HN       GLN  13  -5.311   0.797   6.687
  Start of MODEL   11
 7145    HA   LEU  14           HA       LEU  14  -0.703  -0.204   6.734
  Start of MODEL   11
 7146    HB3  LEU  14           HB2      LEU  14   1.400   1.200   6.822
  Start of MODEL   11
 7147    HB2  LEU  14           HB3      LEU  14   0.472   2.408   7.701
  Start of MODEL   11
 7148    HG   LEU  14           HG       LEU  14  -1.129   2.399   5.697
  Start of MODEL   11
 7149   HD11  LEU  14          HD11      LEU  14   1.726   3.220   5.224
  Start of MODEL   11
 7150   HD13  LEU  14          HD12      LEU  14   0.476   4.202   6.007
  Start of MODEL   11
 7151   HD12  LEU  14          HD13      LEU  14   0.325   3.757   4.304
  Start of MODEL   11
 7152   HD21  LEU  14          HD21      LEU  14  -0.449   0.279   4.786
  Start of MODEL   11
 7153   HD23  LEU  14          HD22      LEU  14   1.178   0.911   4.514
  Start of MODEL   11
 7154   HD22  LEU  14          HD23      LEU  14  -0.184   1.576   3.618
  Start of MODEL   11
 7155    H    LEU  14           HN       LEU  14  -1.662   1.724   8.684
  Start of MODEL   11
 7156    HA   HIS  15           HA       HIS  15   1.576  -1.782  10.120
  Start of MODEL   11
 7157    HB3  HIS  15           HB2      HIS  15   1.708  -4.229   9.641
  Start of MODEL   11
 7158    HB2  HIS  15           HB3      HIS  15   1.299  -3.902   7.963
  Start of MODEL   11
 7159    HD1  HIS  15           HD1      HIS  15  -0.248  -4.475  11.270
  Start of MODEL   11
 7160    HD2  HIS  15           HD2      HIS  15  -1.421  -3.012   7.555
  Start of MODEL   11
 7161    HE1  HIS  15           HE1      HIS  15  -2.733  -4.421  11.322
  Start of MODEL   11
 7162    HE2  HIS  15           HE2      HIS  15  -3.435  -3.433   9.161
  Start of MODEL   11
 7163    H    HIS  15           HN       HIS  15   1.337  -1.312   7.239
  Start of MODEL   11
 7164    HA   THR  16           HA       THR  16   5.806  -1.295   9.592
  Start of MODEL   11
 7165    HB   THR  16           HB       THR  16   5.705  -3.586  11.553
  Start of MODEL   11
 7166    HG1  THR  16           HG1      THR  16   5.061  -0.856  11.749
  Start of MODEL   11
 7167   HG23  THR  16          HG21      THR  16   7.951  -2.864  10.786
  Start of MODEL   11
 7168   HG22  THR  16          HG22      THR  16   7.690  -2.486  12.491
  Start of MODEL   11
 7169   HG21  THR  16          HG23      THR  16   7.575  -1.212  11.280
  Start of MODEL   11
 7170    H    THR  16           HN       THR  16   3.556  -2.312  10.775
  Start of MODEL   11
 7171    HA   ALA  17           HA       ALA  17   6.778  -4.216   6.497
  Start of MODEL   11
 7172    HB2  ALA  17           HB1      ALA  17   9.433  -2.890   7.028
  Start of MODEL   11
 7173    HB1  ALA  17           HB2      ALA  17   8.190  -2.250   5.965
  Start of MODEL   11
 7174    HB3  ALA  17           HB3      ALA  17   8.974  -3.787   5.579
  Start of MODEL   11
 7175    H    ALA  17           HN       ALA  17   7.353  -2.109   8.252
  Start of MODEL   11
 7176    HA   VAL  18           HA       VAL  18   8.623  -7.317   8.842
  Start of MODEL   11
 7177    HB   VAL  18           HB       VAL  18   8.186  -9.577   7.852
  Start of MODEL   11
 7178    H    VAL  18           HN       VAL  18   7.589  -6.242   6.348
  Start of MODEL   11
 7179    HA   GLU  19           HA       GLU  19  12.496  -7.420   7.253
  Start of MODEL   11
 7180    HB3  GLU  19           HB2      GLU  19  12.720  -8.761   9.931
  Start of MODEL   11
 7181    HB2  GLU  19           HB3      GLU  19  12.658  -7.032   9.650
  Start of MODEL   11
 7182    HG2  GLU  19           HG2      GLU  19  14.824  -8.895   8.736
  Start of MODEL   11
 7183    HG3  GLU  19           HG3      GLU  19  14.754  -7.162   8.397
  Start of MODEL   11
 7184    H    GLU  19           HN       GLU  19  10.478  -8.428   9.038
  Start of MODEL   11
 7185    HA   MET  20           HA       MET  20  14.287 -11.024   5.784
  Start of MODEL   11
 7186    HB3  MET  20           HB2      MET  20  12.028 -11.972   5.735
  Start of MODEL   11
 7187    HB2  MET  20           HB3      MET  20  12.758 -12.192   4.156
  Start of MODEL   11
 7188    HG2  MET  20           HG2      MET  20  10.785 -10.036   4.852
  Start of MODEL   11
 7189    HG3  MET  20           HG3      MET  20  11.490 -10.337   3.267
  Start of MODEL   11
 7190    HE1  MET  20           HE1      MET  20   9.021 -10.412   2.218
  Start of MODEL   11
 7191    HE3  MET  20           HE2      MET  20   8.345 -10.117   3.818
  Start of MODEL   11
 7192    HE2  MET  20           HE3      MET  20   7.733 -11.444   2.835
  Start of MODEL   11
 7193    H    MET  20           HN       MET  20  13.098  -8.541   5.671
  Start of MODEL   11
 7194    HA   HIS  21           HA       HIS  21  15.922  -9.133   2.407
  Start of MODEL   11
 7195    HB3  HIS  21           HB2      HIS  21  16.298 -10.289   0.101
  Start of MODEL   11
 7196    HB2  HIS  21           HB3      HIS  21  15.626 -11.700   0.923
  Start of MODEL   11
 7197    HD1  HIS  21           HD1      HIS  21  18.496  -9.279   1.153
  Start of MODEL   11
 7198    HD2  HIS  21           HD2      HIS  21  17.331 -12.960   2.651
  Start of MODEL   11
 7199    HE1  HIS  21           HE1      HIS  21  20.478 -10.144   2.390
  Start of MODEL   11
 7200    HE2  HIS  21           HE2      HIS  21  19.647 -12.235   3.511
  Start of MODEL   11
 7201    H    HIS  21           HN       HIS  21  14.533 -11.513   3.080
  Start of MODEL   11
 7202    HA   HIS  22           HA       HIS  22  12.617  -7.976  -0.373
  Start of MODEL   11
 7203    HB3  HIS  22           HB2      HIS  22  10.310  -9.049  -0.881
  Start of MODEL   11
 7204    HB2  HIS  22           HB3      HIS  22  10.986 -10.500  -0.159
  Start of MODEL   11
 7205    HD1  HIS  22           HD1      HIS  22  10.122 -10.400  -3.132
  Start of MODEL   11
 7206    HD2  HIS  22           HD2      HIS  22  14.005  -9.826  -1.765
  Start of MODEL   11
 7207    HE1  HIS  22           HE1      HIS  22  11.606 -10.872  -5.086
  Start of MODEL   11
 7208    HE2  HIS  22           HE2      HIS  22  13.934 -10.407  -4.277
  Start of MODEL   11
 7209    H    HIS  22           HN       HIS  22  12.913 -10.384   1.250
  Start of MODEL   11
 7210    HA   TRP  23           HA       TRP  23  10.680  -6.538   3.159
  Start of MODEL   11
 7211    HB3  TRP  23           HB2      TRP  23  10.680  -4.008   3.094
  Start of MODEL   11
 7212    HB2  TRP  23           HB3      TRP  23  11.397  -4.161   1.482
  Start of MODEL   11
 7213    HD1  TRP  23           HD1      TRP  23  13.917  -4.783   1.275
  Start of MODEL   11
 7214    HE1  TRP  23           HE1      TRP  23  15.844  -4.927   2.993
  Start of MODEL   11
 7215    HE3  TRP  23           HE3      TRP  23  11.194  -4.624   5.598
  Start of MODEL   11
 7216    HZ2  TRP  23           HZ2      TRP  23  16.166  -4.958   5.783
  Start of MODEL   11
 7217    HZ3  TRP  23           HZ3      TRP  23  12.384  -4.712   7.746
  Start of MODEL   11
 7218    HH2  TRP  23           HH2      TRP  23  14.819  -4.872   7.838
  Start of MODEL   11
 7219    H    TRP  23           HN       TRP  23  11.839  -6.262   0.554
  Start of MODEL   11
 7220    HA   CYS  24           HA       CYS  24   6.748  -5.997   1.444
  Start of MODEL   11
 7221    HB3  CYS  24           HB2      CYS  24   6.638  -8.209   3.515
  Start of MODEL   11
 7222    HB2  CYS  24           HB3      CYS  24   6.855  -8.415   1.789
  Start of MODEL   11
 7223    H    CYS  24           HN       CYS  24   8.695  -6.801   3.476
  Start of MODEL   11
 7224    HA   ILE  25           HA       ILE  25   5.108  -3.724   4.824
  Start of MODEL   11
 7225    HB   ILE  25           HB       ILE  25   4.673  -1.986   2.378
  Start of MODEL   11
 7226   HD12  ILE  25          HD11      ILE  25   7.882  -0.135   3.100
  Start of MODEL   11
 7227   HD11  ILE  25          HD12      ILE  25   6.283   0.377   3.650
  Start of MODEL   11
 7228   HD13  ILE  25          HD13      ILE  25   6.505  -0.189   1.997
  Start of MODEL   11
 7229    H    ILE  25           HN       ILE  25   5.530  -4.351   1.987
  Start of MODEL   11
 7230    HA   PRO  26           HA       PRO  26   1.064  -5.438   3.598
  Start of MODEL   11
 7231    HB3  PRO  26           HB2      PRO  26   0.723  -6.955   5.255
  Start of MODEL   11
 7232    HB2  PRO  26           HB3      PRO  26   0.571  -5.672   6.454
  Start of MODEL   11
 7233    HG2  PRO  26           HG2      PRO  26   2.574  -6.525   7.204
  Start of MODEL   11
 7234    HG3  PRO  26           HG3      PRO  26   2.978  -7.198   5.615
  Start of MODEL   11
 7235    HD2  PRO  26           HD2      PRO  26   3.312  -4.401   6.628
  Start of MODEL   11
 7236    HD3  PRO  26           HD3      PRO  26   4.402  -5.397   5.634
  Start of MODEL   11
 7237    HA   PHE  27           HA       PHE  27  -1.300  -2.155   5.220
  Start of MODEL   11
 7238    HB3  PHE  27           HB2      PHE  27  -0.461  -1.058   3.197
  Start of MODEL   11
 7239    HB2  PHE  27           HB3      PHE  27  -2.149  -0.670   3.464
  Start of MODEL   11
 7240    HD1  PHE  27           HD1      PHE  27  -3.894  -1.539   2.001
  Start of MODEL   11
 7241    HD2  PHE  27           HD2      PHE  27   0.232  -2.231   1.252
  Start of MODEL   11
 7242    HE1  PHE  27           HE1      PHE  27  -4.426  -2.158  -0.313
  Start of MODEL   11
 7243    HE2  PHE  27           HE2      PHE  27  -0.291  -2.852  -1.059
  Start of MODEL   11
 7244    HZ   PHE  27           HZ       PHE  27  -2.624  -2.816  -1.848
  Start of MODEL   11
 7245    H    PHE  27           HN       PHE  27  -0.709  -4.238   3.258
  Start of MODEL   11
 7246    HA   SER  28           HA       SER  28  -5.369  -3.549   4.419
  Start of MODEL   11
 7247    HB3  SER  28           HB2      SER  28  -6.343  -3.815   6.652
  Start of MODEL   11
 7248    HB2  SER  28           HB3      SER  28  -5.148  -2.699   7.319
  Start of MODEL   11
 7249    HG   SER  28           HG       SER  28  -3.978  -4.644   5.877
  Start of MODEL   11
 7250    H    SER  28           HN       SER  28  -3.497  -1.590   5.462
  Start of MODEL   11
 7251    HA   VAL  29           HA       VAL  29  -7.690   0.159   4.407
  Start of MODEL   11
 7252    HB   VAL  29           HB       VAL  29  -6.295   0.879   2.454
  Start of MODEL   11
 7253    H    VAL  29           HN       VAL  29  -6.623  -2.293   3.216
  Start of MODEL   11
 7254    HA   ASP  30           HA       ASP  30 -11.245  -2.110   3.373
  Start of MODEL   11
 7255    HB3  ASP  30           HB2      ASP  30 -11.161  -2.237   5.887
  Start of MODEL   11
 7256    HB2  ASP  30           HB3      ASP  30 -12.775  -2.334   5.198
  Start of MODEL   11
 7257    H    ASP  30           HN       ASP  30  -9.839   0.057   4.766
  Start of MODEL   11
 7258    HA2  GLY  31           HA2      GLY  31 -15.051   0.296   2.842
  Start of MODEL   11
 7259    H    GLY  31           HN       GLY  31 -13.471  -1.818   2.887
  Start of MODEL   11
 7260    HA3  GLY  31           HA1      GLY  31 -13.849   0.766   1.645
  Start of MODEL   11
 7261    HA   GLN  32           HA       GLN  32 -16.084  -1.984  -0.701
  Start of MODEL   11
 7262    HB3  GLN  32           HB2      GLN  32 -18.562  -1.523  -1.455
  Start of MODEL   11
 7263    HB2  GLN  32           HB3      GLN  32 -18.575  -0.492  -0.024
  Start of MODEL   11
 7264    HG2  GLN  32           HG2      GLN  32 -17.821  -2.404   1.322
  Start of MODEL   11
 7265    HG3  GLN  32           HG3      GLN  32 -19.390  -2.688   0.554
  Start of MODEL   11
 7266   HE21  GLN  32          HE21      GLN  32 -15.981  -3.522   0.545
  Start of MODEL   11
 7267   HE22  GLN  32          HE22      GLN  32 -16.149  -4.942  -0.411
  Start of MODEL   11
 7268    H    GLN  32           HN       GLN  32 -16.234   0.586   0.625
  Start of MODEL   11
 7269    HA   PRO  33           HA       PRO  33 -16.197   0.924  -4.360
  Start of MODEL   11
 7270    HB3  PRO  33           HB2      PRO  33 -16.842   3.161  -4.446
  Start of MODEL   11
 7271    HB2  PRO  33           HB3      PRO  33 -15.736   3.591  -3.140
  Start of MODEL   11
 7272    HG2  PRO  33           HG2      PRO  33 -17.756   3.827  -2.012
  Start of MODEL   11
 7273    HG3  PRO  33           HG3      PRO  33 -18.548   2.586  -2.996
  Start of MODEL   11
 7274    HD2  PRO  33           HD2      PRO  33 -16.673   2.250  -0.688
  Start of MODEL   11
 7275    HD3  PRO  33           HD3      PRO  33 -18.155   1.349  -1.073
  Start of MODEL   11
 7276    HA   ALA  34           HA       ALA  34 -12.087   0.194  -3.055
  Start of MODEL   11
 7277    HB2  ALA  34           HB1      ALA  34 -10.716  -0.477  -4.959
  Start of MODEL   11
 7278    HB1  ALA  34           HB2      ALA  34 -11.943   0.124  -6.071
  Start of MODEL   11
 7279    HB3  ALA  34           HB3      ALA  34 -12.301  -1.251  -5.024
  Start of MODEL   11
 7280    H    ALA  34           HN       ALA  34 -14.174   0.404  -4.900
  Start of MODEL   11
 7281    HA   PRO  35           HA       PRO  35 -10.994   4.521  -3.376
  Start of MODEL   11
 7282    HB3  PRO  35           HB2      PRO  35 -10.987   4.534  -1.058
  Start of MODEL   11
 7283    HB2  PRO  35           HB3      PRO  35  -9.251   4.595  -1.360
  Start of MODEL   11
 7284    HG2  PRO  35           HG2      PRO  35  -8.991   2.307  -1.005
  Start of MODEL   11
 7285    HG3  PRO  35           HG3      PRO  35 -10.282   2.661   0.157
  Start of MODEL   11
 7286    HD2  PRO  35           HD2      PRO  35 -10.525   0.782  -1.768
  Start of MODEL   11
 7287    HD3  PRO  35           HD3      PRO  35 -11.913   1.738  -1.201
  Start of MODEL   11
 7288    HA   SER  36           HA       SER  36  -7.487   3.907  -5.812
  Start of MODEL   11
 7289    HB3  SER  36           HB2      SER  36  -8.374   5.643  -7.119
  Start of MODEL   11
 7290    HB2  SER  36           HB3      SER  36  -6.801   6.275  -6.638
  Start of MODEL   11
 7291    HG   SER  36           HG       SER  36  -9.364   7.047  -5.878
  Start of MODEL   11
 7292    H    SER  36           HN       SER  36  -9.493   5.433  -4.587
  Start of MODEL   11
 7293    HA   LEU  37           HA       LEU  37  -4.733   4.515  -2.473
  Start of MODEL   11
 7294    HB3  LEU  37           HB2      LEU  37  -3.291   2.540  -2.338
  Start of MODEL   11
 7295    HB2  LEU  37           HB3      LEU  37  -3.891   1.981  -3.884
  Start of MODEL   11
 7296    HG   LEU  37           HG       LEU  37  -6.153   1.732  -2.855
  Start of MODEL   11
 7297   HD13  LEU  37          HD11      LEU  37  -4.586  -0.138  -3.026
  Start of MODEL   11
 7298   HD12  LEU  37          HD12      LEU  37  -5.614  -0.263  -1.605
  Start of MODEL   11
 7299   HD11  LEU  37          HD13      LEU  37  -3.942   0.263  -1.433
  Start of MODEL   11
 7300   HD22  LEU  37          HD21      LEU  37  -6.295   1.753  -0.387
  Start of MODEL   11
 7301   HD21  LEU  37          HD22      LEU  37  -5.951   3.342  -1.061
  Start of MODEL   11
 7302   HD23  LEU  37          HD23      LEU  37  -4.651   2.389  -0.333
  Start of MODEL   11
 7303    H    LEU  37           HN       LEU  37  -5.778   3.209  -4.825
  Start of MODEL   11
 7304    HA   ARG  38           HA       ARG  38  -1.089   5.576  -4.594
  Start of MODEL   11
 7305    HB3  ARG  38           HB2      ARG  38  -2.439   8.195  -3.875
  Start of MODEL   11
 7306    HB2  ARG  38           HB3      ARG  38  -2.563   7.353  -5.400
  Start of MODEL   11
 7307    HG2  ARG  38           HG2      ARG  38  -1.100   9.184  -5.794
  Start of MODEL   11
 7308    HG3  ARG  38           HG3      ARG  38  -0.189   8.867  -4.324
  Start of MODEL   11
 7309    HD2  ARG  38           HD2      ARG  38   0.688   8.251  -6.713
  Start of MODEL   11
 7310    HD3  ARG  38           HD3      ARG  38   1.055   7.262  -5.305
  Start of MODEL   11
 7311    HE   ARG  38           HE       ARG  38  -1.286   6.688  -7.011
  Start of MODEL   11
 7312   HH11  ARG  38          HH11      ARG  38   2.037   5.550  -6.233
  Start of MODEL   11
 7313   HH12  ARG  38          HH12      ARG  38   1.671   3.920  -6.554
  Start of MODEL   11
 7314   HH21  ARG  38          HH21      ARG  38  -1.692   4.447  -7.502
  Start of MODEL   11
 7315   HH22  ARG  38          HH22      ARG  38  -0.472   3.288  -7.310
  Start of MODEL   11
 7316    H    ARG  38           HN       ARG  38  -3.107   5.852  -2.519
  Start of MODEL   11
 7317    HA   TRP  39           HA       TRP  39   1.235   6.094  -1.016
  Start of MODEL   11
 7318    HB3  TRP  39           HB2      TRP  39   3.469   5.134  -1.393
  Start of MODEL   11
 7319    HB2  TRP  39           HB3      TRP  39   3.093   4.987  -3.104
  Start of MODEL   11
 7320    HD1  TRP  39           HD1      TRP  39   1.539   3.049  -3.906
  Start of MODEL   11
 7321    HE1  TRP  39           HE1      TRP  39   0.858   0.863  -2.823
  Start of MODEL   11
 7322    HE3  TRP  39           HE3      TRP  39   2.861   4.138   0.904
  Start of MODEL   11
 7323    HZ2  TRP  39           HZ2      TRP  39   0.850  -0.290  -0.208
  Start of MODEL   11
 7324    HZ3  TRP  39           HZ3      TRP  39   2.490   2.436   2.640
  Start of MODEL   11
 7325    HH2  TRP  39           HH2      TRP  39   1.510   0.271   2.097
  Start of MODEL   11
 7326    H    TRP  39           HN       TRP  39   0.842   5.550  -3.828
  Start of MODEL   11
 7327    HA   LEU  40           HA       LEU  40   3.697   9.491  -2.198
  Start of MODEL   11
 7328    HB3  LEU  40           HB2      LEU  40   2.673  10.306   0.526
  Start of MODEL   11
 7329    HB2  LEU  40           HB3      LEU  40   1.655  10.387  -0.906
  Start of MODEL   11
 7330    HG   LEU  40           HG       LEU  40   4.254  11.862  -0.687
  Start of MODEL   11
 7331   HD11  LEU  40          HD11      LEU  40   1.907  12.022  -2.546
  Start of MODEL   11
 7332   HD13  LEU  40          HD12      LEU  40   3.507  11.402  -2.917
  Start of MODEL   11
 7333   HD12  LEU  40          HD13      LEU  40   3.293  13.123  -2.554
  Start of MODEL   11
 7334   HD22  LEU  40          HD21      LEU  40   2.892  13.845  -0.224
  Start of MODEL   11
 7335   HD21  LEU  40          HD22      LEU  40   2.709  12.646   1.056
  Start of MODEL   11
 7336   HD23  LEU  40          HD23      LEU  40   1.443  12.841  -0.157
  Start of MODEL   11
 7337    H    LEU  40           HN       LEU  40   2.269   7.772  -0.296
  Start of MODEL   11
 7338    HA   PHE  41           HA       PHE  41   6.803   8.380   0.649
  Start of MODEL   11
 7339    HB3  PHE  41           HB2      PHE  41   7.927   8.115  -2.153
  Start of MODEL   11
 7340    HB2  PHE  41           HB3      PHE  41   7.144   6.845  -1.233
  Start of MODEL   11
 7341    HD1  PHE  41           HD1      PHE  41  10.194   7.937  -2.303
  Start of MODEL   11
 7342    HD2  PHE  41           HD2      PHE  41   8.262   6.611   1.246
  Start of MODEL   11
 7343    HE1  PHE  41           HE1      PHE  41  12.363   7.278  -1.367
  Start of MODEL   11
 7344    HE2  PHE  41           HE2      PHE  41  10.423   5.949   2.181
  Start of MODEL   11
 7345    HZ   PHE  41           HZ       PHE  41  12.474   6.277   0.883
  Start of MODEL   11
 7346    H    PHE  41           HN       PHE  41   5.841   9.589  -1.824
  Start of MODEL   11
 7347    HA   ASN  42           HA       ASN  42   8.509  11.859   2.546
  Start of MODEL   11
 7348    HB3  ASN  42           HB2      ASN  42  10.721  12.415   1.540
  Start of MODEL   11
 7349    HB2  ASN  42           HB3      ASN  42  10.385  11.309   0.221
  Start of MODEL   11
 7350   HD21  ASN  42          HD21      ASN  42  12.179  10.130   0.649
  Start of MODEL   11
 7351   HD22  ASN  42          HD22      ASN  42  12.311   9.046   1.983
  Start of MODEL   11
 7352    H    ASN  42           HN       ASN  42   7.361  10.065   1.778
  Start of MODEL   11
 7353    HA2  GLY  43           HA2      GLY  43   5.363  14.265   0.070
  Start of MODEL   11
 7354    H    GLY  43           HN       GLY  43   6.354  12.249   0.745
  Start of MODEL   11
 7355    HA3  GLY  43           HA1      GLY  43   6.962  14.983  -0.051
  Start of MODEL   11
 7356    HA   SER  44           HA       SER  44   6.813  13.464  -4.236
  Start of MODEL   11
 7357    HB3  SER  44           HB2      SER  44   8.659  12.129  -5.088
  Start of MODEL   11
 7358    HB2  SER  44           HB3      SER  44   8.891  11.386  -3.507
  Start of MODEL   11
 7359    HG   SER  44           HG       SER  44   8.941  14.040  -3.235
  Start of MODEL   11
 7360    H    SER  44           HN       SER  44   7.584  12.338  -1.631
  Start of MODEL   11
 7361    HA   VAL  45           HA       VAL  45   3.986  10.349  -4.611
  Start of MODEL   11
 7362    HB   VAL  45           HB       VAL  45   4.257  11.525  -7.391
  Start of MODEL   11
 7363    H    VAL  45           HN       VAL  45   5.681  12.388  -5.632
  Start of MODEL   11
 7364    HA   LEU  46           HA       LEU  46   6.604   7.153  -5.829
  Start of MODEL   11
 7365    HB3  LEU  46           HB2      LEU  46   4.366   5.882  -4.281
  Start of MODEL   11
 7366    HB2  LEU  46           HB3      LEU  46   5.887   6.418  -3.595
  Start of MODEL   11
 7367    HG   LEU  46           HG       LEU  46   5.571   4.209  -5.634
  Start of MODEL   11
 7368   HD11  LEU  46          HD11      LEU  46   7.959   5.179  -4.050
  Start of MODEL   11
 7369   HD13  LEU  46          HD12      LEU  46   7.743   5.307  -5.799
  Start of MODEL   11
 7370   HD12  LEU  46          HD13      LEU  46   7.942   3.722  -5.047
  Start of MODEL   11
 7371   HD23  LEU  46          HD21      LEU  46   6.095   4.085  -2.665
  Start of MODEL   11
 7372   HD22  LEU  46          HD22      LEU  46   6.159   2.713  -3.769
  Start of MODEL   11
 7373   HD21  LEU  46          HD23      LEU  46   4.631   3.551  -3.492
  Start of MODEL   11
 7374    H    LEU  46           HN       LEU  46   4.303   8.277  -4.556
  Start of MODEL   11
 7375    HA   ASN  47           HA       ASN  47   4.029   5.888  -9.110
  Start of MODEL   11
 7376    HB3  ASN  47           HB2      ASN  47   6.795   6.142 -10.343
  Start of MODEL   11
 7377    HB2  ASN  47           HB3      ASN  47   5.747   7.530 -10.095
  Start of MODEL   11
 7378   HD21  ASN  47          HD21      ASN  47   5.673   7.989 -12.251
  Start of MODEL   11
 7379   HD22  ASN  47          HD22      ASN  47   4.765   7.058 -13.376
  Start of MODEL   11
 7380    H    ASN  47           HN       ASN  47   6.564   6.475  -7.806
  Start of MODEL   11
 7381    HA   GLU  48           HA       GLU  48   4.947   1.668  -8.272
  Start of MODEL   11
 7382    HB3  GLU  48           HB2      GLU  48   3.451   0.218  -9.478
  Start of MODEL   11
 7383    HB2  GLU  48           HB3      GLU  48   3.110   1.479 -10.648
  Start of MODEL   11
 7384    HG2  GLU  48           HG2      GLU  48   2.127   2.814  -8.787
  Start of MODEL   11
 7385    HG3  GLU  48           HG3      GLU  48   1.236   1.323  -9.201
  Start of MODEL   11
 7386    H    GLU  48           HN       GLU  48   3.575   3.768  -9.488
  Start of MODEL   11
 7387    HA   THR  49           HA       THR  49   7.536   0.664 -11.690
  Start of MODEL   11
 7388    HB   THR  49           HB       THR  49   9.892   0.601 -10.697
  Start of MODEL   11
 7389    HG1  THR  49           HG1      THR  49   8.502   1.545  -8.436
  Start of MODEL   11
 7390   HG22  THR  49          HG21      THR  49   9.991   3.031 -10.293
  Start of MODEL   11
 7391   HG21  THR  49          HG22      THR  49   8.234   3.078 -10.161
  Start of MODEL   11
 7392   HG23  THR  49          HG23      THR  49   8.990   2.663 -11.699
  Start of MODEL   11
 7393    H    THR  49           HN       THR  49   6.645   0.513  -8.902
  Start of MODEL   11
 7394    HA   SER  50           HA       SER  50   8.141  -3.639 -11.125
  Start of MODEL   11
 7395    HB3  SER  50           HB2      SER  50   9.801  -4.619 -12.582
  Start of MODEL   11
 7396    HB2  SER  50           HB3      SER  50  10.736  -3.121 -12.589
  Start of MODEL   11
 7397    HG   SER  50           HG       SER  50   8.422  -3.811 -13.953
  Start of MODEL   11
 7398    H    SER  50           HN       SER  50   9.234  -1.175 -12.025
  Start of MODEL   11
 7399    HA   PHE  51           HA       PHE  51  11.628  -3.445  -8.117
  Start of MODEL   11
 7400    HB3  PHE  51           HB2      PHE  51  12.873  -1.466  -7.281
  Start of MODEL   11
 7401    HB2  PHE  51           HB3      PHE  51  11.839  -0.420  -8.246
  Start of MODEL   11
 7402    HD1  PHE  51           HD1      PHE  51  14.797  -2.413  -8.210
  Start of MODEL   11
 7403    HD2  PHE  51           HD2      PHE  51  11.888  -0.676 -10.778
  Start of MODEL   11
 7404    HE1  PHE  51           HE1      PHE  51  16.340  -2.641 -10.110
  Start of MODEL   11
 7405    HE2  PHE  51           HE2      PHE  51  13.427  -0.896 -12.681
  Start of MODEL   11
 7406    HZ   PHE  51           HZ       PHE  51  15.656  -1.877 -12.347
  Start of MODEL   11
 7407    H    PHE  51           HN       PHE  51  10.034  -1.488  -9.613
  Start of MODEL   11
 7408    HA   ILE  52           HA       ILE  52   8.616  -1.683  -5.109
  Start of MODEL   11
 7409    HB   ILE  52           HB       ILE  52   8.459   1.161  -6.150
  Start of MODEL   11
 7410   HD11  ILE  52          HD11      ILE  52  10.071   2.387  -3.824
  Start of MODEL   11
 7411   HD13  ILE  52          HD12      ILE  52  10.358   2.769  -5.522
  Start of MODEL   11
 7412   HD12  ILE  52          HD13      ILE  52  11.681   2.177  -4.516
  Start of MODEL   11
 7413    H    ILE  52           HN       ILE  52   9.296  -0.782  -7.828
  Start of MODEL   11
 7414    HA   PHE  53           HA       PHE  53   4.609  -1.049  -6.837
  Start of MODEL   11
 7415    HB3  PHE  53           HB2      PHE  53   5.409  -2.441  -8.631
  Start of MODEL   11
 7416    HB2  PHE  53           HB3      PHE  53   3.816  -3.003  -8.148
  Start of MODEL   11
 7417    HD1  PHE  53           HD1      PHE  53   7.337  -3.847  -8.385
  Start of MODEL   11
 7418    HD2  PHE  53           HD2      PHE  53   3.527  -5.147  -7.000
  Start of MODEL   11
 7419    HE1  PHE  53           HE1      PHE  53   8.190  -6.137  -8.198
  Start of MODEL   11
 7420    HE2  PHE  53           HE2      PHE  53   4.382  -7.446  -6.797
  Start of MODEL   11
 7421    HZ   PHE  53           HZ       PHE  53   6.719  -7.943  -7.395
  Start of MODEL   11
 7422    H    PHE  53           HN       PHE  53   6.599  -2.641  -5.438
  Start of MODEL   11
 7423    HA   THR  54           HA       THR  54   2.099  -2.537  -3.686
  Start of MODEL   11
 7424    HB   THR  54           HB       THR  54   0.109  -1.478  -5.715
  Start of MODEL   11
 7425    HG1  THR  54           HG1      THR  54   1.705   0.094  -5.317
  Start of MODEL   11
 7426   HG21  THR  54          HG21      THR  54   0.054  -1.601  -2.701
  Start of MODEL   11
 7427   HG23  THR  54          HG22      THR  54  -0.822  -2.684  -3.782
  Start of MODEL   11
 7428   HG22  THR  54          HG23      THR  54  -1.225  -0.963  -3.739
  Start of MODEL   11
 7429    H    THR  54           HN       THR  54   2.593  -1.378  -6.242
  Start of MODEL   11
 7430    HA   GLU  55           HA       GLU  55   0.845  -6.280  -5.739
  Start of MODEL   11
 7431    HB3  GLU  55           HB2      GLU  55   2.407  -7.170  -3.305
  Start of MODEL   11
 7432    HB2  GLU  55           HB3      GLU  55   3.215  -6.527  -4.709
  Start of MODEL   11
 7433    HG2  GLU  55           HG2      GLU  55   2.222  -8.378  -6.054
  Start of MODEL   11
 7434    HG3  GLU  55           HG3      GLU  55   3.404  -8.846  -4.844
  Start of MODEL   11
 7435    H    GLU  55           HN       GLU  55   1.899  -4.694  -3.513
  Start of MODEL   11
 7436    HA   PHE  56           HA       PHE  56  -2.469  -6.521  -2.744
  Start of MODEL   11
 7437    HB3  PHE  56           HB2      PHE  56  -4.632  -6.752  -3.983
  Start of MODEL   11
 7438    HB2  PHE  56           HB3      PHE  56  -3.726  -6.780  -5.481
  Start of MODEL   11
 7439    HD1  PHE  56           HD1      PHE  56  -5.082  -4.721  -2.860
  Start of MODEL   11
 7440    HD2  PHE  56           HD2      PHE  56  -2.517  -4.767  -6.249
  Start of MODEL   11
 7441    HE1  PHE  56           HE1      PHE  56  -5.217  -2.276  -2.996
  Start of MODEL   11
 7442    HE2  PHE  56           HE2      PHE  56  -2.644  -2.329  -6.391
  Start of MODEL   11
 7443    HZ   PHE  56           HZ       PHE  56  -3.993  -1.072  -4.770
  Start of MODEL   11
 7444    H    PHE  56           HN       PHE  56  -1.302  -6.629  -5.412
  Start of MODEL   11
 7445    HA   LEU  57           HA       LEU  57  -3.412 -10.770  -3.102
  Start of MODEL   11
 7446    HB3  LEU  57           HB2      LEU  57  -1.893 -10.611  -1.144
  Start of MODEL   11
 7447    HB2  LEU  57           HB3      LEU  57  -3.090 -11.859  -0.941
  Start of MODEL   11
 7448    HG   LEU  57           HG       LEU  57  -3.580  -9.223   0.332
  Start of MODEL   11
 7449   HD13  LEU  57          HD11      LEU  57  -5.310 -10.947   0.362
  Start of MODEL   11
 7450   HD12  LEU  57          HD12      LEU  57  -4.687 -10.629   1.984
  Start of MODEL   11
 7451   HD11  LEU  57          HD13      LEU  57  -4.175 -12.070   1.111
  Start of MODEL   11
 7452   HD22  LEU  57          HD21      LEU  57  -2.329  -9.976   2.302
  Start of MODEL   11
 7453   HD21  LEU  57          HD22      LEU  57  -1.276  -9.734   0.906
  Start of MODEL   11
 7454   HD23  LEU  57          HD23      LEU  57  -1.748 -11.366   1.383
  Start of MODEL   11
 7455    H    LEU  57           HN       LEU  57  -3.653  -8.177  -1.803
  Start of MODEL   11
 7456    HA   GLU  58           HA       GLU  58  -7.566 -10.889  -2.975
  Start of MODEL   11
 7457    HB3  GLU  58           HB2      GLU  58  -8.594 -13.112  -3.041
  Start of MODEL   11
 7458    HB2  GLU  58           HB3      GLU  58  -7.111 -13.779  -2.368
  Start of MODEL   11
 7459    HG2  GLU  58           HG2      GLU  58  -7.416 -12.369  -5.005
  Start of MODEL   11
 7460    HG3  GLU  58           HG3      GLU  58  -5.883 -12.922  -4.349
  Start of MODEL   11
 7461    H    GLU  58           HN       GLU  58  -5.201 -12.304  -2.142
  Start of MODEL   11
 7462    HA   PRO  59           HA       PRO  59  -9.221 -10.533   1.151
  Start of MODEL   11
 7463    HB3  PRO  59           HB2      PRO  59  -9.868  -8.407   0.493
  Start of MODEL   11
 7464    HB2  PRO  59           HB3      PRO  59 -11.452  -9.189   0.471
  Start of MODEL   11
 7465    HG2  PRO  59           HG2      PRO  59 -11.460  -9.399  -1.827
  Start of MODEL   11
 7466    HG3  PRO  59           HG3      PRO  59 -10.450  -7.951  -1.690
  Start of MODEL   11
 7467    HD2  PRO  59           HD2      PRO  59  -9.683 -10.315  -2.896
  Start of MODEL   11
 7468    HD3  PRO  59           HD3      PRO  59  -8.562  -9.082  -2.276
  Start of MODEL   11
 7469    HA   ALA  60           HA       ALA  60 -12.064 -13.837   0.891
  Start of MODEL   11
 7470    HB1  ALA  60           HB1      ALA  60 -11.710 -13.235   3.839
  Start of MODEL   11
 7471    HB3  ALA  60           HB2      ALA  60 -10.766 -14.388   2.896
  Start of MODEL   11
 7472    HB2  ALA  60           HB3      ALA  60 -12.482 -14.678   3.182
  Start of MODEL   11
 7473    H    ALA  60           HN       ALA  60 -10.592 -11.784   2.283
  Start of MODEL   11
 7474    HA   ALA  61           HA       ALA  61 -15.850 -11.948   0.920
  Start of MODEL   11
 7475    HB2  ALA  61           HB1      ALA  61 -17.797 -13.407   1.015
  Start of MODEL   11
 7476    HB1  ALA  61           HB2      ALA  61 -16.835 -14.652   1.819
  Start of MODEL   11
 7477    HB3  ALA  61           HB3      ALA  61 -16.464 -14.177   0.162
  Start of MODEL   11
 7478    H    ALA  61           HN       ALA  61 -14.329 -14.229   1.571
  Start of MODEL   11
 7479    HA   ASN  62           HA       ASN  62 -17.003 -11.799   5.363
  Start of MODEL   11
 7480    HB3  ASN  62           HB2      ASN  62 -15.951 -14.007   6.172
  Start of MODEL   11
 7481    HB2  ASN  62           HB3      ASN  62 -16.137 -12.739   7.375
  Start of MODEL   11
 7482   HD21  ASN  62          HD21      ASN  62 -13.849 -14.587   5.522
  Start of MODEL   11
 7483   HD22  ASN  62          HD22      ASN  62 -12.450 -14.063   6.400
  Start of MODEL   11
 7484    H    ASN  62           HN       ASN  62 -14.859 -13.145   3.914
  Start of MODEL   11
 7485    HA   GLU  63           HA       GLU  63 -13.508  -8.861   5.849
  Start of MODEL   11
 7486    HB3  GLU  63           HB2      GLU  63 -11.455  -8.559   4.588
  Start of MODEL   11
 7487    HB2  GLU  63           HB3      GLU  63 -11.980  -9.731   3.397
  Start of MODEL   11
 7488    HG2  GLU  63           HG2      GLU  63 -11.352 -10.329   6.268
  Start of MODEL   11
 7489    HG3  GLU  63           HG3      GLU  63 -11.871 -11.499   5.052
  Start of MODEL   11
 7490    H    GLU  63           HN       GLU  63 -14.170 -10.930   3.885
  Start of MODEL   11
 7491    HA   THR  64           HA       THR  64 -14.807  -6.145   2.645
  Start of MODEL   11
 7492    HB   THR  64           HB       THR  64 -15.100  -4.450   5.150
  Start of MODEL   11
 7493    HG1  THR  64           HG1      THR  64 -16.501  -6.695   4.269
  Start of MODEL   11
 7494   HG23  THR  64          HG21      THR  64 -15.483  -3.327   2.979
  Start of MODEL   11
 7495   HG22  THR  64          HG22      THR  64 -16.977  -3.451   3.908
  Start of MODEL   11
 7496   HG21  THR  64          HG23      THR  64 -16.678  -4.556   2.566
  Start of MODEL   11
 7497    H    THR  64           HN       THR  64 -13.985  -6.801   5.381
  Start of MODEL   11
 7498    HA   VAL  65           HA       VAL  65 -10.886  -3.941   3.613
  Start of MODEL   11
 7499    HB   VAL  65           HB       VAL  65  -9.681  -6.379   4.921
  Start of MODEL   11
 7500    H    VAL  65           HN       VAL  65 -12.092  -6.609   3.778
  Start of MODEL   11
 7501    HA   ARG  66           HA       ARG  66  -8.787  -5.705   0.167
  Start of MODEL   11
 7502    HB3  ARG  66           HB2      ARG  66  -7.696  -3.919  -1.083
  Start of MODEL   11
 7503    HB2  ARG  66           HB3      ARG  66  -7.801  -2.845   0.289
  Start of MODEL   11
 7504    HG2  ARG  66           HG2      ARG  66 -10.152  -3.850  -1.318
  Start of MODEL   11
 7505    HG3  ARG  66           HG3      ARG  66 -10.236  -2.756   0.059
  Start of MODEL   11
 7506    HD2  ARG  66           HD2      ARG  66 -10.363  -1.481  -2.004
  Start of MODEL   11
 7507    HD3  ARG  66           HD3      ARG  66  -8.848  -1.114  -1.186
  Start of MODEL   11
 7508    HE   ARG  66           HE       ARG  66  -8.479  -3.215  -2.994
  Start of MODEL   11
 7509   HH11  ARG  66          HH11      ARG  66  -8.780   0.341  -2.984
  Start of MODEL   11
 7510   HH12  ARG  66          HH12      ARG  66  -8.204   0.530  -4.558
  Start of MODEL   11
 7511   HH21  ARG  66          HH21      ARG  66  -7.649  -2.901  -5.193
  Start of MODEL   11
 7512   HH22  ARG  66          HH22      ARG  66  -7.491  -1.337  -5.826
  Start of MODEL   11
 7513    H    ARG  66           HN       ARG  66  -9.458  -3.610   2.063
  Start of MODEL   11
 7514    HA   HIS  67           HA       HIS  67  -5.000  -5.841   2.371
  Start of MODEL   11
 7515    HB3  HIS  67           HB2      HIS  67  -4.233  -8.259   2.484
  Start of MODEL   11
 7516    HB2  HIS  67           HB3      HIS  67  -5.714  -8.667   1.634
  Start of MODEL   11
 7517    HD1  HIS  67           HD1      HIS  67  -4.380  -8.075   4.942
  Start of MODEL   11
 7518    HD2  HIS  67           HD2      HIS  67  -8.109  -8.121   3.132
  Start of MODEL   11
 7519    HE1  HIS  67           HE1      HIS  67  -6.028  -8.296   6.816
  Start of MODEL   11
 7520    HE2  HIS  67           HE2      HIS  67  -8.144  -8.861   5.578
  Start of MODEL   11
 7521    H    HIS  67           HN       HIS  67  -6.975  -6.863   0.451
  Start of MODEL   11
 7522    HA2  GLY  68           HA2      GLY  68  -1.933  -6.995  -0.528
  Start of MODEL   11
 7523    H    GLY  68           HN       GLY  68  -2.906  -5.693   1.784
  Start of MODEL   11
 7524    HA3  GLY  68           HA1      GLY  68  -2.208  -5.274  -0.781
  Start of MODEL   11
 7525    HA   CYS  69           HA       CYS  69   1.544  -4.975   1.339
  Start of MODEL   11
 7526    HB3  CYS  69           HB2      CYS  69   2.224  -7.415  -0.297
  Start of MODEL   11
 7527    HB2  CYS  69           HB3      CYS  69   1.937  -7.317   1.433
  Start of MODEL   11
 7528    H    CYS  69           HN       CYS  69   0.225  -5.968  -1.062
  Start of MODEL   11
 7529    HA   LEU  70           HA       LEU  70   3.469  -2.806  -1.969
  Start of MODEL   11
 7530    HB3  LEU  70           HB2      LEU  70   4.620  -1.484   0.514
  Start of MODEL   11
 7531    HB2  LEU  70           HB3      LEU  70   3.187  -0.916  -0.315
  Start of MODEL   11
 7532    HG   LEU  70           HG       LEU  70   5.954  -1.026  -1.525
  Start of MODEL   11
 7533   HD12  LEU  70          HD11      LEU  70   4.980   0.393  -3.258
  Start of MODEL   11
 7534   HD11  LEU  70          HD12      LEU  70   3.391   0.189  -2.520
  Start of MODEL   11
 7535   HD13  LEU  70          HD13      LEU  70   4.235  -1.203  -3.208
  Start of MODEL   11
 7536   HD23  LEU  70          HD21      LEU  70   4.391   1.308  -0.460
  Start of MODEL   11
 7537   HD22  LEU  70          HD22      LEU  70   5.926   1.401  -1.320
  Start of MODEL   11
 7538   HD21  LEU  70          HD23      LEU  70   5.849   0.624   0.266
  Start of MODEL   11
 7539    H    LEU  70           HN       LEU  70   2.876  -3.327   0.819
  Start of MODEL   11
 7540    HA   ARG  71           HA       ARG  71   6.727  -5.512  -1.097
  Start of MODEL   11
 7541    HB3  ARG  71           HB2      ARG  71   5.832  -6.217  -3.890
  Start of MODEL   11
 7542    HB2  ARG  71           HB3      ARG  71   5.125  -6.867  -2.421
  Start of MODEL   11
 7543    HG2  ARG  71           HG2      ARG  71   8.019  -7.188  -3.197
  Start of MODEL   11
 7544    HG3  ARG  71           HG3      ARG  71   7.187  -7.957  -1.847
  Start of MODEL   11
 7545    HD2  ARG  71           HD2      ARG  71   6.628  -8.390  -4.778
  Start of MODEL   11
 7546    HD3  ARG  71           HD3      ARG  71   7.463  -9.502  -3.696
  Start of MODEL   11
 7547    HE   ARG  71           HE       ARG  71   4.672  -8.734  -3.200
  Start of MODEL   11
 7548   HH11  ARG  71          HH11      ARG  71   7.075 -11.263  -3.805
  Start of MODEL   11
 7549   HH12  ARG  71          HH12      ARG  71   5.991 -12.552  -3.655
  Start of MODEL   11
 7550   HH21  ARG  71          HH21      ARG  71   3.121 -10.550  -3.022
  Start of MODEL   11
 7551   HH22  ARG  71          HH22      ARG  71   3.722 -12.128  -3.178
  Start of MODEL   11
 7552    H    ARG  71           HN       ARG  71   4.863  -4.123  -2.858
  Start of MODEL   11
 7553    HA   LEU  72           HA       LEU  72   9.721  -3.380  -3.422
  Start of MODEL   11
 7554    HB3  LEU  72           HB2      LEU  72  11.742  -3.070  -2.042
  Start of MODEL   11
 7555    HB2  LEU  72           HB3      LEU  72  11.091  -4.084  -0.785
  Start of MODEL   11
 7556    HG   LEU  72           HG       LEU  72   9.160  -2.325  -0.680
  Start of MODEL   11
 7557   HD13  LEU  72          HD11      LEU  72  10.768  -2.417   1.066
  Start of MODEL   11
 7558   HD12  LEU  72          HD12      LEU  72  10.504  -0.728   0.634
  Start of MODEL   11
 7559   HD11  LEU  72          HD13      LEU  72  11.967  -1.563   0.093
  Start of MODEL   11
 7560   HD23  LEU  72          HD21      LEU  72  11.200  -0.771  -2.222
  Start of MODEL   11
 7561   HD22  LEU  72          HD22      LEU  72   9.714  -0.131  -1.512
  Start of MODEL   11
 7562   HD21  LEU  72          HD23      LEU  72   9.636  -1.315  -2.823
  Start of MODEL   11
 7563    H    LEU  72           HN       LEU  72   8.700  -4.662  -1.068
  Start of MODEL   11
 7564    HA   ASN  73           HA       ASN  73  10.671  -7.420  -4.850
  Start of MODEL   11
 7565    HB3  ASN  73           HB2      ASN  73  10.852  -5.450  -7.139
  Start of MODEL   11
 7566    HB2  ASN  73           HB3      ASN  73   9.458  -6.420  -6.693
  Start of MODEL   11
 7567   HD21  ASN  73          HD21      ASN  73  10.908  -6.273  -9.201
  Start of MODEL   11
 7568   HD22  ASN  73          HD22      ASN  73  11.445  -7.867  -9.558
  Start of MODEL   11
 7569    H    ASN  73           HN       ASN  73  10.185  -4.597  -4.978
  Start of MODEL   11
 7570    HA   GLN  74           HA       GLN  74  14.989  -6.157  -5.058
  Start of MODEL   11
 7571    HB3  GLN  74           HB2      GLN  74  16.191  -4.617  -6.694
  Start of MODEL   11
 7572    HB2  GLN  74           HB3      GLN  74  14.597  -4.155  -7.282
  Start of MODEL   11
 7573    HG2  GLN  74           HG2      GLN  74  14.161  -6.511  -7.869
  Start of MODEL   11
 7574    HG3  GLN  74           HG3      GLN  74  15.512  -5.797  -8.758
  Start of MODEL   11
 7575   HE21  GLN  74          HE21      GLN  74  14.590  -8.089  -6.288
  Start of MODEL   11
 7576   HE22  GLN  74          HE22      GLN  74  16.101  -8.902  -6.218
  Start of MODEL   11
 7577    H    GLN  74           HN       GLN  74  12.623  -4.639  -5.810
  Start of MODEL   11
 7578    HA   PRO  75           HA       PRO  75  14.536  -2.834  -2.040
  Start of MODEL   11
 7579    HB3  PRO  75           HB2      PRO  75  15.419  -3.767  -0.119
  Start of MODEL   11
 7580    HB2  PRO  75           HB3      PRO  75  16.896  -4.284  -0.940
  Start of MODEL   11
 7581    HG2  PRO  75           HG2      PRO  75  15.764  -6.316  -0.701
  Start of MODEL   11
 7582    HG3  PRO  75           HG3      PRO  75  14.183  -5.559  -0.949
  Start of MODEL   11
 7583    HD2  PRO  75           HD2      PRO  75  16.301  -6.194  -2.967
  Start of MODEL   11
 7584    HD3  PRO  75           HD3      PRO  75  14.537  -6.435  -3.055
  Start of MODEL   11
 7585    HA   THR  76           HA       THR  76  18.237  -0.738  -3.185
  Start of MODEL   11
 7586    HB   THR  76           HB       THR  76  17.305   1.371  -4.415
  Start of MODEL   11
 7587    HG1  THR  76           HG1      THR  76  14.985  -0.202  -4.041
  Start of MODEL   11
 7588   HG21  THR  76          HG21      THR  76  16.668  -1.408  -5.439
  Start of MODEL   11
 7589   HG23  THR  76          HG22      THR  76  18.222  -0.590  -5.596
  Start of MODEL   11
 7590   HG22  THR  76          HG23      THR  76  16.805   0.039  -6.435
  Start of MODEL   11
 7591    H    THR  76           HN       THR  76  15.491  -0.925  -2.224
  Start of MODEL   11
 7592    HA   HIS  77           HA       HIS  77  18.738   1.765   0.121
  Start of MODEL   11
 7593    HB3  HIS  77           HB2      HIS  77  20.999   1.850  -0.978
  Start of MODEL   11
 7594    HB2  HIS  77           HB3      HIS  77  20.679   3.092   0.210
  Start of MODEL   11
 7595    HD1  HIS  77           HD1      HIS  77  21.558   5.278  -0.445
  Start of MODEL   11
 7596    HD2  HIS  77           HD2      HIS  77  20.475   3.003  -3.721
  Start of MODEL   11
 7597    HE1  HIS  77           HE1      HIS  77  22.081   6.707  -2.425
  Start of MODEL   11
 7598    HE2  HIS  77           HE2      HIS  77  21.149   5.442  -4.373
  Start of MODEL   11
 7599    H    HIS  77           HN       HIS  77  19.174   1.343  -2.635
  Start of MODEL   11
 7600    HA   VAL  78           HA       VAL  78  16.734   5.664  -1.103
  Start of MODEL   11
 7601    HB   VAL  78           HB       VAL  78  14.840   6.013  -2.763
  Start of MODEL   11
 7602    H    VAL  78           HN       VAL  78  17.098   3.141  -2.365
  Start of MODEL   11
 7603    HA   ASN  79           HA       ASN  79  12.837   3.076  -0.055
  Start of MODEL   11
 7604    HB3  ASN  79           HB2      ASN  79  12.786   0.713   0.769
  Start of MODEL   11
 7605    HB2  ASN  79           HB3      ASN  79  14.525   0.643   0.510
  Start of MODEL   11
 7606   HD21  ASN  79          HD21      ASN  79  12.254   2.302  -1.637
  Start of MODEL   11
 7607   HD22  ASN  79          HD22      ASN  79  12.521   1.234  -2.966
  Start of MODEL   11
 7608    H    ASN  79           HN       ASN  79  15.631   2.582  -0.489
  Start of MODEL   11
 7609    HA   ASN  80           HA       ASN  80  13.576   3.745   4.202
  Start of MODEL   11
 7610    HB3  ASN  80           HB2      ASN  80  16.042   3.714   4.326
  Start of MODEL   11
 7611    HB2  ASN  80           HB3      ASN  80  15.401   4.998   5.335
  Start of MODEL   11
 7612   HD21  ASN  80          HD21      ASN  80  17.197   4.252   2.487
  Start of MODEL   11
 7613   HD22  ASN  80          HD22      ASN  80  17.815   5.824   2.200
  Start of MODEL   11
 7614    H    ASN  80           HN       ASN  80  14.668   4.588   1.621
  Start of MODEL   11
 7615    HA2  GLY  81           HA2      GLY  81  11.965   7.672   5.204
  Start of MODEL   11
 7616    H    GLY  81           HN       GLY  81  12.048   5.009   4.948
  Start of MODEL   11
 7617    HA3  GLY  81           HA1      GLY  81  11.537   7.465   3.514
  Start of MODEL   11
 7618    HA   ASN  82           HA       ASN  82   7.895   6.791   5.916
  Start of MODEL   11
 7619    HB3  ASN  82           HB2      ASN  82   6.403   8.803   6.136
  Start of MODEL   11
 7620    HB2  ASN  82           HB3      ASN  82   7.595   9.729   5.236
  Start of MODEL   11
 7621   HD21  ASN  82          HD21      ASN  82   6.816   8.271   8.290
  Start of MODEL   11
 7622   HD22  ASN  82          HD22      ASN  82   8.119   8.934   9.175
  Start of MODEL   11
 7623    H    ASN  82           HN       ASN  82   9.596   8.538   4.355
  Start of MODEL   11
 7624    HA   TYR  83           HA       TYR  83   5.812   6.278   2.016
  Start of MODEL   11
 7625    HB3  TYR  83           HB2      TYR  83   4.894   3.888   1.953
  Start of MODEL   11
 7626    HB2  TYR  83           HB3      TYR  83   5.749   3.610   3.459
  Start of MODEL   11
 7627    HD1  TYR  83           HD1      TYR  83   6.159   4.242  -0.138
  Start of MODEL   11
 7628    HD2  TYR  83           HD2      TYR  83   8.157   3.241   3.495
  Start of MODEL   11
 7629    HE1  TYR  83           HE1      TYR  83   8.155   3.576  -1.419
  Start of MODEL   11
 7630    HE2  TYR  83           HE2      TYR  83  10.157   2.596   2.206
  Start of MODEL   11
 7631    HH   TYR  83           HH       TYR  83  10.663   1.822  -0.017
  Start of MODEL   11
 7632    H    TYR  83           HN       TYR  83   6.829   5.400   4.581
  Start of MODEL   11
 7633    HA   THR  84           HA       THR  84   2.037   6.977   4.153
  Start of MODEL   11
 7634    HB   THR  84           HB       THR  84   2.288   9.206   2.142
  Start of MODEL   11
 7635    HG1  THR  84           HG1      THR  84   3.937   8.653   3.945
  Start of MODEL   11
 7636   HG21  THR  84          HG21      THR  84   0.763   9.018   4.762
  Start of MODEL   11
 7637   HG23  THR  84          HG22      THR  84   0.043   8.989   3.152
  Start of MODEL   11
 7638   HG22  THR  84          HG23      THR  84   0.853  10.445   3.728
  Start of MODEL   11
 7639    H    THR  84           HN       THR  84   4.010   7.396   2.028
  Start of MODEL   11
 7640    HA   LEU  85           HA       LEU  85  -0.397   5.611   0.806
  Start of MODEL   11
 7641    HB3  LEU  85           HB2      LEU  85  -1.512   4.199   3.237
  Start of MODEL   11
 7642    HB2  LEU  85           HB3      LEU  85  -0.199   3.626   2.233
  Start of MODEL   11
 7643    HG   LEU  85           HG       LEU  85  -3.072   3.926   1.358
  Start of MODEL   11
 7644   HD12  LEU  85          HD11      LEU  85  -2.277   2.752  -0.639
  Start of MODEL   11
 7645   HD11  LEU  85          HD12      LEU  85  -0.617   2.951  -0.029
  Start of MODEL   11
 7646   HD13  LEU  85          HD13      LEU  85  -1.580   4.369  -0.455
  Start of MODEL   11
 7647   HD23  LEU  85          HD21      LEU  85  -1.394   1.471   1.793
  Start of MODEL   11
 7648   HD22  LEU  85          HD22      LEU  85  -3.094   1.540   1.299
  Start of MODEL   11
 7649   HD21  LEU  85          HD23      LEU  85  -2.610   2.084   2.909
  Start of MODEL   11
 7650    H    LEU  85           HN       LEU  85   0.059   6.176   3.636
  Start of MODEL   11
 7651    HA   LEU  86           HA       LEU  86  -3.887   8.188   1.459
  Start of MODEL   11
 7652    HB3  LEU  86           HB2      LEU  86  -4.200   9.571  -0.607
  Start of MODEL   11
 7653    HB2  LEU  86           HB3      LEU  86  -2.872   8.725  -1.353
  Start of MODEL   11
 7654    HG   LEU  86           HG       LEU  86  -2.332  11.016  -0.617
  Start of MODEL   11
 7655   HD13  LEU  86          HD11      LEU  86  -3.647  11.153   1.371
  Start of MODEL   11
 7656   HD12  LEU  86          HD12      LEU  86  -1.956  11.525   1.702
  Start of MODEL   11
 7657   HD11  LEU  86          HD13      LEU  86  -2.616   9.954   2.156
  Start of MODEL   11
 7658   HD22  LEU  86          HD21      LEU  86  -0.173  10.515   0.410
  Start of MODEL   11
 7659   HD21  LEU  86          HD22      LEU  86  -0.535   9.403  -0.917
  Start of MODEL   11
 7660   HD23  LEU  86          HD23      LEU  86  -0.717   8.873   0.756
  Start of MODEL   11
 7661    H    LEU  86           HN       LEU  86  -1.768   6.914  -0.096
  Start of MODEL   11
 7662    HA   ALA  87           HA       ALA  87  -6.583   5.964  -1.237
  Start of MODEL   11
 7663    HB1  ALA  87           HB1      ALA  87  -7.570   5.461   1.565
  Start of MODEL   11
 7664    HB3  ALA  87           HB2      ALA  87  -6.384   4.483   0.719
  Start of MODEL   11
 7665    HB2  ALA  87           HB3      ALA  87  -8.047   4.544   0.139
  Start of MODEL   11
 7666    H    ALA  87           HN       ALA  87  -5.930   7.517   1.172
  Start of MODEL   11
 7667    HA   ALA  88           HA       ALA  88 -10.018   8.648  -0.823
  Start of MODEL   11
 7668    HB3  ALA  88           HB1      ALA  88  -8.455   9.991  -2.159
  Start of MODEL   11
 7669    HB2  ALA  88           HB2      ALA  88 -10.115  10.161  -2.730
  Start of MODEL   11
 7670    HB1  ALA  88           HB3      ALA  88  -8.981   9.140  -3.614
  Start of MODEL   11
 7671    H    ALA  88           HN       ALA  88  -8.193   6.920  -2.340
  Start of MODEL   11
 7672    HA   ASN  89           HA       ASN  89 -13.183   7.213  -3.503
  Start of MODEL   11
 7673    HB3  ASN  89           HB2      ASN  89 -12.669   5.125  -2.120
  Start of MODEL   11
 7674    HB2  ASN  89           HB3      ASN  89 -14.357   5.267  -2.513
  Start of MODEL   11
 7675   HD21  ASN  89          HD21      ASN  89 -13.394   3.616  -0.611
  Start of MODEL   11
 7676   HD22  ASN  89          HD22      ASN  89 -13.929   4.114   0.954
  Start of MODEL   11
 7677    H    ASN  89           HN       ASN  89 -12.115   8.304  -1.090
  Start of MODEL   11
 7678    HA   PRO  90           HA       PRO  90 -16.795   9.770  -2.768
  Start of MODEL   11
 7679    HB3  PRO  90           HB2      PRO  90 -18.881   8.735  -2.715
  Start of MODEL   11
 7680    HB2  PRO  90           HB3      PRO  90 -18.321   7.467  -1.616
  Start of MODEL   11
 7681    HG2  PRO  90           HG2      PRO  90 -18.261   6.395  -3.723
  Start of MODEL   11
 7682    HG3  PRO  90           HG3      PRO  90 -17.676   7.860  -4.530
  Start of MODEL   11
 7683    HD2  PRO  90           HD2      PRO  90 -16.201   5.920  -2.824
  Start of MODEL   11
 7684    HD3  PRO  90           HD3      PRO  90 -15.635   6.811  -4.254
  Start of MODEL   11
 7685    HA   CYS  91           HA       CYS  91 -17.431   9.404   1.870
  Start of MODEL   11
 7686    HB3  CYS  91           HB2      CYS  91 -16.180   8.079   3.614
  Start of MODEL   11
 7687    HB2  CYS  91           HB3      CYS  91 -15.514   7.144   2.280
  Start of MODEL   11
 7688    H    CYS  91           HN       CYS  91 -16.042   7.701   0.033
  Start of MODEL   11
 7689    HA2  GLY  92           HA2      GLY  92 -13.376  11.771   0.816
  Start of MODEL   11
 7690    H    GLY  92           HN       GLY  92 -14.287   9.470   0.461
  Start of MODEL   11
 7691    HA3  GLY  92           HA1      GLY  92 -13.479  11.379   2.529
  Start of MODEL   11
 7692    HA   GLN  93           HA       GLN  93  -9.479   9.941   1.224
  Start of MODEL   11
 7693    HB3  GLN  93           HB2      GLN  93  -8.982  12.567   2.621
  Start of MODEL   11
 7694    HB2  GLN  93           HB3      GLN  93  -8.941  12.267   0.895
  Start of MODEL   11
 7695    HG2  GLN  93           HG2      GLN  93  -7.011  11.102   2.894
  Start of MODEL   11
 7696    HG3  GLN  93           HG3      GLN  93  -6.966  10.875   1.147
  Start of MODEL   11
 7697   HE21  GLN  93          HE21      GLN  93  -5.015  12.071   3.010
  Start of MODEL   11
 7698   HE22  GLN  93          HE22      GLN  93  -4.716  13.653   2.399
  Start of MODEL   11
 7699    H    GLN  93           HN       GLN  93 -11.248  11.815   2.598
  Start of MODEL   11
 7700    HA   ALA  94           HA       ALA  94  -8.221   8.599   5.221
  Start of MODEL   11
 7701    HB3  ALA  94           HB1      ALA  94  -9.542   6.656   4.583
  Start of MODEL   11
 7702    HB2  ALA  94           HB2      ALA  94  -7.914   6.113   5.053
  Start of MODEL   11
 7703    HB1  ALA  94           HB3      ALA  94  -8.344   6.232   3.362
  Start of MODEL   11
 7704    H    ALA  94           HN       ALA  94  -8.467   8.429   2.297
  Start of MODEL   11
 7705    HA   SER  95           HA       SER  95  -4.038   7.442   4.197
  Start of MODEL   11
 7706    HB3  SER  95           HB2      SER  95  -4.206   9.715   3.490
  Start of MODEL   11
 7707    HB2  SER  95           HB3      SER  95  -2.747   9.574   4.465
  Start of MODEL   11
 7708    HG   SER  95           HG       SER  95  -3.531  10.913   5.827
  Start of MODEL   11
 7709    H    SER  95           HN       SER  95  -6.093   8.105   6.007
  Start of MODEL   11
 7710    HA   ALA  96           HA       ALA  96  -1.747   7.343   7.971
  Start of MODEL   11
 7711    HB2  ALA  96           HB1      ALA  96  -1.430   4.940   8.491
  Start of MODEL   11
 7712    HB1  ALA  96           HB2      ALA  96  -2.057   4.522   6.898
  Start of MODEL   11
 7713    HB3  ALA  96           HB3      ALA  96  -3.112   5.288   8.086
  Start of MODEL   11
 7714    H    ALA  96           HN       ALA  96  -2.274   6.748   5.188
  Start of MODEL   11
 7715    HA   SER  97           HA       SER  97   2.013   6.173   5.956
  Start of MODEL   11
 7716    HB3  SER  97           HB2      SER  97   2.171   8.517   6.371
  Start of MODEL   11
 7717    HB2  SER  97           HB3      SER  97   3.709   7.810   6.858
  Start of MODEL   11
 7718    HG   SER  97           HG       SER  97   1.991   9.228   8.302
  Start of MODEL   11
 7719    H    SER  97           HN       SER  97   0.562   6.490   8.439
  Start of MODEL   11
 7720    HA   ILE  98           HA       ILE  98   4.446   3.770   8.662
  Start of MODEL   11
 7721    HB   ILE  98           HB       ILE  98   3.000   2.242   7.356
  Start of MODEL   11
 7722   HD11  ILE  98          HD11      ILE  98   6.825   1.662   7.470
  Start of MODEL   11
 7723   HD13  ILE  98          HD12      ILE  98   6.173   0.591   6.229
  Start of MODEL   11
 7724   HD12  ILE  98          HD13      ILE  98   6.588  -0.053   7.819
  Start of MODEL   11
 7725    H    ILE  98           HN       ILE  98   3.766   4.903   6.060
  Start of MODEL   11
 7726    HA   MET  99           HA       MET  99   8.224   4.785   6.838
  Start of MODEL   11
 7727    HB3  MET  99           HB2      MET  99   8.890   4.949   9.778
  Start of MODEL   11
 7728    HB2  MET  99           HB3      MET  99   8.138   6.251   8.857
  Start of MODEL   11
 7729    HG2  MET  99           HG2      MET  99  10.847   5.036   8.404
  Start of MODEL   11
 7730    HG3  MET  99           HG3      MET  99  10.092   6.208   7.334
  Start of MODEL   11
 7731    HE2  MET  99           HE1      MET  99  12.723   8.510   8.761
  Start of MODEL   11
 7732    HE1  MET  99           HE2      MET  99  11.792   7.964   7.355
  Start of MODEL   11
 7733    HE3  MET  99           HE3      MET  99  12.864   6.838   8.189
  Start of MODEL   11
 7734    H    MET  99           HN       MET  99   6.565   3.955   9.072
  Start of MODEL   11
 7735    HA   ALA 100           HA       ALA 100  10.528   1.197   7.572
  Start of MODEL   11
 7736    HB2  ALA 100           HB1      ALA 100  10.909   0.081   5.405
  Start of MODEL   11
 7737    HB1  ALA 100           HB2      ALA 100  10.286   1.505   4.572
  Start of MODEL   11
 7738    HB3  ALA 100           HB3      ALA 100   9.217   0.546   5.591
  Start of MODEL   11
 7739    H    ALA 100           HN       ALA 100   9.692   3.546   6.041
  Start of MODEL   11
 7740    HA   ALA 101           HA       ALA 101  14.262   3.134   6.596
  Start of MODEL   11
 7741    HB2  ALA 101           HB1      ALA 101  15.773   2.928   8.498
  Start of MODEL   11
 7742    HB1  ALA 101           HB2      ALA 101  14.778   1.629   9.157
  Start of MODEL   11
 7743    HB3  ALA 101           HB3      ALA 101  14.125   3.265   9.027
  Start of MODEL   11
 7744    H    ALA 101           HN       ALA 101  12.699   0.970   7.787
  Start of MODEL   11
 7745    HA   PHE 102           HA       PHE 102  16.890   0.054   5.221
  Start of MODEL   11
 7746    HB3  PHE 102           HB2      PHE 102  15.191   0.375   2.726
  Start of MODEL   11
 7747    HB2  PHE 102           HB3      PHE 102  14.889  -0.814   3.992
  Start of MODEL   11
 7748    HD1  PHE 102           HD1      PHE 102  16.817  -2.419   4.538
  Start of MODEL   11
 7749    HD2  PHE 102           HD2      PHE 102  16.555  -0.202   0.923
  Start of MODEL   11
 7750    HE1  PHE 102           HE1      PHE 102  18.357  -4.009   3.457
  Start of MODEL   11
 7751    HE2  PHE 102           HE2      PHE 102  18.092  -1.784  -0.168
  Start of MODEL   11
 7752    HZ   PHE 102           HZ       PHE 102  18.995  -3.693   1.104
  Start of MODEL   11
 7753    H    PHE 102           HN       PHE 102  15.008   2.211   4.774
  Start of MODEL   11
 7754    HA   MET 103           HA       MET 103  19.112   3.073   3.070
  Start of MODEL   11
 7755    HB3  MET 103           HB2      MET 103  18.834   4.678   4.812
  Start of MODEL   11
 7756    HB2  MET 103           HB3      MET 103  20.559   4.506   4.575
  Start of MODEL   11
 7757    HG2  MET 103           HG2      MET 103  20.648   3.030   6.583
  Start of MODEL   11
 7758    HG3  MET 103           HG3      MET 103  20.179   4.693   6.915
  Start of MODEL   11
 7759    HE3  MET 103           HE1      MET 103  19.770   2.296   9.005
  Start of MODEL   11
 7760    HE2  MET 103           HE2      MET 103  18.156   2.669   9.608
  Start of MODEL   11
 7761    HE1  MET 103           HE3      MET 103  19.314   3.969   9.325
  Start of MODEL   11
 7762    H    MET 103           HN       MET 103  18.372   1.701   5.520
  Start of MODEL   11
 7763    HA   ASP 104           HA       ASP 104  22.269   0.040   3.282
  Start of MODEL   11
 7764    HB3  ASP 104           HB2      ASP 104  21.046  -0.096   0.509
  Start of MODEL   11
 7765    HB2  ASP 104           HB3      ASP 104  20.590  -1.103   1.873
  Start of MODEL   11
 7766    H    ASP 104           HN       ASP 104  20.192   1.669   2.009
  Start of MODEL   11
 7767    HA   ASN 105           HA       ASN 105  24.957   2.437   0.794
  Start of MODEL   11
 7768    HB3  ASN 105           HB2      ASN 105  26.838   0.810   2.519
  Start of MODEL   11
 7769    HB2  ASN 105           HB3      ASN 105  26.140   2.365   2.953
  Start of MODEL   11
 7770   HD21  ASN 105          HD21      ASN 105  28.529   0.753   1.088
  Start of MODEL   11
 7771   HD22  ASN 105          HD22      ASN 105  29.374   2.160   0.544
  Start of MODEL   11
 7772    H    ASN 105           HN       ASN 105  24.397   0.055   2.398
  Start of MODEL   11
 7773    HA   PRO 106           HA       PRO 106  25.267  -0.905  -2.212
  Start of MODEL   11
 7774    HB3  PRO 106           HB2      PRO 106  24.145  -0.015  -3.970
  Start of MODEL   11
 7775    HB2  PRO 106           HB3      PRO 106  25.373   1.232  -4.192
  Start of MODEL   11
 7776    HG2  PRO 106           HG2      PRO 106  23.679   2.595  -3.421
  Start of MODEL   11
 7777    HG3  PRO 106           HG3      PRO 106  22.907   1.270  -2.536
  Start of MODEL   11
 7778    HD2  PRO 106           HD2      PRO 106  25.223   2.972  -1.745
  Start of MODEL   11
 7779    HD3  PRO 106           HD3      PRO 106  23.840   2.391  -0.783
  Start of MODEL   11
 7780    HA   PHE 107           HA       PHE 107  29.203  -2.322  -3.138
  Start of MODEL   11
 7781    HB3  PHE 107           HB2      PHE 107  30.223  -1.125  -5.011
  Start of MODEL   11
 7782    HB2  PHE 107           HB3      PHE 107  29.067   0.189  -4.827
  Start of MODEL   11
 7783    HD1  PHE 107           HD1      PHE 107  26.995   0.142  -5.907
  Start of MODEL   11
 7784    HD2  PHE 107           HD2      PHE 107  29.332  -3.404  -5.688
  Start of MODEL   11
 7785    HE1  PHE 107           HE1      PHE 107  25.455  -0.960  -7.471
  Start of MODEL   11
 7786    HE2  PHE 107           HE2      PHE 107  27.792  -4.517  -7.256
  Start of MODEL   11
 7787    HZ   PHE 107           HZ       PHE 107  25.849  -3.292  -8.148
  Start of MODEL   11
 7788    H    PHE 107           HN       PHE 107  27.096  -1.824  -2.566
  Start of MODEL   12
 7789    H1   ASP   1           H        ASP   1 -29.369  -3.211  -2.483
  Start of MODEL   12
 7790    H2   ASP   1           H2       ASP   1 -28.523  -1.753  -2.276
  Start of MODEL   12
 7791    H3   ASP   1           H3       ASP   1 -29.330  -2.045  -3.714
  Start of MODEL   12
 7792    HA   ASP   1           HA       ASP   1 -30.548  -0.498  -2.425
  Start of MODEL   12
 7793    HB3  ASP   1           HB2      ASP   1 -31.796  -2.323  -3.662
  Start of MODEL   12
 7794    HB2  ASP   1           HB3      ASP   1 -32.678  -1.590  -2.328
  Start of MODEL   12
 7795    HA   ASP   2           HA       ASP   2 -30.173  -1.930   1.863
  Start of MODEL   12
 7796    HB3  ASP   2           HB2      ASP   2 -29.920  -4.857   1.157
  Start of MODEL   12
 7797    HB2  ASP   2           HB3      ASP   2 -31.419  -3.960   1.366
  Start of MODEL   12
 7798    H    ASP   2           HN       ASP   2 -29.037  -2.992  -0.618
  Start of MODEL   12
 7799    HA   ASP   3           HA       ASP   3 -25.979  -4.004   2.735
  Start of MODEL   12
 7800    HB3  ASP   3           HB2      ASP   3 -25.540  -4.782  -0.149
  Start of MODEL   12
 7801    HB2  ASP   3           HB3      ASP   3 -25.840  -5.853   1.207
  Start of MODEL   12
 7802    H    ASP   3           HN       ASP   3 -27.734  -4.127   0.514
  Start of MODEL   12
 7803    HA   ASP   4           HA       ASP   4 -23.871  -0.696   0.219
  Start of MODEL   12
 7804    HB3  ASP   4           HB2      ASP   4 -24.700  -1.133  -1.998
  Start of MODEL   12
 7805    HB2  ASP   4           HB3      ASP   4 -24.594   0.603  -1.735
  Start of MODEL   12
 7806    H    ASP   4           HN       ASP   4 -26.397  -2.008  -0.069
  Start of MODEL   12
 7807    HA   ASP   5           HA       ASP   5 -26.995   2.376   2.084
  Start of MODEL   12
 7808    HB3  ASP   5           HB2      ASP   5 -27.716   0.171   4.031
  Start of MODEL   12
 7809    HB2  ASP   5           HB3      ASP   5 -28.789   0.939   2.870
  Start of MODEL   12
 7810    H    ASP   5           HN       ASP   5 -26.625  -0.457   1.908
  Start of MODEL   12
 7811    HA   VAL   6           HA       VAL   6 -24.091   2.089   5.615
  Start of MODEL   12
 7812    HB   VAL   6           HB       VAL   6 -22.659   0.163   6.574
  Start of MODEL   12
 7813    H    VAL   6           HN       VAL   6 -25.157   0.020   3.956
  Start of MODEL   12
 7814    HA   SER   7           HA       SER   7 -21.005   2.430   2.624
  Start of MODEL   12
 7815    HB3  SER   7           HB2      SER   7 -21.563   5.220   3.635
  Start of MODEL   12
 7816    HB2  SER   7           HB3      SER   7 -22.341   4.468   2.244
  Start of MODEL   12
 7817    HG   SER   7           HG       SER   7 -20.505   5.880   1.800
  Start of MODEL   12
 7818    H    SER   7           HN       SER   7 -22.870   3.382   4.583
  Start of MODEL   12
 7819    HA   PHE   8           HA       PHE   8 -18.131   2.470   5.958
  Start of MODEL   12
 7820    HB3  PHE   8           HB2      PHE   8 -16.575   0.619   5.714
  Start of MODEL   12
 7821    HB2  PHE   8           HB3      PHE   8 -17.138   0.304   4.080
  Start of MODEL   12
 7822    HD1  PHE   8           HD1      PHE   8 -18.108  -1.811   4.054
  Start of MODEL   12
 7823    HD2  PHE   8           HD2      PHE   8 -18.985   0.852   7.252
  Start of MODEL   12
 7824    HE1  PHE   8           HE1      PHE   8 -19.749  -3.400   4.926
  Start of MODEL   12
 7825    HE2  PHE   8           HE2      PHE   8 -20.615  -0.738   8.130
  Start of MODEL   12
 7826    HZ   PHE   8           HZ       PHE   8 -20.947  -2.944   6.941
  Start of MODEL   12
 7827    H    PHE   8           HN       PHE   8 -19.459   1.372   3.660
  Start of MODEL   12
 7828    HA   CYS   9           HA       CYS   9 -15.930   4.961   3.198
  Start of MODEL   12
 7829    HB3  CYS   9           HB2      CYS   9 -14.952   6.849   4.429
  Start of MODEL   12
 7830    HB2  CYS   9           HB3      CYS   9 -15.175   5.978   5.949
  Start of MODEL   12
 7831    H    CYS   9           HN       CYS   9 -16.582   3.969   5.827
  Start of MODEL   12
 7832    HA   ALA  10           HA       ALA  10 -12.051   3.310   3.174
  Start of MODEL   12
 7833    HB1  ALA  10           HB1      ALA  10 -11.035   6.068   2.542
  Start of MODEL   12
 7834    HB3  ALA  10           HB2      ALA  10 -11.760   4.942   1.378
  Start of MODEL   12
 7835    HB2  ALA  10           HB3      ALA  10 -10.219   4.558   2.169
  Start of MODEL   12
 7836    H    ALA  10           HN       ALA  10 -13.276   5.923   3.589
  Start of MODEL   12
 7837    HA   SER  11           HA       SER  11  -9.636   4.194   6.613
  Start of MODEL   12
 7838    HB3  SER  11           HB2      SER  11  -9.989   2.442   8.261
  Start of MODEL   12
 7839    HB2  SER  11           HB3      SER  11 -10.665   1.376   7.021
  Start of MODEL   12
 7840    HG   SER  11           HG       SER  11 -12.495   2.266   7.357
  Start of MODEL   12
 7841    H    SER  11           HN       SER  11 -11.003   2.476   4.701
  Start of MODEL   12
 7842    HA   VAL  12           HA       VAL  12  -6.319   1.724   5.102
  Start of MODEL   12
 7843    HB   VAL  12           HB       VAL  12  -5.227   4.522   5.567
  Start of MODEL   12
 7844    H    VAL  12           HN       VAL  12  -7.460   3.884   6.726
  Start of MODEL   12
 7845    HA   GLN  13           HA       GLN  13  -3.943   1.234   8.724
  Start of MODEL   12
 7846    HB3  GLN  13           HB2      GLN  13  -4.028  -1.098   9.551
  Start of MODEL   12
 7847    HB2  GLN  13           HB3      GLN  13  -4.937  -1.556   8.123
  Start of MODEL   12
 7848    HG2  GLN  13           HG2      GLN  13  -5.888   0.442  10.158
  Start of MODEL   12
 7849    HG3  GLN  13           HG3      GLN  13  -6.800  -0.213   8.795
  Start of MODEL   12
 7850   HE21  GLN  13          HE21      GLN  13  -8.377  -1.081  10.078
  Start of MODEL   12
 7851   HE22  GLN  13          HE22      GLN  13  -8.117  -2.461  11.084
  Start of MODEL   12
 7852    H    GLN  13           HN       GLN  13  -5.329   0.258   6.352
  Start of MODEL   12
 7853    HA   LEU  14           HA       LEU  14  -0.548  -0.406   6.533
  Start of MODEL   12
 7854    HB3  LEU  14           HB2      LEU  14   1.392   1.296   6.843
  Start of MODEL   12
 7855    HB2  LEU  14           HB3      LEU  14   0.159   2.341   7.524
  Start of MODEL   12
 7856    HG   LEU  14           HG       LEU  14  -1.111   2.110   5.350
  Start of MODEL   12
 7857   HD12  LEU  14          HD11      LEU  14   0.342   3.583   4.095
  Start of MODEL   12
 7858   HD11  LEU  14          HD12      LEU  14   1.697   3.177   5.146
  Start of MODEL   12
 7859   HD13  LEU  14          HD13      LEU  14   0.310   4.063   5.794
  Start of MODEL   12
 7860   HD22  LEU  14          HD21      LEU  14   0.126   1.291   3.440
  Start of MODEL   12
 7861   HD21  LEU  14          HD22      LEU  14  -0.099   0.031   4.655
  Start of MODEL   12
 7862   HD23  LEU  14          HD23      LEU  14   1.464   0.842   4.498
  Start of MODEL   12
 7863    H    LEU  14           HN       LEU  14  -1.850   1.373   8.448
  Start of MODEL   12
 7864    HA   HIS  15           HA       HIS  15   1.753  -1.651  10.009
  Start of MODEL   12
 7865    HB3  HIS  15           HB2      HIS  15   1.936  -4.139   9.782
  Start of MODEL   12
 7866    HB2  HIS  15           HB3      HIS  15   1.412  -3.999   8.111
  Start of MODEL   12
 7867    HD1  HIS  15           HD1      HIS  15   0.104  -3.918  11.617
  Start of MODEL   12
 7868    HD2  HIS  15           HD2      HIS  15  -1.349  -3.555   7.737
  Start of MODEL   12
 7869    HE1  HIS  15           HE1      HIS  15  -2.391  -4.032  11.821
  Start of MODEL   12
 7870    HE2  HIS  15           HE2      HIS  15  -3.214  -4.098   9.462
  Start of MODEL   12
 7871    H    HIS  15           HN       HIS  15   1.349  -1.498   7.121
  Start of MODEL   12
 7872    HA   THR  16           HA       THR  16   5.836  -1.097   9.191
  Start of MODEL   12
 7873    HB   THR  16           HB       THR  16   6.084  -3.150  11.407
  Start of MODEL   12
 7874    HG1  THR  16           HG1      THR  16   4.767  -1.603  12.238
  Start of MODEL   12
 7875   HG23  THR  16          HG21      THR  16   8.207  -2.516  10.301
  Start of MODEL   12
 7876   HG22  THR  16          HG22      THR  16   8.137  -1.897  11.955
  Start of MODEL   12
 7877   HG21  THR  16          HG23      THR  16   7.839  -0.817  10.593
  Start of MODEL   12
 7878    H    THR  16           HN       THR  16   3.773  -2.229  10.608
  Start of MODEL   12
 7879    HA   ALA  17           HA       ALA  17   6.962  -4.031   6.169
  Start of MODEL   12
 7880    HB3  ALA  17           HB1      ALA  17   9.066  -3.413   5.185
  Start of MODEL   12
 7881    HB2  ALA  17           HB2      ALA  17   9.510  -2.507   6.620
  Start of MODEL   12
 7882    HB1  ALA  17           HB3      ALA  17   8.210  -1.918   5.596
  Start of MODEL   12
 7883    H    ALA  17           HN       ALA  17   7.275  -1.794   7.784
  Start of MODEL   12
 7884    HA   VAL  18           HA       VAL  18   9.231  -6.782   8.583
  Start of MODEL   12
 7885    HB   VAL  18           HB       VAL  18   8.920  -9.143   7.814
  Start of MODEL   12
 7886    H    VAL  18           HN       VAL  18   7.876  -5.996   6.147
  Start of MODEL   12
 7887    HA   GLU  19           HA       GLU  19  12.958  -6.606   6.502
  Start of MODEL   12
 7888    HB3  GLU  19           HB2      GLU  19  14.803  -6.891   8.088
  Start of MODEL   12
 7889    HB2  GLU  19           HB3      GLU  19  13.657  -7.443   9.302
  Start of MODEL   12
 7890    HG2  GLU  19           HG2      GLU  19  13.640  -4.732   8.018
  Start of MODEL   12
 7891    HG3  GLU  19           HG3      GLU  19  12.571  -5.294   9.304
  Start of MODEL   12
 7892    H    GLU  19           HN       GLU  19  11.287  -7.386   8.715
  Start of MODEL   12
 7893    HA   MET  20           HA       MET  20  14.670 -10.391   5.547
  Start of MODEL   12
 7894    HB3  MET  20           HB2      MET  20  12.446 -11.370   5.866
  Start of MODEL   12
 7895    HB2  MET  20           HB3      MET  20  13.099 -11.937   4.344
  Start of MODEL   12
 7896    HG2  MET  20           HG2      MET  20  11.066  -9.752   4.660
  Start of MODEL   12
 7897    HG3  MET  20           HG3      MET  20  11.715 -10.343   3.134
  Start of MODEL   12
 7898    HE2  MET  20           HE1      MET  20   8.059 -11.737   3.024
  Start of MODEL   12
 7899    HE1  MET  20           HE2      MET  20   9.292 -10.791   2.186
  Start of MODEL   12
 7900    HE3  MET  20           HE3      MET  20   8.577 -10.183   3.678
  Start of MODEL   12
 7901    H    MET  20           HN       MET  20  13.159  -8.053   5.011
  Start of MODEL   12
 7902    HA   HIS  21           HA       HIS  21  16.047  -9.473   1.625
  Start of MODEL   12
 7903    HB3  HIS  21           HB2      HIS  21  16.063 -11.044  -0.359
  Start of MODEL   12
 7904    HB2  HIS  21           HB3      HIS  21  15.071 -12.139   0.591
  Start of MODEL   12
 7905    HD1  HIS  21           HD1      HIS  21  18.503 -11.599  -0.249
  Start of MODEL   12
 7906    HD2  HIS  21           HD2      HIS  21  16.473 -12.765   3.185
  Start of MODEL   12
 7907    HE1  HIS  21           HE1      HIS  21  20.183 -12.762   1.158
  Start of MODEL   12
 7908    HE2  HIS  21           HE2      HIS  21  18.978 -13.311   3.300
  Start of MODEL   12
 7909    H    HIS  21           HN       HIS  21  14.443 -11.475   2.901
  Start of MODEL   12
 7910    HA   HIS  22           HA       HIS  22  12.405  -8.467  -0.822
  Start of MODEL   12
 7911    HB3  HIS  22           HB2      HIS  22  10.119  -9.465  -1.102
  Start of MODEL   12
 7912    HB2  HIS  22           HB3      HIS  22  10.565 -10.727   0.034
  Start of MODEL   12
 7913    HD1  HIS  22           HD1      HIS  22  11.276 -12.837  -1.028
  Start of MODEL   12
 7914    HD2  HIS  22           HD2      HIS  22  12.007  -9.554  -3.469
  Start of MODEL   12
 7915    HE1  HIS  22           HE1      HIS  22  12.117 -13.770  -3.180
  Start of MODEL   12
 7916    HE2  HIS  22           HE2      HIS  22  12.473 -11.780  -4.675
  Start of MODEL   12
 7917    H    HIS  22           HN       HIS  22  12.819 -10.646   1.101
  Start of MODEL   12
 7918    HA   TRP  23           HA       TRP  23  10.885  -6.635   2.819
  Start of MODEL   12
 7919    HB3  TRP  23           HB2      TRP  23  10.900  -4.123   2.569
  Start of MODEL   12
 7920    HB2  TRP  23           HB3      TRP  23  11.517  -4.365   0.940
  Start of MODEL   12
 7921    HD1  TRP  23           HD1      TRP  23  13.971  -5.768   0.846
  Start of MODEL   12
 7922    HE1  TRP  23           HE1      TRP  23  15.992  -5.487   2.398
  Start of MODEL   12
 7923    HE3  TRP  23           HE3      TRP  23  11.628  -3.573   4.822
  Start of MODEL   12
 7924    HZ2  TRP  23           HZ2      TRP  23  16.531  -4.460   4.977
  Start of MODEL   12
 7925    HZ3  TRP  23           HZ3      TRP  23  12.971  -2.970   6.786
  Start of MODEL   12
 7926    HH2  TRP  23           HH2      TRP  23  15.371  -3.406   6.861
  Start of MODEL   12
 7927    H    TRP  23           HN       TRP  23  11.835  -6.580   0.099
  Start of MODEL   12
 7928    HA   CYS  24           HA       CYS  24   6.862  -5.961   1.374
  Start of MODEL   12
 7929    HB3  CYS  24           HB2      CYS  24   6.823  -8.145   3.468
  Start of MODEL   12
 7930    HB2  CYS  24           HB3      CYS  24   7.135  -8.377   1.757
  Start of MODEL   12
 7931    H    CYS  24           HN       CYS  24   8.893  -6.524   3.419
  Start of MODEL   12
 7932    HA   ILE  25           HA       ILE  25   5.137  -3.754   4.779
  Start of MODEL   12
 7933    HB   ILE  25           HB       ILE  25   4.578  -2.068   2.312
  Start of MODEL   12
 7934   HD13  ILE  25          HD11      ILE  25   6.314  -0.134   1.952
  Start of MODEL   12
 7935   HD12  ILE  25          HD12      ILE  25   7.661  -0.004   3.088
  Start of MODEL   12
 7936   HD11  ILE  25          HD13      ILE  25   6.025   0.413   3.604
  Start of MODEL   12
 7937    H    ILE  25           HN       ILE  25   5.569  -4.377   1.939
  Start of MODEL   12
 7938    HA   PRO  26           HA       PRO  26   1.168  -5.741   3.693
  Start of MODEL   12
 7939    HB3  PRO  26           HB2      PRO  26   0.952  -7.227   5.414
  Start of MODEL   12
 7940    HB2  PRO  26           HB3      PRO  26   0.759  -5.914   6.574
  Start of MODEL   12
 7941    HG2  PRO  26           HG2      PRO  26   2.826  -6.640   7.291
  Start of MODEL   12
 7942    HG3  PRO  26           HG3      PRO  26   3.229  -7.328   5.708
  Start of MODEL   12
 7943    HD2  PRO  26           HD2      PRO  26   3.416  -4.487   6.643
  Start of MODEL   12
 7944    HD3  PRO  26           HD3      PRO  26   4.550  -5.440   5.656
  Start of MODEL   12
 7945    HA   PHE  27           HA       PHE  27  -1.473  -2.632   5.309
  Start of MODEL   12
 7946    HB3  PHE  27           HB2      PHE  27  -0.343  -1.454   3.438
  Start of MODEL   12
 7947    HB2  PHE  27           HB3      PHE  27  -2.021  -0.971   3.630
  Start of MODEL   12
 7948    HD1  PHE  27           HD1      PHE  27  -3.682  -1.408   1.867
  Start of MODEL   12
 7949    HD2  PHE  27           HD2      PHE  27   0.374  -2.731   1.527
  Start of MODEL   12
 7950    HE1  PHE  27           HE1      PHE  27  -4.021  -1.854  -0.489
  Start of MODEL   12
 7951    HE2  PHE  27           HE2      PHE  27   0.009  -3.169  -0.847
  Start of MODEL   12
 7952    HZ   PHE  27           HZ       PHE  27  -2.182  -2.732  -1.862
  Start of MODEL   12
 7953    H    PHE  27           HN       PHE  27  -0.684  -4.643   3.350
  Start of MODEL   12
 7954    HA   SER  28           HA       SER  28  -5.359  -3.787   3.647
  Start of MODEL   12
 7955    HB3  SER  28           HB2      SER  28  -6.694  -4.534   5.603
  Start of MODEL   12
 7956    HB2  SER  28           HB3      SER  28  -5.502  -3.780   6.672
  Start of MODEL   12
 7957    HG   SER  28           HG       SER  28  -4.166  -5.264   4.979
  Start of MODEL   12
 7958    H    SER  28           HN       SER  28  -3.669  -2.155   5.308
  Start of MODEL   12
 7959    HA   VAL  29           HA       VAL  29  -7.569  -0.071   4.100
  Start of MODEL   12
 7960    HB   VAL  29           HB       VAL  29  -6.261   0.632   2.136
  Start of MODEL   12
 7961    H    VAL  29           HN       VAL  29  -6.659  -2.503   2.740
  Start of MODEL   12
 7962    HA   ASP  30           HA       ASP  30 -11.337  -1.756   2.867
  Start of MODEL   12
 7963    HB3  ASP  30           HB2      ASP  30 -11.165  -2.735   5.128
  Start of MODEL   12
 7964    HB2  ASP  30           HB3      ASP  30 -12.811  -2.296   4.709
  Start of MODEL   12
 7965    H    ASP  30           HN       ASP  30  -9.684  -0.018   4.518
  Start of MODEL   12
 7966    HA2  GLY  31           HA2      GLY  31 -14.693   1.123   3.248
  Start of MODEL   12
 7967    H    GLY  31           HN       GLY  31 -13.365  -1.146   2.460
  Start of MODEL   12
 7968    HA3  GLY  31           HA1      GLY  31 -13.675   1.584   1.876
  Start of MODEL   12
 7969    HA   GLN  32           HA       GLN  32 -16.980  -1.166   0.530
  Start of MODEL   12
 7970    HB3  GLN  32           HB2      GLN  32 -19.188   0.677   1.467
  Start of MODEL   12
 7971    HB2  GLN  32           HB3      GLN  32 -18.603  -0.706   2.367
  Start of MODEL   12
 7972    HG2  GLN  32           HG2      GLN  32 -19.817  -0.788  -0.375
  Start of MODEL   12
 7973    HG3  GLN  32           HG3      GLN  32 -19.239  -2.177   0.546
  Start of MODEL   12
 7974   HE21  GLN  32          HE21      GLN  32 -21.586   0.229   0.247
  Start of MODEL   12
 7975   HE22  GLN  32          HE22      GLN  32 -22.710  -0.451   1.410
  Start of MODEL   12
 7976    H    GLN  32           HN       GLN  32 -16.651   1.126   2.224
  Start of MODEL   12
 7977    HA   PRO  33           HA       PRO  33 -17.756   2.258  -2.759
  Start of MODEL   12
 7978    HB3  PRO  33           HB2      PRO  33 -17.775   4.574  -2.451
  Start of MODEL   12
 7979    HB2  PRO  33           HB3      PRO  33 -16.447   4.505  -1.283
  Start of MODEL   12
 7980    HG2  PRO  33           HG2      PRO  33 -18.219   4.934   0.144
  Start of MODEL   12
 7981    HG3  PRO  33           HG3      PRO  33 -19.365   4.035  -0.866
  Start of MODEL   12
 7982    HD2  PRO  33           HD2      PRO  33 -17.371   3.012   1.102
  Start of MODEL   12
 7983    HD3  PRO  33           HD3      PRO  33 -19.006   2.433   0.714
  Start of MODEL   12
 7984    HA   ALA  34           HA       ALA  34 -13.736   0.618  -2.810
  Start of MODEL   12
 7985    HB3  ALA  34           HB1      ALA  34 -14.900  -0.367  -4.670
  Start of MODEL   12
 7986    HB2  ALA  34           HB2      ALA  34 -13.231   0.025  -5.125
  Start of MODEL   12
 7987    HB1  ALA  34           HB3      ALA  34 -14.578   1.047  -5.662
  Start of MODEL   12
 7988    H    ALA  34           HN       ALA  34 -16.135   1.574  -3.905
  Start of MODEL   12
 7989    HA   PRO  35           HA       PRO  35 -11.661   4.583  -3.235
  Start of MODEL   12
 7990    HB3  PRO  35           HB2      PRO  35 -11.316   4.308  -0.943
  Start of MODEL   12
 7991    HB2  PRO  35           HB3      PRO  35  -9.665   4.191  -1.563
  Start of MODEL   12
 7992    HG2  PRO  35           HG2      PRO  35  -9.618   1.906  -1.390
  Start of MODEL   12
 7993    HG3  PRO  35           HG3      PRO  35 -10.671   2.242  -0.035
  Start of MODEL   12
 7994    HD2  PRO  35           HD2      PRO  35 -11.410   0.654  -2.223
  Start of MODEL   12
 7995    HD3  PRO  35           HD3      PRO  35 -12.569   1.466  -1.149
  Start of MODEL   12
 7996    HA   SER  36           HA       SER  36  -8.162   3.440  -5.622
  Start of MODEL   12
 7997    HB3  SER  36           HB2      SER  36  -9.080   5.089  -7.052
  Start of MODEL   12
 7998    HB2  SER  36           HB3      SER  36  -7.435   5.653  -6.744
  Start of MODEL   12
 7999    HG   SER  36           HG       SER  36  -9.888   6.625  -5.804
  Start of MODEL   12
 8000    H    SER  36           HN       SER  36  -9.772   5.352  -4.126
  Start of MODEL   12
 8001    HA   LEU  37           HA       LEU  37  -5.122   4.531  -2.676
  Start of MODEL   12
 8002    HB3  LEU  37           HB2      LEU  37  -3.481   2.756  -2.516
  Start of MODEL   12
 8003    HB2  LEU  37           HB3      LEU  37  -3.978   2.100  -4.057
  Start of MODEL   12
 8004    HG   LEU  37           HG       LEU  37  -6.200   1.560  -3.042
  Start of MODEL   12
 8005   HD12  LEU  37          HD11      LEU  37  -5.389  -0.337  -1.772
  Start of MODEL   12
 8006   HD11  LEU  37          HD12      LEU  37  -3.825   0.435  -1.570
  Start of MODEL   12
 8007   HD13  LEU  37          HD13      LEU  37  -4.359  -0.057  -3.180
  Start of MODEL   12
 8008   HD22  LEU  37          HD21      LEU  37  -6.399   1.621  -0.616
  Start of MODEL   12
 8009   HD21  LEU  37          HD22      LEU  37  -6.176   3.239  -1.274
  Start of MODEL   12
 8010   HD23  LEU  37          HD23      LEU  37  -4.817   2.397  -0.506
  Start of MODEL   12
 8011    H    LEU  37           HN       LEU  37  -6.011   3.177  -5.109
  Start of MODEL   12
 8012    HA   ARG  38           HA       ARG  38  -1.294   5.493  -4.796
  Start of MODEL   12
 8013    HB3  ARG  38           HB2      ARG  38  -2.501   8.034  -3.647
  Start of MODEL   12
 8014    HB2  ARG  38           HB3      ARG  38  -2.718   7.427  -5.283
  Start of MODEL   12
 8015    HG2  ARG  38           HG2      ARG  38  -0.182   8.501  -4.071
  Start of MODEL   12
 8016    HG3  ARG  38           HG3      ARG  38  -0.256   7.725  -5.649
  Start of MODEL   12
 8017    HD2  ARG  38           HD2      ARG  38  -0.330  10.134  -5.897
  Start of MODEL   12
 8018    HD3  ARG  38           HD3      ARG  38  -1.867   9.435  -6.383
  Start of MODEL   12
 8019    HE   ARG  38           HE       ARG  38  -1.488  10.619  -3.719
  Start of MODEL   12
 8020   HH11  ARG  38          HH11      ARG  38  -3.335  10.433  -6.780
  Start of MODEL   12
 8021   HH12  ARG  38          HH12      ARG  38  -4.453  11.618  -6.325
  Start of MODEL   12
 8022   HH21  ARG  38          HH21      ARG  38  -3.064  12.240  -3.106
  Start of MODEL   12
 8023   HH22  ARG  38          HH22      ARG  38  -4.326  12.639  -4.193
  Start of MODEL   12
 8024    H    ARG  38           HN       ARG  38  -3.062   5.394  -2.525
  Start of MODEL   12
 8025    HA   TRP  39           HA       TRP  39   1.215   5.798  -1.234
  Start of MODEL   12
 8026    HB3  TRP  39           HB2      TRP  39   3.521   4.970  -1.821
  Start of MODEL   12
 8027    HB2  TRP  39           HB3      TRP  39   2.947   4.804  -3.476
  Start of MODEL   12
 8028    HD1  TRP  39           HD1      TRP  39   1.738   2.678  -4.161
  Start of MODEL   12
 8029    HE1  TRP  39           HE1      TRP  39   1.136   0.512  -2.957
  Start of MODEL   12
 8030    HE3  TRP  39           HE3      TRP  39   2.697   4.150   0.634
  Start of MODEL   12
 8031    HZ2  TRP  39           HZ2      TRP  39   1.028  -0.455  -0.300
  Start of MODEL   12
 8032    HZ3  TRP  39           HZ3      TRP  39   2.319   2.538   2.451
  Start of MODEL   12
 8033    HH2  TRP  39           HH2      TRP  39   1.499   0.284   1.990
  Start of MODEL   12
 8034    H    TRP  39           HN       TRP  39   0.787   5.570  -4.105
  Start of MODEL   12
 8035    HA   LEU  40           HA       LEU  40   3.429   9.406  -2.257
  Start of MODEL   12
 8036    HB3  LEU  40           HB2      LEU  40   2.008  10.118   0.325
  Start of MODEL   12
 8037    HB2  LEU  40           HB3      LEU  40   1.287  10.279  -1.269
  Start of MODEL   12
 8038    HG   LEU  40           HG       LEU  40   3.758  11.774  -0.448
  Start of MODEL   12
 8039   HD13  LEU  40          HD11      LEU  40   3.550  11.460  -2.810
  Start of MODEL   12
 8040   HD12  LEU  40          HD12      LEU  40   3.156  13.136  -2.407
  Start of MODEL   12
 8041   HD11  LEU  40          HD13      LEU  40   1.867  11.974  -2.761
  Start of MODEL   12
 8042   HD23  LEU  40          HD21      LEU  40   0.884  12.677  -0.510
  Start of MODEL   12
 8043   HD22  LEU  40          HD22      LEU  40   2.286  13.702  -0.200
  Start of MODEL   12
 8044   HD21  LEU  40          HD23      LEU  40   1.847  12.432   0.944
  Start of MODEL   12
 8045    H    LEU  40           HN       LEU  40   1.908   7.639  -0.476
  Start of MODEL   12
 8046    HA   PHE  41           HA       PHE  41   6.416   8.603   0.825
  Start of MODEL   12
 8047    HB3  PHE  41           HB2      PHE  41   7.742   8.453  -1.908
  Start of MODEL   12
 8048    HB2  PHE  41           HB3      PHE  41   7.023   7.130  -1.013
  Start of MODEL   12
 8049    HD1  PHE  41           HD1      PHE  41  10.003   8.894  -1.680
  Start of MODEL   12
 8050    HD2  PHE  41           HD2      PHE  41   8.016   6.574   1.271
  Start of MODEL   12
 8051    HE1  PHE  41           HE1      PHE  41  12.155   8.408  -0.618
  Start of MODEL   12
 8052    HE2  PHE  41           HE2      PHE  41  10.168   6.085   2.337
  Start of MODEL   12
 8053    HZ   PHE  41           HZ       PHE  41  12.240   7.001   1.395
  Start of MODEL   12
 8054    H    PHE  41           HN       PHE  41   5.508   9.681  -1.735
  Start of MODEL   12
 8055    HA   ASN  42           HA       ASN  42   7.206  12.425   2.696
  Start of MODEL   12
 8056    HB3  ASN  42           HB2      ASN  42   9.643  13.035   2.371
  Start of MODEL   12
 8057    HB2  ASN  42           HB3      ASN  42   9.774  11.619   1.338
  Start of MODEL   12
 8058   HD21  ASN  42          HD21      ASN  42   9.280  12.704   4.603
  Start of MODEL   12
 8059   HD22  ASN  42          HD22      ASN  42   9.622  11.197   5.357
  Start of MODEL   12
 8060    H    ASN  42           HN       ASN  42   6.623  10.381   1.960
  Start of MODEL   12
 8061    HA2  GLY  43           HA2      GLY  43   5.025  14.853  -0.422
  Start of MODEL   12
 8062    H    GLY  43           HN       GLY  43   5.671  12.750   0.490
  Start of MODEL   12
 8063    HA3  GLY  43           HA1      GLY  43   6.707  15.344  -0.410
  Start of MODEL   12
 8064    HA   SER  44           HA       SER  44   6.631  13.381  -4.459
  Start of MODEL   12
 8065    HB3  SER  44           HB2      SER  44   8.632  11.342  -3.444
  Start of MODEL   12
 8066    HB2  SER  44           HB3      SER  44   9.042  13.040  -3.640
  Start of MODEL   12
 8067    HG   SER  44           HG       SER  44   9.508  12.506  -5.546
  Start of MODEL   12
 8068    H    SER  44           HN       SER  44   7.142  12.492  -1.679
  Start of MODEL   12
 8069    HA   VAL  45           HA       VAL  45   4.012  10.051  -4.620
  Start of MODEL   12
 8070    HB   VAL  45           HB       VAL  45   4.359  10.787  -7.545
  Start of MODEL   12
 8071    H    VAL  45           HN       VAL  45   5.721  12.012  -5.839
  Start of MODEL   12
 8072    HA   LEU  46           HA       LEU  46   6.936   6.984  -5.463
  Start of MODEL   12
 8073    HB3  LEU  46           HB2      LEU  46   4.676   5.551  -4.098
  Start of MODEL   12
 8074    HB2  LEU  46           HB3      LEU  46   6.034   6.298  -3.281
  Start of MODEL   12
 8075    HG   LEU  46           HG       LEU  46   6.270   4.020  -5.232
  Start of MODEL   12
 8076   HD12  LEU  46          HD11      LEU  46   8.524   3.779  -4.238
  Start of MODEL   12
 8077   HD11  LEU  46          HD12      LEU  46   8.237   5.256  -3.307
  Start of MODEL   12
 8078   HD13  LEU  46          HD13      LEU  46   8.297   5.319  -5.065
  Start of MODEL   12
 8079   HD21  LEU  46          HD21      LEU  46   5.012   3.290  -3.321
  Start of MODEL   12
 8080   HD23  LEU  46          HD22      LEU  46   6.185   4.010  -2.231
  Start of MODEL   12
 8081   HD22  LEU  46          HD23      LEU  46   6.645   2.623  -3.231
  Start of MODEL   12
 8082    H    LEU  46           HN       LEU  46   4.392   7.925  -4.528
  Start of MODEL   12
 8083    HA   ASN  47           HA       ASN  47   4.895   5.473  -8.969
  Start of MODEL   12
 8084    HB3  ASN  47           HB2      ASN  47   7.798   5.955  -9.708
  Start of MODEL   12
 8085    HB2  ASN  47           HB3      ASN  47   6.453   7.057  -9.958
  Start of MODEL   12
 8086   HD21  ASN  47          HD21      ASN  47   4.966   6.636 -11.590
  Start of MODEL   12
 8087   HD22  ASN  47          HD22      ASN  47   5.326   5.562 -12.885
  Start of MODEL   12
 8088    H    ASN  47           HN       ASN  47   7.211   6.170  -7.376
  Start of MODEL   12
 8089    HA   GLU  48           HA       GLU  48   5.672   1.197  -8.128
  Start of MODEL   12
 8090    HB3  GLU  48           HB2      GLU  48   4.276  -0.143  -9.695
  Start of MODEL   12
 8091    HB2  GLU  48           HB3      GLU  48   3.855   1.330 -10.541
  Start of MODEL   12
 8092    HG2  GLU  48           HG2      GLU  48   3.005   2.105  -8.215
  Start of MODEL   12
 8093    HG3  GLU  48           HG3      GLU  48   2.019   1.046  -9.230
  Start of MODEL   12
 8094    H    GLU  48           HN       GLU  48   4.415   3.396  -9.326
  Start of MODEL   12
 8095    HA   THR  49           HA       THR  49   8.387   0.407 -11.473
  Start of MODEL   12
 8096    HB   THR  49           HB       THR  49  10.735   0.309 -10.491
  Start of MODEL   12
 8097    HG1  THR  49           HG1      THR  49   9.433   1.212  -8.156
  Start of MODEL   12
 8098   HG21  THR  49          HG21      THR  49   9.072   2.755  -9.846
  Start of MODEL   12
 8099   HG23  THR  49          HG22      THR  49   9.812   2.400 -11.406
  Start of MODEL   12
 8100   HG22  THR  49          HG23      THR  49  10.828   2.718 -10.000
  Start of MODEL   12
 8101    H    THR  49           HN       THR  49   7.471   0.183  -8.701
  Start of MODEL   12
 8102    HA   SER  50           HA       SER  50   9.211  -3.846 -11.082
  Start of MODEL   12
 8103    HB3  SER  50           HB2      SER  50  12.081  -3.120 -11.773
  Start of MODEL   12
 8104    HB2  SER  50           HB3      SER  50  10.796  -3.349 -12.950
  Start of MODEL   12
 8105    HG   SER  50           HG       SER  50  10.597  -5.500 -12.110
  Start of MODEL   12
 8106    H    SER  50           HN       SER  50  10.420  -1.312 -11.508
  Start of MODEL   12
 8107    HA   PHE  51           HA       PHE  51  12.379  -3.773  -7.574
  Start of MODEL   12
 8108    HB3  PHE  51           HB2      PHE  51  13.629  -1.985  -6.566
  Start of MODEL   12
 8109    HB2  PHE  51           HB3      PHE  51  12.614  -0.773  -7.332
  Start of MODEL   12
 8110    HD1  PHE  51           HD1      PHE  51  15.208  -3.310  -7.968
  Start of MODEL   12
 8111    HD2  PHE  51           HD2      PHE  51  13.019  -0.011  -9.517
  Start of MODEL   12
 8112    HE1  PHE  51           HE1      PHE  51  16.755  -3.178  -9.869
  Start of MODEL   12
 8113    HE2  PHE  51           HE2      PHE  51  14.559   0.124 -11.424
  Start of MODEL   12
 8114    HZ   PHE  51           HZ       PHE  51  16.426  -1.460 -11.604
  Start of MODEL   12
 8115    H    PHE  51           HN       PHE  51  11.346  -1.743  -9.349
  Start of MODEL   12
 8116    HA   ILE  52           HA       ILE  52   9.155  -1.919  -4.796
  Start of MODEL   12
 8117    HB   ILE  52           HB       ILE  52   9.070   0.878  -5.970
  Start of MODEL   12
 8118   HD13  ILE  52          HD11      ILE  52  10.906   2.534  -5.250
  Start of MODEL   12
 8119   HD12  ILE  52          HD12      ILE  52  12.175   1.967  -4.162
  Start of MODEL   12
 8120   HD11  ILE  52          HD13      ILE  52  10.521   2.156  -3.573
  Start of MODEL   12
 8121    H    ILE  52           HN       ILE  52  10.079  -1.079  -7.482
  Start of MODEL   12
 8122    HA   PHE  53           HA       PHE  53   5.240  -1.289  -6.672
  Start of MODEL   12
 8123    HB3  PHE  53           HB2      PHE  53   6.168  -2.584  -8.561
  Start of MODEL   12
 8124    HB2  PHE  53           HB3      PHE  53   4.483  -2.977  -8.269
  Start of MODEL   12
 8125    HD1  PHE  53           HD1      PHE  53   7.901  -4.250  -8.220
  Start of MODEL   12
 8126    HD2  PHE  53           HD2      PHE  53   3.813  -5.146  -7.453
  Start of MODEL   12
 8127    HE1  PHE  53           HE1      PHE  53   8.450  -6.643  -8.123
  Start of MODEL   12
 8128    HE2  PHE  53           HE2      PHE  53   4.355  -7.536  -7.362
  Start of MODEL   12
 8129    HZ   PHE  53           HZ       PHE  53   6.642  -8.301  -7.826
  Start of MODEL   12
 8130    H    PHE  53           HN       PHE  53   7.186  -2.976  -5.354
  Start of MODEL   12
 8131    HA   THR  54           HA       THR  54   2.752  -3.234  -3.795
  Start of MODEL   12
 8132    HB   THR  54           HB       THR  54   0.664  -1.940  -5.558
  Start of MODEL   12
 8133    HG1  THR  54           HG1      THR  54   2.379  -0.427  -5.068
  Start of MODEL   12
 8134   HG22  THR  54          HG21      THR  54  -0.498  -1.612  -3.441
  Start of MODEL   12
 8135   HG21  THR  54          HG22      THR  54   0.837  -2.393  -2.591
  Start of MODEL   12
 8136   HG23  THR  54          HG23      THR  54  -0.159  -3.324  -3.714
  Start of MODEL   12
 8137    H    THR  54           HN       THR  54   3.095  -1.995  -6.398
  Start of MODEL   12
 8138    HA   GLU  55           HA       GLU  55   0.960  -6.679  -5.925
  Start of MODEL   12
 8139    HB3  GLU  55           HB2      GLU  55   2.084  -7.823  -3.339
  Start of MODEL   12
 8140    HB2  GLU  55           HB3      GLU  55   2.965  -7.747  -4.859
  Start of MODEL   12
 8141    HG2  GLU  55           HG2      GLU  55   0.399  -9.268  -4.440
  Start of MODEL   12
 8142    HG3  GLU  55           HG3      GLU  55   1.393  -9.255  -5.894
  Start of MODEL   12
 8143    H    GLU  55           HN       GLU  55   2.224  -5.319  -3.655
  Start of MODEL   12
 8144    HA   PHE  56           HA       PHE  56  -2.567  -6.745  -3.251
  Start of MODEL   12
 8145    HB3  PHE  56           HB2      PHE  56  -4.579  -6.416  -4.693
  Start of MODEL   12
 8146    HB2  PHE  56           HB3      PHE  56  -3.530  -6.507  -6.093
  Start of MODEL   12
 8147    HD1  PHE  56           HD1      PHE  56  -4.326  -4.524  -3.122
  Start of MODEL   12
 8148    HD2  PHE  56           HD2      PHE  56  -2.295  -4.655  -6.852
  Start of MODEL   12
 8149    HE1  PHE  56           HE1      PHE  56  -4.009  -2.110  -3.023
  Start of MODEL   12
 8150    HE2  PHE  56           HE2      PHE  56  -1.960  -2.219  -6.762
  Start of MODEL   12
 8151    HZ   PHE  56           HZ       PHE  56  -2.822  -0.935  -4.840
  Start of MODEL   12
 8152    H    PHE  56           HN       PHE  56  -1.158  -7.327  -5.777
  Start of MODEL   12
 8153    HA   LEU  57           HA       LEU  57  -4.397 -10.624  -4.115
  Start of MODEL   12
 8154    HB3  LEU  57           HB2      LEU  57  -3.382 -11.046  -1.837
  Start of MODEL   12
 8155    HB2  LEU  57           HB3      LEU  57  -4.913 -11.850  -2.083
  Start of MODEL   12
 8156    HG   LEU  57           HG       LEU  57  -4.847  -9.292  -0.554
  Start of MODEL   12
 8157   HD13  LEU  57          HD11      LEU  57  -7.009 -10.233  -1.286
  Start of MODEL   12
 8158   HD12  LEU  57          HD12      LEU  57  -6.864 -10.246   0.479
  Start of MODEL   12
 8159   HD11  LEU  57          HD13      LEU  57  -6.624 -11.727  -0.456
  Start of MODEL   12
 8160   HD22  LEU  57          HD21      LEU  57  -4.581 -10.625   1.500
  Start of MODEL   12
 8161   HD21  LEU  57          HD22      LEU  57  -3.157 -10.722   0.470
  Start of MODEL   12
 8162   HD23  LEU  57          HD23      LEU  57  -4.304 -12.060   0.518
  Start of MODEL   12
 8163    H    LEU  57           HN       LEU  57  -3.995  -8.230  -2.500
  Start of MODEL   12
 8164    HA   GLU  58           HA       GLU  58  -8.343  -9.123  -4.276
  Start of MODEL   12
 8165    HB3  GLU  58           HB2      GLU  58  -9.819 -10.755  -5.467
  Start of MODEL   12
 8166    HB2  GLU  58           HB3      GLU  58  -8.566 -11.940  -5.063
  Start of MODEL   12
 8167    HG2  GLU  58           HG2      GLU  58  -8.125  -9.436  -6.686
  Start of MODEL   12
 8168    HG3  GLU  58           HG3      GLU  58  -6.922 -10.667  -6.321
  Start of MODEL   12
 8169    H    GLU  58           HN       GLU  58  -6.754 -11.487  -3.685
  Start of MODEL   12
 8170    HA   PRO  59           HA       PRO  59 -10.878 -10.072  -0.720
  Start of MODEL   12
 8171    HB3  PRO  59           HB2      PRO  59 -10.866  -7.757  -0.426
  Start of MODEL   12
 8172    HB2  PRO  59           HB3      PRO  59 -12.524  -7.961  -1.001
  Start of MODEL   12
 8173    HG2  PRO  59           HG2      PRO  59 -11.999  -7.302  -3.153
  Start of MODEL   12
 8174    HG3  PRO  59           HG3      PRO  59 -10.853  -6.303  -2.238
  Start of MODEL   12
 8175    HD2  PRO  59           HD2      PRO  59 -10.133  -8.055  -4.201
  Start of MODEL   12
 8176    HD3  PRO  59           HD3      PRO  59  -9.066  -7.594  -2.857
  Start of MODEL   12
 8177    HA   ALA  60           HA       ALA  60 -14.330 -11.671  -2.862
  Start of MODEL   12
 8178    HB2  ALA  60           HB1      ALA  60 -15.763 -12.969  -1.361
  Start of MODEL   12
 8179    HB1  ALA  60           HB2      ALA  60 -15.038 -12.170   0.034
  Start of MODEL   12
 8180    HB3  ALA  60           HB3      ALA  60 -14.061 -13.224  -0.991
  Start of MODEL   12
 8181    H    ALA  60           HN       ALA  60 -13.104 -10.668  -0.441
  Start of MODEL   12
 8182    HA   ALA  61           HA       ALA  61 -17.478  -8.937  -3.204
  Start of MODEL   12
 8183    HB1  ALA  61           HB1      ALA  61 -18.786 -10.842  -4.047
  Start of MODEL   12
 8184    HB3  ALA  61           HB2      ALA  61 -19.815  -9.572  -3.388
  Start of MODEL   12
 8185    HB2  ALA  61           HB3      ALA  61 -19.513 -11.034  -2.452
  Start of MODEL   12
 8186    H    ALA  61           HN       ALA  61 -16.940 -11.581  -2.553
  Start of MODEL   12
 8187    HA   ASN  62           HA       ASN  62 -19.108  -8.215   0.975
  Start of MODEL   12
 8188    HB3  ASN  62           HB2      ASN  62 -19.475  -9.699   3.019
  Start of MODEL   12
 8189    HB2  ASN  62           HB3      ASN  62 -19.014 -11.051   1.993
  Start of MODEL   12
 8190   HD21  ASN  62          HD21      ASN  62 -21.044 -11.994   2.138
  Start of MODEL   12
 8191   HD22  ASN  62          HD22      ASN  62 -22.424 -11.334   1.346
  Start of MODEL   12
 8192    H    ASN  62           HN       ASN  62 -17.999 -10.632  -0.204
  Start of MODEL   12
 8193    HA   GLU  63           HA       GLU  63 -15.143  -7.950   2.893
  Start of MODEL   12
 8194    HB3  GLU  63           HB2      GLU  63 -12.910  -8.375   1.851
  Start of MODEL   12
 8195    HB2  GLU  63           HB3      GLU  63 -13.730  -9.005   0.432
  Start of MODEL   12
 8196    HG2  GLU  63           HG2      GLU  63 -14.772 -10.700   1.888
  Start of MODEL   12
 8197    HG3  GLU  63           HG3      GLU  63 -13.022 -10.867   1.677
  Start of MODEL   12
 8198    H    GLU  63           HN       GLU  63 -16.215  -8.743   0.278
  Start of MODEL   12
 8199    HA   THR  64           HA       THR  64 -14.777  -4.321   0.527
  Start of MODEL   12
 8200    HB   THR  64           HB       THR  64 -15.345  -2.312   1.896
  Start of MODEL   12
 8201    HG1  THR  64           HG1      THR  64 -16.029  -4.074   3.993
  Start of MODEL   12
 8202   HG23  THR  64          HG21      THR  64 -17.132  -3.559   0.778
  Start of MODEL   12
 8203   HG22  THR  64          HG22      THR  64 -17.702  -2.893   2.306
  Start of MODEL   12
 8204   HG21  THR  64          HG23      THR  64 -17.293  -4.604   2.187
  Start of MODEL   12
 8205    H    THR  64           HN       THR  64 -15.175  -5.805   2.986
  Start of MODEL   12
 8206    HA   VAL  65           HA       VAL  65 -10.895  -3.766   2.971
  Start of MODEL   12
 8207    HB   VAL  65           HB       VAL  65 -10.618  -6.600   3.852
  Start of MODEL   12
 8208    H    VAL  65           HN       VAL  65 -12.911  -5.835   2.537
  Start of MODEL   12
 8209    HA   ARG  66           HA       ARG  66  -8.653  -5.943  -0.108
  Start of MODEL   12
 8210    HB3  ARG  66           HB2      ARG  66  -7.395  -4.354  -1.438
  Start of MODEL   12
 8211    HB2  ARG  66           HB3      ARG  66  -7.605  -3.106  -0.227
  Start of MODEL   12
 8212    HG2  ARG  66           HG2      ARG  66  -9.781  -4.338  -1.895
  Start of MODEL   12
 8213    HG3  ARG  66           HG3      ARG  66 -10.005  -3.083  -0.675
  Start of MODEL   12
 8214    HD2  ARG  66           HD2      ARG  66  -8.519  -1.604  -1.951
  Start of MODEL   12
 8215    HD3  ARG  66           HD3      ARG  66  -8.354  -2.855  -3.186
  Start of MODEL   12
 8216    HE   ARG  66           HE       ARG  66 -10.971  -1.832  -2.448
  Start of MODEL   12
 8217   HH11  ARG  66          HH11      ARG  66  -8.415  -2.139  -4.929
  Start of MODEL   12
 8218   HH12  ARG  66          HH12      ARG  66  -9.428  -1.783  -6.225
  Start of MODEL   12
 8219   HH21  ARG  66          HH21      ARG  66 -12.382  -1.439  -4.293
  Start of MODEL   12
 8220   HH22  ARG  66          HH22      ARG  66 -11.728  -1.360  -5.869
  Start of MODEL   12
 8221    H    ARG  66           HN       ARG  66  -9.233  -3.701   1.711
  Start of MODEL   12
 8222    HA   HIS  67           HA       HIS  67  -4.898  -5.864   2.147
  Start of MODEL   12
 8223    HB3  HIS  67           HB2      HIS  67  -4.328  -8.229   2.680
  Start of MODEL   12
 8224    HB2  HIS  67           HB3      HIS  67  -5.493  -8.759   1.483
  Start of MODEL   12
 8225    HD1  HIS  67           HD1      HIS  67  -5.292  -7.531   5.006
  Start of MODEL   12
 8226    HD2  HIS  67           HD2      HIS  67  -8.181  -8.597   2.221
  Start of MODEL   12
 8227    HE1  HIS  67           HE1      HIS  67  -7.382  -7.843   6.306
  Start of MODEL   12
 8228    HE2  HIS  67           HE2      HIS  67  -9.012  -8.791   4.638
  Start of MODEL   12
 8229    H    HIS  67           HN       HIS  67  -6.623  -6.857  -0.008
  Start of MODEL   12
 8230    HA2  GLY  68           HA2      GLY  68  -1.727  -7.418  -0.564
  Start of MODEL   12
 8231    H    GLY  68           HN       GLY  68  -2.682  -6.065   1.700
  Start of MODEL   12
 8232    HA3  GLY  68           HA1      GLY  68  -1.964  -5.713  -0.935
  Start of MODEL   12
 8233    HA   CYS  69           HA       CYS  69   1.739  -5.088   1.168
  Start of MODEL   12
 8234    HB3  CYS  69           HB2      CYS  69   2.463  -7.522  -0.449
  Start of MODEL   12
 8235    HB2  CYS  69           HB3      CYS  69   2.178  -7.414   1.278
  Start of MODEL   12
 8236    H    CYS  69           HN       CYS  69   0.369  -5.913  -1.255
  Start of MODEL   12
 8237    HA   LEU  70           HA       LEU  70   3.792  -2.932  -2.094
  Start of MODEL   12
 8238    HB3  LEU  70           HB2      LEU  70   4.671  -1.477   0.426
  Start of MODEL   12
 8239    HB2  LEU  70           HB3      LEU  70   3.313  -0.989  -0.567
  Start of MODEL   12
 8240    HG   LEU  70           HG       LEU  70   6.189  -1.072  -1.492
  Start of MODEL   12
 8241   HD11  LEU  70          HD11      LEU  70   3.713   0.009  -2.788
  Start of MODEL   12
 8242   HD13  LEU  70          HD12      LEU  70   4.680  -1.367  -3.333
  Start of MODEL   12
 8243   HD12  LEU  70          HD13      LEU  70   5.351   0.266  -3.369
  Start of MODEL   12
 8244   HD22  LEU  70          HD21      LEU  70   6.105   1.351  -1.409
  Start of MODEL   12
 8245   HD21  LEU  70          HD22      LEU  70   5.881   0.658   0.193
  Start of MODEL   12
 8246   HD23  LEU  70          HD23      LEU  70   4.493   1.284  -0.705
  Start of MODEL   12
 8247    H    LEU  70           HN       LEU  70   3.047  -3.410   0.679
  Start of MODEL   12
 8248    HA   ARG  71           HA       ARG  71   7.273  -5.110  -0.874
  Start of MODEL   12
 8249    HB3  ARG  71           HB2      ARG  71   6.293  -6.489  -3.353
  Start of MODEL   12
 8250    HB2  ARG  71           HB3      ARG  71   5.728  -6.789  -1.721
  Start of MODEL   12
 8251    HG2  ARG  71           HG2      ARG  71   8.413  -7.418  -2.895
  Start of MODEL   12
 8252    HG3  ARG  71           HG3      ARG  71   8.112  -7.414  -1.153
  Start of MODEL   12
 8253    HD2  ARG  71           HD2      ARG  71   6.620  -9.056  -3.197
  Start of MODEL   12
 8254    HD3  ARG  71           HD3      ARG  71   7.855  -9.644  -2.073
  Start of MODEL   12
 8255    HE   ARG  71           HE       ARG  71   6.049  -8.452  -0.466
  Start of MODEL   12
 8256   HH11  ARG  71          HH11      ARG  71   5.718 -10.993  -2.915
  Start of MODEL   12
 8257   HH12  ARG  71          HH12      ARG  71   4.438 -11.774  -2.125
  Start of MODEL   12
 8258   HH21  ARG  71          HH21      ARG  71   4.296  -9.564   0.635
  Start of MODEL   12
 8259   HH22  ARG  71          HH22      ARG  71   3.633 -10.956  -0.083
  Start of MODEL   12
 8260    H    ARG  71           HN       ARG  71   5.462  -4.048  -2.888
  Start of MODEL   12
 8261    HA   LEU  72           HA       LEU  72  10.242  -3.674  -3.588
  Start of MODEL   12
 8262    HB3  LEU  72           HB2      LEU  72  12.058  -2.638  -2.294
  Start of MODEL   12
 8263    HB2  LEU  72           HB3      LEU  72  11.417  -3.265  -0.805
  Start of MODEL   12
 8264    HG   LEU  72           HG       LEU  72   9.861  -1.412  -2.571
  Start of MODEL   12
 8265   HD12  LEU  72          HD11      LEU  72   8.656  -0.792  -0.523
  Start of MODEL   12
 8266   HD11  LEU  72          HD12      LEU  72   9.601  -1.976   0.377
  Start of MODEL   12
 8267   HD13  LEU  72          HD13      LEU  72   8.509  -2.510  -0.900
  Start of MODEL   12
 8268   HD23  LEU  72          HD21      LEU  72  11.646  -0.549  -0.308
  Start of MODEL   12
 8269   HD22  LEU  72          HD22      LEU  72  10.584   0.465  -1.316
  Start of MODEL   12
 8270   HD21  LEU  72          HD23      LEU  72  11.977  -0.333  -2.032
  Start of MODEL   12
 8271    H    LEU  72           HN       LEU  72   9.246  -4.729  -1.066
  Start of MODEL   12
 8272    HA   ASN  73           HA       ASN  73  12.251  -7.540  -3.602
  Start of MODEL   12
 8273    HB3  ASN  73           HB2      ASN  73  13.094  -7.959  -5.932
  Start of MODEL   12
 8274    HB2  ASN  73           HB3      ASN  73  12.436  -6.396  -6.397
  Start of MODEL   12
 8275   HD21  ASN  73          HD21      ASN  73  10.231  -6.149  -6.652
  Start of MODEL   12
 8276   HD22  ASN  73          HD22      ASN  73   9.173  -7.512  -6.670
  Start of MODEL   12
 8277    H    ASN  73           HN       ASN  73  11.111  -5.140  -4.664
  Start of MODEL   12
 8278    HA   GLN  74           HA       GLN  74  16.014  -5.205  -3.434
  Start of MODEL   12
 8279    HB3  GLN  74           HB2      GLN  74  15.931  -3.873  -6.152
  Start of MODEL   12
 8280    HB2  GLN  74           HB3      GLN  74  16.362  -5.562  -5.903
  Start of MODEL   12
 8281    HG2  GLN  74           HG2      GLN  74  18.334  -4.135  -6.181
  Start of MODEL   12
 8282    HG3  GLN  74           HG3      GLN  74  17.838  -3.184  -4.780
  Start of MODEL   12
 8283   HE21  GLN  74          HE21      GLN  74  19.159  -6.180  -5.867
  Start of MODEL   12
 8284   HE22  GLN  74          HE22      GLN  74  19.691  -6.746  -4.325
  Start of MODEL   12
 8285    H    GLN  74           HN       GLN  74  13.589  -4.534  -4.847
  Start of MODEL   12
 8286    HA   PRO  75           HA       PRO  75  14.443  -1.217  -2.042
  Start of MODEL   12
 8287    HB3  PRO  75           HB2      PRO  75  14.227  -2.168   0.048
  Start of MODEL   12
 8288    HB2  PRO  75           HB3      PRO  75  15.690  -1.220   0.341
  Start of MODEL   12
 8289    HG2  PRO  75           HG2      PRO  75  17.083  -3.053   0.053
  Start of MODEL   12
 8290    HG3  PRO  75           HG3      PRO  75  15.669  -3.844   0.774
  Start of MODEL   12
 8291    HD2  PRO  75           HD2      PRO  75  16.728  -4.577  -1.614
  Start of MODEL   12
 8292    HD3  PRO  75           HD3      PRO  75  15.000  -4.751  -1.234
  Start of MODEL   12
 8293    HA   THR  76           HA       THR  76  18.276   0.755  -2.656
  Start of MODEL   12
 8294    HB   THR  76           HB       THR  76  17.925   2.906  -3.830
  Start of MODEL   12
 8295    HG1  THR  76           HG1      THR  76  15.193   2.373  -3.190
  Start of MODEL   12
 8296   HG23  THR  76          HG21      THR  76  17.916   0.842  -5.135
  Start of MODEL   12
 8297   HG22  THR  76          HG22      THR  76  16.783   2.007  -5.820
  Start of MODEL   12
 8298   HG21  THR  76          HG23      THR  76  16.185   0.659  -4.853
  Start of MODEL   12
 8299    H    THR  76           HN       THR  76  15.401   0.759  -2.180
  Start of MODEL   12
 8300    HA   HIS  77           HA       HIS  77  18.844   3.005   0.843
  Start of MODEL   12
 8301    HB3  HIS  77           HB2      HIS  77  21.104   3.561  -0.161
  Start of MODEL   12
 8302    HB2  HIS  77           HB3      HIS  77  20.606   4.597   1.162
  Start of MODEL   12
 8303    HD1  HIS  77           HD1      HIS  77  20.454   7.102   0.730
  Start of MODEL   12
 8304    HD2  HIS  77           HD2      HIS  77  21.024   4.865  -2.691
  Start of MODEL   12
 8305    HE1  HIS  77           HE1      HIS  77  20.994   8.753  -1.045
  Start of MODEL   12
 8306    HE2  HIS  77           HE2      HIS  77  21.698   7.381  -2.976
  Start of MODEL   12
 8307    H    HIS  77           HN       HIS  77  19.251   3.070  -1.979
  Start of MODEL   12
 8308    HA   VAL  78           HA       VAL  78  17.086   7.236   0.065
  Start of MODEL   12
 8309    HB   VAL  78           HB       VAL  78  15.512   8.182  -1.629
  Start of MODEL   12
 8310    H    VAL  78           HN       VAL  78  17.685   5.195  -1.664
  Start of MODEL   12
 8311    HA   ASN  79           HA       ASN  79  12.854   4.980  -0.006
  Start of MODEL   12
 8312    HB3  ASN  79           HB2      ASN  79  12.526   2.541   0.401
  Start of MODEL   12
 8313    HB2  ASN  79           HB3      ASN  79  14.272   2.352   0.399
  Start of MODEL   12
 8314   HD21  ASN  79          HD21      ASN  79  12.562   4.538  -1.742
  Start of MODEL   12
 8315   HD22  ASN  79          HD22      ASN  79  12.924   3.662  -3.183
  Start of MODEL   12
 8316    H    ASN  79           HN       ASN  79  15.638   4.290  -0.089
  Start of MODEL   12
 8317    HA   ASN  80           HA       ASN  80  13.507   4.133   4.450
  Start of MODEL   12
 8318    HB3  ASN  80           HB2      ASN  80  15.763   3.640   4.947
  Start of MODEL   12
 8319    HB2  ASN  80           HB3      ASN  80  15.363   4.965   6.020
  Start of MODEL   12
 8320   HD21  ASN  80          HD21      ASN  80  17.960   4.071   5.192
  Start of MODEL   12
 8321   HD22  ASN  80          HD22      ASN  80  18.719   5.402   4.419
  Start of MODEL   12
 8322    H    ASN  80           HN       ASN  80  15.228   5.025   2.339
  Start of MODEL   12
 8323    HA2  GLY  81           HA2      GLY  81  11.815   7.913   5.533
  Start of MODEL   12
 8324    H    GLY  81           HN       GLY  81  11.768   5.419   4.042
  Start of MODEL   12
 8325    HA3  GLY  81           HA1      GLY  81  11.352   8.028   3.837
  Start of MODEL   12
 8326    HA   ASN  82           HA       ASN  82   7.575   6.866   5.887
  Start of MODEL   12
 8327    HB3  ASN  82           HB2      ASN  82   6.015   8.782   6.092
  Start of MODEL   12
 8328    HB2  ASN  82           HB3      ASN  82   7.157   9.782   5.209
  Start of MODEL   12
 8329   HD21  ASN  82          HD21      ASN  82   6.461   8.243   8.245
  Start of MODEL   12
 8330   HD22  ASN  82          HD22      ASN  82   7.680   9.037   9.144
  Start of MODEL   12
 8331    H    ASN  82           HN       ASN  82   9.271   8.694   4.317
  Start of MODEL   12
 8332    HA   TYR  83           HA       TYR  83   5.439   6.424   2.073
  Start of MODEL   12
 8333    HB3  TYR  83           HB2      TYR  83   4.586   4.074   1.950
  Start of MODEL   12
 8334    HB2  TYR  83           HB3      TYR  83   5.235   3.788   3.557
  Start of MODEL   12
 8335    HD1  TYR  83           HD1      TYR  83   6.032   4.066   0.025
  Start of MODEL   12
 8336    HD2  TYR  83           HD2      TYR  83   7.652   3.713   3.935
  Start of MODEL   12
 8337    HE1  TYR  83           HE1      TYR  83   8.181   3.410  -0.932
  Start of MODEL   12
 8338    HE2  TYR  83           HE2      TYR  83   9.825   3.046   2.973
  Start of MODEL   12
 8339    HH   TYR  83           HH       TYR  83  10.517   3.390  -0.304
  Start of MODEL   12
 8340    H    TYR  83           HN       TYR  83   6.356   5.602   4.718
  Start of MODEL   12
 8341    HA   THR  84           HA       THR  84   1.609   6.951   4.149
  Start of MODEL   12
 8342    HB   THR  84           HB       THR  84   1.799   9.330   2.275
  Start of MODEL   12
 8343    HG1  THR  84           HG1      THR  84   2.305   9.212   5.089
  Start of MODEL   12
 8344   HG21  THR  84          HG21      THR  84   0.019   8.845   4.680
  Start of MODEL   12
 8345   HG23  THR  84          HG22      THR  84  -0.503   8.797   2.999
  Start of MODEL   12
 8346   HG22  THR  84          HG23      THR  84   0.051  10.314   3.701
  Start of MODEL   12
 8347    H    THR  84           HN       THR  84   3.610   7.549   2.110
  Start of MODEL   12
 8348    HA   LEU  85           HA       LEU  85  -0.557   5.420   0.711
  Start of MODEL   12
 8349    HB3  LEU  85           HB2      LEU  85  -1.580   3.888   3.109
  Start of MODEL   12
 8350    HB2  LEU  85           HB3      LEU  85  -0.258   3.406   2.068
  Start of MODEL   12
 8351    HG   LEU  85           HG       LEU  85  -3.148   3.614   1.227
  Start of MODEL   12
 8352   HD11  LEU  85          HD11      LEU  85  -0.681   2.706  -0.183
  Start of MODEL   12
 8353   HD13  LEU  85          HD12      LEU  85  -1.665   4.127  -0.590
  Start of MODEL   12
 8354   HD12  LEU  85          HD13      LEU  85  -2.324   2.487  -0.792
  Start of MODEL   12
 8355   HD22  LEU  85          HD21      LEU  85  -3.091   1.242   1.113
  Start of MODEL   12
 8356   HD21  LEU  85          HD22      LEU  85  -2.628   1.754   2.748
  Start of MODEL   12
 8357   HD23  LEU  85          HD23      LEU  85  -1.398   1.207   1.610
  Start of MODEL   12
 8358    H    LEU  85           HN       LEU  85  -0.062   5.817   3.556
  Start of MODEL   12
 8359    HA   LEU  86           HA       LEU  86  -4.165   7.786   1.453
  Start of MODEL   12
 8360    HB3  LEU  86           HB2      LEU  86  -4.594   9.137  -0.599
  Start of MODEL   12
 8361    HB2  LEU  86           HB3      LEU  86  -3.240   8.359  -1.371
  Start of MODEL   12
 8362    HG   LEU  86           HG       LEU  86  -2.820  10.663  -0.632
  Start of MODEL   12
 8363   HD11  LEU  86          HD11      LEU  86  -3.014   9.559   2.130
  Start of MODEL   12
 8364   HD13  LEU  86          HD12      LEU  86  -4.095  10.730   1.367
  Start of MODEL   12
 8365   HD12  LEU  86          HD13      LEU  86  -2.416  11.161   1.695
  Start of MODEL   12
 8366   HD21  LEU  86          HD21      LEU  86  -0.935   9.186  -0.995
  Start of MODEL   12
 8367   HD23  LEU  86          HD22      LEU  86  -1.064   8.578   0.654
  Start of MODEL   12
 8368   HD22  LEU  86          HD23      LEU  86  -0.611  10.259   0.366
  Start of MODEL   12
 8369    H    LEU  86           HN       LEU  86  -2.060   6.557  -0.171
  Start of MODEL   12
 8370    HA   ALA  87           HA       ALA  87  -6.886   5.567  -1.204
  Start of MODEL   12
 8371    HB3  ALA  87           HB1      ALA  87  -6.797   4.020   0.728
  Start of MODEL   12
 8372    HB2  ALA  87           HB2      ALA  87  -8.442   4.179   0.123
  Start of MODEL   12
 8373    HB1  ALA  87           HB3      ALA  87  -7.949   5.039   1.583
  Start of MODEL   12
 8374    H    ALA  87           HN       ALA  87  -6.184   7.061   1.246
  Start of MODEL   12
 8375    HA   ALA  88           HA       ALA  88 -10.066   8.532  -0.830
  Start of MODEL   12
 8376    HB2  ALA  88           HB1      ALA  88 -10.046   9.974  -2.775
  Start of MODEL   12
 8377    HB1  ALA  88           HB2      ALA  88  -9.054   8.813  -3.650
  Start of MODEL   12
 8378    HB3  ALA  88           HB3      ALA  88  -8.393   9.651  -2.248
  Start of MODEL   12
 8379    H    ALA  88           HN       ALA  88  -8.371   6.631  -2.311
  Start of MODEL   12
 8380    HA   ASN  89           HA       ASN  89 -13.324   7.238  -3.413
  Start of MODEL   12
 8381    HB3  ASN  89           HB2      ASN  89 -13.121   5.261  -1.898
  Start of MODEL   12
 8382    HB2  ASN  89           HB3      ASN  89 -14.792   5.642  -2.202
  Start of MODEL   12
 8383   HD21  ASN  89          HD21      ASN  89 -13.874   4.044  -0.152
  Start of MODEL   12
 8384   HD22  ASN  89          HD22      ASN  89 -14.240   4.782   1.365
  Start of MODEL   12
 8385    H    ASN  89           HN       ASN  89 -12.156   8.365  -1.038
  Start of MODEL   12
 8386    HA   PRO  90           HA       PRO  90 -16.547  10.303  -3.017
  Start of MODEL   12
 8387    HB3  PRO  90           HB2      PRO  90 -18.730   9.522  -3.169
  Start of MODEL   12
 8388    HB2  PRO  90           HB3      PRO  90 -18.442   8.240  -1.982
  Start of MODEL   12
 8389    HG2  PRO  90           HG2      PRO  90 -18.313   7.096  -4.043
  Start of MODEL   12
 8390    HG3  PRO  90           HG3      PRO  90 -17.457   8.441  -4.820
  Start of MODEL   12
 8391    HD2  PRO  90           HD2      PRO  90 -16.458   6.420  -2.877
  Start of MODEL   12
 8392    HD3  PRO  90           HD3      PRO  90 -15.627   7.121  -4.283
  Start of MODEL   12
 8393    HA   CYS  91           HA       CYS  91 -17.697  10.074   1.545
  Start of MODEL   12
 8394    HB3  CYS  91           HB2      CYS  91 -16.086   7.609   2.266
  Start of MODEL   12
 8395    HB2  CYS  91           HB3      CYS  91 -17.833   7.682   2.076
  Start of MODEL   12
 8396    H    CYS  91           HN       CYS  91 -16.384   8.182  -0.169
  Start of MODEL   12
 8397    HA2  GLY  92           HA2      GLY  92 -13.324  11.755   1.343
  Start of MODEL   12
 8398    H    GLY  92           HN       GLY  92 -14.316   9.290   0.792
  Start of MODEL   12
 8399    HA3  GLY  92           HA1      GLY  92 -13.318  10.923   2.891
  Start of MODEL   12
 8400    HA   GLN  93           HA       GLN  93  -9.747   9.127   1.221
  Start of MODEL   12
 8401    HB3  GLN  93           HB2      GLN  93  -8.586  11.902   1.544
  Start of MODEL   12
 8402    HB2  GLN  93           HB3      GLN  93  -9.379  11.346   0.081
  Start of MODEL   12
 8403    HG2  GLN  93           HG2      GLN  93  -6.859  10.209   1.278
  Start of MODEL   12
 8404    HG3  GLN  93           HG3      GLN  93  -7.669   9.589  -0.160
  Start of MODEL   12
 8405   HE21  GLN  93          HE21      GLN  93  -6.002  10.020  -1.582
  Start of MODEL   12
 8406   HE22  GLN  93          HE22      GLN  93  -5.550  11.622  -2.003
  Start of MODEL   12
 8407    H    GLN  93           HN       GLN  93 -11.007  11.349   2.629
  Start of MODEL   12
 8408    HA   ALA  94           HA       ALA  94  -7.919   8.883   5.198
  Start of MODEL   12
 8409    HB1  ALA  94           HB1      ALA  94  -7.754   6.174   3.916
  Start of MODEL   12
 8410    HB3  ALA  94           HB2      ALA  94  -9.048   6.730   4.980
  Start of MODEL   12
 8411    HB2  ALA  94           HB3      ALA  94  -7.406   6.499   5.604
  Start of MODEL   12
 8412    H    ALA  94           HN       ALA  94  -8.376   8.033   2.411
  Start of MODEL   12
 8413    HA   SER  95           HA       SER  95  -3.686   8.090   4.143
  Start of MODEL   12
 8414    HB3  SER  95           HB2      SER  95  -3.893  10.416   3.851
  Start of MODEL   12
 8415    HB2  SER  95           HB3      SER  95  -2.570  10.240   5.002
  Start of MODEL   12
 8416    HG   SER  95           HG       SER  95  -4.644  11.700   5.290
  Start of MODEL   12
 8417    H    SER  95           HN       SER  95  -5.770   8.539   6.071
  Start of MODEL   12
 8418    HA   ALA  96           HA       ALA  96  -1.783   6.957   7.934
  Start of MODEL   12
 8419    HB3  ALA  96           HB1      ALA  96  -3.164   4.955   7.549
  Start of MODEL   12
 8420    HB2  ALA  96           HB2      ALA  96  -1.516   4.494   7.985
  Start of MODEL   12
 8421    HB1  ALA  96           HB3      ALA  96  -2.039   4.415   6.304
  Start of MODEL   12
 8422    H    ALA  96           HN       ALA  96  -2.370   6.718   5.065
  Start of MODEL   12
 8423    HA   SER  97           HA       SER  97   2.170   6.429   6.063
  Start of MODEL   12
 8424    HB3  SER  97           HB2      SER  97   3.638   8.092   7.095
  Start of MODEL   12
 8425    HB2  SER  97           HB3      SER  97   2.550   8.202   8.482
  Start of MODEL   12
 8426    HG   SER  97           HG       SER  97   0.994   9.056   7.203
  Start of MODEL   12
 8427    H    SER  97           HN       SER  97   0.441   6.512   8.435
  Start of MODEL   12
 8428    HA   ILE  98           HA       ILE  98   4.707   4.081   8.777
  Start of MODEL   12
 8429    HB   ILE  98           HB       ILE  98   3.280   2.430   7.633
  Start of MODEL   12
 8430   HD13  ILE  98          HD11      ILE  98   6.424   0.864   6.284
  Start of MODEL   12
 8431   HD12  ILE  98          HD12      ILE  98   7.034   0.336   7.852
  Start of MODEL   12
 8432   HD11  ILE  98          HD13      ILE  98   7.107   2.039   7.403
  Start of MODEL   12
 8433    H    ILE  98           HN       ILE  98   3.958   5.203   6.193
  Start of MODEL   12
 8434    HA   MET  99           HA       MET  99   8.585   5.092   6.958
  Start of MODEL   12
 8435    HB3  MET  99           HB2      MET  99   8.888   5.457   9.951
  Start of MODEL   12
 8436    HB2  MET  99           HB3      MET  99   8.636   6.722   8.753
  Start of MODEL   12
 8437    HG2  MET  99           HG2      MET  99  11.090   4.969   8.967
  Start of MODEL   12
 8438    HG3  MET  99           HG3      MET  99  10.837   6.242   7.783
  Start of MODEL   12
 8439    HE1  MET  99           HE1      MET  99   9.644   8.660   9.322
  Start of MODEL   12
 8440    HE3  MET  99           HE2      MET  99  11.046   8.762   8.259
  Start of MODEL   12
 8441    HE2  MET  99           HE3      MET  99  11.105   9.488   9.866
  Start of MODEL   12
 8442    H    MET  99           HN       MET  99   6.796   4.392   9.167
  Start of MODEL   12
 8443    HA   ALA 100           HA       ALA 100  10.608   1.378   7.961
  Start of MODEL   12
 8444    HB2  ALA 100           HB1      ALA 100  10.717  -0.026   5.971
  Start of MODEL   12
 8445    HB1  ALA 100           HB2      ALA 100  10.293   1.358   4.962
  Start of MODEL   12
 8446    HB3  ALA 100           HB3      ALA 100   9.126   0.726   6.121
  Start of MODEL   12
 8447    H    ALA 100           HN       ALA 100   9.996   3.669   6.234
  Start of MODEL   12
 8448    HA   ALA 101           HA       ALA 101  14.695   2.631   6.996
  Start of MODEL   12
 8449    HB1  ALA 101           HB1      ALA 101  14.829   0.856   9.441
  Start of MODEL   12
 8450    HB3  ALA 101           HB2      ALA 101  14.746   2.620   9.437
  Start of MODEL   12
 8451    HB2  ALA 101           HB3      ALA 101  16.169   1.802   8.798
  Start of MODEL   12
 8452    H    ALA 101           HN       ALA 101  12.666   1.158   8.436
  Start of MODEL   12
 8453    HA   PHE 102           HA       PHE 102  15.434  -1.192   5.004
  Start of MODEL   12
 8454    HB3  PHE 102           HB2      PHE 102  16.064  -0.790   2.610
  Start of MODEL   12
 8455    HB2  PHE 102           HB3      PHE 102  16.010   0.940   2.939
  Start of MODEL   12
 8456    HD1  PHE 102           HD1      PHE 102  14.061  -2.057   2.386
  Start of MODEL   12
 8457    HD2  PHE 102           HD2      PHE 102  13.894   2.039   3.437
  Start of MODEL   12
 8458    HE1  PHE 102           HE1      PHE 102  11.667  -2.043   1.918
  Start of MODEL   12
 8459    HE2  PHE 102           HE2      PHE 102  11.481   2.067   2.975
  Start of MODEL   12
 8460    HZ   PHE 102           HZ       PHE 102  10.352   0.010   2.243
  Start of MODEL   12
 8461    H    PHE 102           HN       PHE 102  15.513   1.710   5.276
  Start of MODEL   12
 8462    HA   MET 103           HA       MET 103  19.849  -0.428   5.365
  Start of MODEL   12
 8463    HB3  MET 103           HB2      MET 103  19.786  -1.529   3.180
  Start of MODEL   12
 8464    HB2  MET 103           HB3      MET 103  21.355  -0.804   3.489
  Start of MODEL   12
 8465    HG2  MET 103           HG2      MET 103  19.215   0.354   1.714
  Start of MODEL   12
 8466    HG3  MET 103           HG3      MET 103  20.825   1.029   1.986
  Start of MODEL   12
 8467    HE2  MET 103           HE1      MET 103  21.154  -0.289  -1.686
  Start of MODEL   12
 8468    HE1  MET 103           HE2      MET 103  21.361   1.093  -0.605
  Start of MODEL   12
 8469    HE3  MET 103           HE3      MET 103  19.749   0.478  -0.948
  Start of MODEL   12
 8470    H    MET 103           HN       MET 103  17.961   1.064   3.790
  Start of MODEL   12
 8471    HA   ASP 104           HA       ASP 104  21.634   3.307   6.198
  Start of MODEL   12
 8472    HB3  ASP 104           HB2      ASP 104  23.471   1.746   6.969
  Start of MODEL   12
 8473    HB2  ASP 104           HB3      ASP 104  23.974   3.397   6.650
  Start of MODEL   12
 8474    H    ASP 104           HN       ASP 104  21.998   0.660   5.326
  Start of MODEL   12
 8475    HA   ASN 105           HA       ASN 105  22.330   5.506   2.566
  Start of MODEL   12
 8476    HB3  ASN 105           HB2      ASN 105  22.241   7.508   4.825
  Start of MODEL   12
 8477    HB2  ASN 105           HB3      ASN 105  20.925   7.020   3.776
  Start of MODEL   12
 8478   HD21  ASN 105          HD21      ASN 105  23.682   9.055   4.133
  Start of MODEL   12
 8479   HD22  ASN 105          HD22      ASN 105  23.529   9.951   2.680
  Start of MODEL   12
 8480    H    ASN 105           HN       ASN 105  22.548   5.225   5.460
  Start of MODEL   12
 8481    HA   PRO 106           HA       PRO 106  26.803   6.158   2.609
  Start of MODEL   12
 8482    HB3  PRO 106           HB2      PRO 106  27.463   4.703   0.962
  Start of MODEL   12
 8483    HB2  PRO 106           HB3      PRO 106  26.693   5.718  -0.254
  Start of MODEL   12
 8484    HG2  PRO 106           HG2      PRO 106  25.253   3.953  -0.460
  Start of MODEL   12
 8485    HG3  PRO 106           HG3      PRO 106  25.646   3.335   1.153
  Start of MODEL   12
 8486    HD2  PRO 106           HD2      PRO 106  23.692   5.459   0.359
  Start of MODEL   12
 8487    HD3  PRO 106           HD3      PRO 106  23.548   4.184   1.592
  Start of MODEL   12
 8488    HA   PHE 107           HA       PHE 107  28.012  10.225   1.721
  Start of MODEL   12
 8489    HB3  PHE 107           HB2      PHE 107  27.611  10.954  -0.618
  Start of MODEL   12
 8490    HB2  PHE 107           HB3      PHE 107  26.692   9.482  -0.906
  Start of MODEL   12
 8491    HD1  PHE 107           HD1      PHE 107  30.056  10.707   0.022
  Start of MODEL   12
 8492    HD2  PHE 107           HD2      PHE 107  27.755   7.520  -1.592
  Start of MODEL   12
 8493    HE1  PHE 107           HE1      PHE 107  32.128   9.537  -0.608
  Start of MODEL   12
 8494    HE2  PHE 107           HE2      PHE 107  29.817   6.344  -2.226
  Start of MODEL   12
 8495    HZ   PHE 107           HZ       PHE 107  32.009   7.353  -1.728
  Start of MODEL   12
 8496    H    PHE 107           HN       PHE 107  27.726   8.071   2.205
  Start of MODEL   13
 8497    H1   ASP   1           H        ASP   1 -28.029  -5.830   1.159
  Start of MODEL   13
 8498    H2   ASP   1           H2       ASP   1 -28.294  -6.834  -0.160
  Start of MODEL   13
 8499    H3   ASP   1           H3       ASP   1 -29.267  -5.477   0.060
  Start of MODEL   13
 8500    HA   ASP   1           HA       ASP   1 -27.438  -4.050  -0.338
  Start of MODEL   13
 8501    HB3  ASP   1           HB2      ASP   1 -25.577  -5.419   0.446
  Start of MODEL   13
 8502    HB2  ASP   1           HB3      ASP   1 -25.299  -5.021  -1.238
  Start of MODEL   13
 8503    HA   ASP   2           HA       ASP   2 -29.163  -4.791  -4.278
  Start of MODEL   13
 8504    HB3  ASP   2           HB2      ASP   2 -31.485  -3.968  -4.249
  Start of MODEL   13
 8505    HB2  ASP   2           HB3      ASP   2 -31.200  -3.166  -2.713
  Start of MODEL   13
 8506    H    ASP   2           HN       ASP   2 -28.750  -3.353  -1.717
  Start of MODEL   13
 8507    HA   ASP   3           HA       ASP   3 -29.222  -0.137  -4.957
  Start of MODEL   13
 8508    HB3  ASP   3           HB2      ASP   3 -29.600   0.583  -2.027
  Start of MODEL   13
 8509    HB2  ASP   3           HB3      ASP   3 -30.887   0.413  -3.201
  Start of MODEL   13
 8510    H    ASP   3           HN       ASP   3 -29.342  -1.746  -2.509
  Start of MODEL   13
 8511    HA   ASP   4           HA       ASP   4 -24.906  -1.873  -3.155
  Start of MODEL   13
 8512    HB3  ASP   4           HB2      ASP   4 -24.682   0.909  -4.382
  Start of MODEL   13
 8513    HB2  ASP   4           HB3      ASP   4 -24.653  -0.567  -5.335
  Start of MODEL   13
 8514    H    ASP   4           HN       ASP   4 -27.064  -1.804  -3.813
  Start of MODEL   13
 8515    HA   ASP   5           HA       ASP   5 -26.928   0.752   0.202
  Start of MODEL   13
 8516    HB3  ASP   5           HB2      ASP   5 -27.384  -0.842   2.003
  Start of MODEL   13
 8517    HB2  ASP   5           HB3      ASP   5 -26.669  -2.115   1.036
  Start of MODEL   13
 8518    H    ASP   5           HN       ASP   5 -26.619  -1.383  -1.397
  Start of MODEL   13
 8519    HA   VAL   6           HA       VAL   6 -23.464  -0.475   2.920
  Start of MODEL   13
 8520    HB   VAL   6           HB       VAL   6 -21.619  -2.219   2.779
  Start of MODEL   13
 8521    H    VAL   6           HN       VAL   6 -24.430  -1.713   0.575
  Start of MODEL   13
 8522    HA   SER   7           HA       SER   7 -20.526   1.806   0.763
  Start of MODEL   13
 8523    HB3  SER   7           HB2      SER   7 -22.331   3.879   2.058
  Start of MODEL   13
 8524    HB2  SER   7           HB3      SER   7 -22.430   3.337   0.385
  Start of MODEL   13
 8525    HG   SER   7           HG       SER   7 -20.724   5.077   1.609
  Start of MODEL   13
 8526    H    SER   7           HN       SER   7 -22.702   1.447   2.669
  Start of MODEL   13
 8527    HA   PHE   8           HA       PHE   8 -18.409   2.343   4.480
  Start of MODEL   13
 8528    HB3  PHE   8           HB2      PHE   8 -16.670   0.592   4.774
  Start of MODEL   13
 8529    HB2  PHE   8           HB3      PHE   8 -17.094  -0.063   3.193
  Start of MODEL   13
 8530    HD1  PHE   8           HD1      PHE   8 -18.569  -1.824   3.118
  Start of MODEL   13
 8531    HD2  PHE   8           HD2      PHE   8 -18.734   0.859   6.410
  Start of MODEL   13
 8532    HE1  PHE   8           HE1      PHE   8 -20.325  -3.194   4.144
  Start of MODEL   13
 8533    HE2  PHE   8           HE2      PHE   8 -20.491  -0.511   7.439
  Start of MODEL   13
 8534    HZ   PHE   8           HZ       PHE   8 -21.289  -2.539   6.298
  Start of MODEL   13
 8535    H    PHE   8           HN       PHE   8 -18.900   1.112   1.891
  Start of MODEL   13
 8536    HA   CYS   9           HA       CYS   9 -15.686   4.894   2.395
  Start of MODEL   13
 8537    HB3  CYS   9           HB2      CYS   9 -15.169   6.644   3.931
  Start of MODEL   13
 8538    HB2  CYS   9           HB3      CYS   9 -15.336   5.555   5.318
  Start of MODEL   13
 8539    H    CYS   9           HN       CYS   9 -16.824   3.663   4.732
  Start of MODEL   13
 8540    HA   ALA  10           HA       ALA  10 -11.891   3.070   3.122
  Start of MODEL   13
 8541    HB1  ALA  10           HB1      ALA  10 -10.856   5.696   2.082
  Start of MODEL   13
 8542    HB3  ALA  10           HB2      ALA  10 -11.511   4.381   1.104
  Start of MODEL   13
 8543    HB2  ALA  10           HB3      ALA  10 -10.019   4.146   2.021
  Start of MODEL   13
 8544    H    ALA  10           HN       ALA  10 -13.221   5.650   2.913
  Start of MODEL   13
 8545    HA   SER  11           HA       SER  11  -9.538   4.634   6.378
  Start of MODEL   13
 8546    HB3  SER  11           HB2      SER  11  -9.822   3.167   8.379
  Start of MODEL   13
 8547    HB2  SER  11           HB3      SER  11 -10.781   2.055   7.392
  Start of MODEL   13
 8548    HG   SER  11           HG       SER  11 -11.806   4.345   6.947
  Start of MODEL   13
 8549    H    SER  11           HN       SER  11 -10.880   2.546   4.852
  Start of MODEL   13
 8550    HA   VAL  12           HA       VAL  12  -6.294   1.941   5.369
  Start of MODEL   13
 8551    HB   VAL  12           HB       VAL  12  -5.158   4.752   5.591
  Start of MODEL   13
 8552    H    VAL  12           HN       VAL  12  -7.385   4.259   6.794
  Start of MODEL   13
 8553    HA   GLN  13           HA       GLN  13  -4.076   1.553   9.082
  Start of MODEL   13
 8554    HB3  GLN  13           HB2      GLN  13  -4.461  -0.604  10.076
  Start of MODEL   13
 8555    HB2  GLN  13           HB3      GLN  13  -5.010  -1.276   8.552
  Start of MODEL   13
 8556    HG2  GLN  13           HG2      GLN  13  -6.469   0.893  10.045
  Start of MODEL   13
 8557    HG3  GLN  13           HG3      GLN  13  -7.023   0.015   8.627
  Start of MODEL   13
 8558   HE21  GLN  13          HE21      GLN  13  -6.482  -0.102  12.004
  Start of MODEL   13
 8559   HE22  GLN  13          HE22      GLN  13  -7.353  -1.562  12.319
  Start of MODEL   13
 8560    H    GLN  13           HN       GLN  13  -5.402   0.556   6.680
  Start of MODEL   13
 8561    HA   LEU  14           HA       LEU  14  -0.754  -0.233   6.879
  Start of MODEL   13
 8562    HB3  LEU  14           HB2      LEU  14   1.312   1.324   7.234
  Start of MODEL   13
 8563    HB2  LEU  14           HB3      LEU  14   0.147   2.448   7.895
  Start of MODEL   13
 8564    HG   LEU  14           HG       LEU  14  -1.119   2.253   5.693
  Start of MODEL   13
 8565   HD12  LEU  14          HD11      LEU  14   0.452   3.658   4.459
  Start of MODEL   13
 8566   HD11  LEU  14          HD12      LEU  14   1.721   3.254   5.623
  Start of MODEL   13
 8567   HD13  LEU  14          HD13      LEU  14   0.303   4.172   6.139
  Start of MODEL   13
 8568   HD22  LEU  14          HD21      LEU  14   0.136   1.402   3.803
  Start of MODEL   13
 8569   HD21  LEU  14          HD22      LEU  14  -0.164   0.138   4.994
  Start of MODEL   13
 8570   HD23  LEU  14          HD23      LEU  14   1.430   0.891   4.886
  Start of MODEL   13
 8571    H    LEU  14           HN       LEU  14  -1.942   1.565   8.837
  Start of MODEL   13
 8572    HA   HIS  15           HA       HIS  15   1.660  -1.902  10.113
  Start of MODEL   13
 8573    HB3  HIS  15           HB2      HIS  15   2.179  -4.211   9.290
  Start of MODEL   13
 8574    HB2  HIS  15           HB3      HIS  15   1.657  -3.721   7.690
  Start of MODEL   13
 8575    HD1  HIS  15           HD1      HIS  15   0.474  -5.452  10.505
  Start of MODEL   13
 8576    HD2  HIS  15           HD2      HIS  15  -1.238  -2.891   7.733
  Start of MODEL   13
 8577    HE1  HIS  15           HE1      HIS  15  -2.009  -5.873  10.640
  Start of MODEL   13
 8578    HE2  HIS  15           HE2      HIS  15  -3.006  -4.111   9.171
  Start of MODEL   13
 8579    H    HIS  15           HN       HIS  15   1.347  -1.151   7.301
  Start of MODEL   13
 8580    HA   THR  16           HA       THR  16   5.802  -0.997   9.186
  Start of MODEL   13
 8581    HB   THR  16           HB       THR  16   6.013  -3.053  11.398
  Start of MODEL   13
 8582    HG1  THR  16           HG1      THR  16   5.108  -0.427  11.363
  Start of MODEL   13
 8583   HG21  THR  16          HG21      THR  16   7.867  -0.796  10.578
  Start of MODEL   13
 8584   HG23  THR  16          HG22      THR  16   8.149  -2.508  10.279
  Start of MODEL   13
 8585   HG22  THR  16          HG23      THR  16   8.120  -1.898  11.932
  Start of MODEL   13
 8586    H    THR  16           HN       THR  16   3.773  -2.211  10.655
  Start of MODEL   13
 8587    HA   ALA  17           HA       ALA  17   6.804  -4.027   6.203
  Start of MODEL   13
 8588    HB2  ALA  17           HB1      ALA  17   9.525  -2.865   6.778
  Start of MODEL   13
 8589    HB1  ALA  17           HB2      ALA  17   8.340  -2.109   5.736
  Start of MODEL   13
 8590    HB3  ALA  17           HB3      ALA  17   9.006  -3.689   5.305
  Start of MODEL   13
 8591    H    ALA  17           HN       ALA  17   7.326  -1.864   7.843
  Start of MODEL   13
 8592    HA   VAL  18           HA       VAL  18   8.371  -7.158   8.690
  Start of MODEL   13
 8593    HB   VAL  18           HB       VAL  18   7.796  -9.407   7.791
  Start of MODEL   13
 8594    H    VAL  18           HN       VAL  18   7.519  -6.102   6.122
  Start of MODEL   13
 8595    HA   GLU  19           HA       GLU  19  12.361  -7.391   7.398
  Start of MODEL   13
 8596    HB3  GLU  19           HB2      GLU  19  13.710  -8.219   9.279
  Start of MODEL   13
 8597    HB2  GLU  19           HB3      GLU  19  12.226  -8.714  10.088
  Start of MODEL   13
 8598    HG2  GLU  19           HG2      GLU  19  13.081  -5.926   9.376
  Start of MODEL   13
 8599    HG3  GLU  19           HG3      GLU  19  11.464  -6.336   9.943
  Start of MODEL   13
 8600    H    GLU  19           HN       GLU  19  10.189  -8.071   9.096
  Start of MODEL   13
 8601    HA   MET  20           HA       MET  20  13.927 -11.143   6.135
  Start of MODEL   13
 8602    HB3  MET  20           HB2      MET  20  11.639 -11.958   5.994
  Start of MODEL   13
 8603    HB2  MET  20           HB3      MET  20  12.442 -12.351   4.486
  Start of MODEL   13
 8604    HG2  MET  20           HG2      MET  20  10.539 -10.081   4.890
  Start of MODEL   13
 8605    HG3  MET  20           HG3      MET  20  11.354 -10.506   3.381
  Start of MODEL   13
 8606    HE2  MET  20           HE1      MET  20   7.665 -11.600   2.639
  Start of MODEL   13
 8607    HE1  MET  20           HE2      MET  20   9.053 -10.682   2.064
  Start of MODEL   13
 8608    HE3  MET  20           HE3      MET  20   8.210 -10.178   3.527
  Start of MODEL   13
 8609    H    MET  20           HN       MET  20  12.895  -8.595   5.790
  Start of MODEL   13
 8610    HA   HIS  21           HA       HIS  21  15.968  -9.782   2.669
  Start of MODEL   13
 8611    HB3  HIS  21           HB2      HIS  21  15.313 -12.224   1.020
  Start of MODEL   13
 8612    HB2  HIS  21           HB3      HIS  21  16.432 -12.272   2.374
  Start of MODEL   13
 8613    HD1  HIS  21           HD1      HIS  21  18.744 -11.152   2.058
  Start of MODEL   13
 8614    HD2  HIS  21           HD2      HIS  21  16.318 -11.015  -1.319
  Start of MODEL   13
 8615    HE1  HIS  21           HE1      HIS  21  20.259 -10.558   0.158
  Start of MODEL   13
 8616    HE2  HIS  21           HE2      HIS  21  18.824 -10.797  -1.878
  Start of MODEL   13
 8617    H    HIS  21           HN       HIS  21  14.195 -11.906   3.459
  Start of MODEL   13
 8618    HA   HIS  22           HA       HIS  22  12.799  -8.848  -0.500
  Start of MODEL   13
 8619    HB3  HIS  22           HB2      HIS  22  10.631  -9.896  -1.139
  Start of MODEL   13
 8620    HB2  HIS  22           HB3      HIS  22  10.811 -11.058   0.164
  Start of MODEL   13
 8621    HD1  HIS  22           HD1      HIS  22  12.061 -13.180  -0.380
  Start of MODEL   13
 8622    HD2  HIS  22           HD2      HIS  22  12.607 -10.211  -3.222
  Start of MODEL   13
 8623    HE1  HIS  22           HE1      HIS  22  13.342 -14.263  -2.231
  Start of MODEL   13
 8624    HE2  HIS  22           HE2      HIS  22  13.962 -12.347  -3.721
  Start of MODEL   13
 8625    H    HIS  22           HN       HIS  22  12.852 -10.888   1.610
  Start of MODEL   13
 8626    HA   TRP  23           HA       TRP  23  10.686  -6.850   2.626
  Start of MODEL   13
 8627    HB3  TRP  23           HB2      TRP  23  10.737  -4.354   2.344
  Start of MODEL   13
 8628    HB2  TRP  23           HB3      TRP  23  11.565  -4.638   0.807
  Start of MODEL   13
 8629    HD1  TRP  23           HD1      TRP  23  14.090  -5.397   0.915
  Start of MODEL   13
 8630    HE1  TRP  23           HE1      TRP  23  15.807  -5.562   2.806
  Start of MODEL   13
 8631    HE3  TRP  23           HE3      TRP  23  10.944  -4.898   4.903
  Start of MODEL   13
 8632    HZ2  TRP  23           HZ2      TRP  23  15.838  -5.499   5.625
  Start of MODEL   13
 8633    HZ3  TRP  23           HZ3      TRP  23  11.898  -4.971   7.167
  Start of MODEL   13
 8634    HH2  TRP  23           HH2      TRP  23  14.295  -5.261   7.519
  Start of MODEL   13
 8635    H    TRP  23           HN       TRP  23  11.809  -6.916  -0.012
  Start of MODEL   13
 8636    HA   CYS  24           HA       CYS  24   6.719  -6.042   1.187
  Start of MODEL   13
 8637    HB3  CYS  24           HB2      CYS  24   6.744  -8.235   3.278
  Start of MODEL   13
 8638    HB2  CYS  24           HB3      CYS  24   6.751  -8.438   1.536
  Start of MODEL   13
 8639    H    CYS  24           HN       CYS  24   8.770  -6.658   3.178
  Start of MODEL   13
 8640    HA   ILE  25           HA       ILE  25   5.300  -3.720   4.659
  Start of MODEL   13
 8641    HB   ILE  25           HB       ILE  25   4.785  -1.890   2.279
  Start of MODEL   13
 8642   HD13  ILE  25          HD11      ILE  25   6.627  -0.053   1.917
  Start of MODEL   13
 8643   HD12  ILE  25          HD12      ILE  25   8.070  -0.109   2.924
  Start of MODEL   13
 8644   HD11  ILE  25          HD13      ILE  25   6.524   0.389   3.618
  Start of MODEL   13
 8645    H    ILE  25           HN       ILE  25   5.634  -4.312   1.798
  Start of MODEL   13
 8646    HA   PRO  26           HA       PRO  26   1.252  -5.448   3.444
  Start of MODEL   13
 8647    HB3  PRO  26           HB2      PRO  26   0.961  -7.055   5.027
  Start of MODEL   13
 8648    HB2  PRO  26           HB3      PRO  26   0.845  -5.840   6.303
  Start of MODEL   13
 8649    HG2  PRO  26           HG2      PRO  26   2.876  -6.741   6.918
  Start of MODEL   13
 8650    HG3  PRO  26           HG3      PRO  26   3.231  -7.293   5.273
  Start of MODEL   13
 8651    HD2  PRO  26           HD2      PRO  26   3.566  -4.569   6.468
  Start of MODEL   13
 8652    HD3  PRO  26           HD3      PRO  26   4.644  -5.475   5.380
  Start of MODEL   13
 8653    HA   PHE  27           HA       PHE  27  -1.249  -2.427   5.364
  Start of MODEL   13
 8654    HB3  PHE  27           HB2      PHE  27  -0.344  -1.173   3.479
  Start of MODEL   13
 8655    HB2  PHE  27           HB3      PHE  27  -2.054  -0.824   3.684
  Start of MODEL   13
 8656    HD1  PHE  27           HD1      PHE  27  -3.702  -1.531   2.022
  Start of MODEL   13
 8657    HD2  PHE  27           HD2      PHE  27   0.461  -2.297   1.533
  Start of MODEL   13
 8658    HE1  PHE  27           HE1      PHE  27  -4.071  -2.019  -0.337
  Start of MODEL   13
 8659    HE2  PHE  27           HE2      PHE  27   0.088  -2.789  -0.834
  Start of MODEL   13
 8660    HZ   PHE  27           HZ       PHE  27  -2.181  -2.651  -1.775
  Start of MODEL   13
 8661    H    PHE  27           HN       PHE  27  -0.657  -4.429   3.338
  Start of MODEL   13
 8662    HA   SER  28           HA       SER  28  -5.301  -3.677   4.216
  Start of MODEL   13
 8663    HB3  SER  28           HB2      SER  28  -5.027  -4.831   6.235
  Start of MODEL   13
 8664    HB2  SER  28           HB3      SER  28  -6.401  -3.784   6.600
  Start of MODEL   13
 8665    HG   SER  28           HG       SER  28  -4.496  -2.300   7.234
  Start of MODEL   13
 8666    H    SER  28           HN       SER  28  -3.455  -1.835   5.452
  Start of MODEL   13
 8667    HA   VAL  29           HA       VAL  29  -7.613   0.041   4.448
  Start of MODEL   13
 8668    HB   VAL  29           HB       VAL  29  -6.221   0.730   2.533
  Start of MODEL   13
 8669    H    VAL  29           HN       VAL  29  -6.767  -2.504   3.269
  Start of MODEL   13
 8670    HA   ASP  30           HA       ASP  30 -11.225  -2.042   3.348
  Start of MODEL   13
 8671    HB3  ASP  30           HB2      ASP  30 -11.149  -2.133   5.900
  Start of MODEL   13
 8672    HB2  ASP  30           HB3      ASP  30 -12.714  -2.350   5.134
  Start of MODEL   13
 8673    H    ASP  30           HN       ASP  30  -9.765   0.034   4.804
  Start of MODEL   13
 8674    HA2  GLY  31           HA2      GLY  31 -14.943   0.439   2.779
  Start of MODEL   13
 8675    H    GLY  31           HN       GLY  31 -13.375  -1.689   2.783
  Start of MODEL   13
 8676    HA3  GLY  31           HA1      GLY  31 -13.725   0.918   1.601
  Start of MODEL   13
 8677    HA   GLN  32           HA       GLN  32 -16.103  -1.795  -0.733
  Start of MODEL   13
 8678    HB3  GLN  32           HB2      GLN  32 -18.653  -1.515  -1.191
  Start of MODEL   13
 8679    HB2  GLN  32           HB3      GLN  32 -18.622  -0.495   0.244
  Start of MODEL   13
 8680    HG2  GLN  32           HG2      GLN  32 -17.563  -2.389   1.469
  Start of MODEL   13
 8681    HG3  GLN  32           HG3      GLN  32 -19.211  -2.719   0.919
  Start of MODEL   13
 8682   HE21  GLN  32          HE21      GLN  32 -15.794  -3.428   0.429
  Start of MODEL   13
 8683   HE22  GLN  32          HE22      GLN  32 -16.050  -4.838  -0.524
  Start of MODEL   13
 8684    H    GLN  32           HN       GLN  32 -16.328   0.615   0.859
  Start of MODEL   13
 8685    HA   PRO  33           HA       PRO  33 -16.792   1.602  -4.014
  Start of MODEL   13
 8686    HB3  PRO  33           HB2      PRO  33 -17.704   3.647  -3.405
  Start of MODEL   13
 8687    HB2  PRO  33           HB3      PRO  33 -16.061   4.096  -2.959
  Start of MODEL   13
 8688    HG2  PRO  33           HG2      PRO  33 -16.411   3.693  -0.724
  Start of MODEL   13
 8689    HG3  PRO  33           HG3      PRO  33 -18.088   4.049  -1.168
  Start of MODEL   13
 8690    HD2  PRO  33           HD2      PRO  33 -17.393   1.741   0.011
  Start of MODEL   13
 8691    HD3  PRO  33           HD3      PRO  33 -18.686   1.820  -1.197
  Start of MODEL   13
 8692    HA   ALA  34           HA       ALA  34 -12.613   0.509  -3.478
  Start of MODEL   13
 8693    HB1  ALA  34           HB1      ALA  34 -12.820   1.067  -6.431
  Start of MODEL   13
 8694    HB3  ALA  34           HB2      ALA  34 -13.177  -0.470  -5.644
  Start of MODEL   13
 8695    HB2  ALA  34           HB3      ALA  34 -11.533   0.169  -5.623
  Start of MODEL   13
 8696    H    ALA  34           HN       ALA  34 -14.892   1.210  -4.952
  Start of MODEL   13
 8697    HA   PRO  35           HA       PRO  35 -10.914   4.651  -3.281
  Start of MODEL   13
 8698    HB3  PRO  35           HB2      PRO  35 -10.826   4.334  -0.987
  Start of MODEL   13
 8699    HB2  PRO  35           HB3      PRO  35  -9.113   4.213  -1.405
  Start of MODEL   13
 8700    HG2  PRO  35           HG2      PRO  35  -9.116   1.901  -1.307
  Start of MODEL   13
 8701    HG3  PRO  35           HG3      PRO  35 -10.312   2.238  -0.060
  Start of MODEL   13
 8702    HD2  PRO  35           HD2      PRO  35 -10.835   0.683  -2.273
  Start of MODEL   13
 8703    HD3  PRO  35           HD3      PRO  35 -12.089   1.616  -1.435
  Start of MODEL   13
 8704    HA   SER  36           HA       SER  36  -7.398   3.831  -5.703
  Start of MODEL   13
 8705    HB3  SER  36           HB2      SER  36  -8.100   5.736  -6.883
  Start of MODEL   13
 8706    HB2  SER  36           HB3      SER  36  -6.490   6.189  -6.313
  Start of MODEL   13
 8707    HG   SER  36           HG       SER  36  -8.053   7.806  -5.943
  Start of MODEL   13
 8708    H    SER  36           HN       SER  36  -9.200   5.522  -4.328
  Start of MODEL   13
 8709    HA   LEU  37           HA       LEU  37  -4.570   4.214  -2.388
  Start of MODEL   13
 8710    HB3  LEU  37           HB2      LEU  37  -3.201   2.200  -2.308
  Start of MODEL   13
 8711    HB2  LEU  37           HB3      LEU  37  -3.875   1.673  -3.841
  Start of MODEL   13
 8712    HG   LEU  37           HG       LEU  37  -6.139   1.633  -2.719
  Start of MODEL   13
 8713   HD12  LEU  37          HD11      LEU  37  -5.727  -0.452  -1.560
  Start of MODEL   13
 8714   HD11  LEU  37          HD12      LEU  37  -4.003  -0.089  -1.487
  Start of MODEL   13
 8715   HD13  LEU  37          HD13      LEU  37  -4.783  -0.373  -3.046
  Start of MODEL   13
 8716   HD23  LEU  37          HD21      LEU  37  -4.453   2.013  -0.251
  Start of MODEL   13
 8717   HD22  LEU  37          HD22      LEU  37  -6.164   1.610  -0.259
  Start of MODEL   13
 8718   HD21  LEU  37          HD23      LEU  37  -5.622   3.166  -0.887
  Start of MODEL   13
 8719    H    LEU  37           HN       LEU  37  -5.539   3.122  -4.902
  Start of MODEL   13
 8720    HA   ARG  38           HA       ARG  38  -1.077   5.573  -4.603
  Start of MODEL   13
 8721    HB3  ARG  38           HB2      ARG  38  -2.346   7.920  -3.196
  Start of MODEL   13
 8722    HB2  ARG  38           HB3      ARG  38  -2.711   7.390  -4.825
  Start of MODEL   13
 8723    HG2  ARG  38           HG2      ARG  38  -0.059   8.450  -3.886
  Start of MODEL   13
 8724    HG3  ARG  38           HG3      ARG  38  -0.433   7.948  -5.535
  Start of MODEL   13
 8725    HD2  ARG  38           HD2      ARG  38  -1.690  10.206  -3.986
  Start of MODEL   13
 8726    HD3  ARG  38           HD3      ARG  38  -0.621  10.337  -5.385
  Start of MODEL   13
 8727    HE   ARG  38           HE       ARG  38  -2.688   8.827  -6.268
  Start of MODEL   13
 8728   HH11  ARG  38          HH11      ARG  38  -2.454  12.046  -4.835
  Start of MODEL   13
 8729   HH12  ARG  38          HH12      ARG  38  -3.865  12.638  -5.572
  Start of MODEL   13
 8730   HH21  ARG  38          HH21      ARG  38  -4.584   9.600  -7.276
  Start of MODEL   13
 8731   HH22  ARG  38          HH22      ARG  38  -5.135  11.200  -7.032
  Start of MODEL   13
 8732    H    ARG  38           HN       ARG  38  -3.048   5.542  -2.408
  Start of MODEL   13
 8733    HA   TRP  39           HA       TRP  39   1.466   5.878  -1.078
  Start of MODEL   13
 8734    HB3  TRP  39           HB2      TRP  39   3.751   5.045  -1.651
  Start of MODEL   13
 8735    HB2  TRP  39           HB3      TRP  39   3.223   4.879  -3.320
  Start of MODEL   13
 8736    HD1  TRP  39           HD1      TRP  39   1.914   2.761  -3.987
  Start of MODEL   13
 8737    HE1  TRP  39           HE1      TRP  39   1.261   0.629  -2.774
  Start of MODEL   13
 8738    HE3  TRP  39           HE3      TRP  39   2.969   4.235   0.791
  Start of MODEL   13
 8739    HZ2  TRP  39           HZ2      TRP  39   1.169  -0.331  -0.087
  Start of MODEL   13
 8740    HZ3  TRP  39           HZ3      TRP  39   2.571   2.647   2.629
  Start of MODEL   13
 8741    HH2  TRP  39           HH2      TRP  39   1.690   0.413   2.196
  Start of MODEL   13
 8742    H    TRP  39           HN       TRP  39   0.994   5.660  -3.939
  Start of MODEL   13
 8743    HA   LEU  40           HA       LEU  40   3.486   9.556  -2.168
  Start of MODEL   13
 8744    HB3  LEU  40           HB2      LEU  40   2.175  10.197   0.494
  Start of MODEL   13
 8745    HB2  LEU  40           HB3      LEU  40   1.342  10.344  -1.039
  Start of MODEL   13
 8746    HG   LEU  40           HG       LEU  40   3.820  11.911  -0.417
  Start of MODEL   13
 8747   HD11  LEU  40          HD11      LEU  40   1.683  12.127  -2.503
  Start of MODEL   13
 8748   HD13  LEU  40          HD12      LEU  40   3.370  11.654  -2.748
  Start of MODEL   13
 8749   HD12  LEU  40          HD13      LEU  40   2.979  13.300  -2.250
  Start of MODEL   13
 8750   HD22  LEU  40          HD21      LEU  40   2.323  13.781   0.049
  Start of MODEL   13
 8751   HD21  LEU  40          HD22      LEU  40   2.065  12.471   1.202
  Start of MODEL   13
 8752   HD23  LEU  40          HD23      LEU  40   0.927  12.718  -0.123
  Start of MODEL   13
 8753    H    LEU  40           HN       LEU  40   1.965   7.784  -0.403
  Start of MODEL   13
 8754    HA   PHE  41           HA       PHE  41   6.535   8.640   0.826
  Start of MODEL   13
 8755    HB3  PHE  41           HB2      PHE  41   7.764   8.427  -1.935
  Start of MODEL   13
 8756    HB2  PHE  41           HB3      PHE  41   7.010   7.115  -1.035
  Start of MODEL   13
 8757    HD1  PHE  41           HD1      PHE  41   9.996   9.043  -1.536
  Start of MODEL   13
 8758    HD2  PHE  41           HD2      PHE  41   8.072   6.255   1.025
  Start of MODEL   13
 8759    HE1  PHE  41           HE1      PHE  41  12.159   8.474  -0.533
  Start of MODEL   13
 8760    HE2  PHE  41           HE2      PHE  41  10.229   5.678   2.027
  Start of MODEL   13
 8761    HZ   PHE  41           HZ       PHE  41  12.267   6.835   1.297
  Start of MODEL   13
 8762    H    PHE  41           HN       PHE  41   5.572   9.780  -1.691
  Start of MODEL   13
 8763    HA   ASN  42           HA       ASN  42   8.171  12.191   2.658
  Start of MODEL   13
 8764    HB3  ASN  42           HB2      ASN  42  10.298  12.857   1.351
  Start of MODEL   13
 8765    HB2  ASN  42           HB3      ASN  42   9.990  11.437   0.368
  Start of MODEL   13
 8766   HD21  ASN  42          HD21      ASN  42  12.244  11.916   1.926
  Start of MODEL   13
 8767   HD22  ASN  42          HD22      ASN  42  12.359  10.688   3.133
  Start of MODEL   13
 8768    H    ASN  42           HN       ASN  42   7.123  10.312   1.957
  Start of MODEL   13
 8769    HA2  GLY  43           HA2      GLY  43   4.792  14.350   0.205
  Start of MODEL   13
 8770    H    GLY  43           HN       GLY  43   5.957  12.486   0.974
  Start of MODEL   13
 8771    HA3  GLY  43           HA1      GLY  43   6.288  15.269   0.266
  Start of MODEL   13
 8772    HA   SER  44           HA       SER  44   6.316  13.710  -4.032
  Start of MODEL   13
 8773    HB3  SER  44           HB2      SER  44   8.467  11.719  -3.211
  Start of MODEL   13
 8774    HB2  SER  44           HB3      SER  44   8.742  13.445  -3.421
  Start of MODEL   13
 8775    HG   SER  44           HG       SER  44   8.347  13.282  -5.542
  Start of MODEL   13
 8776    H    SER  44           HN       SER  44   6.792  12.428  -1.408
  Start of MODEL   13
 8777    HA   VAL  45           HA       VAL  45   3.843  10.347  -4.650
  Start of MODEL   13
 8778    HB   VAL  45           HB       VAL  45   4.307  11.349  -7.485
  Start of MODEL   13
 8779    H    VAL  45           HN       VAL  45   5.540  12.459  -5.598
  Start of MODEL   13
 8780    HA   LEU  46           HA       LEU  46   7.101   7.571  -5.479
  Start of MODEL   13
 8781    HB3  LEU  46           HB2      LEU  46   5.026   6.042  -3.906
  Start of MODEL   13
 8782    HB2  LEU  46           HB3      LEU  46   6.415   6.870  -3.237
  Start of MODEL   13
 8783    HG   LEU  46           HG       LEU  46   6.590   4.508  -5.100
  Start of MODEL   13
 8784   HD11  LEU  46          HD11      LEU  46   8.691   5.881  -3.428
  Start of MODEL   13
 8785   HD13  LEU  46          HD12      LEU  46   8.561   5.914  -5.187
  Start of MODEL   13
 8786   HD12  LEU  46          HD13      LEU  46   8.917   4.400  -4.357
  Start of MODEL   13
 8787   HD22  LEU  46          HD21      LEU  46   7.184   3.220  -3.105
  Start of MODEL   13
 8788   HD21  LEU  46          HD22      LEU  46   5.542   3.861  -3.013
  Start of MODEL   13
 8789   HD23  LEU  46          HD23      LEU  46   6.842   4.633  -2.102
  Start of MODEL   13
 8790    H    LEU  46           HN       LEU  46   4.589   8.365  -4.374
  Start of MODEL   13
 8791    HA   ASN  47           HA       ASN  47   4.978   6.030  -8.897
  Start of MODEL   13
 8792    HB3  ASN  47           HB2      ASN  47   7.878   5.954  -9.773
  Start of MODEL   13
 8793    HB2  ASN  47           HB3      ASN  47   6.790   7.316  -9.998
  Start of MODEL   13
 8794   HD21  ASN  47          HD21      ASN  47   4.463   5.721 -10.666
  Start of MODEL   13
 8795   HD22  ASN  47          HD22      ASN  47   4.738   5.068 -12.219
  Start of MODEL   13
 8796    H    ASN  47           HN       ASN  47   7.312   6.796  -7.449
  Start of MODEL   13
 8797    HA   GLU  48           HA       GLU  48   5.639   1.875  -7.685
  Start of MODEL   13
 8798    HB3  GLU  48           HB2      GLU  48   3.561   0.649  -8.169
  Start of MODEL   13
 8799    HB2  GLU  48           HB3      GLU  48   2.940   2.046  -9.041
  Start of MODEL   13
 8800    HG2  GLU  48           HG2      GLU  48   3.426   1.713  -6.098
  Start of MODEL   13
 8801    HG3  GLU  48           HG3      GLU  48   3.337   3.316  -6.828
  Start of MODEL   13
 8802    H    GLU  48           HN       GLU  48   4.186   4.082  -8.705
  Start of MODEL   13
 8803    HA   THR  49           HA       THR  49   7.040   0.899 -11.716
  Start of MODEL   13
 8804    HB   THR  49           HB       THR  49   9.509   0.489 -11.440
  Start of MODEL   13
 8805    HG1  THR  49           HG1      THR  49   9.814   1.438  -8.999
  Start of MODEL   13
 8806   HG22  THR  49          HG21      THR  49  10.072   2.793 -10.805
  Start of MODEL   13
 8807   HG21  THR  49          HG22      THR  49   8.472   2.991 -10.094
  Start of MODEL   13
 8808   HG23  THR  49          HG23      THR  49   8.637   2.778 -11.833
  Start of MODEL   13
 8809    H    THR  49           HN       THR  49   7.099   0.960  -8.801
  Start of MODEL   13
 8810    HA   SER  50           HA       SER  50   7.330  -3.466 -11.266
  Start of MODEL   13
 8811    HB3  SER  50           HB2      SER  50   9.996  -3.337 -12.717
  Start of MODEL   13
 8812    HB2  SER  50           HB3      SER  50   8.423  -3.362 -13.503
  Start of MODEL   13
 8813    HG   SER  50           HG       SER  50   8.080  -5.389 -12.814
  Start of MODEL   13
 8814    H    SER  50           HN       SER  50   8.874  -1.190 -12.086
  Start of MODEL   13
 8815    HA   PHE  51           HA       PHE  51  11.273  -3.832  -8.636
  Start of MODEL   13
 8816    HB3  PHE  51           HB2      PHE  51  12.833  -2.116  -7.861
  Start of MODEL   13
 8817    HB2  PHE  51           HB3      PHE  51  11.822  -0.857  -8.558
  Start of MODEL   13
 8818    HD1  PHE  51           HD1      PHE  51  14.054  -3.679  -9.356
  Start of MODEL   13
 8819    HD2  PHE  51           HD2      PHE  51  11.943  -0.306 -10.865
  Start of MODEL   13
 8820    HE1  PHE  51           HE1      PHE  51  15.306  -3.843 -11.463
  Start of MODEL   13
 8821    HE2  PHE  51           HE2      PHE  51  13.193  -0.470 -12.977
  Start of MODEL   13
 8822    HZ   PHE  51           HZ       PHE  51  14.830  -2.246 -13.302
  Start of MODEL   13
 8823    H    PHE  51           HN       PHE  51  10.086  -1.705 -10.176
  Start of MODEL   13
 8824    HA   ILE  52           HA       ILE  52   8.736  -1.920  -5.309
  Start of MODEL   13
 8825    HB   ILE  52           HB       ILE  52   8.585   0.913  -6.433
  Start of MODEL   13
 8826   HD12  ILE  52          HD11      ILE  52  11.852   1.855  -4.840
  Start of MODEL   13
 8827   HD11  ILE  52          HD12      ILE  52  10.260   2.095  -4.108
  Start of MODEL   13
 8828   HD13  ILE  52          HD13      ILE  52  10.520   2.495  -5.806
  Start of MODEL   13
 8829    H    ILE  52           HN       ILE  52   9.309  -0.982  -8.053
  Start of MODEL   13
 8830    HA   PHE  53           HA       PHE  53   4.746  -1.548  -7.214
  Start of MODEL   13
 8831    HB3  PHE  53           HB2      PHE  53   5.521  -4.445  -7.525
  Start of MODEL   13
 8832    HB2  PHE  53           HB3      PHE  53   5.914  -3.160  -8.655
  Start of MODEL   13
 8833    HD1  PHE  53           HD1      PHE  53   3.905  -1.874  -9.662
  Start of MODEL   13
 8834    HD2  PHE  53           HD2      PHE  53   3.665  -5.730  -7.920
  Start of MODEL   13
 8835    HE1  PHE  53           HE1      PHE  53   1.851  -2.315 -10.931
  Start of MODEL   13
 8836    HE2  PHE  53           HE2      PHE  53   1.605  -6.184  -9.180
  Start of MODEL   13
 8837    HZ   PHE  53           HZ       PHE  53   0.695  -4.478 -10.690
  Start of MODEL   13
 8838    H    PHE  53           HN       PHE  53   6.731  -2.943  -5.575
  Start of MODEL   13
 8839    HA   THR  54           HA       THR  54   2.269  -2.937  -3.917
  Start of MODEL   13
 8840    HB   THR  54           HB       THR  54   0.333  -1.451  -5.713
  Start of MODEL   13
 8841    HG1  THR  54           HG1      THR  54   1.371   0.254  -5.139
  Start of MODEL   13
 8842   HG23  THR  54          HG21      THR  54  -0.743  -2.751  -3.926
  Start of MODEL   13
 8843   HG22  THR  54          HG22      THR  54  -0.886  -1.016  -3.638
  Start of MODEL   13
 8844   HG21  THR  54          HG23      THR  54   0.300  -1.964  -2.740
  Start of MODEL   13
 8845    H    THR  54           HN       THR  54   2.666  -1.783  -6.529
  Start of MODEL   13
 8846    HA   GLU  55           HA       GLU  55   0.033  -6.154  -5.876
  Start of MODEL   13
 8847    HB3  GLU  55           HB2      GLU  55   0.946  -8.375  -5.159
  Start of MODEL   13
 8848    HB2  GLU  55           HB3      GLU  55   2.097  -7.516  -4.141
  Start of MODEL   13
 8849    HG2  GLU  55           HG2      GLU  55   1.858  -7.242  -7.128
  Start of MODEL   13
 8850    HG3  GLU  55           HG3      GLU  55   3.023  -6.423  -6.087
  Start of MODEL   13
 8851    H    GLU  55           HN       GLU  55   1.776  -5.050  -3.810
  Start of MODEL   13
 8852    HA   PHE  56           HA       PHE  56  -2.422  -6.955  -2.408
  Start of MODEL   13
 8853    HB3  PHE  56           HB2      PHE  56  -4.757  -7.132  -3.261
  Start of MODEL   13
 8854    HB2  PHE  56           HB3      PHE  56  -4.105  -7.304  -4.887
  Start of MODEL   13
 8855    HD1  PHE  56           HD1      PHE  56  -4.908  -5.003  -2.226
  Start of MODEL   13
 8856    HD2  PHE  56           HD2      PHE  56  -2.888  -5.439  -5.936
  Start of MODEL   13
 8857    HE1  PHE  56           HE1      PHE  56  -4.861  -2.560  -2.476
  Start of MODEL   13
 8858    HE2  PHE  56           HE2      PHE  56  -2.837  -3.002  -6.195
  Start of MODEL   13
 8859    HZ   PHE  56           HZ       PHE  56  -3.807  -1.558  -4.460
  Start of MODEL   13
 8860    H    PHE  56           HN       PHE  56  -1.575  -7.637  -5.133
  Start of MODEL   13
 8861    HA   LEU  57           HA       LEU  57  -3.543 -11.187  -2.573
  Start of MODEL   13
 8862    HB3  LEU  57           HB2      LEU  57  -2.102 -10.806  -0.502
  Start of MODEL   13
 8863    HB2  LEU  57           HB3      LEU  57  -3.186 -12.171  -0.411
  Start of MODEL   13
 8864    HG   LEU  57           HG       LEU  57  -4.014  -9.616   0.850
  Start of MODEL   13
 8865   HD13  LEU  57          HD11      LEU  57  -5.624 -11.448   0.691
  Start of MODEL   13
 8866   HD12  LEU  57          HD12      LEU  57  -5.183 -11.156   2.377
  Start of MODEL   13
 8867   HD11  LEU  57          HD13      LEU  57  -4.492 -12.525   1.502
  Start of MODEL   13
 8868   HD21  LEU  57          HD21      LEU  57  -1.758  -9.967   1.670
  Start of MODEL   13
 8869   HD23  LEU  57          HD22      LEU  57  -2.138 -11.647   2.045
  Start of MODEL   13
 8870   HD22  LEU  57          HD23      LEU  57  -2.925 -10.345   2.940
  Start of MODEL   13
 8871    H    LEU  57           HN       LEU  57  -3.926  -8.533  -1.466
  Start of MODEL   13
 8872    HA   GLU  58           HA       GLU  58  -7.723 -11.079  -2.843
  Start of MODEL   13
 8873    HB3  GLU  58           HB2      GLU  58  -7.225 -13.990  -2.393
  Start of MODEL   13
 8874    HB2  GLU  58           HB3      GLU  58  -7.041 -13.158  -3.934
  Start of MODEL   13
 8875    HG2  GLU  58           HG2      GLU  58  -9.617 -13.299  -2.411
  Start of MODEL   13
 8876    HG3  GLU  58           HG3      GLU  58  -9.376 -12.707  -4.057
  Start of MODEL   13
 8877    H    GLU  58           HN       GLU  58  -5.315 -12.450  -2.462
  Start of MODEL   13
 8878    HA   PRO  59           HA       PRO  59  -8.938 -11.183   1.488
  Start of MODEL   13
 8879    HB3  PRO  59           HB2      PRO  59  -9.271  -8.894   1.271
  Start of MODEL   13
 8880    HB2  PRO  59           HB3      PRO  59 -10.959  -9.412   1.264
  Start of MODEL   13
 8881    HG2  PRO  59           HG2      PRO  59 -11.165  -9.151  -1.009
  Start of MODEL   13
 8882    HG3  PRO  59           HG3      PRO  59  -9.877  -7.967  -0.743
  Start of MODEL   13
 8883    HD2  PRO  59           HD2      PRO  59  -9.712 -10.216  -2.371
  Start of MODEL   13
 8884    HD3  PRO  59           HD3      PRO  59  -8.330  -9.277  -1.758
  Start of MODEL   13
 8885    HA   ALA  60           HA       ALA  60 -12.407 -13.768   1.194
  Start of MODEL   13
 8886    HB3  ALA  60           HB1      ALA  60 -11.842 -14.001   3.551
  Start of MODEL   13
 8887    HB2  ALA  60           HB2      ALA  60 -13.594 -14.021   3.353
  Start of MODEL   13
 8888    HB1  ALA  60           HB3      ALA  60 -12.785 -12.563   3.941
  Start of MODEL   13
 8889    H    ALA  60           HN       ALA  60 -11.047 -11.639   2.569
  Start of MODEL   13
 8890    HA   ALA  61           HA       ALA  61 -15.518 -11.241  -0.389
  Start of MODEL   13
 8891    HB2  ALA  61           HB1      ALA  61 -17.008 -13.851  -0.159
  Start of MODEL   13
 8892    HB1  ALA  61           HB2      ALA  61 -15.953 -13.390  -1.493
  Start of MODEL   13
 8893    HB3  ALA  61           HB3      ALA  61 -17.438 -12.487  -1.188
  Start of MODEL   13
 8894    H    ALA  61           HN       ALA  61 -14.540 -13.705   0.560
  Start of MODEL   13
 8895    HA   ASN  62           HA       ASN  62 -18.310 -11.213   3.273
  Start of MODEL   13
 8896    HB3  ASN  62           HB2      ASN  62 -18.171 -13.578   3.961
  Start of MODEL   13
 8897    HB2  ASN  62           HB3      ASN  62 -18.365 -12.507   5.345
  Start of MODEL   13
 8898   HD21  ASN  62          HD21      ASN  62 -16.732 -12.362   6.845
  Start of MODEL   13
 8899   HD22  ASN  62          HD22      ASN  62 -15.351 -13.389   6.826
  Start of MODEL   13
 8900    H    ASN  62           HN       ASN  62 -15.842 -12.657   2.644
  Start of MODEL   13
 8901    HA   GLU  63           HA       GLU  63 -15.515  -8.662   5.511
  Start of MODEL   13
 8902    HB3  GLU  63           HB2      GLU  63 -13.501 -10.203   5.583
  Start of MODEL   13
 8903    HB2  GLU  63           HB3      GLU  63 -13.131  -8.498   5.757
  Start of MODEL   13
 8904    HG2  GLU  63           HG2      GLU  63 -12.791 -10.094   3.241
  Start of MODEL   13
 8905    HG3  GLU  63           HG3      GLU  63 -12.413  -8.387   3.444
  Start of MODEL   13
 8906    H    GLU  63           HN       GLU  63 -15.223 -10.304   3.108
  Start of MODEL   13
 8907    HA   THR  64           HA       THR  64 -15.221  -5.528   2.553
  Start of MODEL   13
 8908    HB   THR  64           HB       THR  64 -15.713  -3.352   3.836
  Start of MODEL   13
 8909    HG1  THR  64           HG1      THR  64 -15.688  -3.454   5.958
  Start of MODEL   13
 8910   HG21  THR  64          HG21      THR  64 -17.489  -5.772   4.229
  Start of MODEL   13
 8911   HG23  THR  64          HG22      THR  64 -17.460  -4.737   2.802
  Start of MODEL   13
 8912   HG22  THR  64          HG23      THR  64 -18.011  -4.091   4.349
  Start of MODEL   13
 8913    H    THR  64           HN       THR  64 -14.786  -6.474   5.273
  Start of MODEL   13
 8914    HA   VAL  65           HA       VAL  65 -11.179  -3.872   3.983
  Start of MODEL   13
 8915    HB   VAL  65           HB       VAL  65 -10.332  -6.453   5.325
  Start of MODEL   13
 8916    H    VAL  65           HN       VAL  65 -12.714  -6.338   4.247
  Start of MODEL   13
 8917    HA   ARG  66           HA       ARG  66  -9.130  -5.905   0.654
  Start of MODEL   13
 8918    HB3  ARG  66           HB2      ARG  66  -7.928  -4.187  -0.658
  Start of MODEL   13
 8919    HB2  ARG  66           HB3      ARG  66  -8.205  -3.033   0.629
  Start of MODEL   13
 8920    HG2  ARG  66           HG2      ARG  66 -10.307  -4.286  -1.123
  Start of MODEL   13
 8921    HG3  ARG  66           HG3      ARG  66 -10.635  -3.209   0.240
  Start of MODEL   13
 8922    HD2  ARG  66           HD2      ARG  66 -10.663  -2.006  -1.905
  Start of MODEL   13
 8923    HD3  ARG  66           HD3      ARG  66  -9.379  -1.420  -0.848
  Start of MODEL   13
 8924    HE   ARG  66           HE       ARG  66  -8.427  -3.457  -2.543
  Start of MODEL   13
 8925   HH11  ARG  66          HH11      ARG  66  -9.237  -0.027  -2.588
  Start of MODEL   13
 8926   HH12  ARG  66          HH12      ARG  66  -8.329   0.372  -3.960
  Start of MODEL   13
 8927   HH21  ARG  66          HH21      ARG  66  -7.181  -2.992  -4.427
  Start of MODEL   13
 8928   HH22  ARG  66          HH22      ARG  66  -7.090  -1.420  -5.064
  Start of MODEL   13
 8929    H    ARG  66           HN       ARG  66  -9.597  -3.698   2.509
  Start of MODEL   13
 8930    HA   HIS  67           HA       HIS  67  -5.160  -6.025   2.530
  Start of MODEL   13
 8931    HB3  HIS  67           HB2      HIS  67  -4.532  -8.469   2.595
  Start of MODEL   13
 8932    HB2  HIS  67           HB3      HIS  67  -5.940  -8.794   1.605
  Start of MODEL   13
 8933    HD1  HIS  67           HD1      HIS  67  -4.975  -8.932   5.001
  Start of MODEL   13
 8934    HD2  HIS  67           HD2      HIS  67  -8.397  -7.702   3.008
  Start of MODEL   13
 8935    HE1  HIS  67           HE1      HIS  67  -6.824  -9.130   6.659
  Start of MODEL   13
 8936    HE2  HIS  67           HE2      HIS  67  -8.916  -8.675   5.287
  Start of MODEL   13
 8937    H    HIS  67           HN       HIS  67  -7.040  -6.757   0.401
  Start of MODEL   13
 8938    HA2  GLY  68           HA2      GLY  68  -2.066  -7.163  -0.416
  Start of MODEL   13
 8939    H    GLY  68           HN       GLY  68  -3.022  -5.952   1.926
  Start of MODEL   13
 8940    HA3  GLY  68           HA1      GLY  68  -2.388  -5.451  -0.694
  Start of MODEL   13
 8941    HA   CYS  69           HA       CYS  69   1.408  -4.850   1.253
  Start of MODEL   13
 8942    HB3  CYS  69           HB2      CYS  69   2.111  -7.471  -0.059
  Start of MODEL   13
 8943    HB2  CYS  69           HB3      CYS  69   1.794  -7.166   1.648
  Start of MODEL   13
 8944    H    CYS  69           HN       CYS  69   0.049  -5.894  -1.069
  Start of MODEL   13
 8945    HA   LEU  70           HA       LEU  70   3.473  -2.995  -2.124
  Start of MODEL   13
 8946    HB3  LEU  70           HB2      LEU  70   4.781  -1.766   0.312
  Start of MODEL   13
 8947    HB2  LEU  70           HB3      LEU  70   3.354  -1.105  -0.464
  Start of MODEL   13
 8948    HG   LEU  70           HG       LEU  70   6.101  -1.326  -1.714
  Start of MODEL   13
 8949   HD12  LEU  70          HD11      LEU  70   5.141   0.097  -3.469
  Start of MODEL   13
 8950   HD11  LEU  70          HD12      LEU  70   3.552  -0.112  -2.737
  Start of MODEL   13
 8951   HD13  LEU  70          HD13      LEU  70   4.406  -1.503  -3.410
  Start of MODEL   13
 8952   HD22  LEU  70          HD21      LEU  70   6.132   1.102  -1.550
  Start of MODEL   13
 8953   HD21  LEU  70          HD22      LEU  70   6.004   0.365   0.045
  Start of MODEL   13
 8954   HD23  LEU  70          HD23      LEU  70   4.579   1.071  -0.722
  Start of MODEL   13
 8955    H    LEU  70           HN       LEU  70   2.948  -3.447   0.679
  Start of MODEL   13
 8956    HA   ARG  71           HA       ARG  71   6.683  -5.917  -1.558
  Start of MODEL   13
 8957    HB3  ARG  71           HB2      ARG  71   6.765  -7.287  -3.652
  Start of MODEL   13
 8958    HB2  ARG  71           HB3      ARG  71   5.531  -6.237  -4.325
  Start of MODEL   13
 8959    HG2  ARG  71           HG2      ARG  71   4.029  -6.914  -2.449
  Start of MODEL   13
 8960    HG3  ARG  71           HG3      ARG  71   4.438  -8.189  -3.597
  Start of MODEL   13
 8961    HD2  ARG  71           HD2      ARG  71   6.133  -9.024  -2.065
  Start of MODEL   13
 8962    HD3  ARG  71           HD3      ARG  71   5.735  -7.759  -0.901
  Start of MODEL   13
 8963    HE   ARG  71           HE       ARG  71   3.382  -8.967  -1.356
  Start of MODEL   13
 8964   HH11  ARG  71          HH11      ARG  71   6.538 -10.341  -0.446
  Start of MODEL   13
 8965   HH12  ARG  71          HH12      ARG  71   5.899 -11.589   0.504
  Start of MODEL   13
 8966   HH21  ARG  71          HH21      ARG  71   2.498 -10.677  -0.039
  Start of MODEL   13
 8967   HH22  ARG  71          HH22      ARG  71   3.505 -11.773   0.757
  Start of MODEL   13
 8968    H    ARG  71           HN       ARG  71   4.733  -4.384  -3.080
  Start of MODEL   13
 8969    HA   LEU  72           HA       LEU  72   9.505  -3.557  -3.880
  Start of MODEL   13
 8970    HB3  LEU  72           HB2      LEU  72  11.304  -2.556  -2.589
  Start of MODEL   13
 8971    HB2  LEU  72           HB3      LEU  72  10.839  -3.382  -1.137
  Start of MODEL   13
 8972    HG   LEU  72           HG       LEU  72   8.933  -1.518  -2.482
  Start of MODEL   13
 8973   HD12  LEU  72          HD11      LEU  72   8.152  -1.078  -0.234
  Start of MODEL   13
 8974   HD11  LEU  72          HD12      LEU  72   9.330  -2.229   0.396
  Start of MODEL   13
 8975   HD13  LEU  72          HD13      LEU  72   8.032  -2.784  -0.670
  Start of MODEL   13
 8976   HD23  LEU  72          HD21      LEU  72  11.168  -0.642  -0.660
  Start of MODEL   13
 8977   HD22  LEU  72          HD22      LEU  72   9.809   0.358  -1.210
  Start of MODEL   13
 8978   HD21  LEU  72          HD23      LEU  72  10.971  -0.250  -2.374
  Start of MODEL   13
 8979    H    LEU  72           HN       LEU  72   8.532  -4.763  -1.419
  Start of MODEL   13
 8980    HA   ASN  73           HA       ASN  73  11.633  -7.285  -4.271
  Start of MODEL   13
 8981    HB3  ASN  73           HB2      ASN  73  12.114  -7.597  -6.697
  Start of MODEL   13
 8982    HB2  ASN  73           HB3      ASN  73  11.495  -5.975  -6.993
  Start of MODEL   13
 8983   HD21  ASN  73          HD21      ASN  73   9.878  -6.822  -8.346
  Start of MODEL   13
 8984   HD22  ASN  73          HD22      ASN  73   8.487  -7.577  -7.667
  Start of MODEL   13
 8985    H    ASN  73           HN       ASN  73  10.410  -4.821  -5.110
  Start of MODEL   13
 8986    HA   GLN  74           HA       GLN  74  15.412  -4.958  -4.740
  Start of MODEL   13
 8987    HB3  GLN  74           HB2      GLN  74  14.746  -3.098  -7.039
  Start of MODEL   13
 8988    HB2  GLN  74           HB3      GLN  74  15.393  -4.727  -7.221
  Start of MODEL   13
 8989    HG2  GLN  74           HG2      GLN  74  16.747  -2.431  -5.806
  Start of MODEL   13
 8990    HG3  GLN  74           HG3      GLN  74  17.391  -4.055  -5.987
  Start of MODEL   13
 8991   HE21  GLN  74          HE21      GLN  74  16.429  -4.286  -8.753
  Start of MODEL   13
 8992   HE22  GLN  74          HE22      GLN  74  17.474  -3.295  -9.697
  Start of MODEL   13
 8993    H    GLN  74           HN       GLN  74  12.803  -4.331  -5.863
  Start of MODEL   13
 8994    HA   PRO  75           HA       PRO  75  13.977  -1.438  -2.307
  Start of MODEL   13
 8995    HB3  PRO  75           HB2      PRO  75  14.030  -2.387  -0.238
  Start of MODEL   13
 8996    HB2  PRO  75           HB3      PRO  75  15.790  -2.294  -0.239
  Start of MODEL   13
 8997    HG2  PRO  75           HG2      PRO  75  15.688  -4.582  -0.329
  Start of MODEL   13
 8998    HG3  PRO  75           HG3      PRO  75  14.020  -4.554  -0.938
  Start of MODEL   13
 8999    HD2  PRO  75           HD2      PRO  75  16.589  -4.308  -2.442
  Start of MODEL   13
 9000    HD3  PRO  75           HD3      PRO  75  15.096  -5.196  -2.844
  Start of MODEL   13
 9001    HA   THR  76           HA       THR  76  17.904   0.540  -2.734
  Start of MODEL   13
 9002    HB   THR  76           HB       THR  76  17.529   2.771  -3.886
  Start of MODEL   13
 9003    HG1  THR  76           HG1      THR  76  14.805   1.975  -3.629
  Start of MODEL   13
 9004   HG22  THR  76          HG21      THR  76  16.747   1.823  -6.022
  Start of MODEL   13
 9005   HG21  THR  76          HG22      THR  76  16.167   0.395  -5.170
  Start of MODEL   13
 9006   HG23  THR  76          HG23      THR  76  17.896   0.754  -5.218
  Start of MODEL   13
 9007    H    THR  76           HN       THR  76  14.978   0.508  -2.466
  Start of MODEL   13
 9008    HA   HIS  77           HA       HIS  77  17.791   2.630   0.940
  Start of MODEL   13
 9009    HB3  HIS  77           HB2      HIS  77  20.293   2.323   0.645
  Start of MODEL   13
 9010    HB2  HIS  77           HB3      HIS  77  19.813   3.520   1.829
  Start of MODEL   13
 9011    HD1  HIS  77           HD1      HIS  77  21.219   5.553   1.786
  Start of MODEL   13
 9012    HD2  HIS  77           HD2      HIS  77  20.898   3.791  -1.943
  Start of MODEL   13
 9013    HE1  HIS  77           HE1      HIS  77  22.669   6.910   0.296
  Start of MODEL   13
 9014    HE2  HIS  77           HE2      HIS  77  22.060   6.078  -1.983
  Start of MODEL   13
 9015    H    HIS  77           HN       HIS  77  18.971   2.383  -1.663
  Start of MODEL   13
 9016    HA   VAL  78           HA       VAL  78  16.892   6.843  -0.365
  Start of MODEL   13
 9017    HB   VAL  78           HB       VAL  78  15.686   7.628  -2.463
  Start of MODEL   13
 9018    H    VAL  78           HN       VAL  78  17.334   4.414  -1.759
  Start of MODEL   13
 9019    HA   ASN  79           HA       ASN  79  12.565   4.837  -0.395
  Start of MODEL   13
 9020    HB3  ASN  79           HB2      ASN  79  12.146   2.393   0.040
  Start of MODEL   13
 9021    HB2  ASN  79           HB3      ASN  79  13.876   2.119  -0.089
  Start of MODEL   13
 9022   HD21  ASN  79          HD21      ASN  79  11.956   4.282  -2.069
  Start of MODEL   13
 9023   HD22  ASN  79          HD22      ASN  79  12.243   3.456  -3.551
  Start of MODEL   13
 9024    H    ASN  79           HN       ASN  79  15.314   3.948  -0.618
  Start of MODEL   13
 9025    HA   ASN  80           HA       ASN  80  14.017   3.961   4.028
  Start of MODEL   13
 9026    HB3  ASN  80           HB2      ASN  80  16.431   5.715   3.515
  Start of MODEL   13
 9027    HB2  ASN  80           HB3      ASN  80  16.476   3.969   3.356
  Start of MODEL   13
 9028   HD21  ASN  80          HD21      ASN  80  18.049   3.796   4.892
  Start of MODEL   13
 9029   HD22  ASN  80          HD22      ASN  80  17.716   3.982   6.574
  Start of MODEL   13
 9030    H    ASN  80           HN       ASN  80  15.117   4.895   1.534
  Start of MODEL   13
 9031    HA2  GLY  81           HA2      GLY  81  12.303   7.790   5.245
  Start of MODEL   13
 9032    H    GLY  81           HN       GLY  81  12.076   5.219   4.041
  Start of MODEL   13
 9033    HA3  GLY  81           HA1      GLY  81  11.763   7.903   3.575
  Start of MODEL   13
 9034    HA   ASN  82           HA       ASN  82   8.124   6.894   5.809
  Start of MODEL   13
 9035    HB3  ASN  82           HB2      ASN  82   7.614   9.785   5.095
  Start of MODEL   13
 9036    HB2  ASN  82           HB3      ASN  82   8.292   9.199   6.613
  Start of MODEL   13
 9037   HD21  ASN  82          HD21      ASN  82   6.957   8.298   8.118
  Start of MODEL   13
 9038   HD22  ASN  82          HD22      ASN  82   5.238   8.371   8.032
  Start of MODEL   13
 9039    H    ASN  82           HN       ASN  82   9.693   8.638   4.079
  Start of MODEL   13
 9040    HA   TYR  83           HA       TYR  83   5.656   6.385   2.164
  Start of MODEL   13
 9041    HB3  TYR  83           HB2      TYR  83   4.676   4.087   2.254
  Start of MODEL   13
 9042    HB2  TYR  83           HB3      TYR  83   5.393   3.886   3.846
  Start of MODEL   13
 9043    HD1  TYR  83           HD1      TYR  83   5.935   3.605   0.319
  Start of MODEL   13
 9044    HD2  TYR  83           HD2      TYR  83   7.884   3.972   4.076
  Start of MODEL   13
 9045    HE1  TYR  83           HE1      TYR  83   8.012   2.783  -0.684
  Start of MODEL   13
 9046    HE2  TYR  83           HE2      TYR  83   9.971   3.152   3.070
  Start of MODEL   13
 9047    HH   TYR  83           HH       TYR  83  10.358   2.858  -0.275
  Start of MODEL   13
 9048    H    TYR  83           HN       TYR  83   6.580   5.713   4.853
  Start of MODEL   13
 9049    HA   THR  84           HA       THR  84   1.924   7.266   4.334
  Start of MODEL   13
 9050    HB   THR  84           HB       THR  84   2.096   9.395   2.200
  Start of MODEL   13
 9051    HG1  THR  84           HG1      THR  84   3.717   8.994   4.308
  Start of MODEL   13
 9052   HG23  THR  84          HG21      THR  84  -0.080   9.200   3.317
  Start of MODEL   13
 9053   HG22  THR  84          HG22      THR  84   0.723  10.702   3.778
  Start of MODEL   13
 9054   HG21  THR  84          HG23      THR  84   0.708   9.331   4.890
  Start of MODEL   13
 9055    H    THR  84           HN       THR  84   3.874   7.592   2.182
  Start of MODEL   13
 9056    HA   LEU  85           HA       LEU  85  -0.316   5.568   0.970
  Start of MODEL   13
 9057    HB3  LEU  85           HB2      LEU  85  -1.375   4.097   3.390
  Start of MODEL   13
 9058    HB2  LEU  85           HB3      LEU  85  -0.029   3.582   2.390
  Start of MODEL   13
 9059    HG   LEU  85           HG       LEU  85  -2.907   3.780   1.481
  Start of MODEL   13
 9060   HD11  LEU  85          HD11      LEU  85  -0.428   2.819   0.137
  Start of MODEL   13
 9061   HD13  LEU  85          HD12      LEU  85  -1.384   4.244  -0.312
  Start of MODEL   13
 9062   HD12  LEU  85          HD13      LEU  85  -2.062   2.613  -0.504
  Start of MODEL   13
 9063   HD23  LEU  85          HD21      LEU  85  -1.185   1.362   1.970
  Start of MODEL   13
 9064   HD22  LEU  85          HD22      LEU  85  -2.879   1.394   1.446
  Start of MODEL   13
 9065   HD21  LEU  85          HD23      LEU  85  -2.438   1.959   3.055
  Start of MODEL   13
 9066    H    LEU  85           HN       LEU  85   0.162   6.093   3.799
  Start of MODEL   13
 9067    HA   LEU  86           HA       LEU  86  -3.984   7.853   1.561
  Start of MODEL   13
 9068    HB3  LEU  86           HB2      LEU  86  -4.371   9.163  -0.541
  Start of MODEL   13
 9069    HB2  LEU  86           HB3      LEU  86  -2.963   8.411  -1.235
  Start of MODEL   13
 9070    HG   LEU  86           HG       LEU  86  -2.612  10.741  -0.524
  Start of MODEL   13
 9071   HD11  LEU  86          HD11      LEU  86  -2.949   9.691   2.248
  Start of MODEL   13
 9072   HD13  LEU  86          HD12      LEU  86  -4.009  10.817   1.399
  Start of MODEL   13
 9073   HD12  LEU  86          HD13      LEU  86  -2.359  11.295   1.813
  Start of MODEL   13
 9074   HD23  LEU  86          HD21      LEU  86  -0.902   8.744   0.953
  Start of MODEL   13
 9075   HD22  LEU  86          HD22      LEU  86  -0.462  10.410   0.584
  Start of MODEL   13
 9076   HD21  LEU  86          HD23      LEU  86  -0.696   9.250  -0.724
  Start of MODEL   13
 9077    H    LEU  86           HN       LEU  86  -1.811   6.616   0.028
  Start of MODEL   13
 9078    HA   ALA  87           HA       ALA  87  -6.553   5.517  -1.157
  Start of MODEL   13
 9079    HB1  ALA  87           HB1      ALA  87  -7.660   5.169   1.636
  Start of MODEL   13
 9080    HB3  ALA  87           HB2      ALA  87  -6.490   4.111   0.868
  Start of MODEL   13
 9081    HB2  ALA  87           HB3      ALA  87  -8.134   4.198   0.246
  Start of MODEL   13
 9082    H    ALA  87           HN       ALA  87  -5.998   7.199   1.198
  Start of MODEL   13
 9083    HA   ALA  88           HA       ALA  88  -9.823   8.392  -0.985
  Start of MODEL   13
 9084    HB1  ALA  88           HB1      ALA  88  -8.113   9.586  -2.277
  Start of MODEL   13
 9085    HB3  ALA  88           HB2      ALA  88  -9.741   9.880  -2.892
  Start of MODEL   13
 9086    HB2  ALA  88           HB3      ALA  88  -8.665   8.770  -3.737
  Start of MODEL   13
 9087    H    ALA  88           HN       ALA  88  -8.014   6.548  -2.379
  Start of MODEL   13
 9088    HA   ASN  89           HA       ASN  89 -12.900   6.848  -3.542
  Start of MODEL   13
 9089    HB3  ASN  89           HB2      ASN  89 -12.806   4.759  -2.198
  Start of MODEL   13
 9090    HB2  ASN  89           HB3      ASN  89 -14.467   5.236  -2.411
  Start of MODEL   13
 9091   HD21  ASN  89          HD21      ASN  89 -13.568   3.434  -0.571
  Start of MODEL   13
 9092   HD22  ASN  89          HD22      ASN  89 -13.908   4.020   1.016
  Start of MODEL   13
 9093    H    ASN  89           HN       ASN  89 -11.784   7.646  -0.979
  Start of MODEL   13
 9094    HA   PRO  90           HA       PRO  90 -15.915  10.016  -3.335
  Start of MODEL   13
 9095    HB3  PRO  90           HB2      PRO  90 -17.822   9.172  -4.187
  Start of MODEL   13
 9096    HB2  PRO  90           HB3      PRO  90 -18.245   8.491  -2.620
  Start of MODEL   13
 9097    HG2  PRO  90           HG2      PRO  90 -17.408   6.432  -3.155
  Start of MODEL   13
 9098    HG3  PRO  90           HG3      PRO  90 -17.559   6.991  -4.828
  Start of MODEL   13
 9099    HD2  PRO  90           HD2      PRO  90 -15.214   6.175  -3.883
  Start of MODEL   13
 9100    HD3  PRO  90           HD3      PRO  90 -15.313   7.571  -4.962
  Start of MODEL   13
 9101    HA   CYS  91           HA       CYS  91 -17.701   9.559   0.987
  Start of MODEL   13
 9102    HB3  CYS  91           HB2      CYS  91 -16.203   7.088   1.854
  Start of MODEL   13
 9103    HB2  CYS  91           HB3      CYS  91 -17.890   7.132   1.346
  Start of MODEL   13
 9104    H    CYS  91           HN       CYS  91 -16.282   7.725  -0.639
  Start of MODEL   13
 9105    HA2  GLY  92           HA2      GLY  92 -13.464  11.327   1.636
  Start of MODEL   13
 9106    H    GLY  92           HN       GLY  92 -14.228   8.891   0.634
  Start of MODEL   13
 9107    HA3  GLY  92           HA1      GLY  92 -13.495  10.232   3.011
  Start of MODEL   13
 9108    HA   GLN  93           HA       GLN  93  -9.645   9.284   1.007
  Start of MODEL   13
 9109    HB3  GLN  93           HB2      GLN  93  -8.878  12.133   1.686
  Start of MODEL   13
 9110    HB2  GLN  93           HB3      GLN  93  -9.460  11.613   0.113
  Start of MODEL   13
 9111    HG2  GLN  93           HG2      GLN  93  -6.938  10.632   1.439
  Start of MODEL   13
 9112    HG3  GLN  93           HG3      GLN  93  -7.507  10.190  -0.167
  Start of MODEL   13
 9113   HE21  GLN  93          HE21      GLN  93  -5.706  10.991  -1.195
  Start of MODEL   13
 9114   HE22  GLN  93          HE22      GLN  93  -5.372  12.675  -1.337
  Start of MODEL   13
 9115    H    GLN  93           HN       GLN  93 -11.183  11.340   2.405
  Start of MODEL   13
 9116    HA   ALA  94           HA       ALA  94  -8.039   8.758   5.052
  Start of MODEL   13
 9117    HB1  ALA  94           HB1      ALA  94  -7.781   6.162   3.573
  Start of MODEL   13
 9118    HB3  ALA  94           HB2      ALA  94  -9.086   6.602   4.684
  Start of MODEL   13
 9119    HB2  ALA  94           HB3      ALA  94  -7.435   6.363   5.277
  Start of MODEL   13
 9120    H    ALA  94           HN       ALA  94  -8.421   8.076   2.218
  Start of MODEL   13
 9121    HA   SER  95           HA       SER  95  -3.716   8.090   4.208
  Start of MODEL   13
 9122    HB3  SER  95           HB2      SER  95  -4.051  10.438   3.952
  Start of MODEL   13
 9123    HB2  SER  95           HB3      SER  95  -2.705  10.247   5.077
  Start of MODEL   13
 9124    HG   SER  95           HG       SER  95  -5.196  10.331   6.240
  Start of MODEL   13
 9125    H    SER  95           HN       SER  95  -5.956   8.403   5.977
  Start of MODEL   13
 9126    HA   ALA  96           HA       ALA  96  -1.788   7.242   8.077
  Start of MODEL   13
 9127    HB2  ALA  96           HB1      ALA  96  -1.611   4.783   8.332
  Start of MODEL   13
 9128    HB1  ALA  96           HB2      ALA  96  -2.138   4.582   6.664
  Start of MODEL   13
 9129    HB3  ALA  96           HB3      ALA  96  -3.245   5.257   7.862
  Start of MODEL   13
 9130    H    ALA  96           HN       ALA  96  -2.233   6.948   5.213
  Start of MODEL   13
 9131    HA   SER  97           HA       SER  97   2.037   6.213   6.175
  Start of MODEL   13
 9132    HB3  SER  97           HB2      SER  97   2.183   8.511   6.630
  Start of MODEL   13
 9133    HB2  SER  97           HB3      SER  97   3.671   7.821   7.276
  Start of MODEL   13
 9134    HG   SER  97           HG       SER  97   1.616   9.068   8.516
  Start of MODEL   13
 9135    H    SER  97           HN       SER  97   0.454   6.364   8.588
  Start of MODEL   13
 9136    HA   ILE  98           HA       ILE  98   4.671   3.996   8.866
  Start of MODEL   13
 9137    HB   ILE  98           HB       ILE  98   3.310   2.300   7.693
  Start of MODEL   13
 9138   HD11  ILE  98          HD11      ILE  98   7.148   2.086   7.463
  Start of MODEL   13
 9139   HD13  ILE  98          HD12      ILE  98   6.512   0.880   6.343
  Start of MODEL   13
 9140   HD12  ILE  98          HD13      ILE  98   7.141   0.379   7.912
  Start of MODEL   13
 9141    H    ILE  98           HN       ILE  98   3.925   5.153   6.315
  Start of MODEL   13
 9142    HA   MET  99           HA       MET  99   8.373   5.213   6.968
  Start of MODEL   13
 9143    HB3  MET  99           HB2      MET  99   8.927   5.649   9.910
  Start of MODEL   13
 9144    HB2  MET  99           HB3      MET  99   8.136   6.828   8.868
  Start of MODEL   13
 9145    HG2  MET  99           HG2      MET  99  10.932   5.761   8.615
  Start of MODEL   13
 9146    HG3  MET  99           HG3      MET  99  10.153   6.786   7.421
  Start of MODEL   13
 9147    HE2  MET  99           HE1      MET  99  12.588   9.346   8.745
  Start of MODEL   13
 9148    HE1  MET  99           HE2      MET  99  11.789   8.562   7.364
  Start of MODEL   13
 9149    HE3  MET  99           HE3      MET  99  12.860   7.628   8.405
  Start of MODEL   13
 9150    H    MET  99           HN       MET  99   6.724   4.428   9.246
  Start of MODEL   13
 9151    HA   ALA 100           HA       ALA 100  10.765   1.752   8.048
  Start of MODEL   13
 9152    HB2  ALA 100           HB1      ALA 100  10.692   0.195   6.157
  Start of MODEL   13
 9153    HB1  ALA 100           HB2      ALA 100  10.029   1.469   5.136
  Start of MODEL   13
 9154    HB3  ALA 100           HB3      ALA 100   9.097   0.861   6.500
  Start of MODEL   13
 9155    H    ALA 100           HN       ALA 100   9.908   3.913   6.275
  Start of MODEL   13
 9156    HA   ALA 101           HA       ALA 101  14.537   3.016   6.353
  Start of MODEL   13
 9157    HB1  ALA 101           HB1      ALA 101  15.218   1.128   8.606
  Start of MODEL   13
 9158    HB3  ALA 101           HB2      ALA 101  14.938   2.862   8.762
  Start of MODEL   13
 9159    HB2  ALA 101           HB3      ALA 101  16.326   2.274   7.847
  Start of MODEL   13
 9160    H    ALA 101           HN       ALA 101  12.854   1.216   7.905
  Start of MODEL   13
 9161    HA   PHE 102           HA       PHE 102  16.125  -0.608   4.357
  Start of MODEL   13
 9162    HB3  PHE 102           HB2      PHE 102  15.971  -0.106   1.889
  Start of MODEL   13
 9163    HB2  PHE 102           HB3      PHE 102  15.473   1.524   2.304
  Start of MODEL   13
 9164    HD1  PHE 102           HD1      PHE 102  14.482  -2.015   2.424
  Start of MODEL   13
 9165    HD2  PHE 102           HD2      PHE 102  13.275   2.017   2.986
  Start of MODEL   13
 9166    HE1  PHE 102           HE1      PHE 102  12.138  -2.735   2.535
  Start of MODEL   13
 9167    HE2  PHE 102           HE2      PHE 102  10.933   1.300   3.099
  Start of MODEL   13
 9168    HZ   PHE 102           HZ       PHE 102  10.367  -1.109   2.859
  Start of MODEL   13
 9169    H    PHE 102           HN       PHE 102  16.085   2.231   4.911
  Start of MODEL   13
 9170    HA   MET 103           HA       MET 103  20.124   0.823   3.471
  Start of MODEL   13
 9171    HB3  MET 103           HB2      MET 103  20.614   0.181   5.738
  Start of MODEL   13
 9172    HB2  MET 103           HB3      MET 103  21.826  -0.561   4.711
  Start of MODEL   13
 9173    HG2  MET 103           HG2      MET 103  19.455  -1.967   5.923
  Start of MODEL   13
 9174    HG3  MET 103           HG3      MET 103  20.644  -2.702   4.853
  Start of MODEL   13
 9175    HE3  MET 103           HE1      MET 103  21.384  -0.040   7.703
  Start of MODEL   13
 9176    HE2  MET 103           HE2      MET 103  21.652  -1.105   9.082
  Start of MODEL   13
 9177    HE1  MET 103           HE3      MET 103  20.051  -0.994   8.351
  Start of MODEL   13
 9178    H    MET 103           HN       MET 103  18.126  -1.118   4.380
  Start of MODEL   13
 9179    HA   ASP 104           HA       ASP 104  20.603  -2.118   0.234
  Start of MODEL   13
 9180    HB3  ASP 104           HB2      ASP 104  20.050   0.558  -1.059
  Start of MODEL   13
 9181    HB2  ASP 104           HB3      ASP 104  18.935  -0.793  -0.915
  Start of MODEL   13
 9182    H    ASP 104           HN       ASP 104  20.246   0.557   1.391
  Start of MODEL   13
 9183    HA   ASN 105           HA       ASN 105  24.799  -1.215   0.177
  Start of MODEL   13
 9184    HB3  ASN 105           HB2      ASN 105  24.637  -3.768  -1.442
  Start of MODEL   13
 9185    HB2  ASN 105           HB3      ASN 105  24.736  -3.707   0.313
  Start of MODEL   13
 9186   HD21  ASN 105          HD21      ASN 105  26.491  -3.530  -2.648
  Start of MODEL   13
 9187   HD22  ASN 105          HD22      ASN 105  28.047  -3.327  -1.932
  Start of MODEL   13
 9188    H    ASN 105           HN       ASN 105  22.508  -2.760  -0.472
  Start of MODEL   13
 9189    HA   PRO 106           HA       PRO 106  24.668   1.112  -3.609
  Start of MODEL   13
 9190    HB3  PRO 106           HB2      PRO 106  25.555   2.928  -2.587
  Start of MODEL   13
 9191    HB2  PRO 106           HB3      PRO 106  27.075   2.364  -3.268
  Start of MODEL   13
 9192    HG2  PRO 106           HG2      PRO 106  27.797   1.437  -1.305
  Start of MODEL   13
 9193    HG3  PRO 106           HG3      PRO 106  26.715   2.645  -0.598
  Start of MODEL   13
 9194    HD2  PRO 106           HD2      PRO 106  26.491  -0.035  -0.152
  Start of MODEL   13
 9195    HD3  PRO 106           HD3      PRO 106  25.117   1.084  -0.079
  Start of MODEL   13
 9196    HA   PHE 107           HA       PHE 107  27.226  -0.892  -6.355
  Start of MODEL   13
 9197    HB3  PHE 107           HB2      PHE 107  27.540   0.430  -8.456
  Start of MODEL   13
 9198    HB2  PHE 107           HB3      PHE 107  26.912   1.831  -7.563
  Start of MODEL   13
 9199    HD1  PHE 107           HD1      PHE 107  24.691   2.343  -7.639
  Start of MODEL   13
 9200    HD2  PHE 107           HD2      PHE 107  25.941  -1.631  -8.478
  Start of MODEL   13
 9201    HE1  PHE 107           HE1      PHE 107  22.375   1.743  -8.207
  Start of MODEL   13
 9202    HE2  PHE 107           HE2      PHE 107  23.636  -2.243  -9.049
  Start of MODEL   13
 9203    HZ   PHE 107           HZ       PHE 107  21.843  -0.556  -8.916
  Start of MODEL   13
 9204    H    PHE 107           HN       PHE 107  25.996   1.494  -5.446
  Start of MODEL   14
 9205    H1   ASP   1           H        ASP   1 -30.177   1.603  -3.388
  Start of MODEL   14
 9206    H2   ASP   1           H2       ASP   1 -31.016   2.406  -4.583
  Start of MODEL   14
 9207    H3   ASP   1           H3       ASP   1 -29.442   1.902  -4.886
  Start of MODEL   14
 9208    HA   ASP   1           HA       ASP   1 -31.811   0.187  -4.512
  Start of MODEL   14
 9209    HB3  ASP   1           HB2      ASP   1 -31.706   1.334  -6.703
  Start of MODEL   14
 9210    HB2  ASP   1           HB3      ASP   1 -31.447  -0.397  -6.884
  Start of MODEL   14
 9211    HA   ASP   2           HA       ASP   2 -28.248  -2.416  -3.807
  Start of MODEL   14
 9212    HB3  ASP   2           HB2      ASP   2 -26.530  -1.844  -2.065
  Start of MODEL   14
 9213    HB2  ASP   2           HB3      ASP   2 -27.405  -0.350  -1.768
  Start of MODEL   14
 9214    H    ASP   2           HN       ASP   2 -29.710  -0.111  -2.746
  Start of MODEL   14
 9215    HA   ASP   3           HA       ASP   3 -30.428  -4.462  -0.688
  Start of MODEL   14
 9216    HB3  ASP   3           HB2      ASP   3 -29.651  -6.310  -2.249
  Start of MODEL   14
 9217    HB2  ASP   3           HB3      ASP   3 -29.917  -6.798  -0.584
  Start of MODEL   14
 9218    H    ASP   3           HN       ASP   3 -28.306  -4.215  -2.579
  Start of MODEL   14
 9219    HA   ASP   4           HA       ASP   4 -27.156  -4.134   2.437
  Start of MODEL   14
 9220    HB3  ASP   4           HB2      ASP   4 -25.180  -5.035   1.337
  Start of MODEL   14
 9221    HB2  ASP   4           HB3      ASP   4 -24.731  -3.685   2.361
  Start of MODEL   14
 9222    H    ASP   4           HN       ASP   4 -27.146  -3.697  -0.456
  Start of MODEL   14
 9223    HA   ASP   5           HA       ASP   5 -27.530   0.203   2.833
  Start of MODEL   14
 9224    HB3  ASP   5           HB2      ASP   5 -27.799  -1.053   5.578
  Start of MODEL   14
 9225    HB2  ASP   5           HB3      ASP   5 -29.109  -0.687   4.467
  Start of MODEL   14
 9226    H    ASP   5           HN       ASP   5 -26.960  -2.507   3.840
  Start of MODEL   14
 9227    HA   VAL   6           HA       VAL   6 -23.801   0.497   5.516
  Start of MODEL   14
 9228    HB   VAL   6           HB       VAL   6 -22.025  -1.259   6.052
  Start of MODEL   14
 9229    H    VAL   6           HN       VAL   6 -25.007  -1.638   4.053
  Start of MODEL   14
 9230    HA   SER   7           HA       SER   7 -21.283   1.186   2.089
  Start of MODEL   14
 9231    HB3  SER   7           HB2      SER   7 -21.582   3.779   1.708
  Start of MODEL   14
 9232    HB2  SER   7           HB3      SER   7 -22.863   3.495   2.947
  Start of MODEL   14
 9233    HG   SER   7           HG       SER   7 -23.061   1.711   1.000
  Start of MODEL   14
 9234    H    SER   7           HN       SER   7 -23.113   1.910   4.207
  Start of MODEL   14
 9235    HA   PHE   8           HA       PHE   8 -18.481   2.249   5.363
  Start of MODEL   14
 9236    HB3  PHE   8           HB2      PHE   8 -16.640   0.689   5.376
  Start of MODEL   14
 9237    HB2  PHE   8           HB3      PHE   8 -17.071   0.092   3.786
  Start of MODEL   14
 9238    HD1  PHE   8           HD1      PHE   8 -18.016  -2.002   3.752
  Start of MODEL   14
 9239    HD2  PHE   8           HD2      PHE   8 -18.780   0.556   7.067
  Start of MODEL   14
 9240    HE1  PHE   8           HE1      PHE   8 -19.425  -3.726   4.754
  Start of MODEL   14
 9241    HE2  PHE   8           HE2      PHE   8 -20.188  -1.176   8.080
  Start of MODEL   14
 9242    HZ   PHE   8           HZ       PHE   8 -20.364  -3.423   6.957
  Start of MODEL   14
 9243    H    PHE   8           HN       PHE   8 -19.422   0.748   3.083
  Start of MODEL   14
 9244    HA   CYS   9           HA       CYS   9 -16.009   4.664   2.679
  Start of MODEL   14
 9245    HB3  CYS   9           HB2      CYS   9 -15.140   6.576   3.932
  Start of MODEL   14
 9246    HB2  CYS   9           HB3      CYS   9 -15.477   5.760   5.454
  Start of MODEL   14
 9247    H    CYS   9           HN       CYS   9 -16.989   3.823   5.262
  Start of MODEL   14
 9248    HA   ALA  10           HA       ALA  10 -12.288   2.696   3.376
  Start of MODEL   14
 9249    HB2  ALA  10           HB1      ALA  10 -10.410   3.469   2.084
  Start of MODEL   14
 9250    HB1  ALA  10           HB2      ALA  10 -11.090   5.087   2.021
  Start of MODEL   14
 9251    HB3  ALA  10           HB3      ALA  10 -11.912   3.750   1.195
  Start of MODEL   14
 9252    H    ALA  10           HN       ALA  10 -13.427   5.344   2.966
  Start of MODEL   14
 9253    HA   SER  11           HA       SER  11  -9.776   4.407   6.435
  Start of MODEL   14
 9254    HB3  SER  11           HB2      SER  11 -10.550   1.631   7.427
  Start of MODEL   14
 9255    HB2  SER  11           HB3      SER  11 -11.522   3.071   7.706
  Start of MODEL   14
 9256    HG   SER  11           HG       SER  11  -9.873   2.246   9.325
  Start of MODEL   14
 9257    H    SER  11           HN       SER  11 -11.057   2.253   4.940
  Start of MODEL   14
 9258    HA   VAL  12           HA       VAL  12  -6.336   1.980   5.227
  Start of MODEL   14
 9259    HB   VAL  12           HB       VAL  12  -5.364   4.857   5.429
  Start of MODEL   14
 9260    H    VAL  12           HN       VAL  12  -7.560   4.203   6.698
  Start of MODEL   14
 9261    HA   GLN  13           HA       GLN  13  -3.980   1.771   8.847
  Start of MODEL   14
 9262    HB3  GLN  13           HB2      GLN  13  -4.252  -0.454   9.888
  Start of MODEL   14
 9263    HB2  GLN  13           HB3      GLN  13  -5.147  -0.990   8.480
  Start of MODEL   14
 9264    HG2  GLN  13           HG2      GLN  13  -5.992   1.203  10.372
  Start of MODEL   14
 9265    HG3  GLN  13           HG3      GLN  13  -6.872   0.689   8.936
  Start of MODEL   14
 9266   HE21  GLN  13          HE21      GLN  13  -7.636   0.709  11.739
  Start of MODEL   14
 9267   HE22  GLN  13          HE22      GLN  13  -8.115  -0.898  12.124
  Start of MODEL   14
 9268    H    GLN  13           HN       GLN  13  -5.373   0.653   6.541
  Start of MODEL   14
 9269    HA   LEU  14           HA       LEU  14  -0.755  -0.198   6.702
  Start of MODEL   14
 9270    HB3  LEU  14           HB2      LEU  14   1.354   1.307   7.012
  Start of MODEL   14
 9271    HB2  LEU  14           HB3      LEU  14   0.218   2.484   7.641
  Start of MODEL   14
 9272    HG   LEU  14           HG       LEU  14  -1.055   2.218   5.425
  Start of MODEL   14
 9273   HD11  LEU  14          HD11      LEU  14   1.773   3.254   5.332
  Start of MODEL   14
 9274   HD13  LEU  14          HD12      LEU  14   0.340   4.161   5.857
  Start of MODEL   14
 9275   HD12  LEU  14          HD13      LEU  14   0.483   3.617   4.189
  Start of MODEL   14
 9276   HD22  LEU  14          HD21      LEU  14   0.201   1.330   3.569
  Start of MODEL   14
 9277   HD21  LEU  14          HD22      LEU  14  -0.016   0.094   4.821
  Start of MODEL   14
 9278   HD23  LEU  14          HD23      LEU  14   1.533   0.920   4.649
  Start of MODEL   14
 9279    H    LEU  14           HN       LEU  14  -1.873   1.772   8.510
  Start of MODEL   14
 9280    HA   HIS  15           HA       HIS  15   1.403  -1.727  10.184
  Start of MODEL   14
 9281    HB3  HIS  15           HB2      HIS  15   1.629  -4.139   9.662
  Start of MODEL   14
 9282    HB2  HIS  15           HB3      HIS  15   1.415  -3.797   7.954
  Start of MODEL   14
 9283    HD1  HIS  15           HD1      HIS  15  -0.454  -4.715  10.917
  Start of MODEL   14
 9284    HD2  HIS  15           HD2      HIS  15  -1.313  -2.865   7.305
  Start of MODEL   14
 9285    HE1  HIS  15           HE1      HIS  15  -2.946  -4.899  10.628
  Start of MODEL   14
 9286    HE2  HIS  15           HE2      HIS  15  -3.305  -4.138   8.248
  Start of MODEL   14
 9287    H    HIS  15           HN       HIS  15   1.280  -1.207   7.302
  Start of MODEL   14
 9288    HA   THR  16           HA       THR  16   5.565  -1.073   9.381
  Start of MODEL   14
 9289    HB   THR  16           HB       THR  16   5.855  -3.068  11.646
  Start of MODEL   14
 9290    HG1  THR  16           HG1      THR  16   4.582  -0.727  11.582
  Start of MODEL   14
 9291   HG21  THR  16          HG21      THR  16   7.551  -0.710  10.785
  Start of MODEL   14
 9292   HG23  THR  16          HG22      THR  16   7.945  -2.401  10.492
  Start of MODEL   14
 9293   HG22  THR  16          HG23      THR  16   7.887  -1.782  12.145
  Start of MODEL   14
 9294    H    THR  16           HN       THR  16   3.498  -2.274  10.839
  Start of MODEL   14
 9295    HA   ALA  17           HA       ALA  17   6.461  -4.054   6.410
  Start of MODEL   14
 9296    HB3  ALA  17           HB1      ALA  17   8.536  -3.571   5.340
  Start of MODEL   14
 9297    HB2  ALA  17           HB2      ALA  17   9.104  -2.676   6.752
  Start of MODEL   14
 9298    HB1  ALA  17           HB3      ALA  17   7.769  -2.042   5.792
  Start of MODEL   14
 9299    H    ALA  17           HN       ALA  17   6.968  -1.858   7.994
  Start of MODEL   14
 9300    HA   VAL  18           HA       VAL  18   8.539  -7.063   8.628
  Start of MODEL   14
 9301    HB   VAL  18           HB       VAL  18   8.040  -9.343   7.725
  Start of MODEL   14
 9302    H    VAL  18           HN       VAL  18   7.312  -6.040   6.220
  Start of MODEL   14
 9303    HA   GLU  19           HA       GLU  19  12.339  -7.084   6.700
  Start of MODEL   14
 9304    HB3  GLU  19           HB2      GLU  19  14.036  -7.614   8.362
  Start of MODEL   14
 9305    HB2  GLU  19           HB3      GLU  19  12.816  -8.326   9.406
  Start of MODEL   14
 9306    HG2  GLU  19           HG2      GLU  19  12.920  -5.434   8.580
  Start of MODEL   14
 9307    HG3  GLU  19           HG3      GLU  19  11.756  -6.163   9.681
  Start of MODEL   14
 9308    H    GLU  19           HN       GLU  19  10.483  -7.779   8.771
  Start of MODEL   14
 9309    HA   MET  20           HA       MET  20  13.179 -11.240   5.674
  Start of MODEL   14
 9310    HB3  MET  20           HB2      MET  20  11.936 -11.961   3.698
  Start of MODEL   14
 9311    HB2  MET  20           HB3      MET  20  11.425 -10.317   3.366
  Start of MODEL   14
 9312    HG2  MET  20           HG2      MET  20  10.595 -11.970   5.741
  Start of MODEL   14
 9313    HG3  MET  20           HG3      MET  20  10.068 -10.325   5.393
  Start of MODEL   14
 9314    HE1  MET  20           HE1      MET  20   9.724 -10.509   2.141
  Start of MODEL   14
 9315    HE3  MET  20           HE2      MET  20   8.610  -9.681   3.227
  Start of MODEL   14
 9316    HE2  MET  20           HE3      MET  20   7.995 -10.855   2.065
  Start of MODEL   14
 9317    H    MET  20           HN       MET  20  12.521  -8.453   5.091
  Start of MODEL   14
 9318    HA   HIS  21           HA       HIS  21  16.243 -10.521   2.606
  Start of MODEL   14
 9319    HB3  HIS  21           HB2      HIS  21  16.387 -11.675   0.422
  Start of MODEL   14
 9320    HB2  HIS  21           HB3      HIS  21  14.744 -12.246   0.597
  Start of MODEL   14
 9321    HD1  HIS  21           HD1      HIS  21  18.105 -12.655   2.309
  Start of MODEL   14
 9322    HD2  HIS  21           HD2      HIS  21  14.531 -14.693   1.748
  Start of MODEL   14
 9323    HE1  HIS  21           HE1      HIS  21  18.466 -14.898   3.268
  Start of MODEL   14
 9324    HE2  HIS  21           HE2      HIS  21  16.315 -16.127   2.970
  Start of MODEL   14
 9325    H    HIS  21           HN       HIS  21  13.762 -11.905   2.990
  Start of MODEL   14
 9326    HA   HIS  22           HA       HIS  22  13.730  -7.824  -0.049
  Start of MODEL   14
 9327    HB3  HIS  22           HB2      HIS  22  11.778  -8.334  -1.592
  Start of MODEL   14
 9328    HB2  HIS  22           HB3      HIS  22  11.725  -9.949  -0.898
  Start of MODEL   14
 9329    HD1  HIS  22           HD1      HIS  22  12.173 -10.633  -3.522
  Start of MODEL   14
 9330    HD2  HIS  22           HD2      HIS  22  15.334  -8.881  -1.476
  Start of MODEL   14
 9331    HE1  HIS  22           HE1      HIS  22  14.205 -11.061  -4.908
  Start of MODEL   14
 9332    HE2  HIS  22           HE2      HIS  22  16.058  -9.846  -3.737
  Start of MODEL   14
 9333    H    HIS  22           HN       HIS  22  13.083 -10.374   1.227
  Start of MODEL   14
 9334    HA   TRP  23           HA       TRP  23  10.822  -6.650   2.765
  Start of MODEL   14
 9335    HB3  TRP  23           HB2      TRP  23  10.567  -4.154   2.731
  Start of MODEL   14
 9336    HB2  TRP  23           HB3      TRP  23  11.434  -4.171   1.198
  Start of MODEL   14
 9337    HD1  TRP  23           HD1      TRP  23  14.010  -5.192   1.313
  Start of MODEL   14
 9338    HE1  TRP  23           HE1      TRP  23  15.744  -5.005   3.218
  Start of MODEL   14
 9339    HE3  TRP  23           HE3      TRP  23  10.868  -4.006   5.135
  Start of MODEL   14
 9340    HZ2  TRP  23           HZ2      TRP  23  15.756  -4.439   5.950
  Start of MODEL   14
 9341    HZ3  TRP  23           HZ3      TRP  23  11.816  -3.647   7.376
  Start of MODEL   14
 9342    HH2  TRP  23           HH2      TRP  23  14.214  -3.860   7.771
  Start of MODEL   14
 9343    H    TRP  23           HN       TRP  23  11.875  -6.294   0.076
  Start of MODEL   14
 9344    HA   CYS  24           HA       CYS  24   6.822  -5.828   1.216
  Start of MODEL   14
 9345    HB3  CYS  24           HB2      CYS  24   6.858  -7.989   3.336
  Start of MODEL   14
 9346    HB2  CYS  24           HB3      CYS  24   6.994  -8.225   1.602
  Start of MODEL   14
 9347    H    CYS  24           HN       CYS  24   8.791  -6.183   3.336
  Start of MODEL   14
 9348    HA   ILE  25           HA       ILE  25   5.222  -3.465   4.605
  Start of MODEL   14
 9349    HB   ILE  25           HB       ILE  25   4.593  -1.809   2.136
  Start of MODEL   14
 9350   HD12  ILE  25          HD11      ILE  25   7.755   0.216   2.646
  Start of MODEL   14
 9351   HD11  ILE  25          HD12      ILE  25   6.188   0.659   3.322
  Start of MODEL   14
 9352   HD13  ILE  25          HD13      ILE  25   6.303   0.113   1.647
  Start of MODEL   14
 9353    H    ILE  25           HN       ILE  25   5.609  -4.139   1.768
  Start of MODEL   14
 9354    HA   PRO  26           HA       PRO  26   1.214  -5.393   3.564
  Start of MODEL   14
 9355    HB3  PRO  26           HB2      PRO  26   1.017  -6.920   5.240
  Start of MODEL   14
 9356    HB2  PRO  26           HB3      PRO  26   0.822  -5.638   6.434
  Start of MODEL   14
 9357    HG2  PRO  26           HG2      PRO  26   2.890  -6.355   7.136
  Start of MODEL   14
 9358    HG3  PRO  26           HG3      PRO  26   3.285  -7.047   5.552
  Start of MODEL   14
 9359    HD2  PRO  26           HD2      PRO  26   3.521  -4.217   6.499
  Start of MODEL   14
 9360    HD3  PRO  26           HD3      PRO  26   4.620  -5.179   5.481
  Start of MODEL   14
 9361    HA   PHE  27           HA       PHE  27  -1.288  -2.237   5.253
  Start of MODEL   14
 9362    HB3  PHE  27           HB2      PHE  27  -0.416  -1.086   3.298
  Start of MODEL   14
 9363    HB2  PHE  27           HB3      PHE  27  -2.123  -0.739   3.487
  Start of MODEL   14
 9364    HD1  PHE  27           HD1      PHE  27  -3.765  -1.644   1.918
  Start of MODEL   14
 9365    HD2  PHE  27           HD2      PHE  27   0.412  -2.195   1.371
  Start of MODEL   14
 9366    HE1  PHE  27           HE1      PHE  27  -4.159  -2.230  -0.430
  Start of MODEL   14
 9367    HE2  PHE  27           HE2      PHE  27   0.029  -2.779  -0.979
  Start of MODEL   14
 9368    HZ   PHE  27           HZ       PHE  27  -2.261  -2.798  -1.885
  Start of MODEL   14
 9369    H    PHE  27           HN       PHE  27  -0.646  -4.310   3.306
  Start of MODEL   14
 9370    HA   SER  28           HA       SER  28  -5.339  -3.738   4.485
  Start of MODEL   14
 9371    HB3  SER  28           HB2      SER  28  -6.440  -3.722   6.660
  Start of MODEL   14
 9372    HB2  SER  28           HB3      SER  28  -5.287  -2.538   7.268
  Start of MODEL   14
 9373    HG   SER  28           HG       SER  28  -5.119  -5.205   7.126
  Start of MODEL   14
 9374    H    SER  28           HN       SER  28  -3.460  -1.768   5.553
  Start of MODEL   14
 9375    HA   VAL  29           HA       VAL  29  -7.628  -0.042   4.261
  Start of MODEL   14
 9376    HB   VAL  29           HB       VAL  29  -6.217   0.659   2.361
  Start of MODEL   14
 9377    H    VAL  29           HN       VAL  29  -6.673  -2.579   3.197
  Start of MODEL   14
 9378    HA   ASP  30           HA       ASP  30 -11.250  -2.092   3.214
  Start of MODEL   14
 9379    HB3  ASP  30           HB2      ASP  30 -10.879  -2.752   5.628
  Start of MODEL   14
 9380    HB2  ASP  30           HB3      ASP  30 -12.549  -2.706   5.087
  Start of MODEL   14
 9381    H    ASP  30           HN       ASP  30  -9.644  -0.247   4.816
  Start of MODEL   14
 9382    HA2  GLY  31           HA2      GLY  31 -14.681   0.680   3.323
  Start of MODEL   14
 9383    H    GLY  31           HN       GLY  31 -13.242  -1.571   2.625
  Start of MODEL   14
 9384    HA3  GLY  31           HA1      GLY  31 -13.682   1.089   1.924
  Start of MODEL   14
 9385    HA   GLN  32           HA       GLN  32 -16.933  -1.554   0.461
  Start of MODEL   14
 9386    HB3  GLN  32           HB2      GLN  32 -18.923   0.732   0.870
  Start of MODEL   14
 9387    HB2  GLN  32           HB3      GLN  32 -18.600  -0.507   2.045
  Start of MODEL   14
 9388    HG2  GLN  32           HG2      GLN  32 -19.389  -2.200   0.407
  Start of MODEL   14
 9389    HG3  GLN  32           HG3      GLN  32 -20.589  -1.082   1.040
  Start of MODEL   14
 9390   HE21  GLN  32          HE21      GLN  32 -20.675  -2.696  -1.333
  Start of MODEL   14
 9391   HE22  GLN  32          HE22      GLN  32 -20.882  -1.593  -2.639
  Start of MODEL   14
 9392    H    GLN  32           HN       GLN  32 -16.402   1.040   1.647
  Start of MODEL   14
 9393    HA   PRO  33           HA       PRO  33 -16.877   0.965  -3.470
  Start of MODEL   14
 9394    HB3  PRO  33           HB2      PRO  33 -17.578   3.141  -3.759
  Start of MODEL   14
 9395    HB2  PRO  33           HB3      PRO  33 -16.120   3.728  -2.953
  Start of MODEL   14
 9396    HG2  PRO  33           HG2      PRO  33 -17.621   4.373  -1.327
  Start of MODEL   14
 9397    HG3  PRO  33           HG3      PRO  33 -18.812   3.160  -1.829
  Start of MODEL   14
 9398    HD2  PRO  33           HD2      PRO  33 -16.383   2.831  -0.110
  Start of MODEL   14
 9399    HD3  PRO  33           HD3      PRO  33 -18.020   2.189   0.127
  Start of MODEL   14
 9400    HA   ALA  34           HA       ALA  34 -12.646   0.130  -2.781
  Start of MODEL   14
 9401    HB1  ALA  34           HB1      ALA  34 -12.979  -0.080  -5.770
  Start of MODEL   14
 9402    HB3  ALA  34           HB2      ALA  34 -13.201  -1.380  -4.590
  Start of MODEL   14
 9403    HB2  ALA  34           HB3      ALA  34 -11.601  -0.670  -4.827
  Start of MODEL   14
 9404    H    ALA  34           HN       ALA  34 -14.996   0.252  -4.224
  Start of MODEL   14
 9405    HA   PRO  35           HA       PRO  35 -11.285   4.336  -3.393
  Start of MODEL   14
 9406    HB3  PRO  35           HB2      PRO  35 -11.034   4.275  -1.081
  Start of MODEL   14
 9407    HB2  PRO  35           HB3      PRO  35  -9.344   4.317  -1.596
  Start of MODEL   14
 9408    HG2  PRO  35           HG2      PRO  35  -9.069   2.033  -1.290
  Start of MODEL   14
 9409    HG3  PRO  35           HG3      PRO  35 -10.234   2.378   0.001
  Start of MODEL   14
 9410    HD2  PRO  35           HD2      PRO  35 -10.666   0.544  -1.973
  Start of MODEL   14
 9411    HD3  PRO  35           HD3      PRO  35 -11.971   1.417  -1.145
  Start of MODEL   14
 9412    HA   SER  36           HA       SER  36  -7.696   3.860  -5.883
  Start of MODEL   14
 9413    HB3  SER  36           HB2      SER  36  -7.088   6.011  -6.769
  Start of MODEL   14
 9414    HB2  SER  36           HB3      SER  36  -7.827   6.846  -5.403
  Start of MODEL   14
 9415    HG   SER  36           HG       SER  36  -9.457   5.173  -6.938
  Start of MODEL   14
 9416    H    SER  36           HN       SER  36  -9.589   5.375  -4.332
  Start of MODEL   14
 9417    HA   LEU  37           HA       LEU  37  -4.888   4.452  -2.514
  Start of MODEL   14
 9418    HB3  LEU  37           HB2      LEU  37  -3.323   2.547  -2.396
  Start of MODEL   14
 9419    HB2  LEU  37           HB3      LEU  37  -3.918   1.966  -3.929
  Start of MODEL   14
 9420    HG   LEU  37           HG       LEU  37  -6.153   1.616  -2.872
  Start of MODEL   14
 9421   HD11  LEU  37          HD11      LEU  37  -3.868   0.255  -1.464
  Start of MODEL   14
 9422   HD13  LEU  37          HD12      LEU  37  -4.472  -0.153  -3.069
  Start of MODEL   14
 9423   HD12  LEU  37          HD13      LEU  37  -5.512  -0.363  -1.662
  Start of MODEL   14
 9424   HD23  LEU  37          HD21      LEU  37  -4.644   2.366  -0.379
  Start of MODEL   14
 9425   HD22  LEU  37          HD22      LEU  37  -6.235   1.615  -0.402
  Start of MODEL   14
 9426   HD21  LEU  37          HD23      LEU  37  -6.018   3.238  -1.070
  Start of MODEL   14
 9427    H    LEU  37           HN       LEU  37  -5.787   3.187  -4.968
  Start of MODEL   14
 9428    HA   ARG  38           HA       ARG  38  -1.446   5.983  -4.774
  Start of MODEL   14
 9429    HB3  ARG  38           HB2      ARG  38  -2.501   8.210  -3.014
  Start of MODEL   14
 9430    HB2  ARG  38           HB3      ARG  38  -3.004   7.900  -4.665
  Start of MODEL   14
 9431    HG2  ARG  38           HG2      ARG  38  -0.167   8.543  -3.922
  Start of MODEL   14
 9432    HG3  ARG  38           HG3      ARG  38  -0.881   8.545  -5.532
  Start of MODEL   14
 9433    HD2  ARG  38           HD2      ARG  38  -1.502  10.434  -3.267
  Start of MODEL   14
 9434    HD3  ARG  38           HD3      ARG  38  -0.631  10.818  -4.744
  Start of MODEL   14
 9435    HE   ARG  38           HE       ARG  38  -3.222   9.838  -5.336
  Start of MODEL   14
 9436   HH11  ARG  38          HH11      ARG  38  -1.530  12.752  -4.218
  Start of MODEL   14
 9437   HH12  ARG  38          HH12      ARG  38  -2.774  13.815  -4.645
  Start of MODEL   14
 9438   HH21  ARG  38          HH21      ARG  38  -4.958  11.319  -5.924
  Start of MODEL   14
 9439   HH22  ARG  38          HH22      ARG  38  -4.756  12.983  -5.642
  Start of MODEL   14
 9440    H    ARG  38           HN       ARG  38  -3.285   5.802  -2.471
  Start of MODEL   14
 9441    HA   TRP  39           HA       TRP  39   1.319   5.753  -1.374
  Start of MODEL   14
 9442    HB3  TRP  39           HB2      TRP  39   3.557   4.930  -2.187
  Start of MODEL   14
 9443    HB2  TRP  39           HB3      TRP  39   2.881   4.890  -3.807
  Start of MODEL   14
 9444    HD1  TRP  39           HD1      TRP  39   1.630   2.765  -4.513
  Start of MODEL   14
 9445    HE1  TRP  39           HE1      TRP  39   0.960   0.604  -3.351
  Start of MODEL   14
 9446    HE3  TRP  39           HE3      TRP  39   2.734   4.111   0.289
  Start of MODEL   14
 9447    HZ2  TRP  39           HZ2      TRP  39   0.878  -0.417  -0.671
  Start of MODEL   14
 9448    HZ3  TRP  39           HZ3      TRP  39   2.331   2.493   2.099
  Start of MODEL   14
 9449    HH2  TRP  39           HH2      TRP  39   1.428   0.283   1.638
  Start of MODEL   14
 9450    H    TRP  39           HN       TRP  39   0.664   5.758  -4.202
  Start of MODEL   14
 9451    HA   LEU  40           HA       LEU  40   3.514   9.402  -2.207
  Start of MODEL   14
 9452    HB3  LEU  40           HB2      LEU  40   2.195   9.880   0.470
  Start of MODEL   14
 9453    HB2  LEU  40           HB3      LEU  40   1.435  10.200  -1.076
  Start of MODEL   14
 9454    HG   LEU  40           HG       LEU  40   3.961  11.571  -0.238
  Start of MODEL   14
 9455   HD11  LEU  40          HD11      LEU  40   1.908  12.079  -2.360
  Start of MODEL   14
 9456   HD13  LEU  40          HD12      LEU  40   3.574  11.544  -2.594
  Start of MODEL   14
 9457   HD12  LEU  40          HD13      LEU  40   3.248  13.157  -1.966
  Start of MODEL   14
 9458   HD23  LEU  40          HD21      LEU  40   1.104  12.503   0.063
  Start of MODEL   14
 9459   HD22  LEU  40          HD22      LEU  40   2.543  13.481   0.345
  Start of MODEL   14
 9460   HD21  LEU  40          HD23      LEU  40   2.202  12.094   1.383
  Start of MODEL   14
 9461    H    LEU  40           HN       LEU  40   2.050   7.522  -0.500
  Start of MODEL   14
 9462    HA   PHE  41           HA       PHE  41   6.589   8.377   0.702
  Start of MODEL   14
 9463    HB3  PHE  41           HB2      PHE  41   7.826   8.364  -2.060
  Start of MODEL   14
 9464    HB2  PHE  41           HB3      PHE  41   7.293   6.974  -1.119
  Start of MODEL   14
 9465    HD1  PHE  41           HD1      PHE  41  10.060   8.919  -2.046
  Start of MODEL   14
 9466    HD2  PHE  41           HD2      PHE  41   8.460   6.711   1.217
  Start of MODEL   14
 9467    HE1  PHE  41           HE1      PHE  41  12.302   8.767  -1.053
  Start of MODEL   14
 9468    HE2  PHE  41           HE2      PHE  41  10.697   6.549   2.204
  Start of MODEL   14
 9469    HZ   PHE  41           HZ       PHE  41  12.619   7.583   1.075
  Start of MODEL   14
 9470    H    PHE  41           HN       PHE  41   5.625   9.570  -1.774
  Start of MODEL   14
 9471    HA   ASN  42           HA       ASN  42   7.917  11.786   2.931
  Start of MODEL   14
 9472    HB3  ASN  42           HB2      ASN  42  10.019  11.564   0.762
  Start of MODEL   14
 9473    HB2  ASN  42           HB3      ASN  42   9.944  10.464   2.123
  Start of MODEL   14
 9474   HD21  ASN  42          HD21      ASN  42   9.224  12.482   4.101
  Start of MODEL   14
 9475   HD22  ASN  42          HD22      ASN  42  10.653  13.402   4.347
  Start of MODEL   14
 9476    H    ASN  42           HN       ASN  42   6.966   9.977   1.973
  Start of MODEL   14
 9477    HA2  GLY  43           HA2      GLY  43   4.971  14.416   0.440
  Start of MODEL   14
 9478    H    GLY  43           HN       GLY  43   5.919  12.300   0.989
  Start of MODEL   14
 9479    HA3  GLY  43           HA1      GLY  43   6.593  15.084   0.352
  Start of MODEL   14
 9480    HA   SER  44           HA       SER  44   6.246  13.707  -3.887
  Start of MODEL   14
 9481    HB3  SER  44           HB2      SER  44   8.644  13.864  -3.784
  Start of MODEL   14
 9482    HB2  SER  44           HB3      SER  44   8.267  12.518  -4.855
  Start of MODEL   14
 9483    HG   SER  44           HG       SER  44   8.453  11.472  -2.444
  Start of MODEL   14
 9484    H    SER  44           HN       SER  44   7.230  12.569  -1.338
  Start of MODEL   14
 9485    HA   VAL  45           HA       VAL  45   3.857  10.297  -4.454
  Start of MODEL   14
 9486    HB   VAL  45           HB       VAL  45   4.166  11.463  -7.248
  Start of MODEL   14
 9487    H    VAL  45           HN       VAL  45   5.328  12.525  -5.367
  Start of MODEL   14
 9488    HA   LEU  46           HA       LEU  46   6.839   7.429  -5.649
  Start of MODEL   14
 9489    HB3  LEU  46           HB2      LEU  46   4.830   5.940  -3.975
  Start of MODEL   14
 9490    HB2  LEU  46           HB3      LEU  46   6.256   6.759  -3.372
  Start of MODEL   14
 9491    HG   LEU  46           HG       LEU  46   6.353   4.444  -5.292
  Start of MODEL   14
 9492   HD11  LEU  46          HD11      LEU  46   8.482   5.715  -3.586
  Start of MODEL   14
 9493   HD13  LEU  46          HD12      LEU  46   8.327   5.842  -5.337
  Start of MODEL   14
 9494   HD12  LEU  46          HD13      LEU  46   8.685   4.284  -4.594
  Start of MODEL   14
 9495   HD21  LEU  46          HD21      LEU  46   5.319   3.722  -3.237
  Start of MODEL   14
 9496   HD23  LEU  46          HD22      LEU  46   6.618   4.478  -2.311
  Start of MODEL   14
 9497   HD22  LEU  46          HD23      LEU  46   6.965   3.087  -3.362
  Start of MODEL   14
 9498    H    LEU  46           HN       LEU  46   4.284   8.213  -4.550
  Start of MODEL   14
 9499    HA   ASN  47           HA       ASN  47   4.436   5.814  -8.909
  Start of MODEL   14
 9500    HB3  ASN  47           HB2      ASN  47   5.890   5.689 -10.953
  Start of MODEL   14
 9501    HB2  ASN  47           HB3      ASN  47   7.216   6.329 -10.000
  Start of MODEL   14
 9502   HD21  ASN  47          HD21      ASN  47   4.231   7.069 -11.563
  Start of MODEL   14
 9503   HD22  ASN  47          HD22      ASN  47   4.390   8.784 -11.471
  Start of MODEL   14
 9504    H    ASN  47           HN       ASN  47   6.796   6.895  -7.665
  Start of MODEL   14
 9505    HA   GLU  48           HA       GLU  48   5.900   1.767  -8.089
  Start of MODEL   14
 9506    HB3  GLU  48           HB2      GLU  48   4.424   0.071  -9.129
  Start of MODEL   14
 9507    HB2  GLU  48           HB3      GLU  48   3.586   1.359  -9.979
  Start of MODEL   14
 9508    HG2  GLU  48           HG2      GLU  48   3.719   1.000  -7.001
  Start of MODEL   14
 9509    HG3  GLU  48           HG3      GLU  48   2.901   2.320  -7.838
  Start of MODEL   14
 9510    H    GLU  48           HN       GLU  48   4.162   3.644  -9.338
  Start of MODEL   14
 9511    HA   THR  49           HA       THR  49   7.984   0.850 -11.798
  Start of MODEL   14
 9512    HB   THR  49           HB       THR  49  10.352   0.421 -11.091
  Start of MODEL   14
 9513    HG1  THR  49           HG1      THR  49  10.118   1.112  -8.539
  Start of MODEL   14
 9514   HG23  THR  49          HG21      THR  49   9.585   2.732 -11.424
  Start of MODEL   14
 9515   HG22  THR  49          HG22      THR  49  10.748   2.650 -10.099
  Start of MODEL   14
 9516   HG21  THR  49          HG23      THR  49   9.025   2.791  -9.752
  Start of MODEL   14
 9517    H    THR  49           HN       THR  49   7.261   0.343  -9.008
  Start of MODEL   14
 9518    HA   SER  50           HA       SER  50   8.329  -3.513 -11.884
  Start of MODEL   14
 9519    HB3  SER  50           HB2      SER  50  10.163  -4.510 -13.045
  Start of MODEL   14
 9520    HB2  SER  50           HB3      SER  50  11.245  -3.199 -12.565
  Start of MODEL   14
 9521    HG   SER  50           HG       SER  50   8.995  -3.082 -14.279
  Start of MODEL   14
 9522    H    SER  50           HN       SER  50   9.932  -1.160 -12.004
  Start of MODEL   14
 9523    HA   PHE  51           HA       PHE  51  11.184  -4.362  -8.356
  Start of MODEL   14
 9524    HB3  PHE  51           HB2      PHE  51  12.946  -3.061  -7.257
  Start of MODEL   14
 9525    HB2  PHE  51           HB3      PHE  51  12.408  -1.611  -8.100
  Start of MODEL   14
 9526    HD1  PHE  51           HD1      PHE  51  13.836  -4.987  -8.634
  Start of MODEL   14
 9527    HD2  PHE  51           HD2      PHE  51  13.184  -1.106 -10.240
  Start of MODEL   14
 9528    HE1  PHE  51           HE1      PHE  51  15.322  -5.521 -10.514
  Start of MODEL   14
 9529    HE2  PHE  51           HE2      PHE  51  14.669  -1.632 -12.127
  Start of MODEL   14
 9530    HZ   PHE  51           HZ       PHE  51  15.737  -3.843 -12.267
  Start of MODEL   14
 9531    H    PHE  51           HN       PHE  51  10.473  -1.888  -9.783
  Start of MODEL   14
 9532    HA   ILE  52           HA       ILE  52   8.765  -1.991  -5.256
  Start of MODEL   14
 9533    HB   ILE  52           HB       ILE  52   8.657   0.727  -6.626
  Start of MODEL   14
 9534   HD13  ILE  52          HD11      ILE  52  10.567   2.380  -6.024
  Start of MODEL   14
 9535   HD12  ILE  52          HD12      ILE  52  11.846   1.829  -4.940
  Start of MODEL   14
 9536   HD11  ILE  52          HD13      ILE  52  10.208   2.086  -4.326
  Start of MODEL   14
 9537    H    ILE  52           HN       ILE  52   9.569  -1.287  -8.006
  Start of MODEL   14
 9538    HA   PHE  53           HA       PHE  53   4.814  -1.741  -7.186
  Start of MODEL   14
 9539    HB3  PHE  53           HB2      PHE  53   5.716  -3.254  -8.758
  Start of MODEL   14
 9540    HB2  PHE  53           HB3      PHE  53   4.256  -4.036  -8.164
  Start of MODEL   14
 9541    HD1  PHE  53           HD1      PHE  53   7.896  -4.165  -8.249
  Start of MODEL   14
 9542    HD2  PHE  53           HD2      PHE  53   4.374  -6.006  -6.774
  Start of MODEL   14
 9543    HE1  PHE  53           HE1      PHE  53   9.199  -6.157  -7.657
  Start of MODEL   14
 9544    HE2  PHE  53           HE2      PHE  53   5.671  -8.008  -6.175
  Start of MODEL   14
 9545    HZ   PHE  53           HZ       PHE  53   8.089  -8.078  -6.613
  Start of MODEL   14
 9546    H    PHE  53           HN       PHE  53   6.797  -3.001  -5.486
  Start of MODEL   14
 9547    HA   THR  54           HA       THR  54   2.310  -3.004  -3.919
  Start of MODEL   14
 9548    HB   THR  54           HB       THR  54   0.228  -2.044  -5.891
  Start of MODEL   14
 9549    HG1  THR  54           HG1      THR  54   1.718  -0.491  -5.872
  Start of MODEL   14
 9550   HG23  THR  54          HG21      THR  54  -0.583  -3.013  -3.776
  Start of MODEL   14
 9551   HG22  THR  54          HG22      THR  54  -0.902  -1.280  -3.860
  Start of MODEL   14
 9552   HG21  THR  54          HG23      THR  54   0.433  -1.880  -2.883
  Start of MODEL   14
 9553    H    THR  54           HN       THR  54   2.708  -2.142  -6.633
  Start of MODEL   14
 9554    HA   GLU  55           HA       GLU  55   0.716  -6.760  -5.519
  Start of MODEL   14
 9555    HB3  GLU  55           HB2      GLU  55   1.395  -8.595  -3.881
  Start of MODEL   14
 9556    HB2  GLU  55           HB3      GLU  55   2.368  -7.359  -3.095
  Start of MODEL   14
 9557    HG2  GLU  55           HG2      GLU  55   3.603  -6.993  -5.106
  Start of MODEL   14
 9558    HG3  GLU  55           HG3      GLU  55   3.637  -8.710  -4.683
  Start of MODEL   14
 9559    H    GLU  55           HN       GLU  55   2.014  -5.092  -3.543
  Start of MODEL   14
 9560    HA   PHE  56           HA       PHE  56  -2.641  -6.674  -2.764
  Start of MODEL   14
 9561    HB3  PHE  56           HB2      PHE  56  -4.754  -6.776  -4.098
  Start of MODEL   14
 9562    HB2  PHE  56           HB3      PHE  56  -3.784  -6.868  -5.561
  Start of MODEL   14
 9563    HD1  PHE  56           HD1      PHE  56  -4.732  -4.732  -2.743
  Start of MODEL   14
 9564    HD2  PHE  56           HD2      PHE  56  -2.790  -4.938  -6.514
  Start of MODEL   14
 9565    HE1  PHE  56           HE1      PHE  56  -4.679  -2.291  -2.840
  Start of MODEL   14
 9566    HE2  PHE  56           HE2      PHE  56  -2.725  -2.480  -6.623
  Start of MODEL   14
 9567    HZ   PHE  56           HZ       PHE  56  -3.669  -1.149  -4.784
  Start of MODEL   14
 9568    H    PHE  56           HN       PHE  56  -1.360  -6.856  -5.362
  Start of MODEL   14
 9569    HA   LEU  57           HA       LEU  57  -3.390 -10.915  -3.233
  Start of MODEL   14
 9570    HB3  LEU  57           HB2      LEU  57  -1.864 -10.765  -1.306
  Start of MODEL   14
 9571    HB2  LEU  57           HB3      LEU  57  -3.064 -12.007  -1.068
  Start of MODEL   14
 9572    HG   LEU  57           HG       LEU  57  -3.483  -9.355   0.216
  Start of MODEL   14
 9573   HD13  LEU  57          HD11      LEU  57  -5.304 -10.941   0.279
  Start of MODEL   14
 9574   HD12  LEU  57          HD12      LEU  57  -4.616 -10.755   1.897
  Start of MODEL   14
 9575   HD11  LEU  57          HD13      LEU  57  -4.232 -12.179   0.929
  Start of MODEL   14
 9576   HD23  LEU  57          HD21      LEU  57  -1.739 -11.577   1.265
  Start of MODEL   14
 9577   HD22  LEU  57          HD22      LEU  57  -2.260 -10.164   2.184
  Start of MODEL   14
 9578   HD21  LEU  57          HD23      LEU  57  -1.199  -9.967   0.788
  Start of MODEL   14
 9579    H    LEU  57           HN       LEU  57  -3.760  -8.375  -1.867
  Start of MODEL   14
 9580    HA   GLU  58           HA       GLU  58  -7.507 -11.422  -3.202
  Start of MODEL   14
 9581    HB3  GLU  58           HB2      GLU  58  -8.322 -13.771  -2.825
  Start of MODEL   14
 9582    HB2  GLU  58           HB3      GLU  58  -6.674 -14.162  -2.353
  Start of MODEL   14
 9583    HG2  GLU  58           HG2      GLU  58  -7.574 -13.093  -5.009
  Start of MODEL   14
 9584    HG3  GLU  58           HG3      GLU  58  -5.894 -13.344  -4.550
  Start of MODEL   14
 9585    H    GLU  58           HN       GLU  58  -5.023 -12.516  -2.463
  Start of MODEL   14
 9586    HA   PRO  59           HA       PRO  59  -9.060 -10.691   0.993
  Start of MODEL   14
 9587    HB3  PRO  59           HB2      PRO  59  -9.898  -8.584   0.680
  Start of MODEL   14
 9588    HB2  PRO  59           HB3      PRO  59 -11.200  -9.237  -0.315
  Start of MODEL   14
 9589    HG2  PRO  59           HG2      PRO  59 -10.135  -8.106  -1.997
  Start of MODEL   14
 9590    HG3  PRO  59           HG3      PRO  59  -8.586  -8.110  -1.138
  Start of MODEL   14
 9591    HD2  PRO  59           HD2      PRO  59  -9.821 -10.256  -2.819
  Start of MODEL   14
 9592    HD3  PRO  59           HD3      PRO  59  -8.136  -9.679  -2.737
  Start of MODEL   14
 9593    HA   ALA  60           HA       ALA  60 -12.301 -13.588   0.627
  Start of MODEL   14
 9594    HB2  ALA  60           HB1      ALA  60 -13.477 -13.916   2.775
  Start of MODEL   14
 9595    HB1  ALA  60           HB2      ALA  60 -12.797 -12.402   3.367
  Start of MODEL   14
 9596    HB3  ALA  60           HB3      ALA  60 -11.736 -13.761   3.010
  Start of MODEL   14
 9597    H    ALA  60           HN       ALA  60 -11.073 -11.372   2.007
  Start of MODEL   14
 9598    HA   ALA  61           HA       ALA  61 -15.612 -11.127  -0.686
  Start of MODEL   14
 9599    HB2  ALA  61           HB1      ALA  61 -17.302 -12.445  -1.850
  Start of MODEL   14
 9600    HB1  ALA  61           HB2      ALA  61 -16.695 -13.906  -1.068
  Start of MODEL   14
 9601    HB3  ALA  61           HB3      ALA  61 -15.676 -13.034  -2.217
  Start of MODEL   14
 9602    H    ALA  61           HN       ALA  61 -14.495 -13.676   0.061
  Start of MODEL   14
 9603    HA   ASN  62           HA       ASN  62 -18.235 -11.530   2.898
  Start of MODEL   14
 9604    HB3  ASN  62           HB2      ASN  62 -17.722 -12.816   5.014
  Start of MODEL   14
 9605    HB2  ASN  62           HB3      ASN  62 -16.246 -13.380   4.231
  Start of MODEL   14
 9606   HD21  ASN  62          HD21      ASN  62 -19.667 -13.735   4.426
  Start of MODEL   14
 9607   HD22  ASN  62          HD22      ASN  62 -19.766 -15.097   3.379
  Start of MODEL   14
 9608    H    ASN  62           HN       ASN  62 -15.466 -12.148   2.116
  Start of MODEL   14
 9609    HA   GLU  63           HA       GLU  63 -15.704  -8.465   4.857
  Start of MODEL   14
 9610    HB3  GLU  63           HB2      GLU  63 -13.725 -10.057   5.103
  Start of MODEL   14
 9611    HB2  GLU  63           HB3      GLU  63 -13.321  -8.351   5.197
  Start of MODEL   14
 9612    HG2  GLU  63           HG2      GLU  63 -12.926 -10.159   2.812
  Start of MODEL   14
 9613    HG3  GLU  63           HG3      GLU  63 -12.591  -8.435   2.836
  Start of MODEL   14
 9614    H    GLU  63           HN       GLU  63 -15.417 -10.143   2.496
  Start of MODEL   14
 9615    HA   THR  64           HA       THR  64 -14.648  -5.810   1.506
  Start of MODEL   14
 9616    HB   THR  64           HB       THR  64 -15.455  -3.412   2.246
  Start of MODEL   14
 9617    HG1  THR  64           HG1      THR  64 -15.707  -3.470   4.381
  Start of MODEL   14
 9618   HG22  THR  64          HG21      THR  64 -17.804  -4.071   1.896
  Start of MODEL   14
 9619   HG21  THR  64          HG22      THR  64 -17.364  -5.757   2.163
  Start of MODEL   14
 9620   HG23  THR  64          HG23      THR  64 -16.739  -4.895   0.759
  Start of MODEL   14
 9621    H    THR  64           HN       THR  64 -14.851  -6.280   4.371
  Start of MODEL   14
 9622    HA   VAL  65           HA       VAL  65 -10.979  -4.052   3.398
  Start of MODEL   14
 9623    HB   VAL  65           HB       VAL  65 -10.172  -6.720   4.538
  Start of MODEL   14
 9624    H    VAL  65           HN       VAL  65 -12.520  -6.540   3.162
  Start of MODEL   14
 9625    HA   ARG  66           HA       ARG  66  -8.701  -5.929   0.153
  Start of MODEL   14
 9626    HB3  ARG  66           HB2      ARG  66  -7.502  -4.183  -1.101
  Start of MODEL   14
 9627    HB2  ARG  66           HB3      ARG  66  -7.825  -3.029   0.173
  Start of MODEL   14
 9628    HG2  ARG  66           HG2      ARG  66  -9.872  -4.296  -1.638
  Start of MODEL   14
 9629    HG3  ARG  66           HG3      ARG  66 -10.237  -3.189  -0.314
  Start of MODEL   14
 9630    HD2  ARG  66           HD2      ARG  66 -10.218  -1.976  -2.420
  Start of MODEL   14
 9631    HD3  ARG  66           HD3      ARG  66  -8.879  -1.448  -1.411
  Start of MODEL   14
 9632    HE   ARG  66           HE       ARG  66  -7.972  -3.491  -3.069
  Start of MODEL   14
 9633   HH11  ARG  66          HH11      ARG  66  -8.968  -0.077  -3.341
  Start of MODEL   14
 9634   HH12  ARG  66          HH12      ARG  66  -8.197   0.180  -4.819
  Start of MODEL   14
 9635   HH21  ARG  66          HH21      ARG  66  -6.892  -3.105  -5.171
  Start of MODEL   14
 9636   HH22  ARG  66          HH22      ARG  66  -7.019  -1.574  -5.889
  Start of MODEL   14
 9637    H    ARG  66           HN       ARG  66  -9.419  -3.765   1.985
  Start of MODEL   14
 9638    HA   HIS  67           HA       HIS  67  -4.983  -5.941   2.471
  Start of MODEL   14
 9639    HB3  HIS  67           HB2      HIS  67  -4.271  -8.269   2.845
  Start of MODEL   14
 9640    HB2  HIS  67           HB3      HIS  67  -5.417  -8.813   1.627
  Start of MODEL   14
 9641    HD1  HIS  67           HD1      HIS  67  -5.206  -7.868   5.193
  Start of MODEL   14
 9642    HD2  HIS  67           HD2      HIS  67  -8.105  -8.777   2.371
  Start of MODEL   14
 9643    HE1  HIS  67           HE1      HIS  67  -7.304  -8.300   6.488
  Start of MODEL   14
 9644    HE2  HIS  67           HE2      HIS  67  -9.089  -8.672   4.713
  Start of MODEL   14
 9645    H    HIS  67           HN       HIS  67  -6.790  -6.965   0.384
  Start of MODEL   14
 9646    HA2  GLY  68           HA2      GLY  68  -1.894  -7.001  -0.416
  Start of MODEL   14
 9647    H    GLY  68           HN       GLY  68  -2.902  -5.663   1.889
  Start of MODEL   14
 9648    HA3  GLY  68           HA1      GLY  68  -2.165  -5.275  -0.639
  Start of MODEL   14
 9649    HA   CYS  69           HA       CYS  69   1.642  -4.894   1.336
  Start of MODEL   14
 9650    HB3  CYS  69           HB2      CYS  69   2.199  -7.440  -0.167
  Start of MODEL   14
 9651    HB2  CYS  69           HB3      CYS  69   2.064  -7.199   1.571
  Start of MODEL   14
 9652    H    CYS  69           HN       CYS  69   0.219  -5.902  -0.987
  Start of MODEL   14
 9653    HA   LEU  70           HA       LEU  70   3.550  -3.010  -2.149
  Start of MODEL   14
 9654    HB3  LEU  70           HB2      LEU  70   4.634  -1.424   0.200
  Start of MODEL   14
 9655    HB2  LEU  70           HB3      LEU  70   3.211  -0.974  -0.716
  Start of MODEL   14
 9656    HG   LEU  70           HG       LEU  70   6.012  -1.152  -1.844
  Start of MODEL   14
 9657   HD11  LEU  70          HD11      LEU  70   3.462  -0.093  -3.032
  Start of MODEL   14
 9658   HD13  LEU  70          HD12      LEU  70   4.345  -1.536  -3.551
  Start of MODEL   14
 9659   HD12  LEU  70          HD13      LEU  70   5.065   0.066  -3.738
  Start of MODEL   14
 9660   HD23  LEU  70          HD21      LEU  70   4.379   1.243  -1.050
  Start of MODEL   14
 9661   HD22  LEU  70          HD22      LEU  70   5.921   1.279  -1.906
  Start of MODEL   14
 9662   HD21  LEU  70          HD23      LEU  70   5.845   0.663  -0.252
  Start of MODEL   14
 9663    H    LEU  70           HN       LEU  70   2.986  -3.300   0.686
  Start of MODEL   14
 9664    HA   ARG  71           HA       ARG  71   6.959  -5.443  -1.044
  Start of MODEL   14
 9665    HB3  ARG  71           HB2      ARG  71   6.014  -6.527  -3.700
  Start of MODEL   14
 9666    HB2  ARG  71           HB3      ARG  71   5.453  -7.064  -2.128
  Start of MODEL   14
 9667    HG2  ARG  71           HG2      ARG  71   8.306  -7.244  -3.063
  Start of MODEL   14
 9668    HG3  ARG  71           HG3      ARG  71   7.636  -7.913  -1.574
  Start of MODEL   14
 9669    HD2  ARG  71           HD2      ARG  71   6.877  -8.727  -4.384
  Start of MODEL   14
 9670    HD3  ARG  71           HD3      ARG  71   7.919  -9.625  -3.282
  Start of MODEL   14
 9671    HE   ARG  71           HE       ARG  71   5.744  -9.517  -1.823
  Start of MODEL   14
 9672   HH11  ARG  71          HH11      ARG  71   5.990 -10.197  -5.305
  Start of MODEL   14
 9673   HH12  ARG  71          HH12      ARG  71   4.637 -11.236  -5.315
  Start of MODEL   14
 9674   HH21  ARG  71          HH21      ARG  71   3.934 -10.923  -1.870
  Start of MODEL   14
 9675   HH22  ARG  71          HH22      ARG  71   3.397 -11.642  -3.312
  Start of MODEL   14
 9676    H    ARG  71           HN       ARG  71   4.979  -4.378  -2.899
  Start of MODEL   14
 9677    HA   LEU  72           HA       LEU  72   9.746  -3.770  -3.854
  Start of MODEL   14
 9678    HB3  LEU  72           HB2      LEU  72  11.727  -2.761  -2.636
  Start of MODEL   14
 9679    HB2  LEU  72           HB3      LEU  72  10.946  -3.199  -1.133
  Start of MODEL   14
 9680    HG   LEU  72           HG       LEU  72   9.592  -1.447  -3.144
  Start of MODEL   14
 9681   HD11  LEU  72          HD11      LEU  72   9.236  -1.701  -0.179
  Start of MODEL   14
 9682   HD13  LEU  72          HD12      LEU  72   8.143  -2.300  -1.436
  Start of MODEL   14
 9683   HD12  LEU  72          HD13      LEU  72   8.392  -0.560  -1.223
  Start of MODEL   14
 9684   HD22  LEU  72          HD21      LEU  72  10.374   0.508  -2.033
  Start of MODEL   14
 9685   HD21  LEU  72          HD22      LEU  72  11.752  -0.410  -2.650
  Start of MODEL   14
 9686   HD23  LEU  72          HD23      LEU  72  11.364  -0.442  -0.924
  Start of MODEL   14
 9687    H    LEU  72           HN       LEU  72   8.943  -4.771  -1.243
  Start of MODEL   14
 9688    HA   ASN  73           HA       ASN  73  11.737  -7.586  -3.875
  Start of MODEL   14
 9689    HB3  ASN  73           HB2      ASN  73  11.731  -6.619  -6.736
  Start of MODEL   14
 9690    HB2  ASN  73           HB3      ASN  73  10.450  -7.576  -6.003
  Start of MODEL   14
 9691   HD21  ASN  73          HD21      ASN  73  13.550  -7.643  -7.455
  Start of MODEL   14
 9692   HD22  ASN  73          HD22      ASN  73  13.798  -9.336  -7.397
  Start of MODEL   14
 9693    H    ASN  73           HN       ASN  73  10.526  -5.233  -4.951
  Start of MODEL   14
 9694    HA   GLN  74           HA       GLN  74  15.611  -5.496  -4.460
  Start of MODEL   14
 9695    HB3  GLN  74           HB2      GLN  74  14.894  -3.226  -6.329
  Start of MODEL   14
 9696    HB2  GLN  74           HB3      GLN  74  15.406  -4.820  -6.867
  Start of MODEL   14
 9697    HG2  GLN  74           HG2      GLN  74  17.026  -2.875  -5.234
  Start of MODEL   14
 9698    HG3  GLN  74           HG3      GLN  74  17.545  -4.493  -5.690
  Start of MODEL   14
 9699   HE21  GLN  74          HE21      GLN  74  15.752  -2.320  -7.783
  Start of MODEL   14
 9700   HE22  GLN  74          HE22      GLN  74  17.041  -2.098  -8.913
  Start of MODEL   14
 9701    H    GLN  74           HN       GLN  74  12.968  -4.615  -5.308
  Start of MODEL   14
 9702    HA   PRO  75           HA       PRO  75  14.478  -2.539  -1.247
  Start of MODEL   14
 9703    HB3  PRO  75           HB2      PRO  75  15.267  -3.589   0.613
  Start of MODEL   14
 9704    HB2  PRO  75           HB3      PRO  75  16.927  -3.370   0.084
  Start of MODEL   14
 9705    HG2  PRO  75           HG2      PRO  75  16.847  -5.659  -0.192
  Start of MODEL   14
 9706    HG3  PRO  75           HG3      PRO  75  15.084  -5.673  -0.358
  Start of MODEL   14
 9707    HD2  PRO  75           HD2      PRO  75  17.179  -5.144  -2.412
  Start of MODEL   14
 9708    HD3  PRO  75           HD3      PRO  75  15.633  -6.015  -2.546
  Start of MODEL   14
 9709    HA   THR  76           HA       THR  76  17.753   0.195  -2.205
  Start of MODEL   14
 9710    HB   THR  76           HB       THR  76  16.586   2.213  -3.255
  Start of MODEL   14
 9711    HG1  THR  76           HG1      THR  76  14.296   0.694  -3.505
  Start of MODEL   14
 9712   HG22  THR  76          HG21      THR  76  15.968   0.974  -5.299
  Start of MODEL   14
 9713   HG21  THR  76          HG22      THR  76  15.970  -0.532  -4.381
  Start of MODEL   14
 9714   HG23  THR  76          HG23      THR  76  17.475   0.359  -4.616
  Start of MODEL   14
 9715    H    THR  76           HN       THR  76  15.051  -0.446  -1.308
  Start of MODEL   14
 9716    HA   HIS  77           HA       HIS  77  17.458   2.664   1.345
  Start of MODEL   14
 9717    HB3  HIS  77           HB2      HIS  77  19.989   2.163   1.112
  Start of MODEL   14
 9718    HB2  HIS  77           HB3      HIS  77  19.537   3.551   2.071
  Start of MODEL   14
 9719    HD1  HIS  77           HD1      HIS  77  20.487   5.788   1.406
  Start of MODEL   14
 9720    HD2  HIS  77           HD2      HIS  77  21.116   2.846  -1.432
  Start of MODEL   14
 9721    HE1  HIS  77           HE1      HIS  77  22.109   6.780  -0.241
  Start of MODEL   14
 9722    HE2  HIS  77           HE2      HIS  77  22.216   5.083  -2.086
  Start of MODEL   14
 9723    H    HIS  77           HN       HIS  77  18.716   1.840  -1.108
  Start of MODEL   14
 9724    HA   VAL  78           HA       VAL  78  17.379   6.561  -1.168
  Start of MODEL   14
 9725    HB   VAL  78           HB       VAL  78  16.510   6.974  -3.501
  Start of MODEL   14
 9726    H    VAL  78           HN       VAL  78  17.721   3.873  -1.851
  Start of MODEL   14
 9727    HA   ASN  79           HA       ASN  79  13.033   5.806  -0.850
  Start of MODEL   14
 9728    HB3  ASN  79           HB2      ASN  79  11.537   3.744  -0.909
  Start of MODEL   14
 9729    HB2  ASN  79           HB3      ASN  79  12.999   2.835  -1.281
  Start of MODEL   14
 9730   HD21  ASN  79          HD21      ASN  79  13.931   3.105  -3.149
  Start of MODEL   14
 9731   HD22  ASN  79          HD22      ASN  79  13.255   3.877  -4.549
  Start of MODEL   14
 9732    H    ASN  79           HN       ASN  79  15.262   3.981  -0.856
  Start of MODEL   14
 9733    HA   ASN  80           HA       ASN  80  13.591   4.054   3.406
  Start of MODEL   14
 9734    HB3  ASN  80           HB2      ASN  80  16.161   5.674   3.453
  Start of MODEL   14
 9735    HB2  ASN  80           HB3      ASN  80  16.102   3.954   3.109
  Start of MODEL   14
 9736   HD21  ASN  80          HD21      ASN  80  17.465   3.491   4.845
  Start of MODEL   14
 9737   HD22  ASN  80          HD22      ASN  80  16.904   3.596   6.471
  Start of MODEL   14
 9738    H    ASN  80           HN       ASN  80  14.987   5.416   1.240
  Start of MODEL   14
 9739    HA2  GLY  81           HA2      GLY  81  12.056   7.625   5.500
  Start of MODEL   14
 9740    H    GLY  81           HN       GLY  81  11.859   5.185   4.098
  Start of MODEL   14
 9741    HA3  GLY  81           HA1      GLY  81  11.495   7.952   3.871
  Start of MODEL   14
 9742    HA   ASN  82           HA       ASN  82   7.847   6.594   6.036
  Start of MODEL   14
 9743    HB3  ASN  82           HB2      ASN  82   6.253   8.451   6.565
  Start of MODEL   14
 9744    HB2  ASN  82           HB3      ASN  82   7.426   9.585   5.918
  Start of MODEL   14
 9745   HD21  ASN  82          HD21      ASN  82   6.654   7.473   8.585
  Start of MODEL   14
 9746   HD22  ASN  82          HD22      ASN  82   7.862   8.064   9.638
  Start of MODEL   14
 9747    H    ASN  82           HN       ASN  82   9.532   8.697   4.919
  Start of MODEL   14
 9748    HA   TYR  83           HA       TYR  83   5.610   6.573   2.275
  Start of MODEL   14
 9749    HB3  TYR  83           HB2      TYR  83   4.533   4.262   2.234
  Start of MODEL   14
 9750    HB2  TYR  83           HB3      TYR  83   5.373   3.945   3.739
  Start of MODEL   14
 9751    HD1  TYR  83           HD1      TYR  83   5.489   3.360   0.403
  Start of MODEL   14
 9752    HD2  TYR  83           HD2      TYR  83   8.047   4.626   3.547
  Start of MODEL   14
 9753    HE1  TYR  83           HE1      TYR  83   7.438   2.591  -0.868
  Start of MODEL   14
 9754    HE2  TYR  83           HE2      TYR  83   9.999   3.861   2.260
  Start of MODEL   14
 9755    HH   TYR  83           HH       TYR  83  10.539   2.417   0.474
  Start of MODEL   14
 9756    H    TYR  83           HN       TYR  83   6.450   5.612   4.894
  Start of MODEL   14
 9757    HA   THR  84           HA       THR  84   1.742   7.161   4.255
  Start of MODEL   14
 9758    HB   THR  84           HB       THR  84   2.008   9.511   2.346
  Start of MODEL   14
 9759    HG1  THR  84           HG1      THR  84   2.523   9.358   5.135
  Start of MODEL   14
 9760   HG21  THR  84          HG21      THR  84   0.227   9.120   4.768
  Start of MODEL   14
 9761   HG23  THR  84          HG22      THR  84  -0.312   9.098   3.090
  Start of MODEL   14
 9762   HG22  THR  84          HG23      THR  84   0.329  10.586   3.788
  Start of MODEL   14
 9763    H    THR  84           HN       THR  84   3.729   7.627   2.166
  Start of MODEL   14
 9764    HA   LEU  85           HA       LEU  85  -0.413   5.588   0.809
  Start of MODEL   14
 9765    HB3  LEU  85           HB2      LEU  85  -1.464   4.098   3.223
  Start of MODEL   14
 9766    HB2  LEU  85           HB3      LEU  85  -0.142   3.583   2.196
  Start of MODEL   14
 9767    HG   LEU  85           HG       LEU  85  -3.026   3.795   1.333
  Start of MODEL   14
 9768   HD13  LEU  85          HD11      LEU  85  -1.518   4.257  -0.487
  Start of MODEL   14
 9769   HD12  LEU  85          HD12      LEU  85  -2.202   2.622  -0.661
  Start of MODEL   14
 9770   HD11  LEU  85          HD13      LEU  85  -0.556   2.849  -0.038
  Start of MODEL   14
 9771   HD23  LEU  85          HD21      LEU  85  -1.290   1.388   1.818
  Start of MODEL   14
 9772   HD22  LEU  85          HD22      LEU  85  -2.977   1.407   1.277
  Start of MODEL   14
 9773   HD21  LEU  85          HD23      LEU  85  -2.556   1.976   2.893
  Start of MODEL   14
 9774    H    LEU  85           HN       LEU  85   0.107   5.985   3.652
  Start of MODEL   14
 9775    HA   LEU  86           HA       LEU  86  -4.010   7.981   1.593
  Start of MODEL   14
 9776    HB3  LEU  86           HB2      LEU  86  -4.421   9.452  -0.373
  Start of MODEL   14
 9777    HB2  LEU  86           HB3      LEU  86  -3.103   8.681  -1.207
  Start of MODEL   14
 9778    HG   LEU  86           HG       LEU  86  -2.620  10.947  -0.361
  Start of MODEL   14
 9779   HD11  LEU  86          HD11      LEU  86  -2.741   9.679   2.331
  Start of MODEL   14
 9780   HD13  LEU  86          HD12      LEU  86  -3.813  10.925   1.687
  Start of MODEL   14
 9781   HD12  LEU  86          HD13      LEU  86  -2.106  11.284   1.978
  Start of MODEL   14
 9782   HD22  LEU  86          HD21      LEU  86  -0.388  10.435   0.514
  Start of MODEL   14
 9783   HD21  LEU  86          HD22      LEU  86  -0.798   9.453  -0.893
  Start of MODEL   14
 9784   HD23  LEU  86          HD23      LEU  86  -0.868   8.750   0.720
  Start of MODEL   14
 9785    H    LEU  86           HN       LEU  86  -1.916   6.758  -0.076
  Start of MODEL   14
 9786    HA   ALA  87           HA       ALA  87  -6.597   5.831  -1.196
  Start of MODEL   14
 9787    HB3  ALA  87           HB1      ALA  87  -6.693   4.356   0.763
  Start of MODEL   14
 9788    HB2  ALA  87           HB2      ALA  87  -8.289   4.556   0.048
  Start of MODEL   14
 9789    HB1  ALA  87           HB3      ALA  87  -7.865   5.431   1.518
  Start of MODEL   14
 9790    H    ALA  87           HN       ALA  87  -6.043   7.326   1.283
  Start of MODEL   14
 9791    HA   ALA  88           HA       ALA  88  -9.640   8.961  -1.285
  Start of MODEL   14
 9792    HB3  ALA  88           HB1      ALA  88  -7.974   9.806  -2.876
  Start of MODEL   14
 9793    HB2  ALA  88           HB2      ALA  88  -9.612  10.007  -3.499
  Start of MODEL   14
 9794    HB1  ALA  88           HB3      ALA  88  -8.592   8.703  -4.108
  Start of MODEL   14
 9795    H    ALA  88           HN       ALA  88  -7.890   6.898  -2.441
  Start of MODEL   14
 9796    HA   ASN  89           HA       ASN  89 -12.941   7.038  -3.508
  Start of MODEL   14
 9797    HB3  ASN  89           HB2      ASN  89 -12.376   5.581  -1.487
  Start of MODEL   14
 9798    HB2  ASN  89           HB3      ASN  89 -14.072   5.567  -1.922
  Start of MODEL   14
 9799   HD21  ASN  89          HD21      ASN  89 -11.739   6.696   0.389
  Start of MODEL   14
 9800   HD22  ASN  89          HD22      ASN  89 -12.857   7.104   1.632
  Start of MODEL   14
 9801    H    ASN  89           HN       ASN  89 -11.782   8.770  -1.504
  Start of MODEL   14
 9802    HA   PRO  90           HA       PRO  90 -16.281  10.001  -3.508
  Start of MODEL   14
 9803    HB3  PRO  90           HB2      PRO  90 -18.077   8.765  -4.093
  Start of MODEL   14
 9804    HB2  PRO  90           HB3      PRO  90 -18.388   8.440  -2.389
  Start of MODEL   14
 9805    HG2  PRO  90           HG2      PRO  90 -17.309   6.413  -2.450
  Start of MODEL   14
 9806    HG3  PRO  90           HG3      PRO  90 -17.705   6.499  -4.176
  Start of MODEL   14
 9807    HD2  PRO  90           HD2      PRO  90 -15.192   6.173  -3.412
  Start of MODEL   14
 9808    HD3  PRO  90           HD3      PRO  90 -15.583   7.279  -4.743
  Start of MODEL   14
 9809    HA   CYS  91           HA       CYS  91 -17.647   9.988   1.013
  Start of MODEL   14
 9810    HB3  CYS  91           HB2      CYS  91 -16.057   7.551   1.810
  Start of MODEL   14
 9811    HB2  CYS  91           HB3      CYS  91 -17.788   7.641   1.541
  Start of MODEL   14
 9812    H    CYS  91           HN       CYS  91 -16.164   8.088  -0.519
  Start of MODEL   14
 9813    HA2  GLY  92           HA2      GLY  92 -13.362  11.993   1.166
  Start of MODEL   14
 9814    H    GLY  92           HN       GLY  92 -14.205   9.578   0.347
  Start of MODEL   14
 9815    HA3  GLY  92           HA1      GLY  92 -13.399  11.077   2.663
  Start of MODEL   14
 9816    HA   GLN  93           HA       GLN  93  -9.691   9.379   1.193
  Start of MODEL   14
 9817    HB3  GLN  93           HB2      GLN  93  -8.757  12.202   1.720
  Start of MODEL   14
 9818    HB2  GLN  93           HB3      GLN  93  -9.261  11.551   0.168
  Start of MODEL   14
 9819    HG2  GLN  93           HG2      GLN  93  -6.881  10.622   1.754
  Start of MODEL   14
 9820    HG3  GLN  93           HG3      GLN  93  -7.374  10.021   0.173
  Start of MODEL   14
 9821   HE21  GLN  93          HE21      GLN  93  -6.015  12.675   1.925
  Start of MODEL   14
 9822   HE22  GLN  93          HE22      GLN  93  -5.417  13.531   0.552
  Start of MODEL   14
 9823    H    GLN  93           HN       GLN  93 -11.114  11.336   2.810
  Start of MODEL   14
 9824    HA   ALA  94           HA       ALA  94  -8.022   8.817   5.215
  Start of MODEL   14
 9825    HB2  ALA  94           HB1      ALA  94  -7.668   6.391   5.557
  Start of MODEL   14
 9826    HB1  ALA  94           HB2      ALA  94  -8.032   6.135   3.855
  Start of MODEL   14
 9827    HB3  ALA  94           HB3      ALA  94  -9.286   6.746   4.939
  Start of MODEL   14
 9828    H    ALA  94           HN       ALA  94  -8.557   8.086   2.414
  Start of MODEL   14
 9829    HA   SER  95           HA       SER  95  -3.789   7.771   4.164
  Start of MODEL   14
 9830    HB3  SER  95           HB2      SER  95  -4.042  10.129   3.946
  Start of MODEL   14
 9831    HB2  SER  95           HB3      SER  95  -2.624   9.859   4.962
  Start of MODEL   14
 9832    HG   SER  95           HG       SER  95  -4.893   9.992   6.435
  Start of MODEL   14
 9833    H    SER  95           HN       SER  95  -5.902   8.179   6.079
  Start of MODEL   14
 9834    HA   ALA  96           HA       ALA  96  -1.630   7.070   7.998
  Start of MODEL   14
 9835    HB3  ALA  96           HB1      ALA  96  -2.958   5.011   7.725
  Start of MODEL   14
 9836    HB2  ALA  96           HB2      ALA  96  -1.304   4.630   8.203
  Start of MODEL   14
 9837    HB1  ALA  96           HB3      ALA  96  -1.807   4.427   6.524
  Start of MODEL   14
 9838    H    ALA  96           HN       ALA  96  -2.003   6.890   5.126
  Start of MODEL   14
 9839    HA   SER  97           HA       SER  97   2.336   6.427   6.165
  Start of MODEL   14
 9840    HB3  SER  97           HB2      SER  97   3.833   8.110   7.123
  Start of MODEL   14
 9841    HB2  SER  97           HB3      SER  97   2.753   8.294   8.509
  Start of MODEL   14
 9842    HG   SER  97           HG       SER  97   1.154   9.023   7.110
  Start of MODEL   14
 9843    H    SER  97           HN       SER  97   0.628   6.613   8.533
  Start of MODEL   14
 9844    HA   ILE  98           HA       ILE  98   4.855   4.083   8.963
  Start of MODEL   14
 9845    HB   ILE  98           HB       ILE  98   3.321   2.498   7.825
  Start of MODEL   14
 9846   HD12  ILE  98          HD11      ILE  98   6.916   0.155   7.965
  Start of MODEL   14
 9847   HD11  ILE  98          HD12      ILE  98   7.117   1.836   7.472
  Start of MODEL   14
 9848   HD13  ILE  98          HD13      ILE  98   6.269   0.703   6.419
  Start of MODEL   14
 9849    H    ILE  98           HN       ILE  98   4.146   5.242   6.368
  Start of MODEL   14
 9850    HA   MET  99           HA       MET  99   8.696   4.798   6.912
  Start of MODEL   14
 9851    HB3  MET  99           HB2      MET  99   9.443   4.772   9.849
  Start of MODEL   14
 9852    HB2  MET  99           HB3      MET  99   9.072   6.197   8.885
  Start of MODEL   14
 9853    HG2  MET  99           HG2      MET  99  11.393   4.318   8.405
  Start of MODEL   14
 9854    HG3  MET  99           HG3      MET  99  11.043   5.782   7.497
  Start of MODEL   14
 9855    HE3  MET  99           HE1      MET  99  11.319   8.222   8.480
  Start of MODEL   14
 9856    HE2  MET  99           HE2      MET  99  11.785   8.564  10.148
  Start of MODEL   14
 9857    HE1  MET  99           HE3      MET  99  10.219   7.828   9.801
  Start of MODEL   14
 9858    H    MET  99           HN       MET  99   7.090   3.995   9.232
  Start of MODEL   14
 9859    HA   ALA 100           HA       ALA 100  10.390   0.828   7.268
  Start of MODEL   14
 9860    HB3  ALA 100           HB1      ALA 100   8.777   0.515   5.447
  Start of MODEL   14
 9861    HB2  ALA 100           HB2      ALA 100  10.314  -0.271   5.078
  Start of MODEL   14
 9862    HB1  ALA 100           HB3      ALA 100   9.905   1.268   4.322
  Start of MODEL   14
 9863    H    ALA 100           HN       ALA 100   9.755   3.319   5.861
  Start of MODEL   14
 9864    HA   ALA 101           HA       ALA 101  14.368   2.166   6.095
  Start of MODEL   14
 9865    HB1  ALA 101           HB1      ALA 101  14.773   0.707   8.717
  Start of MODEL   14
 9866    HB3  ALA 101           HB2      ALA 101  14.533   2.446   8.523
  Start of MODEL   14
 9867    HB2  ALA 101           HB3      ALA 101  15.982   1.679   7.875
  Start of MODEL   14
 9868    H    ALA 101           HN       ALA 101  12.496   0.662   7.734
  Start of MODEL   14
 9869    HA   PHE 102           HA       PHE 102  14.848  -1.812   4.248
  Start of MODEL   14
 9870    HB3  PHE 102           HB2      PHE 102  15.353  -1.496   1.870
  Start of MODEL   14
 9871    HB2  PHE 102           HB3      PHE 102  15.619   0.222   2.129
  Start of MODEL   14
 9872    HD1  PHE 102           HD1      PHE 102  13.066  -2.432   2.059
  Start of MODEL   14
 9873    HD2  PHE 102           HD2      PHE 102  13.817   1.741   2.260
  Start of MODEL   14
 9874    HE1  PHE 102           HE1      PHE 102  10.729  -1.997   1.570
  Start of MODEL   14
 9875    HE2  PHE 102           HE2      PHE 102  11.449   2.189   1.784
  Start of MODEL   14
 9876    HZ   PHE 102           HZ       PHE 102   9.872   0.315   1.567
  Start of MODEL   14
 9877    H    PHE 102           HN       PHE 102  14.640   1.052   4.393
  Start of MODEL   14
 9878    HA   MET 103           HA       MET 103  19.314  -0.930   4.540
  Start of MODEL   14
 9879    HB3  MET 103           HB2      MET 103  20.799  -0.337   2.590
  Start of MODEL   14
 9880    HB2  MET 103           HB3      MET 103  19.368   0.214   1.733
  Start of MODEL   14
 9881    HG2  MET 103           HG2      MET 103  19.852  -2.596   2.676
  Start of MODEL   14
 9882    HG3  MET 103           HG3      MET 103  18.437  -2.025   1.796
  Start of MODEL   14
 9883    HE1  MET 103           HE1      MET 103  18.818  -3.997   0.065
  Start of MODEL   14
 9884    HE3  MET 103           HE2      MET 103  20.264  -4.515   0.920
  Start of MODEL   14
 9885    HE2  MET 103           HE3      MET 103  20.316  -4.249  -0.821
  Start of MODEL   14
 9886    H    MET 103           HN       MET 103  17.252   0.615   3.218
  Start of MODEL   14
 9887    HA   ASP 104           HA       ASP 104  20.256   3.137   5.747
  Start of MODEL   14
 9888    HB3  ASP 104           HB2      ASP 104  21.208   1.690   7.560
  Start of MODEL   14
 9889    HB2  ASP 104           HB3      ASP 104  22.138   3.157   7.291
  Start of MODEL   14
 9890    H    ASP 104           HN       ASP 104  21.023   0.391   5.205
  Start of MODEL   14
 9891    HA   ASN 105           HA       ASN 105  23.183   4.500   2.833
  Start of MODEL   14
 9892    HB3  ASN 105           HB2      ASN 105  22.465   6.967   4.425
  Start of MODEL   14
 9893    HB2  ASN 105           HB3      ASN 105  21.676   6.377   2.971
  Start of MODEL   14
 9894   HD21  ASN 105          HD21      ASN 105  24.171   5.770   1.499
  Start of MODEL   14
 9895   HD22  ASN 105          HD22      ASN 105  24.843   7.306   1.130
  Start of MODEL   14
 9896    H    ASN 105           HN       ASN 105  21.841   4.820   5.410
  Start of MODEL   14
 9897    HA   PRO 106           HA       PRO 106  27.019   4.549   5.243
  Start of MODEL   14
 9898    HB3  PRO 106           HB2      PRO 106  28.041   2.735   4.325
  Start of MODEL   14
 9899    HB2  PRO 106           HB3      PRO 106  28.370   3.664   2.864
  Start of MODEL   14
 9900    HG2  PRO 106           HG2      PRO 106  26.885   2.290   1.834
  Start of MODEL   14
 9901    HG3  PRO 106           HG3      PRO 106  26.256   1.688   3.378
  Start of MODEL   14
 9902    HD2  PRO 106           HD2      PRO 106  25.387   3.982   1.712
  Start of MODEL   14
 9903    HD3  PRO 106           HD3      PRO 106  24.439   2.919   2.777
  Start of MODEL   14
 9904    HA   PHE 107           HA       PHE 107  29.379   8.198   4.953
  Start of MODEL   14
 9905    HB3  PHE 107           HB2      PHE 107  30.177   8.711   2.601
  Start of MODEL   14
 9906    HB2  PHE 107           HB3      PHE 107  29.358   7.252   2.068
  Start of MODEL   14
 9907    HD1  PHE 107           HD1      PHE 107  32.173   8.542   4.049
  Start of MODEL   14
 9908    HD2  PHE 107           HD2      PHE 107  30.273   5.100   2.429
  Start of MODEL   14
 9909    HE1  PHE 107           HE1      PHE 107  34.170   7.199   4.565
  Start of MODEL   14
 9910    HE2  PHE 107           HE2      PHE 107  32.269   3.754   2.935
  Start of MODEL   14
 9911    HZ   PHE 107           HZ       PHE 107  34.266   4.855   3.955
  Start of MODEL   14
 9912    H    PHE 107           HN       PHE 107  28.352   6.259   5.354
  Start of MODEL   15
 9913    H1   ASP   1           H        ASP   1 -30.193  -6.921   3.807
  Start of MODEL   15
 9914    H2   ASP   1           H2       ASP   1 -30.999  -7.956   2.739
  Start of MODEL   15
 9915    H3   ASP   1           H3       ASP   1 -31.472  -6.341   2.889
  Start of MODEL   15
 9916    HA   ASP   1           HA       ASP   1 -28.815  -7.182   1.903
  Start of MODEL   15
 9917    HB3  ASP   1           HB2      ASP   1 -30.984  -5.878   0.284
  Start of MODEL   15
 9918    HB2  ASP   1           HB3      ASP   1 -30.952  -7.625   0.454
  Start of MODEL   15
 9919    HA   ASP   2           HA       ASP   2 -28.699  -2.818   2.880
  Start of MODEL   15
 9920    HB3  ASP   2           HB2      ASP   2 -27.186  -2.339   4.775
  Start of MODEL   15
 9921    HB2  ASP   2           HB3      ASP   2 -26.745  -4.026   4.856
  Start of MODEL   15
 9922    H    ASP   2           HN       ASP   2 -27.667  -5.599   3.050
  Start of MODEL   15
 9923    HA   ASP   3           HA       ASP   3 -23.952  -3.663   1.902
  Start of MODEL   15
 9924    HB3  ASP   3           HB2      ASP   3 -23.279  -4.825  -0.196
  Start of MODEL   15
 9925    HB2  ASP   3           HB3      ASP   3 -24.971  -5.233  -0.448
  Start of MODEL   15
 9926    H    ASP   3           HN       ASP   3 -26.415  -4.820   1.591
  Start of MODEL   15
 9927    HA   ASP   4           HA       ASP   4 -24.312  -0.997  -1.857
  Start of MODEL   15
 9928    HB3  ASP   4           HB2      ASP   4 -27.310  -1.095  -2.227
  Start of MODEL   15
 9929    HB2  ASP   4           HB3      ASP   4 -26.135  -1.998  -3.175
  Start of MODEL   15
 9930    H    ASP   4           HN       ASP   4 -26.272  -2.674  -0.546
  Start of MODEL   15
 9931    HA   ASP   5           HA       ASP   5 -26.648   2.295   0.392
  Start of MODEL   15
 9932    HB3  ASP   5           HB2      ASP   5 -28.100   0.596   2.428
  Start of MODEL   15
 9933    HB2  ASP   5           HB3      ASP   5 -28.790   1.235   0.943
  Start of MODEL   15
 9934    H    ASP   5           HN       ASP   5 -26.701  -0.601   0.629
  Start of MODEL   15
 9935    HA   VAL   6           HA       VAL   6 -24.472   1.739   4.433
  Start of MODEL   15
 9936    HB   VAL   6           HB       VAL   6 -23.102  -0.148   5.404
  Start of MODEL   15
 9937    H    VAL   6           HN       VAL   6 -25.416  -0.178   2.587
  Start of MODEL   15
 9938    HA   SER   7           HA       SER   7 -21.140   2.476   1.861
  Start of MODEL   15
 9939    HB3  SER   7           HB2      SER   7 -21.890   5.123   3.123
  Start of MODEL   15
 9940    HB2  SER   7           HB3      SER   7 -22.520   4.475   1.612
  Start of MODEL   15
 9941    HG   SER   7           HG       SER   7 -20.114   5.684   2.171
  Start of MODEL   15
 9942    H    SER   7           HN       SER   7 -23.179   3.169   3.754
  Start of MODEL   15
 9943    HA   PHE   8           HA       PHE   8 -18.514   2.224   5.375
  Start of MODEL   15
 9944    HB3  PHE   8           HB2      PHE   8 -17.084   0.257   5.194
  Start of MODEL   15
 9945    HB2  PHE   8           HB3      PHE   8 -17.639  -0.048   3.557
  Start of MODEL   15
 9946    HD1  PHE   8           HD1      PHE   8 -18.757  -2.102   3.532
  Start of MODEL   15
 9947    HD2  PHE   8           HD2      PHE   8 -19.512   0.656   6.693
  Start of MODEL   15
 9948    HE1  PHE   8           HE1      PHE   8 -20.535  -3.554   4.372
  Start of MODEL   15
 9949    HE2  PHE   8           HE2      PHE   8 -21.284  -0.811   7.544
  Start of MODEL   15
 9950    HZ   PHE   8           HZ       PHE   8 -21.683  -3.046   6.393
  Start of MODEL   15
 9951    H    PHE   8           HN       PHE   8 -19.723   1.282   2.925
  Start of MODEL   15
 9952    HA   CYS   9           HA       CYS   9 -16.035   4.527   2.667
  Start of MODEL   15
 9953    HB3  CYS   9           HB2      CYS   9 -15.198   6.474   3.889
  Start of MODEL   15
 9954    HB2  CYS   9           HB3      CYS   9 -15.513   5.666   5.427
  Start of MODEL   15
 9955    H    CYS   9           HN       CYS   9 -16.995   3.709   5.260
  Start of MODEL   15
 9956    HA   ALA  10           HA       ALA  10 -12.269   2.704   3.132
  Start of MODEL   15
 9957    HB1  ALA  10           HB1      ALA  10 -11.180   5.282   2.025
  Start of MODEL   15
 9958    HB3  ALA  10           HB2      ALA  10 -11.939   3.989   1.089
  Start of MODEL   15
 9959    HB2  ALA  10           HB3      ALA  10 -10.408   3.704   1.928
  Start of MODEL   15
 9960    H    ALA  10           HN       ALA  10 -13.449   5.356   3.038
  Start of MODEL   15
 9961    HA   SER  11           HA       SER  11  -9.763   4.122   6.294
  Start of MODEL   15
 9962    HB3  SER  11           HB2      SER  11 -10.612   1.355   7.195
  Start of MODEL   15
 9963    HB2  SER  11           HB3      SER  11 -11.546   2.816   7.508
  Start of MODEL   15
 9964    HG   SER  11           HG       SER  11 -10.395   2.625   9.257
  Start of MODEL   15
 9965    H    SER  11           HN       SER  11 -11.101   2.102   4.679
  Start of MODEL   15
 9966    HA   VAL  12           HA       VAL  12  -6.404   1.649   5.034
  Start of MODEL   15
 9967    HB   VAL  12           HB       VAL  12  -5.420   4.524   5.216
  Start of MODEL   15
 9968    H    VAL  12           HN       VAL  12  -7.605   3.917   6.447
  Start of MODEL   15
 9969    HA   GLN  13           HA       GLN  13  -4.187   1.515   8.721
  Start of MODEL   15
 9970    HB3  GLN  13           HB2      GLN  13  -4.542  -0.632   9.851
  Start of MODEL   15
 9971    HB2  GLN  13           HB3      GLN  13  -5.306  -1.289   8.419
  Start of MODEL   15
 9972    HG2  GLN  13           HG2      GLN  13  -7.148   0.293   8.652
  Start of MODEL   15
 9973    HG3  GLN  13           HG3      GLN  13  -6.960  -0.687  10.104
  Start of MODEL   15
 9974   HE21  GLN  13          HE21      GLN  13  -8.212   1.936   9.692
  Start of MODEL   15
 9975   HE22  GLN  13          HE22      GLN  13  -7.422   3.011  10.782
  Start of MODEL   15
 9976    H    GLN  13           HN       GLN  13  -5.523   0.360   6.407
  Start of MODEL   15
 9977    HA   LEU  14           HA       LEU  14  -0.905  -0.400   6.641
  Start of MODEL   15
 9978    HB3  LEU  14           HB2      LEU  14   1.121   1.208   6.946
  Start of MODEL   15
 9979    HB2  LEU  14           HB3      LEU  14  -0.064   2.316   7.617
  Start of MODEL   15
 9980    HG   LEU  14           HG       LEU  14  -1.351   2.052   5.406
  Start of MODEL   15
 9981   HD11  LEU  14          HD11      LEU  14   1.445   3.105   5.227
  Start of MODEL   15
 9982   HD13  LEU  14          HD12      LEU  14   0.095   4.030   5.890
  Start of MODEL   15
 9983   HD12  LEU  14          HD13      LEU  14   0.112   3.551   4.184
  Start of MODEL   15
 9984   HD21  LEU  14          HD21      LEU  14  -0.220  -0.021   4.799
  Start of MODEL   15
 9985   HD23  LEU  14          HD22      LEU  14   1.273   0.894   4.552
  Start of MODEL   15
 9986   HD22  LEU  14          HD23      LEU  14  -0.138   1.208   3.536
  Start of MODEL   15
 9987    H    LEU  14           HN       LEU  14  -2.115   1.482   8.487
  Start of MODEL   15
 9988    HA   HIS  15           HA       HIS  15   1.346  -1.737  10.100
  Start of MODEL   15
 9989    HB3  HIS  15           HB2      HIS  15   1.832  -4.178   9.527
  Start of MODEL   15
 9990    HB2  HIS  15           HB3      HIS  15   1.154  -3.833   7.939
  Start of MODEL   15
 9991    HD1  HIS  15           HD1      HIS  15   0.216  -4.706  11.343
  Start of MODEL   15
 9992    HD2  HIS  15           HD2      HIS  15  -1.678  -3.182   7.983
  Start of MODEL   15
 9993    HE1  HIS  15           HE1      HIS  15  -2.229  -4.937  11.800
  Start of MODEL   15
 9994    HE2  HIS  15           HE2      HIS  15  -3.338  -4.270   9.664
  Start of MODEL   15
 9995    H    HIS  15           HN       HIS  15   1.142  -1.322   7.227
  Start of MODEL   15
 9996    HA   THR  16           HA       THR  16   5.527  -1.117   9.834
  Start of MODEL   15
 9997    HB   THR  16           HB       THR  16   5.458  -3.623  11.524
  Start of MODEL   15
 9998    HG1  THR  16           HG1      THR  16   4.812  -0.906  12.055
  Start of MODEL   15
 9999   HG23  THR  16          HG21      THR  16   7.694  -2.763  10.865
  Start of MODEL   15
10000   HG22  THR  16          HG22      THR  16   7.416  -2.618  12.603
  Start of MODEL   15
10001   HG21  THR  16          HG23      THR  16   7.277  -1.201  11.558
  Start of MODEL   15
10002    H    THR  16           HN       THR  16   3.334  -2.485  10.774
  Start of MODEL   15
10003    HA   ALA  17           HA       ALA  17   6.694  -3.605   6.453
  Start of MODEL   15
10004    HB3  ALA  17           HB1      ALA  17   8.789  -2.875   5.521
  Start of MODEL   15
10005    HB2  ALA  17           HB2      ALA  17   9.240  -2.101   7.042
  Start of MODEL   15
10006    HB1  ALA  17           HB3      ALA  17   7.908  -1.453   6.094
  Start of MODEL   15
10007    H    ALA  17           HN       ALA  17   7.109  -1.634   8.425
  Start of MODEL   15
10008    HA   VAL  18           HA       VAL  18   8.765  -6.715   8.518
  Start of MODEL   15
10009    HB   VAL  18           HB       VAL  18   8.430  -8.928   7.461
  Start of MODEL   15
10010    H    VAL  18           HN       VAL  18   7.678  -5.529   6.107
  Start of MODEL   15
10011    HA   GLU  19           HA       GLU  19  12.747  -6.616   6.897
  Start of MODEL   15
10012    HB3  GLU  19           HB2      GLU  19  12.887  -7.415   9.802
  Start of MODEL   15
10013    HB2  GLU  19           HB3      GLU  19  12.953  -5.772   9.187
  Start of MODEL   15
10014    HG2  GLU  19           HG2      GLU  19  14.988  -7.907   8.620
  Start of MODEL   15
10015    HG3  GLU  19           HG3      GLU  19  15.058  -6.225   8.099
  Start of MODEL   15
10016    H    GLU  19           HN       GLU  19  10.727  -7.146   8.867
  Start of MODEL   15
10017    HA   MET  20           HA       MET  20  14.381 -10.544   6.359
  Start of MODEL   15
10018    HB3  MET  20           HB2      MET  20  12.202 -11.503   6.635
  Start of MODEL   15
10019    HB2  MET  20           HB3      MET  20  12.819 -12.122   5.122
  Start of MODEL   15
10020    HG2  MET  20           HG2      MET  20  10.337 -11.363   5.321
  Start of MODEL   15
10021    HG3  MET  20           HG3      MET  20  11.023  -9.768   5.060
  Start of MODEL   15
10022    HE2  MET  20           HE1      MET  20   9.339 -10.658   1.663
  Start of MODEL   15
10023    HE1  MET  20           HE2      MET  20   9.405  -9.534   3.024
  Start of MODEL   15
10024    HE3  MET  20           HE3      MET  20   8.797 -11.162   3.263
  Start of MODEL   15
10025    H    MET  20           HN       MET  20  13.228  -8.176   5.540
  Start of MODEL   15
10026    HA   HIS  21           HA       HIS  21  16.187 -10.329   2.545
  Start of MODEL   15
10027    HB3  HIS  21           HB2      HIS  21  15.869 -11.842   0.506
  Start of MODEL   15
10028    HB2  HIS  21           HB3      HIS  21  14.620 -12.645   1.454
  Start of MODEL   15
10029    HD1  HIS  21           HD1      HIS  21  18.314 -12.178   1.245
  Start of MODEL   15
10030    HD2  HIS  21           HD2      HIS  21  15.559 -14.217   3.579
  Start of MODEL   15
10031    HE1  HIS  21           HE1      HIS  21  19.655 -13.704   2.707
  Start of MODEL   15
10032    HE2  HIS  21           HE2      HIS  21  17.965 -14.898   4.131
  Start of MODEL   15
10033    H    HIS  21           HN       HIS  21  14.102 -11.841   3.714
  Start of MODEL   15
10034    HA   HIS  22           HA       HIS  22  13.277  -7.983   0.190
  Start of MODEL   15
10035    HB3  HIS  22           HB2      HIS  22  10.905  -8.411  -0.592
  Start of MODEL   15
10036    HB2  HIS  22           HB3      HIS  22  10.951  -9.920   0.300
  Start of MODEL   15
10037    HD1  HIS  22           HD1      HIS  22  11.980  -8.384  -2.880
  Start of MODEL   15
10038    HD2  HIS  22           HD2      HIS  22  12.630 -11.934  -0.826
  Start of MODEL   15
10039    HE1  HIS  22           HE1      HIS  22  12.922  -9.973  -4.564
  Start of MODEL   15
10040    HE2  HIS  22           HE2      HIS  22  12.870 -12.179  -3.368
  Start of MODEL   15
10041    H    HIS  22           HN       HIS  22  12.815 -10.200   2.047
  Start of MODEL   15
10042    HA   TRP  23           HA       TRP  23  10.626  -6.397   3.261
  Start of MODEL   15
10043    HB3  TRP  23           HB2      TRP  23  10.720  -3.843   3.151
  Start of MODEL   15
10044    HB2  TRP  23           HB3      TRP  23  11.638  -4.042   1.657
  Start of MODEL   15
10045    HD1  TRP  23           HD1      TRP  23  13.902  -5.760   2.039
  Start of MODEL   15
10046    HE1  TRP  23           HE1      TRP  23  15.622  -5.648   3.925
  Start of MODEL   15
10047    HE3  TRP  23           HE3      TRP  23  11.162  -3.127   5.438
  Start of MODEL   15
10048    HZ2  TRP  23           HZ2      TRP  23  15.812  -4.550   6.534
  Start of MODEL   15
10049    HZ3  TRP  23           HZ3      TRP  23  12.187  -2.576   7.609
  Start of MODEL   15
10050    HH2  TRP  23           HH2      TRP  23  14.462  -3.275   8.141
  Start of MODEL   15
10051    H    TRP  23           HN       TRP  23  11.475  -6.335   0.479
  Start of MODEL   15
10052    HA   CYS  24           HA       CYS  24   6.852  -5.225   1.471
  Start of MODEL   15
10053    HB3  CYS  24           HB2      CYS  24   6.620  -7.648   3.257
  Start of MODEL   15
10054    HB2  CYS  24           HB3      CYS  24   6.690  -7.601   1.507
  Start of MODEL   15
10055    H    CYS  24           HN       CYS  24   8.611  -5.949   3.686
  Start of MODEL   15
10056    HA   ILE  25           HA       ILE  25   4.942  -3.278   4.870
  Start of MODEL   15
10057    HB   ILE  25           HB       ILE  25   4.355  -1.478   2.482
  Start of MODEL   15
10058   HD11  ILE  25          HD11      ILE  25   5.739   0.965   3.968
  Start of MODEL   15
10059   HD13  ILE  25          HD12      ILE  25   6.001   0.554   2.278
  Start of MODEL   15
10060   HD12  ILE  25          HD13      ILE  25   7.369   0.632   3.386
  Start of MODEL   15
10061    H    ILE  25           HN       ILE  25   5.464  -3.753   2.029
  Start of MODEL   15
10062    HA   PRO  26           HA       PRO  26   1.090  -5.366   3.661
  Start of MODEL   15
10063    HB3  PRO  26           HB2      PRO  26   0.930  -6.888   5.342
  Start of MODEL   15
10064    HB2  PRO  26           HB3      PRO  26   0.571  -5.612   6.506
  Start of MODEL   15
10065    HG2  PRO  26           HG2      PRO  26   2.640  -6.158   7.341
  Start of MODEL   15
10066    HG3  PRO  26           HG3      PRO  26   3.170  -6.861   5.805
  Start of MODEL   15
10067    HD2  PRO  26           HD2      PRO  26   3.172  -4.000   6.682
  Start of MODEL   15
10068    HD3  PRO  26           HD3      PRO  26   4.383  -4.917   5.753
  Start of MODEL   15
10069    HA   PHE  27           HA       PHE  27  -1.722  -2.399   5.270
  Start of MODEL   15
10070    HB3  PHE  27           HB2      PHE  27  -0.639  -1.230   3.438
  Start of MODEL   15
10071    HB2  PHE  27           HB3      PHE  27  -2.353  -0.858   3.477
  Start of MODEL   15
10072    HD1  PHE  27           HD1      PHE  27  -3.847  -1.677   1.694
  Start of MODEL   15
10073    HD2  PHE  27           HD2      PHE  27   0.365  -2.335   1.602
  Start of MODEL   15
10074    HE1  PHE  27           HE1      PHE  27  -3.982  -2.202  -0.688
  Start of MODEL   15
10075    HE2  PHE  27           HE2      PHE  27   0.230  -2.859  -0.792
  Start of MODEL   15
10076    HZ   PHE  27           HZ       PHE  27  -1.947  -2.795  -1.941
  Start of MODEL   15
10077    H    PHE  27           HN       PHE  27  -0.927  -4.490   3.430
  Start of MODEL   15
10078    HA   SER  28           HA       SER  28  -5.599  -3.848   3.949
  Start of MODEL   15
10079    HB3  SER  28           HB2      SER  28  -5.404  -4.862   6.119
  Start of MODEL   15
10080    HB2  SER  28           HB3      SER  28  -6.972  -4.059   6.042
  Start of MODEL   15
10081    HG   SER  28           HG       SER  28  -5.922  -2.259   7.065
  Start of MODEL   15
10082    H    SER  28           HN       SER  28  -3.854  -2.132   5.521
  Start of MODEL   15
10083    HA   VAL  29           HA       VAL  29  -7.873  -0.172   3.982
  Start of MODEL   15
10084    HB   VAL  29           HB       VAL  29  -6.470   0.512   2.119
  Start of MODEL   15
10085    H    VAL  29           HN       VAL  29  -6.923  -2.671   2.843
  Start of MODEL   15
10086    HA   ASP  30           HA       ASP  30 -11.503  -2.312   3.086
  Start of MODEL   15
10087    HB3  ASP  30           HB2      ASP  30 -11.095  -2.848   5.532
  Start of MODEL   15
10088    HB2  ASP  30           HB3      ASP  30 -12.777  -2.800   5.038
  Start of MODEL   15
10089    H    ASP  30           HN       ASP  30  -9.877  -0.391   4.578
  Start of MODEL   15
10090    HA2  GLY  31           HA2      GLY  31 -15.229   0.136   3.228
  Start of MODEL   15
10091    H    GLY  31           HN       GLY  31 -13.574  -1.876   2.653
  Start of MODEL   15
10092    HA3  GLY  31           HA1      GLY  31 -14.158   0.853   2.018
  Start of MODEL   15
10093    HA   GLN  32           HA       GLN  32 -16.920  -2.253   0.059
  Start of MODEL   15
10094    HB3  GLN  32           HB2      GLN  32 -19.400  -0.556   0.134
  Start of MODEL   15
10095    HB2  GLN  32           HB3      GLN  32 -18.984  -1.396   1.611
  Start of MODEL   15
10096    HG2  GLN  32           HG2      GLN  32 -19.114  -3.540   0.442
  Start of MODEL   15
10097    HG3  GLN  32           HG3      GLN  32 -20.616  -2.643   0.319
  Start of MODEL   15
10098   HE21  GLN  32          HE21      GLN  32 -17.951  -3.991  -1.394
  Start of MODEL   15
10099   HE22  GLN  32          HE22      GLN  32 -18.527  -3.661  -2.987
  Start of MODEL   15
10100    H    GLN  32           HN       GLN  32 -17.024   0.008   1.859
  Start of MODEL   15
10101    HA   PRO  33           HA       PRO  33 -17.426   1.208  -3.296
  Start of MODEL   15
10102    HB3  PRO  33           HB2      PRO  33 -17.977   3.419  -3.003
  Start of MODEL   15
10103    HB2  PRO  33           HB3      PRO  33 -16.680   3.665  -1.829
  Start of MODEL   15
10104    HG2  PRO  33           HG2      PRO  33 -18.497   3.765  -0.407
  Start of MODEL   15
10105    HG3  PRO  33           HG3      PRO  33 -19.456   2.658  -1.407
  Start of MODEL   15
10106    HD2  PRO  33           HD2      PRO  33 -17.255   2.051   0.516
  Start of MODEL   15
10107    HD3  PRO  33           HD3      PRO  33 -18.805   1.225   0.284
  Start of MODEL   15
10108    HA   ALA  34           HA       ALA  34 -13.172   0.401  -3.018
  Start of MODEL   15
10109    HB2  ALA  34           HB1      ALA  34 -13.685   0.707  -5.963
  Start of MODEL   15
10110    HB1  ALA  34           HB2      ALA  34 -13.950  -0.756  -5.027
  Start of MODEL   15
10111    HB3  ALA  34           HB3      ALA  34 -12.316  -0.113  -5.199
  Start of MODEL   15
10112    H    ALA  34           HN       ALA  34 -15.619   0.893  -4.331
  Start of MODEL   15
10113    HA   PRO  35           HA       PRO  35 -11.586   4.586  -3.470
  Start of MODEL   15
10114    HB3  PRO  35           HB2      PRO  35 -11.303   4.332  -1.159
  Start of MODEL   15
10115    HB2  PRO  35           HB3      PRO  35  -9.630   4.431  -1.728
  Start of MODEL   15
10116    HG2  PRO  35           HG2      PRO  35  -9.329   2.140  -1.601
  Start of MODEL   15
10117    HG3  PRO  35           HG3      PRO  35 -10.423   2.372  -0.234
  Start of MODEL   15
10118    HD2  PRO  35           HD2      PRO  35 -10.952   0.707  -2.402
  Start of MODEL   15
10119    HD3  PRO  35           HD3      PRO  35 -12.200   1.405  -1.347
  Start of MODEL   15
10120    HA   SER  36           HA       SER  36  -8.004   3.667  -5.851
  Start of MODEL   15
10121    HB3  SER  36           HB2      SER  36  -8.196   6.700  -5.949
  Start of MODEL   15
10122    HB2  SER  36           HB3      SER  36  -9.111   5.621  -6.995
  Start of MODEL   15
10123    HG   SER  36           HG       SER  36  -6.758   4.802  -7.433
  Start of MODEL   15
10124    H    SER  36           HN       SER  36  -9.683   5.494  -4.314
  Start of MODEL   15
10125    HA   LEU  37           HA       LEU  37  -5.138   4.565  -2.669
  Start of MODEL   15
10126    HB3  LEU  37           HB2      LEU  37  -3.400   2.823  -2.604
  Start of MODEL   15
10127    HB2  LEU  37           HB3      LEU  37  -4.064   2.123  -4.067
  Start of MODEL   15
10128    HG   LEU  37           HG       LEU  37  -6.166   1.639  -2.833
  Start of MODEL   15
10129   HD11  LEU  37          HD11      LEU  37  -3.667   0.591  -1.524
  Start of MODEL   15
10130   HD13  LEU  37          HD12      LEU  37  -4.334   0.036  -3.051
  Start of MODEL   15
10131   HD12  LEU  37          HD13      LEU  37  -5.252  -0.196  -1.560
  Start of MODEL   15
10132   HD22  LEU  37          HD21      LEU  37  -6.097   1.803  -0.357
  Start of MODEL   15
10133   HD21  LEU  37          HD22      LEU  37  -6.058   3.374  -1.154
  Start of MODEL   15
10134   HD23  LEU  37          HD23      LEU  37  -4.574   2.683  -0.502
  Start of MODEL   15
10135    H    LEU  37           HN       LEU  37  -6.086   3.150  -5.010
  Start of MODEL   15
10136    HA   ARG  38           HA       ARG  38  -1.349   5.644  -4.810
  Start of MODEL   15
10137    HB3  ARG  38           HB2      ARG  38  -2.551   8.006  -3.336
  Start of MODEL   15
10138    HB2  ARG  38           HB3      ARG  38  -3.001   7.486  -4.943
  Start of MODEL   15
10139    HG2  ARG  38           HG2      ARG  38  -1.571   9.388  -5.088
  Start of MODEL   15
10140    HG3  ARG  38           HG3      ARG  38  -0.342   8.593  -4.105
  Start of MODEL   15
10141    HD2  ARG  38           HD2      ARG  38   0.103   8.562  -6.558
  Start of MODEL   15
10142    HD3  ARG  38           HD3      ARG  38   0.089   6.971  -5.794
  Start of MODEL   15
10143    HE   ARG  38           HE       ARG  38  -2.402   7.846  -6.972
  Start of MODEL   15
10144   HH11  ARG  38          HH11      ARG  38   0.589   5.994  -7.465
  Start of MODEL   15
10145   HH12  ARG  38          HH12      ARG  38  -0.031   5.065  -8.747
  Start of MODEL   15
10146   HH21  ARG  38          HH21      ARG  38  -3.224   6.559  -8.742
  Start of MODEL   15
10147   HH22  ARG  38          HH22      ARG  38  -2.225   5.388  -9.485
  Start of MODEL   15
10148    H    ARG  38           HN       ARG  38  -2.957   5.246  -2.469
  Start of MODEL   15
10149    HA   TRP  39           HA       TRP  39   1.278   5.916  -1.288
  Start of MODEL   15
10150    HB3  TRP  39           HB2      TRP  39   3.505   4.976  -1.842
  Start of MODEL   15
10151    HB2  TRP  39           HB3      TRP  39   3.017   4.861  -3.520
  Start of MODEL   15
10152    HD1  TRP  39           HD1      TRP  39   1.440   2.882  -4.218
  Start of MODEL   15
10153    HE1  TRP  39           HE1      TRP  39   0.758   0.725  -3.057
  Start of MODEL   15
10154    HE3  TRP  39           HE3      TRP  39   2.936   4.049   0.529
  Start of MODEL   15
10155    HZ2  TRP  39           HZ2      TRP  39   0.828  -0.369  -0.426
  Start of MODEL   15
10156    HZ3  TRP  39           HZ3      TRP  39   2.594   2.391   2.312
  Start of MODEL   15
10157    HH2  TRP  39           HH2      TRP  39   1.561   0.229   1.845
  Start of MODEL   15
10158    H    TRP  39           HN       TRP  39   0.804   5.801  -4.170
  Start of MODEL   15
10159    HA   LEU  40           HA       LEU  40   3.863   9.257  -2.243
  Start of MODEL   15
10160    HB3  LEU  40           HB2      LEU  40   3.720  11.018  -0.502
  Start of MODEL   15
10161    HB2  LEU  40           HB3      LEU  40   2.578  10.041   0.402
  Start of MODEL   15
10162    HG   LEU  40           HG       LEU  40   0.986  10.251  -1.497
  Start of MODEL   15
10163   HD13  LEU  40          HD11      LEU  40   0.915  11.834   0.378
  Start of MODEL   15
10164   HD12  LEU  40          HD12      LEU  40   0.463  12.606  -1.140
  Start of MODEL   15
10165   HD11  LEU  40          HD13      LEU  40   2.069  12.872  -0.460
  Start of MODEL   15
10166   HD23  LEU  40          HD21      LEU  40   1.508  11.955  -3.220
  Start of MODEL   15
10167   HD22  LEU  40          HD22      LEU  40   2.514  10.507  -3.296
  Start of MODEL   15
10168   HD21  LEU  40          HD23      LEU  40   3.164  11.991  -2.580
  Start of MODEL   15
10169    H    LEU  40           HN       LEU  40   2.242   7.594  -0.469
  Start of MODEL   15
10170    HA   PHE  41           HA       PHE  41   6.998   8.177   0.546
  Start of MODEL   15
10171    HB3  PHE  41           HB2      PHE  41   8.013   8.228  -2.308
  Start of MODEL   15
10172    HB2  PHE  41           HB3      PHE  41   7.377   6.835  -1.444
  Start of MODEL   15
10173    HD1  PHE  41           HD1      PHE  41  10.220   7.883  -2.750
  Start of MODEL   15
10174    HD2  PHE  41           HD2      PHE  41   8.704   6.791   1.063
  Start of MODEL   15
10175    HE1  PHE  41           HE1      PHE  41  12.478   7.274  -2.032
  Start of MODEL   15
10176    HE2  PHE  41           HE2      PHE  41  10.965   6.183   1.792
  Start of MODEL   15
10177    HZ   PHE  41           HZ       PHE  41  12.856   6.422   0.248
  Start of MODEL   15
10178    H    PHE  41           HN       PHE  41   5.898   9.568  -1.775
  Start of MODEL   15
10179    HA   ASN  42           HA       ASN  42   8.397  11.644   2.657
  Start of MODEL   15
10180    HB3  ASN  42           HB2      ASN  42  10.383  12.725   1.426
  Start of MODEL   15
10181    HB2  ASN  42           HB3      ASN  42  10.204  11.437   0.241
  Start of MODEL   15
10182   HD21  ASN  42          HD21      ASN  42  12.180  10.538   0.652
  Start of MODEL   15
10183   HD22  ASN  42          HD22      ASN  42  12.563   9.729   2.120
  Start of MODEL   15
10184    H    ASN  42           HN       ASN  42   7.520   9.761   1.788
  Start of MODEL   15
10185    HA2  GLY  43           HA2      GLY  43   4.655  13.452   0.517
  Start of MODEL   15
10186    H    GLY  43           HN       GLY  43   6.143  11.701   0.966
  Start of MODEL   15
10187    HA3  GLY  43           HA1      GLY  43   6.014  14.568   0.528
  Start of MODEL   15
10188    HA   SER  44           HA       SER  44   6.397  13.643  -3.811
  Start of MODEL   15
10189    HB3  SER  44           HB2      SER  44   8.416  12.680  -4.660
  Start of MODEL   15
10190    HB2  SER  44           HB3      SER  44   8.569  11.619  -3.257
  Start of MODEL   15
10191    HG   SER  44           HG       SER  44   9.603  13.145  -2.317
  Start of MODEL   15
10192    H    SER  44           HN       SER  44   7.198  12.317  -1.318
  Start of MODEL   15
10193    HA   VAL  45           HA       VAL  45   3.977  10.374  -4.885
  Start of MODEL   15
10194    HB   VAL  45           HB       VAL  45   4.734  11.497  -7.602
  Start of MODEL   15
10195    H    VAL  45           HN       VAL  45   5.728  12.500  -5.557
  Start of MODEL   15
10196    HA   LEU  46           HA       LEU  46   7.044   7.374  -5.675
  Start of MODEL   15
10197    HB3  LEU  46           HB2      LEU  46   4.907   6.083  -3.971
  Start of MODEL   15
10198    HB2  LEU  46           HB3      LEU  46   6.339   6.876  -3.353
  Start of MODEL   15
10199    HG   LEU  46           HG       LEU  46   6.343   4.374  -5.046
  Start of MODEL   15
10200   HD12  LEU  46          HD11      LEU  46   8.700   4.222  -4.398
  Start of MODEL   15
10201   HD11  LEU  46          HD12      LEU  46   8.570   5.783  -3.590
  Start of MODEL   15
10202   HD13  LEU  46          HD13      LEU  46   8.365   5.675  -5.338
  Start of MODEL   15
10203   HD23  LEU  46          HD21      LEU  46   6.757   4.729  -2.077
  Start of MODEL   15
10204   HD22  LEU  46          HD22      LEU  46   6.975   3.226  -2.975
  Start of MODEL   15
10205   HD21  LEU  46          HD23      LEU  46   5.375   3.956  -2.856
  Start of MODEL   15
10206    H    LEU  46           HN       LEU  46   4.559   8.382  -4.598
  Start of MODEL   15
10207    HA   ASN  47           HA       ASN  47   4.525   5.589  -8.742
  Start of MODEL   15
10208    HB3  ASN  47           HB2      ASN  47   7.253   5.856 -10.039
  Start of MODEL   15
10209    HB2  ASN  47           HB3      ASN  47   6.016   7.103 -10.035
  Start of MODEL   15
10210   HD21  ASN  47          HD21      ASN  47   4.245   6.873 -11.330
  Start of MODEL   15
10211   HD22  ASN  47          HD22      ASN  47   4.140   5.731 -12.618
  Start of MODEL   15
10212    H    ASN  47           HN       ASN  47   7.086   6.299  -7.559
  Start of MODEL   15
10213    HA   GLU  48           HA       GLU  48   5.744   1.442  -7.877
  Start of MODEL   15
10214    HB3  GLU  48           HB2      GLU  48   4.122  -0.178  -8.681
  Start of MODEL   15
10215    HB2  GLU  48           HB3      GLU  48   3.394   1.013  -9.742
  Start of MODEL   15
10216    HG2  GLU  48           HG2      GLU  48   2.256   0.366  -7.474
  Start of MODEL   15
10217    HG3  GLU  48           HG3      GLU  48   3.397   1.531  -6.811
  Start of MODEL   15
10218    H    GLU  48           HN       GLU  48   4.024   3.445  -8.775
  Start of MODEL   15
10219    HA   THR  49           HA       THR  49   7.700   0.686 -11.666
  Start of MODEL   15
10220    HB   THR  49           HB       THR  49   8.809   2.702 -10.807
  Start of MODEL   15
10221    HG1  THR  49           HG1      THR  49   9.916   2.048 -12.479
  Start of MODEL   15
10222   HG21  THR  49          HG21      THR  49  10.456   0.823  -9.107
  Start of MODEL   15
10223   HG23  THR  49          HG22      THR  49   9.267   1.986  -8.531
  Start of MODEL   15
10224   HG22  THR  49          HG23      THR  49  10.756   2.555  -9.292
  Start of MODEL   15
10225    H    THR  49           HN       THR  49   7.417   0.655  -8.767
  Start of MODEL   15
10226    HA   SER  50           HA       SER  50   9.691  -3.162 -11.561
  Start of MODEL   15
10227    HB3  SER  50           HB2      SER  50  11.871  -3.460 -12.414
  Start of MODEL   15
10228    HB2  SER  50           HB3      SER  50  12.405  -1.899 -11.778
  Start of MODEL   15
10229    HG   SER  50           HG       SER  50  11.064  -2.495 -14.105
  Start of MODEL   15
10230    H    SER  50           HN       SER  50  10.218  -0.445 -11.857
  Start of MODEL   15
10231    HA   PHE  51           HA       PHE  51  12.482  -2.987  -7.760
  Start of MODEL   15
10232    HB3  PHE  51           HB2      PHE  51  13.307  -1.094  -6.398
  Start of MODEL   15
10233    HB2  PHE  51           HB3      PHE  51  12.408   0.013  -7.425
  Start of MODEL   15
10234    HD1  PHE  51           HD1      PHE  51  15.363  -2.082  -7.164
  Start of MODEL   15
10235    HD2  PHE  51           HD2      PHE  51  13.113   0.480  -9.702
  Start of MODEL   15
10236    HE1  PHE  51           HE1      PHE  51  17.298  -1.885  -8.673
  Start of MODEL   15
10237    HE2  PHE  51           HE2      PHE  51  15.038   0.678 -11.218
  Start of MODEL   15
10238    HZ   PHE  51           HZ       PHE  51  17.134  -0.503 -10.702
  Start of MODEL   15
10239    H    PHE  51           HN       PHE  51  11.327  -0.929  -9.435
  Start of MODEL   15
10240    HA   ILE  52           HA       ILE  52   8.947  -1.860  -4.964
  Start of MODEL   15
10241    HB   ILE  52           HB       ILE  52   8.471   0.999  -5.861
  Start of MODEL   15
10242   HD12  ILE  52          HD11      ILE  52  11.597   2.373  -4.344
  Start of MODEL   15
10243   HD11  ILE  52          HD12      ILE  52  10.011   2.335  -3.572
  Start of MODEL   15
10244   HD13  ILE  52          HD13      ILE  52  10.158   2.808  -5.268
  Start of MODEL   15
10245    H    ILE  52           HN       ILE  52   9.697  -0.833  -7.641
  Start of MODEL   15
10246    HA   PHE  53           HA       PHE  53   5.080  -1.375  -7.040
  Start of MODEL   15
10247    HB3  PHE  53           HB2      PHE  53   6.117  -2.926  -8.636
  Start of MODEL   15
10248    HB2  PHE  53           HB3      PHE  53   4.411  -3.279  -8.425
  Start of MODEL   15
10249    HD1  PHE  53           HD1      PHE  53   7.790  -4.429  -7.599
  Start of MODEL   15
10250    HD2  PHE  53           HD2      PHE  53   3.656  -5.407  -7.698
  Start of MODEL   15
10251    HE1  PHE  53           HE1      PHE  53   8.343  -6.791  -7.131
  Start of MODEL   15
10252    HE2  PHE  53           HE2      PHE  53   4.211  -7.775  -7.225
  Start of MODEL   15
10253    HZ   PHE  53           HZ       PHE  53   6.447  -8.496  -7.065
  Start of MODEL   15
10254    H    PHE  53           HN       PHE  53   6.930  -2.919  -5.425
  Start of MODEL   15
10255    HA   THR  54           HA       THR  54   2.310  -2.876  -4.093
  Start of MODEL   15
10256    HB   THR  54           HB       THR  54   0.426  -1.543  -6.062
  Start of MODEL   15
10257    HG1  THR  54           HG1      THR  54   2.563  -0.505  -5.087
  Start of MODEL   15
10258   HG23  THR  54          HG21      THR  54  -0.639  -2.666  -4.155
  Start of MODEL   15
10259   HG22  THR  54          HG22      THR  54  -0.797  -0.913  -4.024
  Start of MODEL   15
10260   HG21  THR  54          HG23      THR  54   0.394  -1.767  -3.046
  Start of MODEL   15
10261    H    THR  54           HN       THR  54   2.821  -2.058  -6.853
  Start of MODEL   15
10262    HA   GLU  55           HA       GLU  55   0.316  -6.231  -6.129
  Start of MODEL   15
10263    HB3  GLU  55           HB2      GLU  55   2.087  -7.573  -4.084
  Start of MODEL   15
10264    HB2  GLU  55           HB3      GLU  55   2.570  -7.206  -5.730
  Start of MODEL   15
10265    HG2  GLU  55           HG2      GLU  55   0.402  -9.106  -4.873
  Start of MODEL   15
10266    HG3  GLU  55           HG3      GLU  55   0.766  -8.688  -6.544
  Start of MODEL   15
10267    H    GLU  55           HN       GLU  55   1.832  -5.012  -3.935
  Start of MODEL   15
10268    HA   PHE  56           HA       PHE  56  -2.638  -6.636  -2.918
  Start of MODEL   15
10269    HB3  PHE  56           HB2      PHE  56  -4.860  -6.523  -3.943
  Start of MODEL   15
10270    HB2  PHE  56           HB3      PHE  56  -4.131  -6.643  -5.536
  Start of MODEL   15
10271    HD1  PHE  56           HD1      PHE  56  -4.581  -4.466  -2.615
  Start of MODEL   15
10272    HD2  PHE  56           HD2      PHE  56  -3.139  -4.804  -6.592
  Start of MODEL   15
10273    HE1  PHE  56           HE1      PHE  56  -4.344  -2.029  -2.727
  Start of MODEL   15
10274    HE2  PHE  56           HE2      PHE  56  -2.902  -2.388  -6.718
  Start of MODEL   15
10275    HZ   PHE  56           HZ       PHE  56  -3.667  -0.966  -4.809
  Start of MODEL   15
10276    H    PHE  56           HN       PHE  56  -1.704  -6.677  -5.687
  Start of MODEL   15
10277    HA   LEU  57           HA       LEU  57  -3.601 -10.835  -3.615
  Start of MODEL   15
10278    HB3  LEU  57           HB2      LEU  57  -2.836 -10.945  -1.276
  Start of MODEL   15
10279    HB2  LEU  57           HB3      LEU  57  -4.212 -11.995  -1.524
  Start of MODEL   15
10280    HG   LEU  57           HG       LEU  57  -4.605  -9.320  -0.260
  Start of MODEL   15
10281   HD11  LEU  57          HD11      LEU  57  -6.085 -11.931  -0.129
  Start of MODEL   15
10282   HD13  LEU  57          HD12      LEU  57  -6.592 -10.496  -1.002
  Start of MODEL   15
10283   HD12  LEU  57          HD13      LEU  57  -6.520 -10.474   0.770
  Start of MODEL   15
10284   HD21  LEU  57          HD21      LEU  57  -2.859 -10.412   1.019
  Start of MODEL   15
10285   HD23  LEU  57          HD22      LEU  57  -3.814 -11.889   1.092
  Start of MODEL   15
10286   HD22  LEU  57          HD23      LEU  57  -4.376 -10.437   1.918
  Start of MODEL   15
10287    H    LEU  57           HN       LEU  57  -3.990  -8.352  -2.144
  Start of MODEL   15
10288    HA   GLU  58           HA       GLU  58  -7.680 -10.838  -4.814
  Start of MODEL   15
10289    HB3  GLU  58           HB2      GLU  58  -8.650 -13.111  -5.095
  Start of MODEL   15
10290    HB2  GLU  58           HB3      GLU  58  -7.291 -13.727  -4.160
  Start of MODEL   15
10291    HG2  GLU  58           HG2      GLU  58  -5.735 -12.990  -5.857
  Start of MODEL   15
10292    HG3  GLU  58           HG3      GLU  58  -6.972 -14.031  -6.565
  Start of MODEL   15
10293    H    GLU  58           HN       GLU  58  -5.516 -12.275  -3.680
  Start of MODEL   15
10294    HA   PRO  59           HA       PRO  59  -9.758 -10.654  -0.778
  Start of MODEL   15
10295    HB3  PRO  59           HB2      PRO  59 -10.608  -8.532  -0.873
  Start of MODEL   15
10296    HB2  PRO  59           HB3      PRO  59 -11.773  -9.019  -2.102
  Start of MODEL   15
10297    HG2  PRO  59           HG2      PRO  59 -10.478  -7.661  -3.439
  Start of MODEL   15
10298    HG3  PRO  59           HG3      PRO  59  -9.040  -7.894  -2.427
  Start of MODEL   15
10299    HD2  PRO  59           HD2      PRO  59 -10.199  -9.711  -4.513
  Start of MODEL   15
10300    HD3  PRO  59           HD3      PRO  59  -8.505  -9.228  -4.239
  Start of MODEL   15
10301    HA   ALA  60           HA       ALA  60 -13.022 -13.388  -1.709
  Start of MODEL   15
10302    HB3  ALA  60           HB1      ALA  60 -12.382 -14.063   0.551
  Start of MODEL   15
10303    HB2  ALA  60           HB2      ALA  60 -14.139 -14.075   0.383
  Start of MODEL   15
10304    HB1  ALA  60           HB3      ALA  60 -13.339 -12.747   1.225
  Start of MODEL   15
10305    H    ALA  60           HN       ALA  60 -11.671 -11.506   0.013
  Start of MODEL   15
10306    HA   ALA  61           HA       ALA  61 -16.150 -10.907  -2.986
  Start of MODEL   15
10307    HB2  ALA  61           HB1      ALA  61 -18.202 -12.085  -3.526
  Start of MODEL   15
10308    HB1  ALA  61           HB2      ALA  61 -17.689 -13.433  -2.509
  Start of MODEL   15
10309    HB3  ALA  61           HB3      ALA  61 -16.769 -13.016  -3.955
  Start of MODEL   15
10310    H    ALA  61           HN       ALA  61 -15.210 -13.335  -2.069
  Start of MODEL   15
10311    HA   ASN  62           HA       ASN  62 -18.792 -10.407   0.632
  Start of MODEL   15
10312    HB3  ASN  62           HB2      ASN  62 -19.039 -11.637   2.851
  Start of MODEL   15
10313    HB2  ASN  62           HB3      ASN  62 -17.905 -12.820   2.200
  Start of MODEL   15
10314   HD21  ASN  62          HD21      ASN  62 -21.087 -11.512   1.946
  Start of MODEL   15
10315   HD22  ASN  62          HD22      ASN  62 -21.728 -12.773   0.954
  Start of MODEL   15
10316    H    ASN  62           HN       ASN  62 -16.694 -12.358   0.119
  Start of MODEL   15
10317    HA   GLU  63           HA       GLU  63 -15.319  -9.006   3.292
  Start of MODEL   15
10318    HB3  GLU  63           HB2      GLU  63 -12.904  -8.707   2.535
  Start of MODEL   15
10319    HB2  GLU  63           HB3      GLU  63 -13.305  -9.733   1.172
  Start of MODEL   15
10320    HG2  GLU  63           HG2      GLU  63 -13.964 -11.497   2.760
  Start of MODEL   15
10321    HG3  GLU  63           HG3      GLU  63 -12.246 -11.074   2.838
  Start of MODEL   15
10322    H    GLU  63           HN       GLU  63 -15.559 -10.358   0.747
  Start of MODEL   15
10323    HA   THR  64           HA       THR  64 -15.208  -5.208   1.146
  Start of MODEL   15
10324    HB   THR  64           HB       THR  64 -15.802  -3.404   2.830
  Start of MODEL   15
10325    HG1  THR  64           HG1      THR  64 -15.499  -3.934   4.805
  Start of MODEL   15
10326   HG21  THR  64          HG21      THR  64 -17.621  -5.812   2.694
  Start of MODEL   15
10327   HG23  THR  64          HG22      THR  64 -17.537  -4.499   1.518
  Start of MODEL   15
10328   HG22  THR  64          HG23      THR  64 -18.123  -4.183   3.154
  Start of MODEL   15
10329    H    THR  64           HN       THR  64 -15.133  -6.865   3.538
  Start of MODEL   15
10330    HA   VAL  65           HA       VAL  65 -11.302  -4.293   3.452
  Start of MODEL   15
10331    HB   VAL  65           HB       VAL  65 -10.767  -7.077   4.449
  Start of MODEL   15
10332    H    VAL  65           HN       VAL  65 -13.097  -6.582   3.177
  Start of MODEL   15
10333    HA   ARG  66           HA       ARG  66  -8.950  -6.248   0.321
  Start of MODEL   15
10334    HB3  ARG  66           HB2      ARG  66  -8.450  -3.289   0.152
  Start of MODEL   15
10335    HB2  ARG  66           HB3      ARG  66  -9.789  -4.107  -0.630
  Start of MODEL   15
10336    HG2  ARG  66           HG2      ARG  66  -6.885  -4.574  -1.239
  Start of MODEL   15
10337    HG3  ARG  66           HG3      ARG  66  -8.264  -5.334  -2.046
  Start of MODEL   15
10338    HD2  ARG  66           HD2      ARG  66  -7.540  -2.411  -2.020
  Start of MODEL   15
10339    HD3  ARG  66           HD3      ARG  66  -7.544  -3.470  -3.420
  Start of MODEL   15
10340    HE   ARG  66           HE       ARG  66  -9.874  -2.484  -1.956
  Start of MODEL   15
10341   HH11  ARG  66          HH11      ARG  66  -8.571  -3.931  -4.925
  Start of MODEL   15
10342   HH12  ARG  66          HH12      ARG  66 -10.032  -3.800  -5.776
  Start of MODEL   15
10343   HH21  ARG  66          HH21      ARG  66 -11.871  -2.361  -3.128
  Start of MODEL   15
10344   HH22  ARG  66          HH22      ARG  66 -11.943  -2.908  -4.734
  Start of MODEL   15
10345    H    ARG  66           HN       ARG  66  -9.652  -4.067   2.149
  Start of MODEL   15
10346    HA   HIS  67           HA       HIS  67  -5.091  -5.682   2.345
  Start of MODEL   15
10347    HB3  HIS  67           HB2      HIS  67  -4.081  -7.951   2.830
  Start of MODEL   15
10348    HB2  HIS  67           HB3      HIS  67  -5.508  -8.655   2.085
  Start of MODEL   15
10349    HD1  HIS  67           HD1      HIS  67  -4.296  -7.244   5.260
  Start of MODEL   15
10350    HD2  HIS  67           HD2      HIS  67  -7.929  -8.278   3.539
  Start of MODEL   15
10351    HE1  HIS  67           HE1      HIS  67  -5.898  -7.446   7.156
  Start of MODEL   15
10352    HE2  HIS  67           HE2      HIS  67  -7.987  -8.390   6.093
  Start of MODEL   15
10353    H    HIS  67           HN       HIS  67  -7.035  -7.183   0.740
  Start of MODEL   15
10354    HA2  GLY  68           HA2      GLY  68  -2.175  -7.049  -0.657
  Start of MODEL   15
10355    H    GLY  68           HN       GLY  68  -2.983  -5.640   1.716
  Start of MODEL   15
10356    HA3  GLY  68           HA1      GLY  68  -2.270  -5.294  -0.814
  Start of MODEL   15
10357    HA   CYS  69           HA       CYS  69   1.576  -5.438   1.163
  Start of MODEL   15
10358    HB3  CYS  69           HB2      CYS  69   1.949  -7.814  -0.656
  Start of MODEL   15
10359    HB2  CYS  69           HB3      CYS  69   1.857  -7.789   1.095
  Start of MODEL   15
10360    H    CYS  69           HN       CYS  69   0.088  -6.122  -1.247
  Start of MODEL   15
10361    HA   LEU  70           HA       LEU  70   3.625  -3.218  -2.030
  Start of MODEL   15
10362    HB3  LEU  70           HB2      LEU  70   4.512  -1.843   0.522
  Start of MODEL   15
10363    HB2  LEU  70           HB3      LEU  70   3.109  -1.348  -0.401
  Start of MODEL   15
10364    HG   LEU  70           HG       LEU  70   5.941  -1.341  -1.458
  Start of MODEL   15
10365   HD13  LEU  70          HD11      LEU  70   4.315  -1.519  -3.225
  Start of MODEL   15
10366   HD12  LEU  70          HD12      LEU  70   5.020   0.105  -3.204
  Start of MODEL   15
10367   HD11  LEU  70          HD13      LEU  70   3.408  -0.162  -2.554
  Start of MODEL   15
10368   HD23  LEU  70          HD21      LEU  70   4.297   0.927  -0.361
  Start of MODEL   15
10369   HD22  LEU  70          HD22      LEU  70   5.814   1.097  -1.237
  Start of MODEL   15
10370   HD21  LEU  70          HD23      LEU  70   5.790   0.267   0.322
  Start of MODEL   15
10371    H    LEU  70           HN       LEU  70   2.948  -3.822   0.739
  Start of MODEL   15
10372    HA   ARG  71           HA       ARG  71   7.046  -5.586  -0.812
  Start of MODEL   15
10373    HB3  ARG  71           HB2      ARG  71   5.665  -7.433  -1.501
  Start of MODEL   15
10374    HB2  ARG  71           HB3      ARG  71   7.261  -7.611  -2.205
  Start of MODEL   15
10375    HG2  ARG  71           HG2      ARG  71   4.896  -6.529  -3.709
  Start of MODEL   15
10376    HG3  ARG  71           HG3      ARG  71   6.473  -6.970  -4.365
  Start of MODEL   15
10377    HD2  ARG  71           HD2      ARG  71   4.455  -8.851  -3.122
  Start of MODEL   15
10378    HD3  ARG  71           HD3      ARG  71   4.825  -8.707  -4.833
  Start of MODEL   15
10379    HE   ARG  71           HE       ARG  71   7.201  -9.277  -3.606
  Start of MODEL   15
10380   HH11  ARG  71          HH11      ARG  71   4.070 -10.936  -4.048
  Start of MODEL   15
10381   HH12  ARG  71          HH12      ARG  71   4.694 -12.488  -3.773
  Start of MODEL   15
10382   HH21  ARG  71          HH21      ARG  71   8.040 -11.448  -3.229
  Start of MODEL   15
10383   HH22  ARG  71          HH22      ARG  71   7.032 -12.789  -3.301
  Start of MODEL   15
10384    H    ARG  71           HN       ARG  71   4.947  -4.774  -2.646
  Start of MODEL   15
10385    HA   LEU  72           HA       LEU  72   9.635  -3.777  -3.639
  Start of MODEL   15
10386    HB3  LEU  72           HB2      LEU  72  11.751  -3.103  -2.581
  Start of MODEL   15
10387    HB2  LEU  72           HB3      LEU  72  11.319  -3.966  -1.126
  Start of MODEL   15
10388    HG   LEU  72           HG       LEU  72   9.400  -1.950  -2.087
  Start of MODEL   15
10389   HD11  LEU  72          HD11      LEU  72  10.445  -2.593   0.639
  Start of MODEL   15
10390   HD13  LEU  72          HD12      LEU  72   8.923  -3.147  -0.066
  Start of MODEL   15
10391   HD12  LEU  72          HD13      LEU  72   9.166  -1.429   0.278
  Start of MODEL   15
10392   HD21  LEU  72          HD21      LEU  72  11.558  -0.866  -2.468
  Start of MODEL   15
10393   HD23  LEU  72          HD22      LEU  72  11.946  -1.079  -0.749
  Start of MODEL   15
10394   HD22  LEU  72          HD23      LEU  72  10.565  -0.085  -1.254
  Start of MODEL   15
10395    H    LEU  72           HN       LEU  72   8.996  -5.051  -1.134
  Start of MODEL   15
10396    HA   ASN  73           HA       ASN  73  11.033  -7.531  -5.211
  Start of MODEL   15
10397    HB3  ASN  73           HB2      ASN  73  11.685  -5.435  -7.289
  Start of MODEL   15
10398    HB2  ASN  73           HB3      ASN  73  10.062  -6.056  -7.097
  Start of MODEL   15
10399   HD21  ASN  73          HD21      ASN  73  10.006  -6.910  -9.143
  Start of MODEL   15
10400   HD22  ASN  73          HD22      ASN  73  10.903  -8.298  -9.610
  Start of MODEL   15
10401    H    ASN  73           HN       ASN  73  10.273  -4.823  -5.148
  Start of MODEL   15
10402    HA   GLN  74           HA       GLN  74  15.178  -5.779  -4.436
  Start of MODEL   15
10403    HB3  GLN  74           HB2      GLN  74  16.570  -4.352  -6.040
  Start of MODEL   15
10404    HB2  GLN  74           HB3      GLN  74  15.088  -4.095  -6.950
  Start of MODEL   15
10405    HG2  GLN  74           HG2      GLN  74  14.908  -6.540  -7.272
  Start of MODEL   15
10406    HG3  GLN  74           HG3      GLN  74  16.320  -5.808  -8.031
  Start of MODEL   15
10407   HE21  GLN  74          HE21      GLN  74  15.200  -7.840  -5.451
  Start of MODEL   15
10408   HE22  GLN  74          HE22      GLN  74  16.733  -8.512  -5.041
  Start of MODEL   15
10409    H    GLN  74           HN       GLN  74  12.823  -4.522  -5.602
  Start of MODEL   15
10410    HA   PRO  75           HA       PRO  75  14.323  -1.876  -2.331
  Start of MODEL   15
10411    HB3  PRO  75           HB2      PRO  75  13.654  -2.684  -0.317
  Start of MODEL   15
10412    HB2  PRO  75           HB3      PRO  75  15.338  -3.000   0.096
  Start of MODEL   15
10413    HG2  PRO  75           HG2      PRO  75  14.773  -5.208   0.008
  Start of MODEL   15
10414    HG3  PRO  75           HG3      PRO  75  13.264  -4.867  -0.848
  Start of MODEL   15
10415    HD2  PRO  75           HD2      PRO  75  15.995  -5.370  -1.928
  Start of MODEL   15
10416    HD3  PRO  75           HD3      PRO  75  14.407  -5.829  -2.587
  Start of MODEL   15
10417    HA   THR  76           HA       THR  76  18.602  -0.892  -1.716
  Start of MODEL   15
10418    HB   THR  76           HB       THR  76  18.963   1.216  -3.180
  Start of MODEL   15
10419    HG1  THR  76           HG1      THR  76  16.221   0.993  -3.225
  Start of MODEL   15
10420   HG21  THR  76          HG21      THR  76  17.725  -1.249  -4.433
  Start of MODEL   15
10421   HG23  THR  76          HG22      THR  76  19.424  -1.065  -4.000
  Start of MODEL   15
10422   HG22  THR  76          HG23      THR  76  18.723  -0.063  -5.271
  Start of MODEL   15
10423    H    THR  76           HN       THR  76  15.765  -0.211  -1.829
  Start of MODEL   15
10424    HA   HIS  77           HA       HIS  77  18.941   2.111   1.358
  Start of MODEL   15
10425    HB3  HIS  77           HB2      HIS  77  21.395   2.223   0.574
  Start of MODEL   15
10426    HB2  HIS  77           HB3      HIS  77  20.860   3.495   1.650
  Start of MODEL   15
10427    HD1  HIS  77           HD1      HIS  77  22.276   2.975  -1.754
  Start of MODEL   15
10428    HD2  HIS  77           HD2      HIS  77  20.685   6.090   0.493
  Start of MODEL   15
10429    HE1  HIS  77           HE1      HIS  77  22.883   5.066  -2.973
  Start of MODEL   15
10430    HE2  HIS  77           HE2      HIS  77  22.217   6.909  -1.413
  Start of MODEL   15
10431    H    HIS  77           HN       HIS  77  19.841   1.505  -1.283
  Start of MODEL   15
10432    HA   VAL  78           HA       VAL  78  17.484   6.043  -0.862
  Start of MODEL   15
10433    HB   VAL  78           HB       VAL  78  16.417   6.322  -2.984
  Start of MODEL   15
10434    H    VAL  78           HN       VAL  78  18.118   3.375  -1.650
  Start of MODEL   15
10435    HA   ASN  79           HA       ASN  79  13.360   4.000  -0.175
  Start of MODEL   15
10436    HB3  ASN  79           HB2      ASN  79  12.883   1.675   0.606
  Start of MODEL   15
10437    HB2  ASN  79           HB3      ASN  79  14.620   1.367   0.548
  Start of MODEL   15
10438   HD21  ASN  79          HD21      ASN  79  11.865   2.306  -1.318
  Start of MODEL   15
10439   HD22  ASN  79          HD22      ASN  79  12.494   1.811  -2.857
  Start of MODEL   15
10440    H    ASN  79           HN       ASN  79  16.098   3.126  -0.144
  Start of MODEL   15
10441    HA   ASN  80           HA       ASN  80  14.345   4.358   4.322
  Start of MODEL   15
10442    HB3  ASN  80           HB2      ASN  80  16.167   5.906   5.170
  Start of MODEL   15
10443    HB2  ASN  80           HB3      ASN  80  16.784   5.985   3.531
  Start of MODEL   15
10444   HD21  ASN  80          HD21      ASN  80  18.115   5.073   5.908
  Start of MODEL   15
10445   HD22  ASN  80          HD22      ASN  80  18.648   3.485   5.552
  Start of MODEL   15
10446    H    ASN  80           HN       ASN  80  15.578   4.894   1.738
  Start of MODEL   15
10447    HA2  GLY  81           HA2      GLY  81  12.412   8.188   4.651
  Start of MODEL   15
10448    H    GLY  81           HN       GLY  81  12.403   5.406   4.224
  Start of MODEL   15
10449    HA3  GLY  81           HA1      GLY  81  11.891   7.846   3.006
  Start of MODEL   15
10450    HA   ASN  82           HA       ASN  82   8.341   7.270   5.657
  Start of MODEL   15
10451    HB3  ASN  82           HB2      ASN  82   7.942  10.122   4.735
  Start of MODEL   15
10452    HB2  ASN  82           HB3      ASN  82   8.526   9.615   6.318
  Start of MODEL   15
10453   HD21  ASN  82          HD21      ASN  82   7.080   8.753   7.785
  Start of MODEL   15
10454   HD22  ASN  82          HD22      ASN  82   5.361   8.851   7.570
  Start of MODEL   15
10455    H    ASN  82           HN       ASN  82  10.014   8.977   3.998
  Start of MODEL   15
10456    HA   TYR  83           HA       TYR  83   5.947   6.373   2.104
  Start of MODEL   15
10457    HB3  TYR  83           HB2      TYR  83   5.167   3.945   2.524
  Start of MODEL   15
10458    HB2  TYR  83           HB3      TYR  83   6.078   4.025   4.047
  Start of MODEL   15
10459    HD1  TYR  83           HD1      TYR  83   6.320   3.083   0.639
  Start of MODEL   15
10460    HD2  TYR  83           HD2      TYR  83   8.571   4.681   3.885
  Start of MODEL   15
10461    HE1  TYR  83           HE1      TYR  83   8.390   2.369  -0.445
  Start of MODEL   15
10462    HE2  TYR  83           HE2      TYR  83  10.644   3.965   2.793
  Start of MODEL   15
10463    HH   TYR  83           HH       TYR  83  11.388   2.476   1.237
  Start of MODEL   15
10464    H    TYR  83           HN       TYR  83   6.870   6.037   4.843
  Start of MODEL   15
10465    HA   THR  84           HA       THR  84   2.018   6.636   4.116
  Start of MODEL   15
10466    HB   THR  84           HB       THR  84   2.198   9.089   2.334
  Start of MODEL   15
10467    HG1  THR  84           HG1      THR  84   3.552   8.504   4.453
  Start of MODEL   15
10468   HG23  THR  84          HG21      THR  84  -0.135   8.537   2.945
  Start of MODEL   15
10469   HG22  THR  84          HG22      THR  84   0.408  10.015   3.727
  Start of MODEL   15
10470   HG21  THR  84          HG23      THR  84   0.322   8.513   4.649
  Start of MODEL   15
10471    H    THR  84           HN       THR  84   3.856   7.007   1.860
  Start of MODEL   15
10472    HA   LEU  85           HA       LEU  85  -0.355   5.277   0.719
  Start of MODEL   15
10473    HB3  LEU  85           HB2      LEU  85  -1.476   3.769   3.082
  Start of MODEL   15
10474    HB2  LEU  85           HB3      LEU  85  -0.156   3.199   2.072
  Start of MODEL   15
10475    HG   LEU  85           HG       LEU  85  -3.018   3.615   1.194
  Start of MODEL   15
10476   HD12  LEU  85          HD11      LEU  85  -2.256   2.502  -0.854
  Start of MODEL   15
10477   HD11  LEU  85          HD12      LEU  85  -0.602   2.595  -0.202
  Start of MODEL   15
10478   HD13  LEU  85          HD13      LEU  85  -1.485   4.077  -0.587
  Start of MODEL   15
10479   HD22  LEU  85          HD21      LEU  85  -3.088   1.225   1.020
  Start of MODEL   15
10480   HD21  LEU  85          HD22      LEU  85  -2.661   1.702   2.667
  Start of MODEL   15
10481   HD23  LEU  85          HD23      LEU  85  -1.416   1.103   1.569
  Start of MODEL   15
10482    H    LEU  85           HN       LEU  85   0.225   5.604   3.562
  Start of MODEL   15
10483    HA   LEU  86           HA       LEU  86  -3.917   7.615   1.651
  Start of MODEL   15
10484    HB3  LEU  86           HB2      LEU  86  -4.293   9.204  -0.185
  Start of MODEL   15
10485    HB2  LEU  86           HB3      LEU  86  -3.093   8.399  -1.157
  Start of MODEL   15
10486    HG   LEU  86           HG       LEU  86  -2.419  10.589  -0.200
  Start of MODEL   15
10487   HD12  LEU  86          HD11      LEU  86  -1.666  10.686   2.101
  Start of MODEL   15
10488   HD11  LEU  86          HD12      LEU  86  -2.390   9.101   2.390
  Start of MODEL   15
10489   HD13  LEU  86          HD13      LEU  86  -3.409  10.470   1.945
  Start of MODEL   15
10490   HD21  LEU  86          HD21      LEU  86  -0.751   9.041  -1.026
  Start of MODEL   15
10491   HD23  LEU  86          HD22      LEU  86  -0.714   8.217   0.533
  Start of MODEL   15
10492   HD22  LEU  86          HD23      LEU  86  -0.147   9.884   0.403
  Start of MODEL   15
10493    H    LEU  86           HN       LEU  86  -1.932   6.366  -0.110
  Start of MODEL   15
10494    HA   ALA  87           HA       ALA  87  -6.552   5.669  -1.251
  Start of MODEL   15
10495    HB3  ALA  87           HB1      ALA  87  -6.918   4.226   0.743
  Start of MODEL   15
10496    HB2  ALA  87           HB2      ALA  87  -8.416   4.545  -0.116
  Start of MODEL   15
10497    HB1  ALA  87           HB3      ALA  87  -8.050   5.419   1.370
  Start of MODEL   15
10498    H    ALA  87           HN       ALA  87  -5.980   7.091   1.268
  Start of MODEL   15
10499    HA   ALA  88           HA       ALA  88  -9.050   9.190  -1.460
  Start of MODEL   15
10500    HB1  ALA  88           HB1      ALA  88  -8.283   8.471  -4.291
  Start of MODEL   15
10501    HB3  ALA  88           HB2      ALA  88  -7.473   9.636  -3.234
  Start of MODEL   15
10502    HB2  ALA  88           HB3      ALA  88  -9.105   9.956  -3.807
  Start of MODEL   15
10503    H    ALA  88           HN       ALA  88  -7.635   6.902  -2.548
  Start of MODEL   15
10504    HA   ASN  89           HA       ASN  89 -12.811   7.364  -2.843
  Start of MODEL   15
10505    HB3  ASN  89           HB2      ASN  89 -12.636   7.451   0.188
  Start of MODEL   15
10506    HB2  ASN  89           HB3      ASN  89 -11.972   6.164  -0.795
  Start of MODEL   15
10507   HD21  ASN  89          HD21      ASN  89 -13.361   4.650  -1.735
  Start of MODEL   15
10508   HD22  ASN  89          HD22      ASN  89 -14.990   4.492  -1.243
  Start of MODEL   15
10509    H    ASN  89           HN       ASN  89 -11.155   9.226  -1.363
  Start of MODEL   15
10510    HA   PRO  90           HA       PRO  90 -15.369  11.052  -2.699
  Start of MODEL   15
10511    HB3  PRO  90           HB2      PRO  90 -17.393  10.459  -3.620
  Start of MODEL   15
10512    HB2  PRO  90           HB3      PRO  90 -17.645   9.150  -2.463
  Start of MODEL   15
10513    HG2  PRO  90           HG2      PRO  90 -17.056   7.947  -4.373
  Start of MODEL   15
10514    HG3  PRO  90           HG3      PRO  90 -15.924   9.203  -4.911
  Start of MODEL   15
10515    HD2  PRO  90           HD2      PRO  90 -15.574   7.130  -2.788
  Start of MODEL   15
10516    HD3  PRO  90           HD3      PRO  90 -14.419   7.728  -3.999
  Start of MODEL   15
10517    HA   CYS  91           HA       CYS  91 -17.226  10.329   1.489
  Start of MODEL   15
10518    HB3  CYS  91           HB2      CYS  91 -15.899   7.660   2.059
  Start of MODEL   15
10519    HB2  CYS  91           HB3      CYS  91 -17.557   7.880   1.516
  Start of MODEL   15
10520    H    CYS  91           HN       CYS  91 -15.550   8.657  -0.204
  Start of MODEL   15
10521    HA2  GLY  92           HA2      GLY  92 -12.821  12.067   1.913
  Start of MODEL   15
10522    H    GLY  92           HN       GLY  92 -13.965  10.159   0.690
  Start of MODEL   15
10523    HA3  GLY  92           HA1      GLY  92 -13.082  11.048   3.326
  Start of MODEL   15
10524    HA   GLN  93           HA       GLN  93  -9.420   9.489   1.100
  Start of MODEL   15
10525    HB3  GLN  93           HB2      GLN  93  -8.155  12.146   1.872
  Start of MODEL   15
10526    HB2  GLN  93           HB3      GLN  93  -8.596  11.621   0.264
  Start of MODEL   15
10527    HG2  GLN  93           HG2      GLN  93  -6.544  10.193   1.935
  Start of MODEL   15
10528    HG3  GLN  93           HG3      GLN  93  -6.888   9.971   0.226
  Start of MODEL   15
10529   HE21  GLN  93          HE21      GLN  93  -6.135  11.506  -1.243
  Start of MODEL   15
10530   HE22  GLN  93          HE22      GLN  93  -4.914  12.638  -0.811
  Start of MODEL   15
10531    H    GLN  93           HN       GLN  93 -10.553  11.869   2.317
  Start of MODEL   15
10532    HA   ALA  94           HA       ALA  94  -8.028   8.419   5.082
  Start of MODEL   15
10533    HB3  ALA  94           HB1      ALA  94  -9.295   6.440   4.429
  Start of MODEL   15
10534    HB2  ALA  94           HB2      ALA  94  -7.753   5.961   5.157
  Start of MODEL   15
10535    HB1  ALA  94           HB3      ALA  94  -7.954   5.916   3.414
  Start of MODEL   15
10536    H    ALA  94           HN       ALA  94  -8.319   8.047   2.186
  Start of MODEL   15
10537    HA   SER  95           HA       SER  95  -3.738   7.542   4.329
  Start of MODEL   15
10538    HB3  SER  95           HB2      SER  95  -3.912   9.875   4.156
  Start of MODEL   15
10539    HB2  SER  95           HB3      SER  95  -2.716   9.628   5.429
  Start of MODEL   15
10540    HG   SER  95           HG       SER  95  -5.449   9.839   6.017
  Start of MODEL   15
10541    H    SER  95           HN       SER  95  -6.007   7.841   6.063
  Start of MODEL   15
10542    HA   ALA  96           HA       ALA  96  -1.854   6.692   8.256
  Start of MODEL   15
10543    HB3  ALA  96           HB1      ALA  96  -3.015   4.591   7.819
  Start of MODEL   15
10544    HB2  ALA  96           HB2      ALA  96  -1.346   4.236   8.277
  Start of MODEL   15
10545    HB1  ALA  96           HB3      ALA  96  -1.838   4.160   6.586
  Start of MODEL   15
10546    H    ALA  96           HN       ALA  96  -2.031   6.653   5.364
  Start of MODEL   15
10547    HA   SER  97           HA       SER  97   2.236   6.839   6.751
  Start of MODEL   15
10548    HB3  SER  97           HB2      SER  97   2.218   7.848   9.603
  Start of MODEL   15
10549    HB2  SER  97           HB3      SER  97   1.818   8.781   8.166
  Start of MODEL   15
10550    HG   SER  97           HG       SER  97   4.083   8.620   9.290
  Start of MODEL   15
10551    H    SER  97           HN       SER  97   0.393   6.158   8.924
  Start of MODEL   15
10552    HA   ILE  98           HA       ILE  98   4.936   3.971   8.707
  Start of MODEL   15
10553    HB   ILE  98           HB       ILE  98   3.785   2.274   7.565
  Start of MODEL   15
10554   HD12  ILE  98          HD11      ILE  98   7.194   0.710   7.693
  Start of MODEL   15
10555   HD11  ILE  98          HD12      ILE  98   5.746   1.033   8.699
  Start of MODEL   15
10556   HD13  ILE  98          HD13      ILE  98   6.906   2.336   8.289
  Start of MODEL   15
10557    H    ILE  98           HN       ILE  98   3.989   5.647   6.539
  Start of MODEL   15
10558    HA   MET  99           HA       MET  99   8.482   5.437   6.703
  Start of MODEL   15
10559    HB3  MET  99           HB2      MET  99   9.208   5.749   9.619
  Start of MODEL   15
10560    HB2  MET  99           HB3      MET  99   8.340   6.963   8.684
  Start of MODEL   15
10561    HG2  MET  99           HG2      MET  99  11.104   5.918   8.133
  Start of MODEL   15
10562    HG3  MET  99           HG3      MET  99  10.240   7.070   7.128
  Start of MODEL   15
10563    HE2  MET  99           HE1      MET  99  12.892   9.380   8.544
  Start of MODEL   15
10564    HE1  MET  99           HE2      MET  99  11.944   8.855   7.144
  Start of MODEL   15
10565    HE3  MET  99           HE3      MET  99  13.027   7.715   7.942
  Start of MODEL   15
10566    H    MET  99           HN       MET  99   6.975   4.415   8.999
  Start of MODEL   15
10567    HA   ALA 100           HA       ALA 100  10.784   1.912   7.470
  Start of MODEL   15
10568    HB2  ALA 100           HB1      ALA 100  10.493   1.966   4.458
  Start of MODEL   15
10569    HB1  ALA 100           HB2      ALA 100   9.359   1.227   5.582
  Start of MODEL   15
10570    HB3  ALA 100           HB3      ALA 100  10.992   0.588   5.435
  Start of MODEL   15
10571    H    ALA 100           HN       ALA 100   9.959   4.181   5.845
  Start of MODEL   15
10572    HA   ALA 101           HA       ALA 101  14.793   2.981   5.941
  Start of MODEL   15
10573    HB2  ALA 101           HB1      ALA 101  16.234   2.951   7.937
  Start of MODEL   15
10574    HB1  ALA 101           HB2      ALA 101  14.973   2.107   8.833
  Start of MODEL   15
10575    HB3  ALA 101           HB3      ALA 101  14.700   3.757   8.264
  Start of MODEL   15
10576    H    ALA 101           HN       ALA 101  12.897   1.257   7.339
  Start of MODEL   15
10577    HA   PHE 102           HA       PHE 102  15.890  -1.133   5.055
  Start of MODEL   15
10578    HB3  PHE 102           HB2      PHE 102  17.220   0.549   2.921
  Start of MODEL   15
10579    HB2  PHE 102           HB3      PHE 102  15.575  -0.061   2.845
  Start of MODEL   15
10580    HD1  PHE 102           HD1      PHE 102  15.260  -2.579   2.957
  Start of MODEL   15
10581    HD2  PHE 102           HD2      PHE 102  18.958  -0.727   2.036
  Start of MODEL   15
10582    HE1  PHE 102           HE1      PHE 102  15.998  -4.629   1.888
  Start of MODEL   15
10583    HE2  PHE 102           HE2      PHE 102  19.738  -2.790   0.964
  Start of MODEL   15
10584    HZ   PHE 102           HZ       PHE 102  18.265  -4.762   0.883
  Start of MODEL   15
10585    H    PHE 102           HN       PHE 102  15.955   1.735   4.738
  Start of MODEL   15
10586    HA   MET 103           HA       MET 103  20.263  -0.445   6.311
  Start of MODEL   15
10587    HB3  MET 103           HB2      MET 103  20.677  -1.520   4.097
  Start of MODEL   15
10588    HB2  MET 103           HB3      MET 103  22.116  -0.757   4.760
  Start of MODEL   15
10589    HG2  MET 103           HG2      MET 103  20.355   0.494   2.643
  Start of MODEL   15
10590    HG3  MET 103           HG3      MET 103  21.859   1.123   3.277
  Start of MODEL   15
10591    HE2  MET 103           HE1      MET 103  24.538  -1.341   1.903
  Start of MODEL   15
10592    HE1  MET 103           HE2      MET 103  23.747  -1.412   3.475
  Start of MODEL   15
10593    HE3  MET 103           HE3      MET 103  24.231   0.146   2.804
  Start of MODEL   15
10594    H    MET 103           HN       MET 103  18.712   1.000   4.312
  Start of MODEL   15
10595    HA   ASP 104           HA       ASP 104  21.992   3.478   6.867
  Start of MODEL   15
10596    HB3  ASP 104           HB2      ASP 104  23.734   2.259   8.102
  Start of MODEL   15
10597    HB2  ASP 104           HB3      ASP 104  24.392   3.710   7.367
  Start of MODEL   15
10598    H    ASP 104           HN       ASP 104  22.613   0.783   6.157
  Start of MODEL   15
10599    HA   ASN 105           HA       ASN 105  22.760   5.103   2.925
  Start of MODEL   15
10600    HB3  ASN 105           HB2      ASN 105  22.234   7.541   2.979
  Start of MODEL   15
10601    HB2  ASN 105           HB3      ASN 105  22.050   7.417   4.717
  Start of MODEL   15
10602   HD21  ASN 105          HD21      ASN 105  19.975   8.012   4.749
  Start of MODEL   15
10603   HD22  ASN 105          HD22      ASN 105  18.684   7.053   4.148
  Start of MODEL   15
10604    H    ASN 105           HN       ASN 105  22.450   5.332   5.807
  Start of MODEL   15
10605    HA   PRO 106           HA       PRO 106  27.075   6.587   3.070
  Start of MODEL   15
10606    HB3  PRO 106           HB2      PRO 106  27.734   6.427   0.922
  Start of MODEL   15
10607    HB2  PRO 106           HB3      PRO 106  26.301   7.297   0.353
  Start of MODEL   15
10608    HG2  PRO 106           HG2      PRO 106  25.790   5.076  -0.329
  Start of MODEL   15
10609    HG3  PRO 106           HG3      PRO 106  26.507   4.395   1.146
  Start of MODEL   15
10610    HD2  PRO 106           HD2      PRO 106  23.924   5.879   0.813
  Start of MODEL   15
10611    HD3  PRO 106           HD3      PRO 106  24.276   4.409   1.757
  Start of MODEL   15
10612    HA   PHE 107           HA       PHE 107  26.468  10.904   2.441
  Start of MODEL   15
10613    HB3  PHE 107           HB2      PHE 107  25.106  10.216   5.042
  Start of MODEL   15
10614    HB2  PHE 107           HB3      PHE 107  24.514   9.936   3.409
  Start of MODEL   15
10615    HD1  PHE 107           HD1      PHE 107  23.581  11.795   2.116
  Start of MODEL   15
10616    HD2  PHE 107           HD2      PHE 107  25.338  12.526   5.919
  Start of MODEL   15
10617    HE1  PHE 107           HE1      PHE 107  22.673  14.077   2.088
  Start of MODEL   15
10618    HE2  PHE 107           HE2      PHE 107  24.435  14.814   5.900
  Start of MODEL   15
10619    HZ   PHE 107           HZ       PHE 107  23.051  15.574   3.982
  Start of MODEL   15
10620    H    PHE 107           HN       PHE 107  27.337   8.640   3.913
  Start of MODEL   16
10621    H1   ASP   1           H        ASP   1 -30.236 -10.984  -1.703
  Start of MODEL   16
10622    H2   ASP   1           H2       ASP   1 -31.490 -11.658  -0.792
  Start of MODEL   16
10623    H3   ASP   1           H3       ASP   1 -30.009 -11.252  -0.072
  Start of MODEL   16
10624    HA   ASP   1           HA       ASP   1 -31.779  -9.270  -1.314
  Start of MODEL   16
10625    HB3  ASP   1           HB2      ASP   1 -32.071  -8.465   1.074
  Start of MODEL   16
10626    HB2  ASP   1           HB3      ASP   1 -31.373  -9.993   1.600
  Start of MODEL   16
10627    HA   ASP   2           HA       ASP   2 -28.480  -6.571  -0.315
  Start of MODEL   16
10628    HB3  ASP   2           HB2      ASP   2 -27.391  -8.220  -1.778
  Start of MODEL   16
10629    HB2  ASP   2           HB3      ASP   2 -26.931  -6.594  -2.242
  Start of MODEL   16
10630    H    ASP   2           HN       ASP   2 -30.804  -7.406  -1.697
  Start of MODEL   16
10631    HA   ASP   3           HA       ASP   3 -30.048  -3.139  -2.481
  Start of MODEL   16
10632    HB3  ASP   3           HB2      ASP   3 -30.639  -1.402  -0.777
  Start of MODEL   16
10633    HB2  ASP   3           HB3      ASP   3 -29.907  -2.416   0.454
  Start of MODEL   16
10634    H    ASP   3           HN       ASP   3 -28.472  -4.465  -0.365
  Start of MODEL   16
10635    HA   ASP   4           HA       ASP   4 -25.069  -2.516  -1.347
  Start of MODEL   16
10636    HB3  ASP   4           HB2      ASP   4 -24.731  -0.639  -3.052
  Start of MODEL   16
10637    HB2  ASP   4           HB3      ASP   4 -26.418  -0.850  -3.494
  Start of MODEL   16
10638    H    ASP   4           HN       ASP   4 -27.055  -3.588  -1.369
  Start of MODEL   16
10639    HA   ASP   5           HA       ASP   5 -26.886   1.157   0.873
  Start of MODEL   16
10640    HB3  ASP   5           HB2      ASP   5 -29.025   0.003   1.359
  Start of MODEL   16
10641    HB2  ASP   5           HB3      ASP   5 -28.386   0.835   2.769
  Start of MODEL   16
10642    H    ASP   5           HN       ASP   5 -27.162  -1.682   0.459
  Start of MODEL   16
10643    HA   VAL   6           HA       VAL   6 -23.921  -0.280   3.933
  Start of MODEL   16
10644    HB   VAL   6           HB       VAL   6 -22.296  -2.260   3.749
  Start of MODEL   16
10645    H    VAL   6           HN       VAL   6 -24.860  -1.241   1.378
  Start of MODEL   16
10646    HA   SER   7           HA       SER   7 -20.939   1.517   1.423
  Start of MODEL   16
10647    HB3  SER   7           HB2      SER   7 -21.218   4.034   1.578
  Start of MODEL   16
10648    HB2  SER   7           HB3      SER   7 -22.562   3.668   2.695
  Start of MODEL   16
10649    HG   SER   7           HG       SER   7 -23.764   3.039   1.184
  Start of MODEL   16
10650    H    SER   7           HN       SER   7 -22.932   1.509   3.535
  Start of MODEL   16
10651    HA   PHE   8           HA       PHE   8 -18.522   1.779   5.020
  Start of MODEL   16
10652    HB3  PHE   8           HB2      PHE   8 -16.616   0.183   4.826
  Start of MODEL   16
10653    HB2  PHE   8           HB3      PHE   8 -17.168  -0.247   3.213
  Start of MODEL   16
10654    HD1  PHE   8           HD1      PHE   8 -18.846  -1.889   2.892
  Start of MODEL   16
10655    HD2  PHE   8           HD2      PHE   8 -18.113  -0.331   6.785
  Start of MODEL   16
10656    HE1  PHE   8           HE1      PHE   8 -20.291  -3.617   3.848
  Start of MODEL   16
10657    HE2  PHE   8           HE2      PHE   8 -19.564  -2.068   7.746
  Start of MODEL   16
10658    HZ   PHE   8           HZ       PHE   8 -20.653  -3.713   6.278
  Start of MODEL   16
10659    H    PHE   8           HN       PHE   8 -19.255   0.784   2.418
  Start of MODEL   16
10660    HA   CYS   9           HA       CYS   9 -15.990   4.776   3.160
  Start of MODEL   16
10661    HB3  CYS   9           HB2      CYS   9 -15.418   4.971   6.134
  Start of MODEL   16
10662    HB2  CYS   9           HB3      CYS   9 -16.831   5.686   5.381
  Start of MODEL   16
10663    H    CYS   9           HN       CYS   9 -16.924   3.152   5.368
  Start of MODEL   16
10664    HA   ALA  10           HA       ALA  10 -12.191   2.787   3.220
  Start of MODEL   16
10665    HB1  ALA  10           HB1      ALA  10 -11.289   5.499   2.320
  Start of MODEL   16
10666    HB3  ALA  10           HB2      ALA  10 -11.989   4.240   1.281
  Start of MODEL   16
10667    HB2  ALA  10           HB3      ALA  10 -10.421   3.989   2.076
  Start of MODEL   16
10668    H    ALA  10           HN       ALA  10 -13.501   5.381   3.396
  Start of MODEL   16
10669    HA   SER  11           HA       SER  11  -9.884   4.113   6.577
  Start of MODEL   16
10670    HB3  SER  11           HB2      SER  11 -10.789   1.294   7.283
  Start of MODEL   16
10671    HB2  SER  11           HB3      SER  11 -11.581   2.781   7.793
  Start of MODEL   16
10672    HG   SER  11           HG       SER  11  -9.468   3.289   8.788
  Start of MODEL   16
10673    H    SER  11           HN       SER  11 -11.265   2.156   4.939
  Start of MODEL   16
10674    HA   VAL  12           HA       VAL  12  -6.395   1.847   5.187
  Start of MODEL   16
10675    HB   VAL  12           HB       VAL  12  -5.513   4.729   5.587
  Start of MODEL   16
10676    H    VAL  12           HN       VAL  12  -7.687   3.961   6.759
  Start of MODEL   16
10677    HA   GLN  13           HA       GLN  13  -4.143   1.519   8.878
  Start of MODEL   16
10678    HB3  GLN  13           HB2      GLN  13  -4.267  -0.778   9.755
  Start of MODEL   16
10679    HB2  GLN  13           HB3      GLN  13  -5.041  -1.304   8.270
  Start of MODEL   16
10680    HG2  GLN  13           HG2      GLN  13  -6.983   0.064   8.758
  Start of MODEL   16
10681    HG3  GLN  13           HG3      GLN  13  -6.647  -1.064  10.069
  Start of MODEL   16
10682   HE21  GLN  13          HE21      GLN  13  -8.159   1.393  10.075
  Start of MODEL   16
10683   HE22  GLN  13          HE22      GLN  13  -7.434   2.383  11.289
  Start of MODEL   16
10684    H    GLN  13           HN       GLN  13  -5.427   0.474   6.483
  Start of MODEL   16
10685    HA   LEU  14           HA       LEU  14  -0.753  -0.172   6.750
  Start of MODEL   16
10686    HB3  LEU  14           HB2      LEU  14   1.251   1.442   7.001
  Start of MODEL   16
10687    HB2  LEU  14           HB3      LEU  14   0.083   2.570   7.663
  Start of MODEL   16
10688    HG   LEU  14           HG       LEU  14  -1.217   2.350   5.512
  Start of MODEL   16
10689   HD11  LEU  14          HD11      LEU  14   1.638   3.282   5.274
  Start of MODEL   16
10690   HD13  LEU  14          HD12      LEU  14   0.277   4.239   5.890
  Start of MODEL   16
10691   HD12  LEU  14          HD13      LEU  14   0.299   3.709   4.206
  Start of MODEL   16
10692   HD22  LEU  14          HD21      LEU  14  -0.044   1.433   3.606
  Start of MODEL   16
10693   HD21  LEU  14          HD22      LEU  14  -0.325   0.202   4.840
  Start of MODEL   16
10694   HD23  LEU  14          HD23      LEU  14   1.278   0.929   4.659
  Start of MODEL   16
10695    H    LEU  14           HN       LEU  14  -2.027   1.697   8.570
  Start of MODEL   16
10696    HA   HIS  15           HA       HIS  15   1.505  -1.461  10.208
  Start of MODEL   16
10697    HB3  HIS  15           HB2      HIS  15   1.772  -3.923   9.816
  Start of MODEL   16
10698    HB2  HIS  15           HB3      HIS  15   1.264  -3.672   8.150
  Start of MODEL   16
10699    HD1  HIS  15           HD1      HIS  15  -0.086  -3.368  11.650
  Start of MODEL   16
10700    HD2  HIS  15           HD2      HIS  15  -1.442  -3.649   7.741
  Start of MODEL   16
10701    HE1  HIS  15           HE1      HIS  15  -2.583  -3.616  11.821
  Start of MODEL   16
10702    HE2  HIS  15           HE2      HIS  15  -3.295  -4.128   9.488
  Start of MODEL   16
10703    H    HIS  15           HN       HIS  15   1.210  -1.166   7.328
  Start of MODEL   16
10704    HA   THR  16           HA       THR  16   5.645  -0.726   9.483
  Start of MODEL   16
10705    HB   THR  16           HB       THR  16   5.686  -2.758  11.722
  Start of MODEL   16
10706    HG1  THR  16           HG1      THR  16   5.301  -1.052  13.065
  Start of MODEL   16
10707   HG21  THR  16          HG21      THR  16   7.539  -0.464  11.034
  Start of MODEL   16
10708   HG23  THR  16          HG22      THR  16   7.901  -2.170  10.773
  Start of MODEL   16
10709   HG22  THR  16          HG23      THR  16   7.716  -1.548  12.413
  Start of MODEL   16
10710    H    THR  16           HN       THR  16   3.521  -1.724  10.848
  Start of MODEL   16
10711    HA   ALA  17           HA       ALA  17   6.681  -3.742   6.550
  Start of MODEL   16
10712    HB2  ALA  17           HB1      ALA  17   9.306  -2.330   6.987
  Start of MODEL   16
10713    HB1  ALA  17           HB2      ALA  17   8.022  -1.737   5.952
  Start of MODEL   16
10714    HB3  ALA  17           HB3      ALA  17   8.830  -3.262   5.566
  Start of MODEL   16
10715    H    ALA  17           HN       ALA  17   7.172  -1.542   8.199
  Start of MODEL   16
10716    HA   VAL  18           HA       VAL  18   8.635  -6.662   8.977
  Start of MODEL   16
10717    HB   VAL  18           HB       VAL  18   8.240  -8.990   8.120
  Start of MODEL   16
10718    H    VAL  18           HN       VAL  18   7.575  -5.751   6.443
  Start of MODEL   16
10719    HA   GLU  19           HA       GLU  19  12.576  -6.616   7.385
  Start of MODEL   16
10720    HB3  GLU  19           HB2      GLU  19  14.151  -7.198   9.208
  Start of MODEL   16
10721    HB2  GLU  19           HB3      GLU  19  12.786  -7.696  10.196
  Start of MODEL   16
10722    HG2  GLU  19           HG2      GLU  19  13.305  -4.921   9.150
  Start of MODEL   16
10723    HG3  GLU  19           HG3      GLU  19  11.891  -5.407  10.073
  Start of MODEL   16
10724    H    GLU  19           HN       GLU  19  10.587  -7.187   9.320
  Start of MODEL   16
10725    HA   MET  20           HA       MET  20  14.260 -10.427   6.404
  Start of MODEL   16
10726    HB3  MET  20           HB2      MET  20  12.004 -11.345   6.381
  Start of MODEL   16
10727    HB2  MET  20           HB3      MET  20  12.804 -11.827   4.902
  Start of MODEL   16
10728    HG2  MET  20           HG2      MET  20  10.775  -9.623   5.160
  Start of MODEL   16
10729    HG3  MET  20           HG3      MET  20  11.603 -10.087   3.675
  Start of MODEL   16
10730    HE3  MET  20           HE1      MET  20   8.403  -9.944   3.921
  Start of MODEL   16
10731    HE2  MET  20           HE2      MET  20   7.941 -11.420   3.071
  Start of MODEL   16
10732    HE1  MET  20           HE3      MET  20   9.238 -10.409   2.440
  Start of MODEL   16
10733    H    MET  20           HN       MET  20  13.133  -7.944   5.877
  Start of MODEL   16
10734    HA   HIS  21           HA       HIS  21  16.211  -9.279   2.885
  Start of MODEL   16
10735    HB3  HIS  21           HB2      HIS  21  16.761 -10.953   0.951
  Start of MODEL   16
10736    HB2  HIS  21           HB3      HIS  21  15.970 -12.112   2.020
  Start of MODEL   16
10737    HD1  HIS  21           HD1      HIS  21  17.652 -13.275   3.549
  Start of MODEL   16
10738    HD2  HIS  21           HD2      HIS  21  18.843  -9.409   2.544
  Start of MODEL   16
10739    HE1  HIS  21           HE1      HIS  21  19.882 -12.939   4.625
  Start of MODEL   16
10740    HE2  HIS  21           HE2      HIS  21  20.648 -10.663   3.853
  Start of MODEL   16
10741    H    HIS  21           HN       HIS  21  14.593 -11.430   3.849
  Start of MODEL   16
10742    HA   HIS  22           HA       HIS  22  13.238  -8.370  -0.233
  Start of MODEL   16
10743    HB3  HIS  22           HB2      HIS  22  11.404  -9.552  -1.398
  Start of MODEL   16
10744    HB2  HIS  22           HB3      HIS  22  11.376 -10.785  -0.148
  Start of MODEL   16
10745    HD1  HIS  22           HD1      HIS  22  13.529  -9.601  -3.051
  Start of MODEL   16
10746    HD2  HIS  22           HD2      HIS  22  13.177 -12.862  -0.497
  Start of MODEL   16
10747    HE1  HIS  22           HE1      HIS  22  15.092 -11.329  -3.943
  Start of MODEL   16
10748    HE2  HIS  22           HE2      HIS  22  15.051 -13.163  -2.219
  Start of MODEL   16
10749    H    HIS  22           HN       HIS  22  13.211 -10.526   1.785
  Start of MODEL   16
10750    HA   TRP  23           HA       TRP  23  10.686  -6.960   2.844
  Start of MODEL   16
10751    HB3  TRP  23           HB2      TRP  23  10.612  -4.464   2.816
  Start of MODEL   16
10752    HB2  TRP  23           HB3      TRP  23  11.402  -4.524   1.242
  Start of MODEL   16
10753    HD1  TRP  23           HD1      TRP  23  13.904  -5.799   1.261
  Start of MODEL   16
10754    HE1  TRP  23           HE1      TRP  23  15.747  -5.664   3.054
  Start of MODEL   16
10755    HE3  TRP  23           HE3      TRP  23  11.086  -4.186   5.208
  Start of MODEL   16
10756    HZ2  TRP  23           HZ2      TRP  23  15.978  -4.979   5.766
  Start of MODEL   16
10757    HZ3  TRP  23           HZ3      TRP  23  12.200  -3.813   7.366
  Start of MODEL   16
10758    HH2  TRP  23           HH2      TRP  23  14.599  -4.199   7.635
  Start of MODEL   16
10759    H    TRP  23           HN       TRP  23  11.785  -6.710   0.168
  Start of MODEL   16
10760    HA   CYS  24           HA       CYS  24   6.710  -5.891   1.388
  Start of MODEL   16
10761    HB3  CYS  24           HB2      CYS  24   6.591  -8.044   3.518
  Start of MODEL   16
10762    HB2  CYS  24           HB3      CYS  24   6.649  -8.287   1.778
  Start of MODEL   16
10763    H    CYS  24           HN       CYS  24   8.700  -6.397   3.464
  Start of MODEL   16
10764    HA   ILE  25           HA       ILE  25   5.198  -3.494   4.746
  Start of MODEL   16
10765    HB   ILE  25           HB       ILE  25   4.673  -1.814   2.268
  Start of MODEL   16
10766   HD13  ILE  25          HD11      ILE  25   6.530  -0.049   1.757
  Start of MODEL   16
10767   HD12  ILE  25          HD12      ILE  25   7.928   0.026   2.826
  Start of MODEL   16
10768   HD11  ILE  25          HD13      ILE  25   6.347   0.569   3.397
  Start of MODEL   16
10769    H    ILE  25           HN       ILE  25   5.533  -4.209   1.921
  Start of MODEL   16
10770    HA   PRO  26           HA       PRO  26   1.194  -5.384   3.679
  Start of MODEL   16
10771    HB3  PRO  26           HB2      PRO  26   0.937  -6.823   5.419
  Start of MODEL   16
10772    HB2  PRO  26           HB3      PRO  26   0.725  -5.489   6.546
  Start of MODEL   16
10773    HG2  PRO  26           HG2      PRO  26   2.767  -6.187   7.329
  Start of MODEL   16
10774    HG3  PRO  26           HG3      PRO  26   3.196  -6.952   5.789
  Start of MODEL   16
10775    HD2  PRO  26           HD2      PRO  26   3.434  -4.086   6.616
  Start of MODEL   16
10776    HD3  PRO  26           HD3      PRO  26   4.545  -5.098   5.666
  Start of MODEL   16
10777    HA   PHE  27           HA       PHE  27  -1.376  -2.198   5.133
  Start of MODEL   16
10778    HB3  PHE  27           HB2      PHE  27  -0.400  -1.035   3.225
  Start of MODEL   16
10779    HB2  PHE  27           HB3      PHE  27  -2.118  -0.705   3.333
  Start of MODEL   16
10780    HD1  PHE  27           HD1      PHE  27  -3.690  -1.590   1.677
  Start of MODEL   16
10781    HD2  PHE  27           HD2      PHE  27   0.516  -2.140   1.325
  Start of MODEL   16
10782    HE1  PHE  27           HE1      PHE  27  -3.961  -2.140  -0.695
  Start of MODEL   16
10783    HE2  PHE  27           HE2      PHE  27   0.245  -2.693  -1.049
  Start of MODEL   16
10784    HZ   PHE  27           HZ       PHE  27  -1.988  -2.695  -2.062
  Start of MODEL   16
10785    H    PHE  27           HN       PHE  27  -0.600  -4.255   3.232
  Start of MODEL   16
10786    HA   SER  28           HA       SER  28  -5.282  -3.810   4.177
  Start of MODEL   16
10787    HB3  SER  28           HB2      SER  28  -6.373  -4.171   6.346
  Start of MODEL   16
10788    HB2  SER  28           HB3      SER  28  -5.214  -3.090   7.124
  Start of MODEL   16
10789    HG   SER  28           HG       SER  28  -4.557  -5.463   5.728
  Start of MODEL   16
10790    H    SER  28           HN       SER  28  -3.489  -1.931   5.494
  Start of MODEL   16
10791    HA   VAL  29           HA       VAL  29  -7.711  -0.191   4.308
  Start of MODEL   16
10792    HB   VAL  29           HB       VAL  29  -6.279   0.576   2.446
  Start of MODEL   16
10793    H    VAL  29           HN       VAL  29  -6.740  -2.662   3.112
  Start of MODEL   16
10794    HA   ASP  30           HA       ASP  30 -11.360  -2.167   3.036
  Start of MODEL   16
10795    HB3  ASP  30           HB2      ASP  30 -11.166  -2.828   5.441
  Start of MODEL   16
10796    HB2  ASP  30           HB3      ASP  30 -12.821  -2.646   4.887
  Start of MODEL   16
10797    H    ASP  30           HN       ASP  30  -9.829  -0.250   4.642
  Start of MODEL   16
10798    HA2  GLY  31           HA2      GLY  31 -14.886   0.554   2.965
  Start of MODEL   16
10799    H    GLY  31           HN       GLY  31 -13.361  -1.636   2.395
  Start of MODEL   16
10800    HA3  GLY  31           HA1      GLY  31 -13.753   1.071   1.706
  Start of MODEL   16
10801    HA   GLN  32           HA       GLN  32 -16.848  -1.849   0.046
  Start of MODEL   16
10802    HB3  GLN  32           HB2      GLN  32 -19.049   0.222  -0.145
  Start of MODEL   16
10803    HB2  GLN  32           HB3      GLN  32 -18.808  -0.624   1.362
  Start of MODEL   16
10804    HG2  GLN  32           HG2      GLN  32 -19.087  -2.773   0.087
  Start of MODEL   16
10805    HG3  GLN  32           HG3      GLN  32 -20.512  -1.764   0.217
  Start of MODEL   16
10806   HE21  GLN  32          HE21      GLN  32 -19.726   0.070  -1.927
  Start of MODEL   16
10807   HE22  GLN  32          HE22      GLN  32 -19.888  -0.841  -3.378
  Start of MODEL   16
10808    H    GLN  32           HN       GLN  32 -16.653   0.649   1.470
  Start of MODEL   16
10809    HA   PRO  33           HA       PRO  33 -16.625   0.840  -3.827
  Start of MODEL   16
10810    HB3  PRO  33           HB2      PRO  33 -17.287   3.035  -4.052
  Start of MODEL   16
10811    HB2  PRO  33           HB3      PRO  33 -15.938   3.570  -3.047
  Start of MODEL   16
10812    HG2  PRO  33           HG2      PRO  33 -17.637   4.090  -1.580
  Start of MODEL   16
10813    HG3  PRO  33           HG3      PRO  33 -18.721   2.861  -2.261
  Start of MODEL   16
10814    HD2  PRO  33           HD2      PRO  33 -16.460   2.538  -0.336
  Start of MODEL   16
10815    HD3  PRO  33           HD3      PRO  33 -18.084   1.832  -0.281
  Start of MODEL   16
10816    HA   ALA  34           HA       ALA  34 -12.452  -0.022  -2.860
  Start of MODEL   16
10817    HB1  ALA  34           HB1      ALA  34 -12.610  -0.122  -5.862
  Start of MODEL   16
10818    HB3  ALA  34           HB2      ALA  34 -12.920  -1.467  -4.767
  Start of MODEL   16
10819    HB2  ALA  34           HB3      ALA  34 -11.302  -0.766  -4.865
  Start of MODEL   16
10820    H    ALA  34           HN       ALA  34 -14.705   0.166  -4.466
  Start of MODEL   16
10821    HA   PRO  35           HA       PRO  35 -11.247   4.255  -3.320
  Start of MODEL   16
10822    HB3  PRO  35           HB2      PRO  35 -11.045   4.255  -1.026
  Start of MODEL   16
10823    HB2  PRO  35           HB3      PRO  35  -9.333   4.268  -1.467
  Start of MODEL   16
10824    HG2  PRO  35           HG2      PRO  35  -9.105   1.986  -1.123
  Start of MODEL   16
10825    HG3  PRO  35           HG3      PRO  35 -10.298   2.363   0.129
  Start of MODEL   16
10826    HD2  PRO  35           HD2      PRO  35 -10.689   0.493  -1.800
  Start of MODEL   16
10827    HD3  PRO  35           HD3      PRO  35 -12.023   1.432  -1.096
  Start of MODEL   16
10828    HA   SER  36           HA       SER  36  -7.759   3.757  -5.823
  Start of MODEL   16
10829    HB3  SER  36           HB2      SER  36  -8.034   6.771  -5.583
  Start of MODEL   16
10830    HB2  SER  36           HB3      SER  36  -8.912   5.794  -6.754
  Start of MODEL   16
10831    HG   SER  36           HG       SER  36  -6.621   6.873  -7.054
  Start of MODEL   16
10832    H    SER  36           HN       SER  36  -9.676   5.290  -4.377
  Start of MODEL   16
10833    HA   LEU  37           HA       LEU  37  -4.987   4.277  -2.443
  Start of MODEL   16
10834    HB3  LEU  37           HB2      LEU  37  -3.550   2.290  -2.390
  Start of MODEL   16
10835    HB2  LEU  37           HB3      LEU  37  -4.187   1.796  -3.939
  Start of MODEL   16
10836    HG   LEU  37           HG       LEU  37  -6.444   1.593  -2.871
  Start of MODEL   16
10837   HD13  LEU  37          HD11      LEU  37  -5.026  -0.304  -3.251
  Start of MODEL   16
10838   HD12  LEU  37          HD12      LEU  37  -5.892  -0.485  -1.721
  Start of MODEL   16
10839   HD11  LEU  37          HD13      LEU  37  -4.186  -0.020  -1.724
  Start of MODEL   16
10840   HD23  LEU  37          HD21      LEU  37  -4.831   2.003  -0.363
  Start of MODEL   16
10841   HD22  LEU  37          HD22      LEU  37  -6.480   1.402  -0.432
  Start of MODEL   16
10842   HD21  LEU  37          HD23      LEU  37  -6.126   3.056  -0.957
  Start of MODEL   16
10843    H    LEU  37           HN       LEU  37  -6.033   3.046  -4.849
  Start of MODEL   16
10844    HA   ARG  38           HA       ARG  38  -1.387   5.359  -4.643
  Start of MODEL   16
10845    HB3  ARG  38           HB2      ARG  38  -2.782   7.926  -3.832
  Start of MODEL   16
10846    HB2  ARG  38           HB3      ARG  38  -2.891   7.103  -5.368
  Start of MODEL   16
10847    HG2  ARG  38           HG2      ARG  38  -1.493   9.008  -5.654
  Start of MODEL   16
10848    HG3  ARG  38           HG3      ARG  38  -0.505   8.554  -4.267
  Start of MODEL   16
10849    HD2  ARG  38           HD2      ARG  38   0.542   8.055  -6.425
  Start of MODEL   16
10850    HD3  ARG  38           HD3      ARG  38   0.350   6.642  -5.414
  Start of MODEL   16
10851    HE   ARG  38           HE       ARG  38  -1.812   7.017  -7.246
  Start of MODEL   16
10852   HH11  ARG  38          HH11      ARG  38   1.507   5.681  -7.012
  Start of MODEL   16
10853   HH12  ARG  38          HH12      ARG  38   1.236   4.411  -8.068
  Start of MODEL   16
10854   HH21  ARG  38          HH21      ARG  38  -2.153   5.301  -8.825
  Start of MODEL   16
10855   HH22  ARG  38          HH22      ARG  38  -0.886   4.229  -9.183
  Start of MODEL   16
10856    H    ARG  38           HN       ARG  38  -3.340   5.608  -2.497
  Start of MODEL   16
10857    HA   TRP  39           HA       TRP  39   1.073   6.073  -1.149
  Start of MODEL   16
10858    HB3  TRP  39           HB2      TRP  39   3.347   5.154  -1.589
  Start of MODEL   16
10859    HB2  TRP  39           HB3      TRP  39   2.876   4.922  -3.266
  Start of MODEL   16
10860    HD1  TRP  39           HD1      TRP  39   1.304   2.929  -3.887
  Start of MODEL   16
10861    HE1  TRP  39           HE1      TRP  39   0.696   0.801  -2.646
  Start of MODEL   16
10862    HE3  TRP  39           HE3      TRP  39   2.871   4.281   0.781
  Start of MODEL   16
10863    HZ2  TRP  39           HZ2      TRP  39   0.841  -0.205   0.010
  Start of MODEL   16
10864    HZ3  TRP  39           HZ3      TRP  39   2.604   2.669   2.622
  Start of MODEL   16
10865    HH2  TRP  39           HH2      TRP  39   1.610   0.475   2.239
  Start of MODEL   16
10866    H    TRP  39           HN       TRP  39   0.705   5.711  -4.015
  Start of MODEL   16
10867    HA   LEU  40           HA       LEU  40   3.585   9.459  -2.317
  Start of MODEL   16
10868    HB3  LEU  40           HB2      LEU  40   2.614  10.178   0.446
  Start of MODEL   16
10869    HB2  LEU  40           HB3      LEU  40   1.511  10.191  -0.916
  Start of MODEL   16
10870    HG   LEU  40           HG       LEU  40   3.999  11.852  -0.904
  Start of MODEL   16
10871   HD11  LEU  40          HD11      LEU  40   1.429  11.974  -2.454
  Start of MODEL   16
10872   HD13  LEU  40          HD12      LEU  40   2.957  11.349  -3.038
  Start of MODEL   16
10873   HD12  LEU  40          HD13      LEU  40   2.810  13.064  -2.629
  Start of MODEL   16
10874   HD21  LEU  40          HD21      LEU  40   2.624  12.478   1.032
  Start of MODEL   16
10875   HD23  LEU  40          HD22      LEU  40   1.212  12.608  -0.016
  Start of MODEL   16
10876   HD22  LEU  40          HD23      LEU  40   2.566  13.717  -0.224
  Start of MODEL   16
10877    H    LEU  40           HN       LEU  40   2.277   7.633  -0.416
  Start of MODEL   16
10878    HA   PHE  41           HA       PHE  41   6.730   8.384   0.557
  Start of MODEL   16
10879    HB3  PHE  41           HB2      PHE  41   7.934   8.136  -2.229
  Start of MODEL   16
10880    HB2  PHE  41           HB3      PHE  41   7.262   6.848  -1.248
  Start of MODEL   16
10881    HD1  PHE  41           HD1      PHE  41  10.216   8.271  -2.308
  Start of MODEL   16
10882    HD2  PHE  41           HD2      PHE  41   8.373   6.735   1.193
  Start of MODEL   16
10883    HE1  PHE  41           HE1      PHE  41  12.428   7.909  -1.308
  Start of MODEL   16
10884    HE2  PHE  41           HE2      PHE  41  10.568   6.371   2.199
  Start of MODEL   16
10885    HZ   PHE  41           HZ       PHE  41  12.603   6.959   0.958
  Start of MODEL   16
10886    H    PHE  41           HN       PHE  41   5.763   9.542  -1.943
  Start of MODEL   16
10887    HA   ASN  42           HA       ASN  42   8.229  11.835   2.589
  Start of MODEL   16
10888    HB3  ASN  42           HB2      ASN  42  10.401  12.665   1.623
  Start of MODEL   16
10889    HB2  ASN  42           HB3      ASN  42  10.215  11.497   0.321
  Start of MODEL   16
10890   HD21  ASN  42          HD21      ASN  42  12.223  10.619   0.936
  Start of MODEL   16
10891   HD22  ASN  42          HD22      ASN  42  12.342   9.558   2.291
  Start of MODEL   16
10892    H    ASN  42           HN       ASN  42   7.360   9.943   1.779
  Start of MODEL   16
10893    HA2  GLY  43           HA2      GLY  43   4.865  14.065   0.357
  Start of MODEL   16
10894    H    GLY  43           HN       GLY  43   6.064  12.143   0.958
  Start of MODEL   16
10895    HA3  GLY  43           HA1      GLY  43   6.385  14.939   0.242
  Start of MODEL   16
10896    HA   SER  44           HA       SER  44   6.473  13.741  -4.000
  Start of MODEL   16
10897    HB3  SER  44           HB2      SER  44   8.375  12.518  -4.896
  Start of MODEL   16
10898    HB2  SER  44           HB3      SER  44   8.548  11.637  -3.379
  Start of MODEL   16
10899    HG   SER  44           HG       SER  44   9.968  13.471  -3.696
  Start of MODEL   16
10900    H    SER  44           HN       SER  44   7.304  12.544  -1.485
  Start of MODEL   16
10901    HA   VAL  45           HA       VAL  45   3.685  10.473  -4.512
  Start of MODEL   16
10902    HB   VAL  45           HB       VAL  45   3.032  12.316  -6.155
  Start of MODEL   16
10903    H    VAL  45           HN       VAL  45   5.206  12.591  -5.503
  Start of MODEL   16
10904    HA   LEU  46           HA       LEU  46   6.230   7.323  -5.981
  Start of MODEL   16
10905    HB3  LEU  46           HB2      LEU  46   4.010   5.893  -4.567
  Start of MODEL   16
10906    HB2  LEU  46           HB3      LEU  46   5.501   6.435  -3.812
  Start of MODEL   16
10907    HG   LEU  46           HG       LEU  46   5.393   4.378  -6.059
  Start of MODEL   16
10908   HD13  LEU  46          HD11      LEU  46   7.513   5.503  -5.903
  Start of MODEL   16
10909   HD12  LEU  46          HD12      LEU  46   7.680   3.853  -5.290
  Start of MODEL   16
10910   HD11  LEU  46          HD13      LEU  46   7.580   5.214  -4.168
  Start of MODEL   16
10911   HD23  LEU  46          HD21      LEU  46   5.541   3.945  -3.073
  Start of MODEL   16
10912   HD22  LEU  46          HD22      LEU  46   5.822   2.701  -4.292
  Start of MODEL   16
10913   HD21  LEU  46          HD23      LEU  46   4.234   3.456  -4.150
  Start of MODEL   16
10914    H    LEU  46           HN       LEU  46   3.764   8.345  -4.846
  Start of MODEL   16
10915    HA   ASN  47           HA       ASN  47   3.928   5.431  -9.107
  Start of MODEL   16
10916    HB3  ASN  47           HB2      ASN  47   5.142   5.690 -11.293
  Start of MODEL   16
10917    HB2  ASN  47           HB3      ASN  47   6.413   6.567 -10.456
  Start of MODEL   16
10918   HD21  ASN  47          HD21      ASN  47   3.152   6.706 -11.617
  Start of MODEL   16
10919   HD22  ASN  47          HD22      ASN  47   2.972   8.415 -11.461
  Start of MODEL   16
10920    H    ASN  47           HN       ASN  47   6.282   6.717  -7.949
  Start of MODEL   16
10921    HA   GLU  48           HA       GLU  48   6.350   2.154  -7.611
  Start of MODEL   16
10922    HB3  GLU  48           HB2      GLU  48   4.489   1.014  -6.993
  Start of MODEL   16
10923    HB2  GLU  48           HB3      GLU  48   5.072  -0.007  -8.300
  Start of MODEL   16
10924    HG2  GLU  48           HG2      GLU  48   3.606   1.561  -9.686
  Start of MODEL   16
10925    HG3  GLU  48           HG3      GLU  48   2.919   0.101  -8.882
  Start of MODEL   16
10926    H    GLU  48           HN       GLU  48   4.103   3.402  -8.532
  Start of MODEL   16
10927    HA   THR  49           HA       THR  49   8.289   1.023 -11.239
  Start of MODEL   16
10928    HB   THR  49           HB       THR  49   9.721   2.606 -10.026
  Start of MODEL   16
10929    HG1  THR  49           HG1      THR  49  11.556   2.080 -11.060
  Start of MODEL   16
10930   HG21  THR  49          HG21      THR  49  10.813   0.180  -8.606
  Start of MODEL   16
10931   HG23  THR  49          HG22      THR  49   9.844   1.462  -7.877
  Start of MODEL   16
10932   HG22  THR  49          HG23      THR  49  11.464   1.816  -8.487
  Start of MODEL   16
10933    H    THR  49           HN       THR  49   7.817   0.761  -8.374
  Start of MODEL   16
10934    HA   SER  50           HA       SER  50   9.444  -3.076 -11.567
  Start of MODEL   16
10935    HB3  SER  50           HB2      SER  50  11.521  -3.703 -12.484
  Start of MODEL   16
10936    HB2  SER  50           HB3      SER  50  12.376  -2.442 -11.590
  Start of MODEL   16
10937    HG   SER  50           HG       SER  50  11.988  -1.169 -13.148
  Start of MODEL   16
10938    H    SER  50           HN       SER  50  10.619  -0.515 -11.309
  Start of MODEL   16
10939    HA   PHE  51           HA       PHE  51  11.850  -4.135  -7.717
  Start of MODEL   16
10940    HB3  PHE  51           HB2      PHE  51  13.149  -2.826  -6.077
  Start of MODEL   16
10941    HB2  PHE  51           HB3      PHE  51  12.742  -1.353  -6.942
  Start of MODEL   16
10942    HD1  PHE  51           HD1      PHE  51  14.343  -4.657  -7.532
  Start of MODEL   16
10943    HD2  PHE  51           HD2      PHE  51  14.209  -0.518  -8.496
  Start of MODEL   16
10944    HE1  PHE  51           HE1      PHE  51  16.362  -4.920  -8.913
  Start of MODEL   16
10945    HE2  PHE  51           HE2      PHE  51  16.220  -0.773  -9.885
  Start of MODEL   16
10946    HZ   PHE  51           HZ       PHE  51  17.302  -2.976 -10.096
  Start of MODEL   16
10947    H    PHE  51           HN       PHE  51  11.503  -1.616  -9.124
  Start of MODEL   16
10948    HA   ILE  52           HA       ILE  52   8.884  -2.074  -4.768
  Start of MODEL   16
10949    HB   ILE  52           HB       ILE  52   8.680   0.671  -6.035
  Start of MODEL   16
10950   HD11  ILE  52          HD11      ILE  52  10.165   2.101  -3.762
  Start of MODEL   16
10951   HD13  ILE  52          HD12      ILE  52  10.462   2.395  -5.478
  Start of MODEL   16
10952   HD12  ILE  52          HD13      ILE  52  11.793   1.937  -4.416
  Start of MODEL   16
10953    H    ILE  52           HN       ILE  52   9.976  -1.209  -7.390
  Start of MODEL   16
10954    HA   PHE  53           HA       PHE  53   5.169  -1.705  -7.101
  Start of MODEL   16
10955    HB3  PHE  53           HB2      PHE  53   5.617  -4.688  -7.229
  Start of MODEL   16
10956    HB2  PHE  53           HB3      PHE  53   6.306  -3.521  -8.350
  Start of MODEL   16
10957    HD1  PHE  53           HD1      PHE  53   4.545  -1.952  -9.524
  Start of MODEL   16
10958    HD2  PHE  53           HD2      PHE  53   3.674  -5.747  -7.831
  Start of MODEL   16
10959    HE1  PHE  53           HE1      PHE  53   2.554  -2.122 -10.961
  Start of MODEL   16
10960    HE2  PHE  53           HE2      PHE  53   1.673  -5.935  -9.265
  Start of MODEL   16
10961    HZ   PHE  53           HZ       PHE  53   1.107  -4.088 -10.825
  Start of MODEL   16
10962    H    PHE  53           HN       PHE  53   6.900  -3.143  -5.246
  Start of MODEL   16
10963    HA   THR  54           HA       THR  54   2.289  -2.554  -3.989
  Start of MODEL   16
10964    HB   THR  54           HB       THR  54   0.610  -1.235  -6.146
  Start of MODEL   16
10965    HG1  THR  54           HG1      THR  54   1.732   0.558  -5.762
  Start of MODEL   16
10966   HG21  THR  54          HG21      THR  54   0.417  -1.239  -3.128
  Start of MODEL   16
10967   HG23  THR  54          HG22      THR  54  -0.595  -2.182  -4.214
  Start of MODEL   16
10968   HG22  THR  54          HG23      THR  54  -0.690  -0.417  -4.231
  Start of MODEL   16
10969    H    THR  54           HN       THR  54   3.072  -1.650  -6.576
  Start of MODEL   16
10970    HA   GLU  55           HA       GLU  55   0.265  -5.930  -5.985
  Start of MODEL   16
10971    HB3  GLU  55           HB2      GLU  55   1.010  -8.100  -4.976
  Start of MODEL   16
10972    HB2  GLU  55           HB3      GLU  55   2.017  -7.177  -3.867
  Start of MODEL   16
10973    HG2  GLU  55           HG2      GLU  55   2.228  -7.138  -6.869
  Start of MODEL   16
10974    HG3  GLU  55           HG3      GLU  55   3.250  -6.249  -5.744
  Start of MODEL   16
10975    H    GLU  55           HN       GLU  55   1.709  -4.669  -3.770
  Start of MODEL   16
10976    HA   PHE  56           HA       PHE  56  -2.806  -6.695  -2.950
  Start of MODEL   16
10977    HB3  PHE  56           HB2      PHE  56  -4.943  -6.456  -4.084
  Start of MODEL   16
10978    HB2  PHE  56           HB3      PHE  56  -4.189  -6.743  -5.643
  Start of MODEL   16
10979    HD1  PHE  56           HD1      PHE  56  -4.126  -4.382  -2.775
  Start of MODEL   16
10980    HD2  PHE  56           HD2      PHE  56  -3.484  -4.987  -6.929
  Start of MODEL   16
10981    HE1  PHE  56           HE1      PHE  56  -3.776  -1.963  -3.064
  Start of MODEL   16
10982    HE2  PHE  56           HE2      PHE  56  -3.141  -2.591  -7.231
  Start of MODEL   16
10983    HZ   PHE  56           HZ       PHE  56  -3.270  -1.057  -5.267
  Start of MODEL   16
10984    H    PHE  56           HN       PHE  56  -1.561  -7.127  -5.584
  Start of MODEL   16
10985    HA   LEU  57           HA       LEU  57  -4.127 -10.800  -3.905
  Start of MODEL   16
10986    HB3  LEU  57           HB2      LEU  57  -2.638 -10.998  -1.902
  Start of MODEL   16
10987    HB2  LEU  57           HB3      LEU  57  -3.944 -12.158  -1.899
  Start of MODEL   16
10988    HG   LEU  57           HG       LEU  57  -4.241  -9.671  -0.298
  Start of MODEL   16
10989   HD11  LEU  57          HD11      LEU  57  -5.217 -12.497   0.039
  Start of MODEL   16
10990   HD13  LEU  57          HD12      LEU  57  -6.150 -11.166  -0.601
  Start of MODEL   16
10991   HD12  LEU  57          HD13      LEU  57  -5.623 -11.141   1.095
  Start of MODEL   16
10992   HD21  LEU  57          HD21      LEU  57  -2.053 -10.526   0.314
  Start of MODEL   16
10993   HD23  LEU  57          HD22      LEU  57  -2.728 -12.138   0.532
  Start of MODEL   16
10994   HD22  LEU  57          HD23      LEU  57  -3.214 -10.829   1.610
  Start of MODEL   16
10995    H    LEU  57           HN       LEU  57  -4.232  -8.374  -2.285
  Start of MODEL   16
10996    HA   GLU  58           HA       GLU  58  -8.334 -10.482  -3.739
  Start of MODEL   16
10997    HB3  GLU  58           HB2      GLU  58  -9.535 -12.704  -4.017
  Start of MODEL   16
10998    HB2  GLU  58           HB3      GLU  58  -7.918 -13.393  -3.958
  Start of MODEL   16
10999    HG2  GLU  58           HG2      GLU  58  -7.265 -12.206  -5.921
  Start of MODEL   16
11000    HG3  GLU  58           HG3      GLU  58  -8.803 -13.002  -6.261
  Start of MODEL   16
11001    H    GLU  58           HN       GLU  58  -6.049 -12.148  -3.575
  Start of MODEL   16
11002    HA   PRO  59           HA       PRO  59  -9.793 -11.116   0.454
  Start of MODEL   16
11003    HB3  PRO  59           HB2      PRO  59 -10.111  -8.804   0.507
  Start of MODEL   16
11004    HB2  PRO  59           HB3      PRO  59 -11.786  -9.304   0.272
  Start of MODEL   16
11005    HG2  PRO  59           HG2      PRO  59 -11.771  -8.781  -1.965
  Start of MODEL   16
11006    HG3  PRO  59           HG3      PRO  59 -10.566  -7.611  -1.412
  Start of MODEL   16
11007    HD2  PRO  59           HD2      PRO  59 -10.128  -9.551  -3.312
  Start of MODEL   16
11008    HD3  PRO  59           HD3      PRO  59  -8.853  -8.770  -2.356
  Start of MODEL   16
11009    HA   ALA  60           HA       ALA  60 -13.166 -13.606  -0.734
  Start of MODEL   16
11010    HB1  ALA  60           HB1      ALA  60 -13.466 -13.545   2.276
  Start of MODEL   16
11011    HB3  ALA  60           HB2      ALA  60 -12.421 -14.644   1.380
  Start of MODEL   16
11012    HB2  ALA  60           HB3      ALA  60 -14.170 -14.737   1.179
  Start of MODEL   16
11013    H    ALA  60           HN       ALA  60 -11.682 -12.134   1.227
  Start of MODEL   16
11014    HA   ALA  61           HA       ALA  61 -16.598 -11.206  -1.009
  Start of MODEL   16
11015    HB2  ALA  61           HB1      ALA  61 -18.308 -13.427   0.096
  Start of MODEL   16
11016    HB1  ALA  61           HB2      ALA  61 -17.780 -13.261  -1.581
  Start of MODEL   16
11017    HB3  ALA  61           HB3      ALA  61 -18.879 -12.073  -0.878
  Start of MODEL   16
11018    H    ALA  61           HN       ALA  61 -15.734 -13.712  -0.093
  Start of MODEL   16
11019    HA   ASN  62           HA       ASN  62 -18.205 -10.547   3.335
  Start of MODEL   16
11020    HB3  ASN  62           HB2      ASN  62 -16.510 -12.679   4.670
  Start of MODEL   16
11021    HB2  ASN  62           HB3      ASN  62 -18.230 -12.804   4.329
  Start of MODEL   16
11022   HD21  ASN  62          HD21      ASN  62 -19.677 -11.502   5.533
  Start of MODEL   16
11023   HD22  ASN  62          HD22      ASN  62 -19.228 -10.841   7.071
  Start of MODEL   16
11024    H    ASN  62           HN       ASN  62 -16.666 -12.652   2.163
  Start of MODEL   16
11025    HA   GLU  63           HA       GLU  63 -13.990  -9.005   4.424
  Start of MODEL   16
11026    HB3  GLU  63           HB2      GLU  63 -11.848  -9.087   3.163
  Start of MODEL   16
11027    HB2  GLU  63           HB3      GLU  63 -12.606 -10.193   2.029
  Start of MODEL   16
11028    HG2  GLU  63           HG2      GLU  63 -12.253 -10.753   4.941
  Start of MODEL   16
11029    HG3  GLU  63           HG3      GLU  63 -12.854 -11.862   3.710
  Start of MODEL   16
11030    H    GLU  63           HN       GLU  63 -14.929 -10.899   2.474
  Start of MODEL   16
11031    HA   THR  64           HA       THR  64 -14.915  -5.847   1.522
  Start of MODEL   16
11032    HB   THR  64           HB       THR  64 -15.111  -4.363   4.156
  Start of MODEL   16
11033    HG1  THR  64           HG1      THR  64 -16.902  -6.226   2.961
  Start of MODEL   16
11034   HG22  THR  64          HG21      THR  64 -16.856  -3.111   2.958
  Start of MODEL   16
11035   HG21  THR  64          HG22      THR  64 -16.635  -4.147   1.546
  Start of MODEL   16
11036   HG23  THR  64          HG23      THR  64 -15.335  -3.069   2.065
  Start of MODEL   16
11037    H    THR  64           HN       THR  64 -14.539  -6.968   4.178
  Start of MODEL   16
11038    HA   VAL  65           HA       VAL  65 -10.888  -4.097   3.215
  Start of MODEL   16
11039    HB   VAL  65           HB       VAL  65  -9.843  -6.741   4.160
  Start of MODEL   16
11040    H    VAL  65           HN       VAL  65 -12.434  -6.555   3.393
  Start of MODEL   16
11041    HA   ARG  66           HA       ARG  66  -8.866  -5.836  -0.255
  Start of MODEL   16
11042    HB3  ARG  66           HB2      ARG  66  -8.317  -2.870  -0.090
  Start of MODEL   16
11043    HB2  ARG  66           HB3      ARG  66  -9.376  -3.687  -1.220
  Start of MODEL   16
11044    HG2  ARG  66           HG2      ARG  66  -6.367  -3.758  -1.184
  Start of MODEL   16
11045    HG3  ARG  66           HG3      ARG  66  -7.360  -4.766  -2.234
  Start of MODEL   16
11046    HD2  ARG  66           HD2      ARG  66  -7.446  -1.753  -2.161
  Start of MODEL   16
11047    HD3  ARG  66           HD3      ARG  66  -6.532  -2.684  -3.347
  Start of MODEL   16
11048    HE   ARG  66           HE       ARG  66  -9.356  -3.224  -3.063
  Start of MODEL   16
11049   HH11  ARG  66          HH11      ARG  66  -6.924  -1.450  -4.969
  Start of MODEL   16
11050   HH12  ARG  66          HH12      ARG  66  -7.869  -1.461  -6.390
  Start of MODEL   16
11051   HH21  ARG  66          HH21      ARG  66 -10.582  -3.215  -5.009
  Start of MODEL   16
11052   HH22  ARG  66          HH22      ARG  66  -9.968  -2.466  -6.424
  Start of MODEL   16
11053    H    ARG  66           HN       ARG  66  -9.550  -3.755   1.635
  Start of MODEL   16
11054    HA   HIS  67           HA       HIS  67  -5.260  -6.141   2.129
  Start of MODEL   16
11055    HB3  HIS  67           HB2      HIS  67  -4.656  -8.533   2.355
  Start of MODEL   16
11056    HB2  HIS  67           HB3      HIS  67  -5.823  -8.930   1.104
  Start of MODEL   16
11057    HD1  HIS  67           HD1      HIS  67  -5.630  -7.955   4.718
  Start of MODEL   16
11058    HD2  HIS  67           HD2      HIS  67  -8.464  -9.045   1.888
  Start of MODEL   16
11059    HE1  HIS  67           HE1      HIS  67  -7.723  -8.440   6.007
  Start of MODEL   16
11060    HE2  HIS  67           HE2      HIS  67  -9.119  -9.608   4.285
  Start of MODEL   16
11061    H    HIS  67           HN       HIS  67  -7.103  -6.988   0.012
  Start of MODEL   16
11062    HA2  GLY  68           HA2      GLY  68  -2.040  -7.081  -0.658
  Start of MODEL   16
11063    H    GLY  68           HN       GLY  68  -3.175  -5.785   1.599
  Start of MODEL   16
11064    HA3  GLY  68           HA1      GLY  68  -2.346  -5.366  -0.905
  Start of MODEL   16
11065    HA   CYS  69           HA       CYS  69   1.349  -4.802   1.237
  Start of MODEL   16
11066    HB3  CYS  69           HB2      CYS  69   2.124  -7.343  -0.204
  Start of MODEL   16
11067    HB2  CYS  69           HB3      CYS  69   1.783  -7.139   1.513
  Start of MODEL   16
11068    H    CYS  69           HN       CYS  69   0.056  -5.745  -1.164
  Start of MODEL   16
11069    HA   LEU  70           HA       LEU  70   3.448  -2.862  -2.082
  Start of MODEL   16
11070    HB3  LEU  70           HB2      LEU  70   4.471  -1.428   0.394
  Start of MODEL   16
11071    HB2  LEU  70           HB3      LEU  70   3.078  -0.904  -0.528
  Start of MODEL   16
11072    HG   LEU  70           HG       LEU  70   5.909  -1.022  -1.577
  Start of MODEL   16
11073   HD12  LEU  70          HD11      LEU  70   5.014   0.314  -3.423
  Start of MODEL   16
11074   HD11  LEU  70          HD12      LEU  70   3.389   0.087  -2.777
  Start of MODEL   16
11075   HD13  LEU  70          HD13      LEU  70   4.312  -1.304  -3.355
  Start of MODEL   16
11076   HD22  LEU  70          HD21      LEU  70   5.824   1.417  -1.494
  Start of MODEL   16
11077   HD21  LEU  70          HD22      LEU  70   5.682   0.710   0.118
  Start of MODEL   16
11078   HD23  LEU  70          HD23      LEU  70   4.251   1.335  -0.707
  Start of MODEL   16
11079    H    LEU  70           HN       LEU  70   2.805  -3.282   0.714
  Start of MODEL   16
11080    HA   ARG  71           HA       ARG  71   6.691  -5.479  -0.882
  Start of MODEL   16
11081    HB3  ARG  71           HB2      ARG  71   5.601  -6.616  -3.460
  Start of MODEL   16
11082    HB2  ARG  71           HB3      ARG  71   5.180  -7.126  -1.833
  Start of MODEL   16
11083    HG2  ARG  71           HG2      ARG  71   7.906  -7.375  -3.088
  Start of MODEL   16
11084    HG3  ARG  71           HG3      ARG  71   7.455  -7.928  -1.476
  Start of MODEL   16
11085    HD2  ARG  71           HD2      ARG  71   6.136  -8.903  -4.001
  Start of MODEL   16
11086    HD3  ARG  71           HD3      ARG  71   7.525  -9.699  -3.273
  Start of MODEL   16
11087    HE   ARG  71           HE       ARG  71   5.733  -9.620  -1.238
  Start of MODEL   16
11088   HH11  ARG  71          HH11      ARG  71   5.312 -10.606  -4.612
  Start of MODEL   16
11089   HH12  ARG  71          HH12      ARG  71   4.362 -11.963  -4.256
  Start of MODEL   16
11090   HH21  ARG  71          HH21      ARG  71   4.409 -11.544  -0.746
  Start of MODEL   16
11091   HH22  ARG  71          HH22      ARG  71   3.860 -12.508  -2.040
  Start of MODEL   16
11092    H    ARG  71           HN       ARG  71   4.736  -4.419  -2.746
  Start of MODEL   16
11093    HA   LEU  72           HA       LEU  72   9.622  -3.945  -3.601
  Start of MODEL   16
11094    HB3  LEU  72           HB2      LEU  72  11.653  -3.182  -2.288
  Start of MODEL   16
11095    HB2  LEU  72           HB3      LEU  72  10.789  -3.623  -0.830
  Start of MODEL   16
11096    HG   LEU  72           HG       LEU  72   9.604  -1.703  -2.763
  Start of MODEL   16
11097   HD11  LEU  72          HD11      LEU  72   9.282  -2.007   0.205
  Start of MODEL   16
11098   HD13  LEU  72          HD12      LEU  72   8.122  -2.465  -1.048
  Start of MODEL   16
11099   HD12  LEU  72          HD13      LEU  72   8.520  -0.762  -0.782
  Start of MODEL   16
11100   HD21  LEU  72          HD21      LEU  72  11.848  -0.864  -2.319
  Start of MODEL   16
11101   HD23  LEU  72          HD22      LEU  72  11.513  -0.903  -0.578
  Start of MODEL   16
11102   HD22  LEU  72          HD23      LEU  72  10.577   0.153  -1.651
  Start of MODEL   16
11103    H    LEU  72           HN       LEU  72   8.679  -4.959  -1.052
  Start of MODEL   16
11104    HA   ASN  73           HA       ASN  73  10.999  -7.965  -4.077
  Start of MODEL   16
11105    HB3  ASN  73           HB2      ASN  73  11.982  -8.076  -6.403
  Start of MODEL   16
11106    HB2  ASN  73           HB3      ASN  73  11.687  -6.349  -6.538
  Start of MODEL   16
11107   HD21  ASN  73          HD21      ASN  73   9.574  -8.763  -5.024
  Start of MODEL   16
11108   HD22  ASN  73          HD22      ASN  73   8.275  -8.567  -6.145
  Start of MODEL   16
11109    H    ASN  73           HN       ASN  73  10.370  -5.328  -4.754
  Start of MODEL   16
11110    HA   GLN  74           HA       GLN  74  15.105  -6.474  -3.173
  Start of MODEL   16
11111    HB3  GLN  74           HB2      GLN  74  16.773  -5.264  -4.702
  Start of MODEL   16
11112    HB2  GLN  74           HB3      GLN  74  15.436  -5.059  -5.823
  Start of MODEL   16
11113    HG2  GLN  74           HG2      GLN  74  15.152  -7.562  -5.766
  Start of MODEL   16
11114    HG3  GLN  74           HG3      GLN  74  16.637  -6.984  -6.523
  Start of MODEL   16
11115   HE21  GLN  74          HE21      GLN  74  18.573  -7.400  -5.550
  Start of MODEL   16
11116   HE22  GLN  74          HE22      GLN  74  18.762  -8.507  -4.235
  Start of MODEL   16
11117    H    GLN  74           HN       GLN  74  13.010  -5.180  -4.686
  Start of MODEL   16
11118    HA   PRO  75           HA       PRO  75  14.454  -2.766  -0.885
  Start of MODEL   16
11119    HB3  PRO  75           HB2      PRO  75  15.143  -3.879   0.992
  Start of MODEL   16
11120    HB2  PRO  75           HB3      PRO  75  16.650  -3.001   0.722
  Start of MODEL   16
11121    HG2  PRO  75           HG2      PRO  75  17.682  -4.805  -0.277
  Start of MODEL   16
11122    HG3  PRO  75           HG3      PRO  75  16.588  -5.667   0.821
  Start of MODEL   16
11123    HD2  PRO  75           HD2      PRO  75  16.616  -6.101  -1.830
  Start of MODEL   16
11124    HD3  PRO  75           HD3      PRO  75  15.133  -6.231  -0.860
  Start of MODEL   16
11125    HA   THR  76           HA       THR  76  17.561  -0.233  -2.595
  Start of MODEL   16
11126    HB   THR  76           HB       THR  76  16.278   1.847  -3.395
  Start of MODEL   16
11127    HG1  THR  76           HG1      THR  76  13.887   0.630  -3.317
  Start of MODEL   16
11128   HG22  THR  76          HG21      THR  76  15.191   0.636  -5.240
  Start of MODEL   16
11129   HG21  THR  76          HG22      THR  76  15.325  -0.870  -4.330
  Start of MODEL   16
11130   HG23  THR  76          HG23      THR  76  16.780  -0.049  -4.893
  Start of MODEL   16
11131    H    THR  76           HN       THR  76  14.980  -0.758  -1.380
  Start of MODEL   16
11132    HA   HIS  77           HA       HIS  77  18.120   2.144   1.015
  Start of MODEL   16
11133    HB3  HIS  77           HB2      HIS  77  20.513   1.615   0.341
  Start of MODEL   16
11134    HB2  HIS  77           HB3      HIS  77  20.300   3.077   1.285
  Start of MODEL   16
11135    HD1  HIS  77           HD1      HIS  77  21.204   5.253   0.310
  Start of MODEL   16
11136    HD2  HIS  77           HD2      HIS  77  21.063   2.157  -2.419
  Start of MODEL   16
11137    HE1  HIS  77           HE1      HIS  77  22.432   6.091  -1.655
  Start of MODEL   16
11138    HE2  HIS  77           HE2      HIS  77  22.040   4.333  -3.416
  Start of MODEL   16
11139    H    HIS  77           HN       HIS  77  18.798   1.429  -1.705
  Start of MODEL   16
11140    HA   VAL  78           HA       VAL  78  17.671   6.074  -1.117
  Start of MODEL   16
11141    HB   VAL  78           HB       VAL  78  16.482   6.778  -3.201
  Start of MODEL   16
11142    H    VAL  78           HN       VAL  78  17.583   3.462  -2.038
  Start of MODEL   16
11143    HA   ASN  79           HA       ASN  79  13.245   5.483  -0.422
  Start of MODEL   16
11144    HB3  ASN  79           HB2      ASN  79  11.726   3.423  -0.387
  Start of MODEL   16
11145    HB2  ASN  79           HB3      ASN  79  13.143   2.548  -0.958
  Start of MODEL   16
11146   HD21  ASN  79          HD21      ASN  79  13.876   2.934  -2.910
  Start of MODEL   16
11147   HD22  ASN  79          HD22      ASN  79  13.037   3.784  -4.177
  Start of MODEL   16
11148    H    ASN  79           HN       ASN  79  15.447   3.611  -0.632
  Start of MODEL   16
11149    HA   ASN  80           HA       ASN  80  13.705   3.640   3.703
  Start of MODEL   16
11150    HB3  ASN  80           HB2      ASN  80  15.979   2.994   3.836
  Start of MODEL   16
11151    HB2  ASN  80           HB3      ASN  80  15.734   4.087   5.187
  Start of MODEL   16
11152   HD21  ASN  80          HD21      ASN  80  18.186   3.354   3.886
  Start of MODEL   16
11153   HD22  ASN  80          HD22      ASN  80  18.867   4.814   3.276
  Start of MODEL   16
11154    H    ASN  80           HN       ASN  80  15.259   4.959   1.636
  Start of MODEL   16
11155    HA2  GLY  81           HA2      GLY  81  12.450   7.431   5.349
  Start of MODEL   16
11156    H    GLY  81           HN       GLY  81  12.102   5.320   3.351
  Start of MODEL   16
11157    HA3  GLY  81           HA1      GLY  81  11.960   7.900   3.723
  Start of MODEL   16
11158    HA   ASN  82           HA       ASN  82   8.200   6.893   5.767
  Start of MODEL   16
11159    HB3  ASN  82           HB2      ASN  82   8.036   9.848   5.218
  Start of MODEL   16
11160    HB2  ASN  82           HB3      ASN  82   8.595   9.113   6.711
  Start of MODEL   16
11161   HD21  ASN  82          HD21      ASN  82   6.464  10.939   6.277
  Start of MODEL   16
11162   HD22  ASN  82          HD22      ASN  82   5.027  10.207   6.905
  Start of MODEL   16
11163    H    ASN  82           HN       ASN  82   9.986   8.666   4.288
  Start of MODEL   16
11164    HA   TYR  83           HA       TYR  83   5.826   6.719   2.086
  Start of MODEL   16
11165    HB3  TYR  83           HB2      TYR  83   4.668   4.404   2.119
  Start of MODEL   16
11166    HB2  TYR  83           HB3      TYR  83   5.735   4.034   3.460
  Start of MODEL   16
11167    HD1  TYR  83           HD1      TYR  83   5.754   4.961  -0.146
  Start of MODEL   16
11168    HD2  TYR  83           HD2      TYR  83   7.913   3.318   3.134
  Start of MODEL   16
11169    HE1  TYR  83           HE1      TYR  83   7.566   4.273  -1.674
  Start of MODEL   16
11170    HE2  TYR  83           HE2      TYR  83   9.714   2.629   1.605
  Start of MODEL   16
11171    HH   TYR  83           HH       TYR  83   9.981   2.113  -0.813
  Start of MODEL   16
11172    H    TYR  83           HN       TYR  83   6.833   5.752   4.637
  Start of MODEL   16
11173    HA   THR  84           HA       THR  84   1.967   7.040   4.150
  Start of MODEL   16
11174    HB   THR  84           HB       THR  84   2.231   9.316   2.179
  Start of MODEL   16
11175    HG1  THR  84           HG1      THR  84   3.633   8.707   4.299
  Start of MODEL   16
11176   HG22  THR  84          HG21      THR  84   0.682  10.513   3.706
  Start of MODEL   16
11177   HG21  THR  84          HG22      THR  84   0.517   9.043   4.672
  Start of MODEL   16
11178   HG23  THR  84          HG23      THR  84  -0.063   9.079   3.005
  Start of MODEL   16
11179    H    THR  84           HN       THR  84   3.731   7.218   1.825
  Start of MODEL   16
11180    HA   LEU  85           HA       LEU  85  -0.441   5.582   0.808
  Start of MODEL   16
11181    HB3  LEU  85           HB2      LEU  85  -1.501   4.149   3.251
  Start of MODEL   16
11182    HB2  LEU  85           HB3      LEU  85  -0.225   3.570   2.197
  Start of MODEL   16
11183    HG   LEU  85           HG       LEU  85  -3.134   3.884   1.435
  Start of MODEL   16
11184   HD11  LEU  85          HD11      LEU  85  -0.773   2.843  -0.061
  Start of MODEL   16
11185   HD13  LEU  85          HD12      LEU  85  -1.671   4.329  -0.438
  Start of MODEL   16
11186   HD12  LEU  85          HD13      LEU  85  -2.451   2.740  -0.606
  Start of MODEL   16
11187   HD22  LEU  85          HD21      LEU  85  -3.153   1.503   1.356
  Start of MODEL   16
11188   HD21  LEU  85          HD22      LEU  85  -2.605   2.028   2.958
  Start of MODEL   16
11189   HD23  LEU  85          HD23      LEU  85  -1.441   1.431   1.777
  Start of MODEL   16
11190    H    LEU  85           HN       LEU  85   0.112   6.045   3.641
  Start of MODEL   16
11191    HA   LEU  86           HA       LEU  86  -3.999   8.000   1.554
  Start of MODEL   16
11192    HB3  LEU  86           HB2      LEU  86  -4.345   9.461  -0.417
  Start of MODEL   16
11193    HB2  LEU  86           HB3      LEU  86  -3.090   8.614  -1.275
  Start of MODEL   16
11194    HG   LEU  86           HG       LEU  86  -2.491  10.881  -0.447
  Start of MODEL   16
11195   HD11  LEU  86          HD11      LEU  86  -2.542   9.612   2.251
  Start of MODEL   16
11196   HD13  LEU  86          HD12      LEU  86  -3.591  10.896   1.649
  Start of MODEL   16
11197   HD12  LEU  86          HD13      LEU  86  -1.866  11.194   1.864
  Start of MODEL   16
11198   HD22  LEU  86          HD21      LEU  86  -0.241  10.288   0.309
  Start of MODEL   16
11199   HD21  LEU  86          HD22      LEU  86  -0.742   9.301  -1.067
  Start of MODEL   16
11200   HD23  LEU  86          HD23      LEU  86  -0.763   8.627   0.567
  Start of MODEL   16
11201    H    LEU  86           HN       LEU  86  -1.973   6.671  -0.097
  Start of MODEL   16
11202    HA   ALA  87           HA       ALA  87  -6.588   5.700  -1.142
  Start of MODEL   16
11203    HB2  ALA  87           HB1      ALA  87  -8.304   4.514   0.181
  Start of MODEL   16
11204    HB1  ALA  87           HB2      ALA  87  -7.869   5.482   1.581
  Start of MODEL   16
11205    HB3  ALA  87           HB3      ALA  87  -6.705   4.351   0.902
  Start of MODEL   16
11206    H    ALA  87           HN       ALA  87  -6.027   7.314   1.266
  Start of MODEL   16
11207    HA   ALA  88           HA       ALA  88  -9.433   8.960  -1.522
  Start of MODEL   16
11208    HB3  ALA  88           HB1      ALA  88  -9.593   9.589  -3.868
  Start of MODEL   16
11209    HB2  ALA  88           HB2      ALA  88  -8.840   8.072  -4.337
  Start of MODEL   16
11210    HB1  ALA  88           HB3      ALA  88  -7.912   9.272  -3.439
  Start of MODEL   16
11211    H    ALA  88           HN       ALA  88  -7.860   6.694  -2.464
  Start of MODEL   16
11212    HA   ASN  89           HA       ASN  89 -13.091   6.796  -2.587
  Start of MODEL   16
11213    HB3  ASN  89           HB2      ASN  89 -12.968   6.996   0.445
  Start of MODEL   16
11214    HB2  ASN  89           HB3      ASN  89 -12.431   5.629  -0.511
  Start of MODEL   16
11215   HD21  ASN  89          HD21      ASN  89 -13.961   4.155  -1.343
  Start of MODEL   16
11216   HD22  ASN  89          HD22      ASN  89 -15.587   4.217  -0.811
  Start of MODEL   16
11217    H    ASN  89           HN       ASN  89 -11.456   8.631  -1.000
  Start of MODEL   16
11218    HA   PRO  90           HA       PRO  90 -15.965  10.303  -2.765
  Start of MODEL   16
11219    HB3  PRO  90           HB2      PRO  90 -17.869   9.272  -3.465
  Start of MODEL   16
11220    HB2  PRO  90           HB3      PRO  90 -18.240   8.853  -1.792
  Start of MODEL   16
11221    HG2  PRO  90           HG2      PRO  90 -17.391   6.739  -2.003
  Start of MODEL   16
11222    HG3  PRO  90           HG3      PRO  90 -17.644   7.009  -3.735
  Start of MODEL   16
11223    HD2  PRO  90           HD2      PRO  90 -15.240   6.375  -2.747
  Start of MODEL   16
11224    HD3  PRO  90           HD3      PRO  90 -15.402   7.512  -4.103
  Start of MODEL   16
11225    HA   CYS  91           HA       CYS  91 -17.407   9.854   1.904
  Start of MODEL   16
11226    HB3  CYS  91           HB2      CYS  91 -15.554   7.501   2.218
  Start of MODEL   16
11227    HB2  CYS  91           HB3      CYS  91 -17.304   7.510   2.339
  Start of MODEL   16
11228    H    CYS  91           HN       CYS  91 -16.255   8.136   0.041
  Start of MODEL   16
11229    HA2  GLY  92           HA2      GLY  92 -13.110  11.976   1.385
  Start of MODEL   16
11230    H    GLY  92           HN       GLY  92 -14.051   9.593   0.872
  Start of MODEL   16
11231    HA3  GLY  92           HA1      GLY  92 -13.102  11.284   3.008
  Start of MODEL   16
11232    HA   GLN  93           HA       GLN  93  -9.553   9.452   1.144
  Start of MODEL   16
11233    HB3  GLN  93           HB2      GLN  93  -8.366  12.232   1.405
  Start of MODEL   16
11234    HB2  GLN  93           HB3      GLN  93  -8.914  11.476  -0.085
  Start of MODEL   16
11235    HG2  GLN  93           HG2      GLN  93  -6.600  10.566   1.622
  Start of MODEL   16
11236    HG3  GLN  93           HG3      GLN  93  -7.167   9.759   0.169
  Start of MODEL   16
11237   HE21  GLN  93          HE21      GLN  93  -5.548  12.560   1.442
  Start of MODEL   16
11238   HE22  GLN  93          HE22      GLN  93  -4.865  13.072  -0.053
  Start of MODEL   16
11239    H    GLN  93           HN       GLN  93 -10.739  11.890   2.236
  Start of MODEL   16
11240    HA   ALA  94           HA       ALA  94  -7.921   9.084   5.181
  Start of MODEL   16
11241    HB2  ALA  94           HB1      ALA  94  -7.705   6.702   5.711
  Start of MODEL   16
11242    HB1  ALA  94           HB2      ALA  94  -7.911   6.309   4.016
  Start of MODEL   16
11243    HB3  ALA  94           HB3      ALA  94  -9.253   7.018   4.916
  Start of MODEL   16
11244    H    ALA  94           HN       ALA  94  -8.436   8.201   2.424
  Start of MODEL   16
11245    HA   SER  95           HA       SER  95  -3.767   7.920   4.232
  Start of MODEL   16
11246    HB3  SER  95           HB2      SER  95  -3.731  10.283   3.995
  Start of MODEL   16
11247    HB2  SER  95           HB3      SER  95  -2.376   9.871   5.043
  Start of MODEL   16
11248    HG   SER  95           HG       SER  95  -4.909  10.631   6.020
  Start of MODEL   16
11249    H    SER  95           HN       SER  95  -5.845   8.656   6.107
  Start of MODEL   16
11250    HA   ALA  96           HA       ALA  96  -1.762   6.904   8.032
  Start of MODEL   16
11251    HB1  ALA  96           HB1      ALA  96  -1.802   4.501   6.195
  Start of MODEL   16
11252    HB3  ALA  96           HB2      ALA  96  -2.990   4.879   7.443
  Start of MODEL   16
11253    HB2  ALA  96           HB3      ALA  96  -1.336   4.459   7.893
  Start of MODEL   16
11254    H    ALA  96           HN       ALA  96  -1.987   7.030   5.138
  Start of MODEL   16
11255    HA   SER  97           HA       SER  97   2.358   7.016   6.503
  Start of MODEL   16
11256    HB3  SER  97           HB2      SER  97   2.629   7.863   9.382
  Start of MODEL   16
11257    HB2  SER  97           HB3      SER  97   1.667   8.810   8.258
  Start of MODEL   16
11258    HG   SER  97           HG       SER  97   4.382   8.155   7.668
  Start of MODEL   16
11259    H    SER  97           HN       SER  97   0.477   6.356   8.663
  Start of MODEL   16
11260    HA   ILE  98           HA       ILE  98   4.726   3.964   8.675
  Start of MODEL   16
11261    HB   ILE  98           HB       ILE  98   3.113   2.632   7.308
  Start of MODEL   16
11262   HD11  ILE  98          HD11      ILE  98   6.913   1.909   7.308
  Start of MODEL   16
11263   HD13  ILE  98          HD12      ILE  98   6.241   0.995   5.957
  Start of MODEL   16
11264   HD12  ILE  98          HD13      ILE  98   6.625   0.175   7.474
  Start of MODEL   16
11265    H    ILE  98           HN       ILE  98   4.025   5.540   6.331
  Start of MODEL   16
11266    HA   MET  99           HA       MET  99   8.461   5.025   6.772
  Start of MODEL   16
11267    HB3  MET  99           HB2      MET  99  10.127   5.683   8.439
  Start of MODEL   16
11268    HB2  MET  99           HB3      MET  99   9.139   4.987   9.713
  Start of MODEL   16
11269    HG2  MET  99           HG2      MET  99   8.216   7.216   7.926
  Start of MODEL   16
11270    HG3  MET  99           HG3      MET  99   7.435   6.605   9.377
  Start of MODEL   16
11271    HE1  MET  99           HE1      MET  99  10.345   8.686   7.867
  Start of MODEL   16
11272    HE3  MET  99           HE2      MET  99  11.268   7.415   8.661
  Start of MODEL   16
11273    HE2  MET  99           HE3      MET  99  11.335   9.070   9.269
  Start of MODEL   16
11274    H    MET  99           HN       MET  99   6.858   3.997   8.988
  Start of MODEL   16
11275    HA   ALA 100           HA       ALA 100  10.093   1.036   6.902
  Start of MODEL   16
11276    HB1  ALA 100           HB1      ALA 100  10.140   1.872   4.011
  Start of MODEL   16
11277    HB3  ALA 100           HB2      ALA 100   8.816   1.022   4.814
  Start of MODEL   16
11278    HB2  ALA 100           HB3      ALA 100  10.386   0.237   4.622
  Start of MODEL   16
11279    H    ALA 100           HN       ALA 100   9.464   3.606   5.684
  Start of MODEL   16
11280    HA   ALA 101           HA       ALA 101  14.290   1.957   6.140
  Start of MODEL   16
11281    HB2  ALA 101           HB1      ALA 101  15.526   1.571   8.231
  Start of MODEL   16
11282    HB1  ALA 101           HB2      ALA 101  14.099   0.815   8.936
  Start of MODEL   16
11283    HB3  ALA 101           HB3      ALA 101  14.072   2.527   8.500
  Start of MODEL   16
11284    H    ALA 101           HN       ALA 101  12.107   0.393   7.278
  Start of MODEL   16
11285    HA   PHE 102           HA       PHE 102  14.938  -2.251   4.931
  Start of MODEL   16
11286    HB3  PHE 102           HB2      PHE 102  15.668  -2.255   2.631
  Start of MODEL   16
11287    HB2  PHE 102           HB3      PHE 102  16.161  -0.563   2.717
  Start of MODEL   16
11288    HD1  PHE 102           HD1      PHE 102  13.204  -2.783   2.833
  Start of MODEL   16
11289    HD2  PHE 102           HD2      PHE 102  14.665   1.148   2.202
  Start of MODEL   16
11290    HE1  PHE 102           HE1      PHE 102  10.974  -2.083   2.086
  Start of MODEL   16
11291    HE2  PHE 102           HE2      PHE 102  12.439   1.856   1.452
  Start of MODEL   16
11292    HZ   PHE 102           HZ       PHE 102  10.589   0.243   1.400
  Start of MODEL   16
11293    H    PHE 102           HN       PHE 102  14.790   0.613   4.641
  Start of MODEL   16
11294    HA   MET 103           HA       MET 103  19.213  -0.974   5.993
  Start of MODEL   16
11295    HB3  MET 103           HB2      MET 103  20.044  -1.952   3.893
  Start of MODEL   16
11296    HB2  MET 103           HB3      MET 103  21.135  -0.675   4.399
  Start of MODEL   16
11297    HG2  MET 103           HG2      MET 103  19.050  -0.445   2.243
  Start of MODEL   16
11298    HG3  MET 103           HG3      MET 103  20.133   0.840   2.765
  Start of MODEL   16
11299    HE3  MET 103           HE1      MET 103  21.091  -2.998   2.409
  Start of MODEL   16
11300    HE2  MET 103           HE2      MET 103  21.600  -3.059   0.724
  Start of MODEL   16
11301    HE1  MET 103           HE3      MET 103  19.913  -2.738   1.125
  Start of MODEL   16
11302    H    MET 103           HN       MET 103  17.492  -0.035   3.860
  Start of MODEL   16
11303    HA   ASP 104           HA       ASP 104  18.854   3.230   6.847
  Start of MODEL   16
11304    HB3  ASP 104           HB2      ASP 104  21.395   2.542   8.351
  Start of MODEL   16
11305    HB2  ASP 104           HB3      ASP 104  19.763   2.378   8.986
  Start of MODEL   16
11306    H    ASP 104           HN       ASP 104  20.166   0.727   7.041
  Start of MODEL   16
11307    HA   ASN 105           HA       ASN 105  21.220   5.035   3.830
  Start of MODEL   16
11308    HB3  ASN 105           HB2      ASN 105  19.338   6.474   3.540
  Start of MODEL   16
11309    HB2  ASN 105           HB3      ASN 105  20.750   7.508   3.542
  Start of MODEL   16
11310   HD21  ASN 105          HD21      ASN 105  17.811   6.732   5.137
  Start of MODEL   16
11311   HD22  ASN 105          HD22      ASN 105  17.842   8.024   6.269
  Start of MODEL   16
11312    H    ASN 105           HN       ASN 105  19.556   5.207   6.126
  Start of MODEL   16
11313    HA   PRO 106           HA       PRO 106  24.841   6.249   6.007
  Start of MODEL   16
11314    HB3  PRO 106           HB2      PRO 106  25.997   4.467   5.257
  Start of MODEL   16
11315    HB2  PRO 106           HB3      PRO 106  26.548   5.579   4.016
  Start of MODEL   16
11316    HG2  PRO 106           HG2      PRO 106  25.317   4.559   2.409
  Start of MODEL   16
11317    HG3  PRO 106           HG3      PRO 106  25.031   3.258   3.567
  Start of MODEL   16
11318    HD2  PRO 106           HD2      PRO 106  23.146   5.163   2.546
  Start of MODEL   16
11319    HD3  PRO 106           HD3      PRO 106  22.876   3.864   3.725
  Start of MODEL   16
11320    HA   PHE 107           HA       PHE 107  25.850   9.745   3.723
  Start of MODEL   16
11321    HB3  PHE 107           HB2      PHE 107  27.653  10.920   5.031
  Start of MODEL   16
11322    HB2  PHE 107           HB3      PHE 107  27.947   9.336   5.798
  Start of MODEL   16
11323    HD1  PHE 107           HD1      PHE 107  25.301  11.916   5.350
  Start of MODEL   16
11324    HD2  PHE 107           HD2      PHE 107  26.753   8.637   7.631
  Start of MODEL   16
11325    HE1  PHE 107           HE1      PHE 107  23.614  12.375   7.075
  Start of MODEL   16
11326    HE2  PHE 107           HE2      PHE 107  25.063   9.088   9.363
  Start of MODEL   16
11327    HZ   PHE 107           HZ       PHE 107  23.351  10.847   8.972
  Start of MODEL   16
11328    H    PHE 107           HN       PHE 107  26.837   7.420   5.162
  Start of MODEL   17
11329    H1   ASP   1           H        ASP   1 -29.516  -5.535  -7.066
  Start of MODEL   17
11330    H2   ASP   1           H2       ASP   1 -27.910  -5.428  -6.600
  Start of MODEL   17
11331    H3   ASP   1           H3       ASP   1 -28.280  -5.639  -8.251
  Start of MODEL   17
11332    HA   ASP   1           HA       ASP   1 -27.610  -3.402  -7.788
  Start of MODEL   17
11333    HB3  ASP   1           HB2      ASP   1 -29.513  -3.749  -9.422
  Start of MODEL   17
11334    HB2  ASP   1           HB3      ASP   1 -29.497  -2.166  -8.652
  Start of MODEL   17
11335    HA   ASP   2           HA       ASP   2 -28.051  -0.198  -4.874
  Start of MODEL   17
11336    HB3  ASP   2           HB2      ASP   2 -30.367  -1.821  -3.826
  Start of MODEL   17
11337    HB2  ASP   2           HB3      ASP   2 -30.560  -0.724  -5.189
  Start of MODEL   17
11338    H    ASP   2           HN       ASP   2 -27.869  -1.503  -6.647
  Start of MODEL   17
11339    HA   ASP   3           HA       ASP   3 -26.449  -3.684  -2.196
  Start of MODEL   17
11340    HB3  ASP   3           HB2      ASP   3 -24.618  -5.090  -3.142
  Start of MODEL   17
11341    HB2  ASP   3           HB3      ASP   3 -24.836  -4.311  -4.700
  Start of MODEL   17
11342    H    ASP   3           HN       ASP   3 -26.755  -2.823  -4.937
  Start of MODEL   17
11343    HA   ASP   4           HA       ASP   4 -22.706  -0.844  -3.230
  Start of MODEL   17
11344    HB3  ASP   4           HB2      ASP   4 -24.545   0.837  -4.935
  Start of MODEL   17
11345    HB2  ASP   4           HB3      ASP   4 -23.339  -0.294  -5.531
  Start of MODEL   17
11346    H    ASP   4           HN       ASP   4 -25.268  -1.402  -4.328
  Start of MODEL   17
11347    HA   ASP   5           HA       ASP   5 -25.440   2.408  -1.061
  Start of MODEL   17
11348    HB3  ASP   5           HB2      ASP   5 -27.564   0.416  -0.279
  Start of MODEL   17
11349    HB2  ASP   5           HB3      ASP   5 -27.714   1.566  -1.601
  Start of MODEL   17
11350    H    ASP   5           HN       ASP   5 -25.863  -0.179  -2.167
  Start of MODEL   17
11351    HA   VAL   6           HA       VAL   6 -24.505  -0.054   2.802
  Start of MODEL   17
11352    HB   VAL   6           HB       VAL   6 -23.054  -2.065   3.104
  Start of MODEL   17
11353    H    VAL   6           HN       VAL   6 -24.525  -0.698   0.067
  Start of MODEL   17
11354    HA   SER   7           HA       SER   7 -21.161   2.331   1.953
  Start of MODEL   17
11355    HB3  SER   7           HB2      SER   7 -21.779   4.583   3.062
  Start of MODEL   17
11356    HB2  SER   7           HB3      SER   7 -23.233   3.609   3.519
  Start of MODEL   17
11357    HG   SER   7           HG       SER   7 -23.887   3.402   1.617
  Start of MODEL   17
11358    H    SER   7           HN       SER   7 -23.490   1.530   3.420
  Start of MODEL   17
11359    HA   PHE   8           HA       PHE   8 -18.731   1.895   5.469
  Start of MODEL   17
11360    HB3  PHE   8           HB2      PHE   8 -17.027   0.146   5.025
  Start of MODEL   17
11361    HB2  PHE   8           HB3      PHE   8 -17.693  -0.086   3.416
  Start of MODEL   17
11362    HD1  PHE   8           HD1      PHE   8 -19.832  -1.170   3.097
  Start of MODEL   17
11363    HD2  PHE   8           HD2      PHE   8 -18.096  -0.751   6.933
  Start of MODEL   17
11364    HE1  PHE   8           HE1      PHE   8 -21.371  -2.879   3.964
  Start of MODEL   17
11365    HE2  PHE   8           HE2      PHE   8 -19.632  -2.448   7.823
  Start of MODEL   17
11366    HZ   PHE   8           HZ       PHE   8 -21.281  -3.509   6.316
  Start of MODEL   17
11367    H    PHE   8           HN       PHE   8 -19.609   1.296   2.749
  Start of MODEL   17
11368    HA   CYS   9           HA       CYS   9 -16.311   4.727   3.184
  Start of MODEL   17
11369    HB3  CYS   9           HB2      CYS   9 -15.513   5.363   6.032
  Start of MODEL   17
11370    HB2  CYS   9           HB3      CYS   9 -17.091   5.825   5.406
  Start of MODEL   17
11371    H    CYS   9           HN       CYS   9 -17.183   3.423   5.611
  Start of MODEL   17
11372    HA   ALA  10           HA       ALA  10 -12.564   2.688   3.483
  Start of MODEL   17
11373    HB2  ALA  10           HB1      ALA  10 -11.354   5.195   2.312
  Start of MODEL   17
11374    HB1  ALA  10           HB2      ALA  10 -12.250   3.992   1.388
  Start of MODEL   17
11375    HB3  ALA  10           HB3      ALA  10 -10.730   3.560   2.179
  Start of MODEL   17
11376    H    ALA  10           HN       ALA  10 -13.735   5.359   3.395
  Start of MODEL   17
11377    HA   SER  11           HA       SER  11  -9.887   4.103   6.538
  Start of MODEL   17
11378    HB3  SER  11           HB2      SER  11 -10.057   2.546   8.442
  Start of MODEL   17
11379    HB2  SER  11           HB3      SER  11 -10.934   1.395   7.419
  Start of MODEL   17
11380    HG   SER  11           HG       SER  11 -12.040   3.813   7.246
  Start of MODEL   17
11381    H    SER  11           HN       SER  11 -11.266   2.089   4.944
  Start of MODEL   17
11382    HA   VAL  12           HA       VAL  12  -6.606   1.581   5.160
  Start of MODEL   17
11383    HB   VAL  12           HB       VAL  12  -5.564   4.418   5.496
  Start of MODEL   17
11384    H    VAL  12           HN       VAL  12  -7.691   3.762   6.791
  Start of MODEL   17
11385    HA   GLN  13           HA       GLN  13  -4.099   0.975   8.694
  Start of MODEL   17
11386    HB3  GLN  13           HB2      GLN  13  -4.190  -1.372   9.326
  Start of MODEL   17
11387    HB2  GLN  13           HB3      GLN  13  -4.914  -1.784   7.789
  Start of MODEL   17
11388    HG2  GLN  13           HG2      GLN  13  -6.197  -0.087   9.907
  Start of MODEL   17
11389    HG3  GLN  13           HG3      GLN  13  -6.924  -0.564   8.371
  Start of MODEL   17
11390   HE21  GLN  13          HE21      GLN  13  -5.912  -1.624  11.496
  Start of MODEL   17
11391   HE22  GLN  13          HE22      GLN  13  -6.759  -3.120  11.513
  Start of MODEL   17
11392    H    GLN  13           HN       GLN  13  -5.443   0.192   6.218
  Start of MODEL   17
11393    HA   LEU  14           HA       LEU  14  -0.713  -0.929   6.619
  Start of MODEL   17
11394    HB3  LEU  14           HB2      LEU  14   1.252   0.760   6.919
  Start of MODEL   17
11395    HB2  LEU  14           HB3      LEU  14   0.026   1.800   7.623
  Start of MODEL   17
11396    HG   LEU  14           HG       LEU  14  -1.272   1.507   5.423
  Start of MODEL   17
11397   HD13  LEU  14          HD11      LEU  14   0.043   3.547   6.012
  Start of MODEL   17
11398   HD12  LEU  14          HD12      LEU  14   0.053   3.162   4.284
  Start of MODEL   17
11399   HD11  LEU  14          HD13      LEU  14   1.443   2.765   5.271
  Start of MODEL   17
11400   HD21  LEU  14          HD21      LEU  14  -0.021  -0.462   4.670
  Start of MODEL   17
11401   HD23  LEU  14          HD22      LEU  14   1.429   0.548   4.554
  Start of MODEL   17
11402   HD22  LEU  14          HD23      LEU  14   0.045   0.872   3.511
  Start of MODEL   17
11403    H    LEU  14           HN       LEU  14  -1.940   0.574   8.781
  Start of MODEL   17
11404    HA   HIS  15           HA       HIS  15   1.662  -2.250  10.087
  Start of MODEL   17
11405    HB3  HIS  15           HB2      HIS  15   2.338  -4.622   9.486
  Start of MODEL   17
11406    HB2  HIS  15           HB3      HIS  15   1.759  -4.318   7.862
  Start of MODEL   17
11407    HD1  HIS  15           HD1      HIS  15   0.342  -6.575   8.656
  Start of MODEL   17
11408    HD2  HIS  15           HD2      HIS  15  -0.846  -2.878  10.140
  Start of MODEL   17
11409    HE1  HIS  15           HE1      HIS  15  -2.012  -6.881   9.431
  Start of MODEL   17
11410    HE2  HIS  15           HE2      HIS  15  -2.737  -4.634  10.248
  Start of MODEL   17
11411    H    HIS  15           HN       HIS  15   1.394  -1.793   7.191
  Start of MODEL   17
11412    HA   THR  16           HA       THR  16   5.815  -1.165   9.410
  Start of MODEL   17
11413    HB   THR  16           HB       THR  16   6.042  -3.216  11.633
  Start of MODEL   17
11414    HG1  THR  16           HG1      THR  16   5.954  -0.609  12.411
  Start of MODEL   17
11415   HG21  THR  16          HG21      THR  16   7.676  -0.753  10.979
  Start of MODEL   17
11416   HG23  THR  16          HG22      THR  16   8.175  -2.409  10.648
  Start of MODEL   17
11417   HG22  THR  16          HG23      THR  16   7.975  -1.866  12.316
  Start of MODEL   17
11418    H    THR  16           HN       THR  16   3.750  -2.382  10.764
  Start of MODEL   17
11419    HA   ALA  17           HA       ALA  17   7.006  -4.250   6.604
  Start of MODEL   17
11420    HB2  ALA  17           HB1      ALA  17   9.478  -2.525   6.724
  Start of MODEL   17
11421    HB1  ALA  17           HB2      ALA  17   8.047  -2.151   5.781
  Start of MODEL   17
11422    HB3  ALA  17           HB3      ALA  17   8.978  -3.599   5.404
  Start of MODEL   17
11423    H    ALA  17           HN       ALA  17   7.398  -1.896   8.088
  Start of MODEL   17
11424    HA   VAL  18           HA       VAL  18   9.360  -6.758   9.166
  Start of MODEL   17
11425    HB   VAL  18           HB       VAL  18   9.040  -9.155   8.570
  Start of MODEL   17
11426    H    VAL  18           HN       VAL  18   8.061  -6.159   6.641
  Start of MODEL   17
11427    HA   GLU  19           HA       GLU  19  13.287  -6.740   7.465
  Start of MODEL   17
11428    HB3  GLU  19           HB2      GLU  19  14.981  -7.505   9.067
  Start of MODEL   17
11429    HB2  GLU  19           HB3      GLU  19  13.730  -8.205  10.070
  Start of MODEL   17
11430    HG2  GLU  19           HG2      GLU  19  14.757  -5.916  10.707
  Start of MODEL   17
11431    HG3  GLU  19           HG3      GLU  19  13.665  -5.290   9.472
  Start of MODEL   17
11432    H    GLU  19           HN       GLU  19  11.379  -7.338   9.431
  Start of MODEL   17
11433    HA   MET  20           HA       MET  20  14.394 -10.526   5.948
  Start of MODEL   17
11434    HB3  MET  20           HB2      MET  20  12.123 -11.329   6.037
  Start of MODEL   17
11435    HB2  MET  20           HB3      MET  20  12.773 -11.712   4.457
  Start of MODEL   17
11436    HG2  MET  20           HG2      MET  20  10.861  -9.494   5.105
  Start of MODEL   17
11437    HG3  MET  20           HG3      MET  20  11.580  -9.774   3.521
  Start of MODEL   17
11438    HE3  MET  20           HE1      MET  20   8.402  -9.646   4.015
  Start of MODEL   17
11439    HE2  MET  20           HE2      MET  20   7.872 -10.997   3.011
  Start of MODEL   17
11440    HE1  MET  20           HE3      MET  20   9.137  -9.911   2.434
  Start of MODEL   17
11441    H    MET  20           HN       MET  20  13.023  -8.020   5.708
  Start of MODEL   17
11442    HA   HIS  21           HA       HIS  21  16.331  -9.506   2.393
  Start of MODEL   17
11443    HB3  HIS  21           HB2      HIS  21  16.391 -10.999   0.322
  Start of MODEL   17
11444    HB2  HIS  21           HB3      HIS  21  15.172 -11.970   1.132
  Start of MODEL   17
11445    HD1  HIS  21           HD1      HIS  21  16.062 -13.800   2.545
  Start of MODEL   17
11446    HD2  HIS  21           HD2      HIS  21  18.839 -10.754   2.034
  Start of MODEL   17
11447    HE1  HIS  21           HE1      HIS  21  18.150 -14.600   3.664
  Start of MODEL   17
11448    HE2  HIS  21           HE2      HIS  21  19.743 -12.658   3.513
  Start of MODEL   17
11449    H    HIS  21           HN       HIS  21  14.393 -11.348   3.328
  Start of MODEL   17
11450    HA   HIS  22           HA       HIS  22  13.321  -7.649  -0.190
  Start of MODEL   17
11451    HB3  HIS  22           HB2      HIS  22  12.787  -9.448  -1.778
  Start of MODEL   17
11452    HB2  HIS  22           HB3      HIS  22  11.412  -8.375  -1.630
  Start of MODEL   17
11453    HD1  HIS  22           HD1      HIS  22  12.329 -11.916  -1.408
  Start of MODEL   17
11454    HD2  HIS  22           HD2      HIS  22   9.193  -9.499  -0.138
  Start of MODEL   17
11455    HE1  HIS  22           HE1      HIS  22  10.428 -13.458  -0.931
  Start of MODEL   17
11456    HE2  HIS  22           HE2      HIS  22   8.503 -11.974  -0.377
  Start of MODEL   17
11457    H    HIS  22           HN       HIS  22  13.088 -10.156   1.283
  Start of MODEL   17
11458    HA   TRP  23           HA       TRP  23  10.854  -6.467   2.987
  Start of MODEL   17
11459    HB3  TRP  23           HB2      TRP  23  10.645  -3.987   3.029
  Start of MODEL   17
11460    HB2  TRP  23           HB3      TRP  23  11.349  -3.948   1.415
  Start of MODEL   17
11461    HD1  TRP  23           HD1      TRP  23  13.955  -4.635   1.205
  Start of MODEL   17
11462    HE1  TRP  23           HE1      TRP  23  15.870  -4.572   2.939
  Start of MODEL   17
11463    HE3  TRP  23           HE3      TRP  23  11.197  -4.337   5.486
  Start of MODEL   17
11464    HZ2  TRP  23           HZ2      TRP  23  16.170  -4.414   5.715
  Start of MODEL   17
11465    HZ3  TRP  23           HZ3      TRP  23  12.370  -4.230   7.634
  Start of MODEL   17
11466    HH2  TRP  23           HH2      TRP  23  14.809  -4.269   7.750
  Start of MODEL   17
11467    H    TRP  23           HN       TRP  23  12.026  -6.046   0.395
  Start of MODEL   17
11468    HA   CYS  24           HA       CYS  24   6.810  -5.705   1.464
  Start of MODEL   17
11469    HB3  CYS  24           HB2      CYS  24   6.885  -7.746   3.698
  Start of MODEL   17
11470    HB2  CYS  24           HB3      CYS  24   7.020  -8.072   1.977
  Start of MODEL   17
11471    H    CYS  24           HN       CYS  24   8.799  -5.873   3.601
  Start of MODEL   17
11472    HA   ILE  25           HA       ILE  25   5.009  -3.384   4.741
  Start of MODEL   17
11473    HB   ILE  25           HB       ILE  25   4.624  -1.588   2.305
  Start of MODEL   17
11474   HD12  ILE  25          HD11      ILE  25   7.690   0.396   3.313
  Start of MODEL   17
11475   HD11  ILE  25          HD12      ILE  25   6.056   0.797   3.812
  Start of MODEL   17
11476   HD13  ILE  25          HD13      ILE  25   6.380   0.358   2.128
  Start of MODEL   17
11477    H    ILE  25           HN       ILE  25   5.610  -3.996   1.928
  Start of MODEL   17
11478    HA   PRO  26           HA       PRO  26   1.170  -5.393   3.298
  Start of MODEL   17
11479    HB3  PRO  26           HB2      PRO  26   0.870  -6.965   4.919
  Start of MODEL   17
11480    HB2  PRO  26           HB3      PRO  26   0.678  -5.731   6.168
  Start of MODEL   17
11481    HG2  PRO  26           HG2      PRO  26   2.731  -6.558   6.829
  Start of MODEL   17
11482    HG3  PRO  26           HG3      PRO  26   3.161  -7.058   5.182
  Start of MODEL   17
11483    HD2  PRO  26           HD2      PRO  26   3.263  -4.329   6.423
  Start of MODEL   17
11484    HD3  PRO  26           HD3      PRO  26   4.449  -5.160   5.393
  Start of MODEL   17
11485    HA   PHE  27           HA       PHE  27  -1.546  -2.318   4.832
  Start of MODEL   17
11486    HB3  PHE  27           HB2      PHE  27  -0.654  -1.219   2.803
  Start of MODEL   17
11487    HB2  PHE  27           HB3      PHE  27  -2.355  -0.882   3.044
  Start of MODEL   17
11488    HD1  PHE  27           HD1      PHE  27  -4.043  -1.561   1.434
  Start of MODEL   17
11489    HD2  PHE  27           HD2      PHE  27   0.063  -2.649   0.940
  Start of MODEL   17
11490    HE1  PHE  27           HE1      PHE  27  -4.492  -2.213  -0.871
  Start of MODEL   17
11491    HE2  PHE  27           HE2      PHE  27  -0.408  -3.300  -1.384
  Start of MODEL   17
11492    HZ   PHE  27           HZ       PHE  27  -2.684  -3.081  -2.288
  Start of MODEL   17
11493    H    PHE  27           HN       PHE  27  -0.721  -4.391   2.943
  Start of MODEL   17
11494    HA   SER  28           HA       SER  28  -5.541  -3.794   3.669
  Start of MODEL   17
11495    HB3  SER  28           HB2      SER  28  -6.708  -4.253   5.759
  Start of MODEL   17
11496    HB2  SER  28           HB3      SER  28  -5.582  -3.235   6.650
  Start of MODEL   17
11497    HG   SER  28           HG       SER  28  -4.097  -4.898   5.353
  Start of MODEL   17
11498    H    SER  28           HN       SER  28  -3.749  -1.931   4.989
  Start of MODEL   17
11499    HA   VAL  29           HA       VAL  29  -7.882  -0.163   4.035
  Start of MODEL   17
11500    HB   VAL  29           HB       VAL  29  -6.629   0.608   2.089
  Start of MODEL   17
11501    H    VAL  29           HN       VAL  29  -7.069  -2.657   2.781
  Start of MODEL   17
11502    HA   ASP  30           HA       ASP  30 -11.585  -2.240   3.353
  Start of MODEL   17
11503    HB3  ASP  30           HB2      ASP  30 -11.066  -2.920   5.663
  Start of MODEL   17
11504    HB2  ASP  30           HB3      ASP  30 -12.782  -2.660   5.419
  Start of MODEL   17
11505    H    ASP  30           HN       ASP  30  -9.823  -0.375   4.756
  Start of MODEL   17
11506    HA2  GLY  31           HA2      GLY  31 -15.303   0.232   3.566
  Start of MODEL   17
11507    H    GLY  31           HN       GLY  31 -13.704  -1.807   3.009
  Start of MODEL   17
11508    HA3  GLY  31           HA1      GLY  31 -14.185   0.979   2.424
  Start of MODEL   17
11509    HA   GLN  32           HA       GLN  32 -16.524  -1.232  -0.440
  Start of MODEL   17
11510    HB3  GLN  32           HB2      GLN  32 -19.001  -0.617  -0.845
  Start of MODEL   17
11511    HB2  GLN  32           HB3      GLN  32 -18.856   0.293   0.657
  Start of MODEL   17
11512    HG2  GLN  32           HG2      GLN  32 -18.104  -1.773   1.784
  Start of MODEL   17
11513    HG3  GLN  32           HG3      GLN  32 -19.750  -1.856   1.155
  Start of MODEL   17
11514   HE21  GLN  32          HE21      GLN  32 -16.474  -3.006   0.751
  Start of MODEL   17
11515   HE22  GLN  32          HE22      GLN  32 -16.885  -4.327  -0.277
  Start of MODEL   17
11516    H    GLN  32           HN       GLN  32 -16.367   1.126   1.257
  Start of MODEL   17
11517    HA   PRO  33           HA       PRO  33 -17.090   2.524  -3.436
  Start of MODEL   17
11518    HB3  PRO  33           HB2      PRO  33 -17.202   4.786  -2.883
  Start of MODEL   17
11519    HB2  PRO  33           HB3      PRO  33 -15.938   4.629  -1.657
  Start of MODEL   17
11520    HG2  PRO  33           HG2      PRO  33 -17.816   4.833  -0.298
  Start of MODEL   17
11521    HG3  PRO  33           HG3      PRO  33 -18.858   4.001  -1.466
  Start of MODEL   17
11522    HD2  PRO  33           HD2      PRO  33 -16.906   2.854   0.484
  Start of MODEL   17
11523    HD3  PRO  33           HD3      PRO  33 -18.498   2.248  -0.017
  Start of MODEL   17
11524    HA   ALA  34           HA       ALA  34 -12.982   1.109  -3.480
  Start of MODEL   17
11525    HB3  ALA  34           HB1      ALA  34 -13.888   0.216  -5.574
  Start of MODEL   17
11526    HB2  ALA  34           HB2      ALA  34 -12.224   0.762  -5.769
  Start of MODEL   17
11527    HB1  ALA  34           HB3      ALA  34 -13.550   1.754  -6.371
  Start of MODEL   17
11528    H    ALA  34           HN       ALA  34 -15.372   2.107  -4.638
  Start of MODEL   17
11529    HA   PRO  35           HA       PRO  35 -11.168   5.188  -3.350
  Start of MODEL   17
11530    HB3  PRO  35           HB2      PRO  35 -10.981   4.761  -1.055
  Start of MODEL   17
11531    HB2  PRO  35           HB3      PRO  35  -9.294   4.701  -1.573
  Start of MODEL   17
11532    HG2  PRO  35           HG2      PRO  35  -9.229   2.406  -1.568
  Start of MODEL   17
11533    HG3  PRO  35           HG3      PRO  35 -10.405   2.650  -0.269
  Start of MODEL   17
11534    HD2  PRO  35           HD2      PRO  35 -10.903   1.195  -2.577
  Start of MODEL   17
11535    HD3  PRO  35           HD3      PRO  35 -12.166   1.954  -1.589
  Start of MODEL   17
11536    HA   SER  36           HA       SER  36  -7.710   4.375  -5.859
  Start of MODEL   17
11537    HB3  SER  36           HB2      SER  36  -7.641   7.386  -5.474
  Start of MODEL   17
11538    HB2  SER  36           HB3      SER  36  -8.610   6.584  -6.703
  Start of MODEL   17
11539    HG   SER  36           HG       SER  36  -6.815   5.947  -7.738
  Start of MODEL   17
11540    H    SER  36           HN       SER  36  -9.464   6.064  -4.339
  Start of MODEL   17
11541    HA   LEU  37           HA       LEU  37  -4.907   4.567  -2.498
  Start of MODEL   17
11542    HB3  LEU  37           HB2      LEU  37  -3.579   2.489  -2.525
  Start of MODEL   17
11543    HB2  LEU  37           HB3      LEU  37  -4.211   2.115  -4.111
  Start of MODEL   17
11544    HG   LEU  37           HG       LEU  37  -6.502   1.965  -3.091
  Start of MODEL   17
11545   HD11  LEU  37          HD11      LEU  37  -4.410   0.158  -1.901
  Start of MODEL   17
11546   HD13  LEU  37          HD12      LEU  37  -5.065   0.060  -3.538
  Start of MODEL   17
11547   HD12  LEU  37          HD13      LEU  37  -6.124  -0.219  -2.147
  Start of MODEL   17
11548   HD21  LEU  37          HD21      LEU  37  -6.133   3.308  -1.096
  Start of MODEL   17
11549   HD23  LEU  37          HD22      LEU  37  -4.913   2.151  -0.547
  Start of MODEL   17
11550   HD22  LEU  37          HD23      LEU  37  -6.602   1.657  -0.650
  Start of MODEL   17
11551    H    LEU  37           HN       LEU  37  -5.869   3.621  -5.083
  Start of MODEL   17
11552    HA   ARG  38           HA       ARG  38  -1.149   5.534  -4.509
  Start of MODEL   17
11553    HB3  ARG  38           HB2      ARG  38  -2.418   8.043  -3.435
  Start of MODEL   17
11554    HB2  ARG  38           HB3      ARG  38  -2.272   7.514  -5.098
  Start of MODEL   17
11555    HG2  ARG  38           HG2      ARG  38  -0.090   8.583  -3.328
  Start of MODEL   17
11556    HG3  ARG  38           HG3      ARG  38   0.206   7.828  -4.893
  Start of MODEL   17
11557    HD2  ARG  38           HD2      ARG  38  -1.624  10.172  -4.474
  Start of MODEL   17
11558    HD3  ARG  38           HD3      ARG  38   0.068  10.320  -4.961
  Start of MODEL   17
11559    HE   ARG  38           HE       ARG  38  -0.941   8.573  -6.729
  Start of MODEL   17
11560   HH11  ARG  38          HH11      ARG  38  -2.098  11.774  -5.721
  Start of MODEL   17
11561   HH12  ARG  38          HH12      ARG  38  -2.609  12.226  -7.283
  Start of MODEL   17
11562   HH21  ARG  38          HH21      ARG  38  -1.630   9.215  -8.870
  Start of MODEL   17
11563   HH22  ARG  38          HH22      ARG  38  -2.362  10.726  -9.114
  Start of MODEL   17
11564    H    ARG  38           HN       ARG  38  -3.123   5.704  -2.368
  Start of MODEL   17
11565    HA   TRP  39           HA       TRP  39   1.413   5.619  -0.991
  Start of MODEL   17
11566    HB3  TRP  39           HB2      TRP  39   3.627   4.649  -1.603
  Start of MODEL   17
11567    HB2  TRP  39           HB3      TRP  39   3.101   4.601  -3.280
  Start of MODEL   17
11568    HD1  TRP  39           HD1      TRP  39   1.584   2.661  -4.055
  Start of MODEL   17
11569    HE1  TRP  39           HE1      TRP  39   0.849   0.481  -2.973
  Start of MODEL   17
11570    HE3  TRP  39           HE3      TRP  39   2.943   3.677   0.761
  Start of MODEL   17
11571    HZ2  TRP  39           HZ2      TRP  39   0.822  -0.687  -0.382
  Start of MODEL   17
11572    HZ3  TRP  39           HZ3      TRP  39   2.528   1.971   2.485
  Start of MODEL   17
11573    HH2  TRP  39           HH2      TRP  39   1.487  -0.166   1.920
  Start of MODEL   17
11574    H    TRP  39           HN       TRP  39   0.880   5.425  -3.848
  Start of MODEL   17
11575    HA   LEU  40           HA       LEU  40   3.590   9.205  -2.137
  Start of MODEL   17
11576    HB3  LEU  40           HB2      LEU  40   2.509   9.901   0.591
  Start of MODEL   17
11577    HB2  LEU  40           HB3      LEU  40   1.549  10.033  -0.877
  Start of MODEL   17
11578    HG   LEU  40           HG       LEU  40   4.119  11.529  -0.496
  Start of MODEL   17
11579   HD12  LEU  40          HD11      LEU  40   3.205  12.886  -2.304
  Start of MODEL   17
11580   HD11  LEU  40          HD12      LEU  40   1.822  11.783  -2.405
  Start of MODEL   17
11581   HD13  LEU  40          HD13      LEU  40   3.447  11.207  -2.775
  Start of MODEL   17
11582   HD22  LEU  40          HD21      LEU  40   2.725  13.463   0.029
  Start of MODEL   17
11583   HD21  LEU  40          HD22      LEU  40   2.520  12.189   1.234
  Start of MODEL   17
11584   HD23  LEU  40          HD23      LEU  40   1.292  12.439  -0.009
  Start of MODEL   17
11585    H    LEU  40           HN       LEU  40   2.152   7.456  -0.284
  Start of MODEL   17
11586    HA   PHE  41           HA       PHE  41   6.887   8.415   0.623
  Start of MODEL   17
11587    HB3  PHE  41           HB2      PHE  41   7.849   8.373  -2.247
  Start of MODEL   17
11588    HB2  PHE  41           HB3      PHE  41   7.375   6.987  -1.276
  Start of MODEL   17
11589    HD1  PHE  41           HD1      PHE  41  10.058   9.078  -2.290
  Start of MODEL   17
11590    HD2  PHE  41           HD2      PHE  41   8.758   6.450   0.781
  Start of MODEL   17
11591    HE1  PHE  41           HE1      PHE  41  12.383   8.806  -1.547
  Start of MODEL   17
11592    HE2  PHE  41           HE2      PHE  41  11.082   6.176   1.529
  Start of MODEL   17
11593    HZ   PHE  41           HZ       PHE  41  12.892   7.353   0.366
  Start of MODEL   17
11594    H    PHE  41           HN       PHE  41   5.675   9.539  -1.784
  Start of MODEL   17
11595    HA   ASN  42           HA       ASN  42   8.122  12.168   2.465
  Start of MODEL   17
11596    HB3  ASN  42           HB2      ASN  42  10.282  12.936   1.384
  Start of MODEL   17
11597    HB2  ASN  42           HB3      ASN  42  10.101  11.613   0.245
  Start of MODEL   17
11598   HD21  ASN  42          HD21      ASN  42  11.968  10.678   0.858
  Start of MODEL   17
11599   HD22  ASN  42          HD22      ASN  42  12.200   9.831   2.343
  Start of MODEL   17
11600    H    ASN  42           HN       ASN  42   7.263  10.176   1.757
  Start of MODEL   17
11601    HA2  GLY  43           HA2      GLY  43   4.813  14.221  -0.157
  Start of MODEL   17
11602    H    GLY  43           HN       GLY  43   5.975  12.315   0.621
  Start of MODEL   17
11603    HA3  GLY  43           HA1      GLY  43   6.334  15.095  -0.217
  Start of MODEL   17
11604    HA   SER  44           HA       SER  44   6.415  13.336  -4.409
  Start of MODEL   17
11605    HB3  SER  44           HB2      SER  44   8.560  11.392  -3.496
  Start of MODEL   17
11606    HB2  SER  44           HB3      SER  44   8.855  13.120  -3.632
  Start of MODEL   17
11607    HG   SER  44           HG       SER  44   9.434  12.542  -5.523
  Start of MODEL   17
11608    H    SER  44           HN       SER  44   7.061  12.332  -1.698
  Start of MODEL   17
11609    HA   VAL  45           HA       VAL  45   3.922   9.942  -4.694
  Start of MODEL   17
11610    HB   VAL  45           HB       VAL  45   4.238  10.717  -7.616
  Start of MODEL   17
11611    H    VAL  45           HN       VAL  45   5.619  11.922  -5.902
  Start of MODEL   17
11612    HA   LEU  46           HA       LEU  46   6.914   6.942  -5.558
  Start of MODEL   17
11613    HB3  LEU  46           HB2      LEU  46   4.802   5.528  -3.940
  Start of MODEL   17
11614    HB2  LEU  46           HB3      LEU  46   6.200   6.353  -3.284
  Start of MODEL   17
11615    HG   LEU  46           HG       LEU  46   6.348   3.947  -5.092
  Start of MODEL   17
11616   HD11  LEU  46          HD11      LEU  46   8.456   5.324  -3.440
  Start of MODEL   17
11617   HD13  LEU  46          HD12      LEU  46   8.337   5.314  -5.202
  Start of MODEL   17
11618   HD12  LEU  46          HD13      LEU  46   8.668   3.819  -4.330
  Start of MODEL   17
11619   HD23  LEU  46          HD21      LEU  46   6.567   4.141  -2.103
  Start of MODEL   17
11620   HD22  LEU  46          HD22      LEU  46   6.913   2.696  -3.068
  Start of MODEL   17
11621   HD21  LEU  46          HD23      LEU  46   5.276   3.347  -3.004
  Start of MODEL   17
11622    H    LEU  46           HN       LEU  46   4.422   7.869  -4.488
  Start of MODEL   17
11623    HA   ASN  47           HA       ASN  47   4.617   5.317  -8.895
  Start of MODEL   17
11624    HB3  ASN  47           HB2      ASN  47   6.074   5.442 -10.956
  Start of MODEL   17
11625    HB2  ASN  47           HB3      ASN  47   7.332   6.156  -9.956
  Start of MODEL   17
11626   HD21  ASN  47          HD21      ASN  47   7.094   8.274  -9.236
  Start of MODEL   17
11627   HD22  ASN  47          HD22      ASN  47   5.900   9.337  -9.877
  Start of MODEL   17
11628    H    ASN  47           HN       ASN  47   6.919   6.476  -7.590
  Start of MODEL   17
11629    HA   GLU  48           HA       GLU  48   6.242   1.361  -8.167
  Start of MODEL   17
11630    HB3  GLU  48           HB2      GLU  48   4.844  -0.345  -9.297
  Start of MODEL   17
11631    HB2  GLU  48           HB3      GLU  48   3.936   0.964 -10.043
  Start of MODEL   17
11632    HG2  GLU  48           HG2      GLU  48   4.127   0.272  -7.140
  Start of MODEL   17
11633    HG3  GLU  48           HG3      GLU  48   3.460   1.794  -7.731
  Start of MODEL   17
11634    H    GLU  48           HN       GLU  48   4.438   3.205  -9.339
  Start of MODEL   17
11635    HA   THR  49           HA       THR  49   8.129   0.102 -11.914
  Start of MODEL   17
11636    HB   THR  49           HB       THR  49   9.620   1.742 -10.947
  Start of MODEL   17
11637    HG1  THR  49           HG1      THR  49  11.168   1.017 -12.090
  Start of MODEL   17
11638   HG21  THR  49          HG21      THR  49  10.479  -0.370  -8.977
  Start of MODEL   17
11639   HG23  THR  49          HG22      THR  49   9.521   1.068  -8.622
  Start of MODEL   17
11640   HG22  THR  49          HG23      THR  49  11.201   1.233  -9.138
  Start of MODEL   17
11641    H    THR  49           HN       THR  49   7.438  -0.193  -9.149
  Start of MODEL   17
11642    HA   SER  50           HA       SER  50   9.005  -4.070 -11.535
  Start of MODEL   17
11643    HB3  SER  50           HB2      SER  50  11.937  -3.633 -12.165
  Start of MODEL   17
11644    HB2  SER  50           HB3      SER  50  10.654  -3.580 -13.374
  Start of MODEL   17
11645    HG   SER  50           HG       SER  50  10.320  -5.659 -13.179
  Start of MODEL   17
11646    H    SER  50           HN       SER  50  10.346  -1.574 -11.885
  Start of MODEL   17
11647    HA   PHE  51           HA       PHE  51  11.683  -4.426  -7.853
  Start of MODEL   17
11648    HB3  PHE  51           HB2      PHE  51  13.391  -2.999  -6.816
  Start of MODEL   17
11649    HB2  PHE  51           HB3      PHE  51  12.986  -1.716  -7.957
  Start of MODEL   17
11650    HD1  PHE  51           HD1      PHE  51  14.281  -5.171  -7.691
  Start of MODEL   17
11651    HD2  PHE  51           HD2      PHE  51  13.881  -1.720 -10.150
  Start of MODEL   17
11652    HE1  PHE  51           HE1      PHE  51  15.826  -6.160  -9.319
  Start of MODEL   17
11653    HE2  PHE  51           HE2      PHE  51  15.431  -2.708 -11.783
  Start of MODEL   17
11654    HZ   PHE  51           HZ       PHE  51  16.406  -4.929 -11.367
  Start of MODEL   17
11655    H    PHE  51           HN       PHE  51  11.127  -2.155  -9.616
  Start of MODEL   17
11656    HA   ILE  52           HA       ILE  52   8.928  -2.090  -5.130
  Start of MODEL   17
11657    HB   ILE  52           HB       ILE  52   8.810   0.542  -6.656
  Start of MODEL   17
11658   HD13  ILE  52          HD11      ILE  52  10.606   2.314  -6.059
  Start of MODEL   17
11659   HD12  ILE  52          HD12      ILE  52  11.882   1.859  -4.922
  Start of MODEL   17
11660   HD11  ILE  52          HD13      ILE  52  10.220   2.059  -4.359
  Start of MODEL   17
11661    H    ILE  52           HN       ILE  52   9.564  -1.849  -7.994
  Start of MODEL   17
11662    HA   PHE  53           HA       PHE  53   5.078  -1.914  -7.196
  Start of MODEL   17
11663    HB3  PHE  53           HB2      PHE  53   5.967  -3.574  -8.576
  Start of MODEL   17
11664    HB2  PHE  53           HB3      PHE  53   4.471  -4.269  -7.965
  Start of MODEL   17
11665    HD1  PHE  53           HD1      PHE  53   8.161  -4.355  -7.597
  Start of MODEL   17
11666    HD2  PHE  53           HD2      PHE  53   4.476  -6.281  -6.753
  Start of MODEL   17
11667    HE1  PHE  53           HE1      PHE  53   9.387  -6.341  -6.840
  Start of MODEL   17
11668    HE2  PHE  53           HE2      PHE  53   5.697  -8.272  -5.986
  Start of MODEL   17
11669    HZ   PHE  53           HZ       PHE  53   8.152  -8.302  -6.026
  Start of MODEL   17
11670    H    PHE  53           HN       PHE  53   6.962  -3.055  -5.305
  Start of MODEL   17
11671    HA   THR  54           HA       THR  54   2.431  -2.785  -3.933
  Start of MODEL   17
11672    HB   THR  54           HB       THR  54   0.580  -1.597  -6.022
  Start of MODEL   17
11673    HG1  THR  54           HG1      THR  54   2.638  -0.489  -5.329
  Start of MODEL   17
11674   HG23  THR  54          HG21      THR  54  -0.553  -2.576  -4.066
  Start of MODEL   17
11675   HG22  THR  54          HG22      THR  54  -0.690  -0.815  -4.066
  Start of MODEL   17
11676   HG21  THR  54          HG23      THR  54   0.468  -1.615  -2.999
  Start of MODEL   17
11677    H    THR  54           HN       THR  54   2.944  -2.121  -6.706
  Start of MODEL   17
11678    HA   GLU  55           HA       GLU  55   0.679  -6.379  -5.620
  Start of MODEL   17
11679    HB3  GLU  55           HB2      GLU  55   1.129  -8.303  -4.081
  Start of MODEL   17
11680    HB2  GLU  55           HB3      GLU  55   2.022  -7.173  -3.069
  Start of MODEL   17
11681    HG2  GLU  55           HG2      GLU  55   3.475  -6.670  -4.993
  Start of MODEL   17
11682    HG3  GLU  55           HG3      GLU  55   3.521  -8.349  -4.444
  Start of MODEL   17
11683    H    GLU  55           HN       GLU  55   1.983  -4.865  -3.567
  Start of MODEL   17
11684    HA   PHE  56           HA       PHE  56  -2.854  -6.315  -3.157
  Start of MODEL   17
11685    HB3  PHE  56           HB2      PHE  56  -4.798  -6.465  -4.740
  Start of MODEL   17
11686    HB2  PHE  56           HB3      PHE  56  -3.640  -6.580  -6.059
  Start of MODEL   17
11687    HD1  PHE  56           HD1      PHE  56  -5.000  -4.402  -3.487
  Start of MODEL   17
11688    HD2  PHE  56           HD2      PHE  56  -2.489  -4.670  -6.898
  Start of MODEL   17
11689    HE1  PHE  56           HE1      PHE  56  -4.962  -1.994  -3.618
  Start of MODEL   17
11690    HE2  PHE  56           HE2      PHE  56  -2.424  -2.209  -7.047
  Start of MODEL   17
11691    HZ   PHE  56           HZ       PHE  56  -3.665  -0.854  -5.398
  Start of MODEL   17
11692    H    PHE  56           HN       PHE  56  -1.311  -6.723  -5.591
  Start of MODEL   17
11693    HA   LEU  57           HA       LEU  57  -2.960 -10.622  -3.430
  Start of MODEL   17
11694    HB3  LEU  57           HB2      LEU  57  -2.085 -10.399  -1.107
  Start of MODEL   17
11695    HB2  LEU  57           HB3      LEU  57  -3.226 -11.708  -1.275
  Start of MODEL   17
11696    HG   LEU  57           HG       LEU  57  -4.104  -9.100  -0.104
  Start of MODEL   17
11697   HD13  LEU  57          HD11      LEU  57  -5.853 -10.667  -0.748
  Start of MODEL   17
11698   HD12  LEU  57          HD12      LEU  57  -5.765 -10.581   1.021
  Start of MODEL   17
11699   HD11  LEU  57          HD13      LEU  57  -5.053 -11.942   0.147
  Start of MODEL   17
11700   HD23  LEU  57          HD21      LEU  57  -2.828 -11.422   1.338
  Start of MODEL   17
11701   HD22  LEU  57          HD22      LEU  57  -3.624 -10.050   2.108
  Start of MODEL   17
11702   HD21  LEU  57          HD23      LEU  57  -2.153  -9.800   1.167
  Start of MODEL   17
11703    H    LEU  57           HN       LEU  57  -3.332  -8.115  -2.057
  Start of MODEL   17
11704    HA   GLU  58           HA       GLU  58  -7.075 -11.025  -4.342
  Start of MODEL   17
11705    HB3  GLU  58           HB2      GLU  58  -7.647 -13.441  -4.767
  Start of MODEL   17
11706    HB2  GLU  58           HB3      GLU  58  -6.082 -13.811  -4.030
  Start of MODEL   17
11707    HG2  GLU  58           HG2      GLU  58  -6.540 -12.150  -6.513
  Start of MODEL   17
11708    HG3  GLU  58           HG3      GLU  58  -4.974 -12.454  -5.774
  Start of MODEL   17
11709    H    GLU  58           HN       GLU  58  -4.649 -12.194  -3.403
  Start of MODEL   17
11710    HA   PRO  59           HA       PRO  59  -8.766 -11.532  -0.188
  Start of MODEL   17
11711    HB3  PRO  59           HB2      PRO  59  -8.745  -9.197  -0.204
  Start of MODEL   17
11712    HB2  PRO  59           HB3      PRO  59 -10.483  -9.505  -0.291
  Start of MODEL   17
11713    HG2  PRO  59           HG2      PRO  59 -10.589  -8.998  -2.535
  Start of MODEL   17
11714    HG3  PRO  59           HG3      PRO  59  -9.184  -8.001  -2.125
  Start of MODEL   17
11715    HD2  PRO  59           HD2      PRO  59  -9.226 -10.139  -3.957
  Start of MODEL   17
11716    HD3  PRO  59           HD3      PRO  59  -7.786  -9.352  -3.287
  Start of MODEL   17
11717    HA   ALA  60           HA       ALA  60 -12.582 -13.336  -1.338
  Start of MODEL   17
11718    HB2  ALA  60           HB1      ALA  60 -13.798 -14.104   0.668
  Start of MODEL   17
11719    HB1  ALA  60           HB2      ALA  60 -12.779 -13.066   1.669
  Start of MODEL   17
11720    HB3  ALA  60           HB3      ALA  60 -12.069 -14.424   0.793
  Start of MODEL   17
11721    H    ALA  60           HN       ALA  60 -10.984 -11.841   0.600
  Start of MODEL   17
11722    HA   ALA  61           HA       ALA  61 -15.226  -9.872  -1.725
  Start of MODEL   17
11723    HB3  ALA  61           HB1      ALA  61 -15.907 -11.272  -3.612
  Start of MODEL   17
11724    HB2  ALA  61           HB2      ALA  61 -17.294 -10.460  -2.867
  Start of MODEL   17
11725    HB1  ALA  61           HB3      ALA  61 -16.975 -12.163  -2.522
  Start of MODEL   17
11726    H    ALA  61           HN       ALA  61 -14.619 -12.636  -1.918
  Start of MODEL   17
11727    HA   ASN  62           HA       ASN  62 -18.046 -11.466   1.737
  Start of MODEL   17
11728    HB3  ASN  62           HB2      ASN  62 -17.354 -13.134   3.431
  Start of MODEL   17
11729    HB2  ASN  62           HB3      ASN  62 -15.798 -13.260   2.608
  Start of MODEL   17
11730   HD21  ASN  62          HD21      ASN  62 -19.189 -14.001   2.361
  Start of MODEL   17
11731   HD22  ASN  62          HD22      ASN  62 -19.026 -15.136   1.077
  Start of MODEL   17
11732    H    ASN  62           HN       ASN  62 -15.583 -12.242   0.448
  Start of MODEL   17
11733    HA   GLU  63           HA       GLU  63 -15.082  -9.394   4.459
  Start of MODEL   17
11734    HB3  GLU  63           HB2      GLU  63 -13.105 -10.905   4.146
  Start of MODEL   17
11735    HB2  GLU  63           HB3      GLU  63 -12.673  -9.296   4.694
  Start of MODEL   17
11736    HG2  GLU  63           HG2      GLU  63 -12.487 -10.168   1.826
  Start of MODEL   17
11737    HG3  GLU  63           HG3      GLU  63 -11.846  -8.696   2.549
  Start of MODEL   17
11738    H    GLU  63           HN       GLU  63 -14.662 -10.615   1.860
  Start of MODEL   17
11739    HA   THR  64           HA       THR  64 -15.425  -5.660   2.357
  Start of MODEL   17
11740    HB   THR  64           HB       THR  64 -15.393  -4.787   5.265
  Start of MODEL   17
11741    HG1  THR  64           HG1      THR  64 -17.581  -5.789   3.775
  Start of MODEL   17
11742   HG23  THR  64          HG21      THR  64 -15.624  -2.980   3.578
  Start of MODEL   17
11743   HG22  THR  64          HG22      THR  64 -17.105  -3.180   4.516
  Start of MODEL   17
11744   HG21  THR  64          HG23      THR  64 -17.005  -3.825   2.880
  Start of MODEL   17
11745    H    THR  64           HN       THR  64 -14.916  -7.220   4.735
  Start of MODEL   17
11746    HA   VAL  65           HA       VAL  65 -11.255  -4.156   3.488
  Start of MODEL   17
11747    HB   VAL  65           HB       VAL  65 -10.204  -6.734   4.594
  Start of MODEL   17
11748    H    VAL  65           HN       VAL  65 -12.680  -6.723   3.332
  Start of MODEL   17
11749    HA   ARG  66           HA       ARG  66  -9.033  -6.096   0.222
  Start of MODEL   17
11750    HB3  ARG  66           HB2      ARG  66  -7.945  -4.358  -1.178
  Start of MODEL   17
11751    HB2  ARG  66           HB3      ARG  66  -8.445  -3.136  -0.030
  Start of MODEL   17
11752    HG2  ARG  66           HG2      ARG  66 -10.309  -4.834  -1.670
  Start of MODEL   17
11753    HG3  ARG  66           HG3      ARG  66 -10.779  -3.542  -0.559
  Start of MODEL   17
11754    HD2  ARG  66           HD2      ARG  66 -10.774  -2.779  -2.903
  Start of MODEL   17
11755    HD3  ARG  66           HD3      ARG  66  -9.587  -1.913  -1.923
  Start of MODEL   17
11756    HE   ARG  66           HE       ARG  66  -8.040  -3.780  -2.888
  Start of MODEL   17
11757   HH11  ARG  66          HH11      ARG  66 -10.464  -1.901  -4.709
  Start of MODEL   17
11758   HH12  ARG  66          HH12      ARG  66  -9.672  -2.088  -6.190
  Start of MODEL   17
11759   HH21  ARG  66          HH21      ARG  66  -7.017  -4.075  -4.931
  Start of MODEL   17
11760   HH22  ARG  66          HH22      ARG  66  -7.662  -3.353  -6.330
  Start of MODEL   17
11761    H    ARG  66           HN       ARG  66  -9.781  -3.852   1.954
  Start of MODEL   17
11762    HA   HIS  67           HA       HIS  67  -5.166  -5.635   2.248
  Start of MODEL   17
11763    HB3  HIS  67           HB2      HIS  67  -4.413  -7.865   2.877
  Start of MODEL   17
11764    HB2  HIS  67           HB3      HIS  67  -5.479  -8.589   1.690
  Start of MODEL   17
11765    HD1  HIS  67           HD1      HIS  67  -5.422  -7.531   5.225
  Start of MODEL   17
11766    HD2  HIS  67           HD2      HIS  67  -8.242  -8.481   2.328
  Start of MODEL   17
11767    HE1  HIS  67           HE1      HIS  67  -7.529  -7.976   6.465
  Start of MODEL   17
11768    HE2  HIS  67           HE2      HIS  67  -9.051  -8.965   4.663
  Start of MODEL   17
11769    H    HIS  67           HN       HIS  67  -6.915  -6.840   0.207
  Start of MODEL   17
11770    HA2  GLY  68           HA2      GLY  68  -1.927  -7.411  -0.367
  Start of MODEL   17
11771    H    GLY  68           HN       GLY  68  -2.882  -6.003   1.841
  Start of MODEL   17
11772    HA3  GLY  68           HA1      GLY  68  -2.145  -5.724  -0.814
  Start of MODEL   17
11773    HA   CYS  69           HA       CYS  69   1.559  -4.924   1.242
  Start of MODEL   17
11774    HB3  CYS  69           HB2      CYS  69   2.269  -7.592   0.039
  Start of MODEL   17
11775    HB2  CYS  69           HB3      CYS  69   2.005  -7.191   1.728
  Start of MODEL   17
11776    H    CYS  69           HN       CYS  69   0.213  -5.965  -1.086
  Start of MODEL   17
11777    HA   LEU  70           HA       LEU  70   3.788  -3.192  -2.141
  Start of MODEL   17
11778    HB3  LEU  70           HB2      LEU  70   4.739  -1.711   0.320
  Start of MODEL   17
11779    HB2  LEU  70           HB3      LEU  70   3.378  -1.208  -0.660
  Start of MODEL   17
11780    HG   LEU  70           HG       LEU  70   6.213  -1.388  -1.672
  Start of MODEL   17
11781   HD12  LEU  70          HD11      LEU  70   5.377   0.035  -3.474
  Start of MODEL   17
11782   HD11  LEU  70          HD12      LEU  70   3.745  -0.137  -2.828
  Start of MODEL   17
11783   HD13  LEU  70          HD13      LEU  70   4.606  -1.551  -3.441
  Start of MODEL   17
11784   HD23  LEU  70          HD21      LEU  70   4.693   1.038  -0.752
  Start of MODEL   17
11785   HD22  LEU  70          HD22      LEU  70   6.286   1.025  -1.509
  Start of MODEL   17
11786   HD21  LEU  70          HD23      LEU  70   6.062   0.301   0.090
  Start of MODEL   17
11787    H    LEU  70           HN       LEU  70   3.106  -3.520   0.671
  Start of MODEL   17
11788    HA   ARG  71           HA       ARG  71   7.366  -5.442  -0.952
  Start of MODEL   17
11789    HB3  ARG  71           HB2      ARG  71   7.905  -7.229  -2.679
  Start of MODEL   17
11790    HB2  ARG  71           HB3      ARG  71   6.429  -6.747  -3.501
  Start of MODEL   17
11791    HG2  ARG  71           HG2      ARG  71   6.505  -7.705  -0.652
  Start of MODEL   17
11792    HG3  ARG  71           HG3      ARG  71   5.083  -7.416  -1.649
  Start of MODEL   17
11793    HD2  ARG  71           HD2      ARG  71   7.208  -9.486  -2.240
  Start of MODEL   17
11794    HD3  ARG  71           HD3      ARG  71   5.679  -9.819  -1.440
  Start of MODEL   17
11795    HE   ARG  71           HE       ARG  71   4.868  -8.685  -3.677
  Start of MODEL   17
11796   HH11  ARG  71          HH11      ARG  71   7.310 -11.241  -3.266
  Start of MODEL   17
11797   HH12  ARG  71          HH12      ARG  71   6.856 -12.088  -4.665
  Start of MODEL   17
11798   HH21  ARG  71          HH21      ARG  71   4.246  -9.938  -5.688
  Start of MODEL   17
11799   HH22  ARG  71          HH22      ARG  71   5.141 -11.337  -6.022
  Start of MODEL   17
11800    H    ARG  71           HN       ARG  71   5.333  -4.565  -2.867
  Start of MODEL   17
11801    HA   LEU  72           HA       LEU  72  10.259  -3.853  -3.713
  Start of MODEL   17
11802    HB3  LEU  72           HB2      LEU  72  11.889  -2.443  -2.637
  Start of MODEL   17
11803    HB2  LEU  72           HB3      LEU  72  11.473  -2.946  -1.042
  Start of MODEL   17
11804    HG   LEU  72           HG       LEU  72   9.558  -1.508  -2.886
  Start of MODEL   17
11805   HD11  LEU  72          HD11      LEU  72   9.543  -1.799   0.100
  Start of MODEL   17
11806   HD13  LEU  72          HD12      LEU  72   8.450  -2.583  -1.044
  Start of MODEL   17
11807   HD12  LEU  72          HD13      LEU  72   8.412  -0.828  -0.842
  Start of MODEL   17
11808   HD21  LEU  72          HD21      LEU  72  11.571  -0.149  -2.587
  Start of MODEL   17
11809   HD23  LEU  72          HD22      LEU  72  11.350  -0.224  -0.834
  Start of MODEL   17
11810   HD22  LEU  72          HD23      LEU  72  10.138   0.561  -1.861
  Start of MODEL   17
11811    H    LEU  72           HN       LEU  72   9.376  -4.919  -1.136
  Start of MODEL   17
11812    HA   ASN  73           HA       ASN  73  12.867  -7.316  -3.191
  Start of MODEL   17
11813    HB3  ASN  73           HB2      ASN  73  13.609  -8.084  -5.467
  Start of MODEL   17
11814    HB2  ASN  73           HB3      ASN  73  12.675  -6.768  -6.160
  Start of MODEL   17
11815   HD21  ASN  73          HD21      ASN  73  11.368  -8.148  -7.292
  Start of MODEL   17
11816   HD22  ASN  73          HD22      ASN  73  10.163  -9.120  -6.542
  Start of MODEL   17
11817    H    ASN  73           HN       ASN  73  11.345  -5.328  -4.633
  Start of MODEL   17
11818    HA   GLN  74           HA       GLN  74  16.389  -4.608  -3.763
  Start of MODEL   17
11819    HB3  GLN  74           HB2      GLN  74  15.047  -2.825  -5.792
  Start of MODEL   17
11820    HB2  GLN  74           HB3      GLN  74  15.969  -4.272  -6.164
  Start of MODEL   17
11821    HG2  GLN  74           HG2      GLN  74  17.107  -1.842  -4.825
  Start of MODEL   17
11822    HG3  GLN  74           HG3      GLN  74  17.997  -3.236  -5.448
  Start of MODEL   17
11823   HE21  GLN  74          HE21      GLN  74  18.279  -3.443  -7.623
  Start of MODEL   17
11824   HE22  GLN  74          HE22      GLN  74  17.964  -2.177  -8.749
  Start of MODEL   17
11825    H    GLN  74           HN       GLN  74  13.536  -4.167  -4.109
  Start of MODEL   17
11826    HA   PRO  75           HA       PRO  75  15.003  -1.269  -1.093
  Start of MODEL   17
11827    HB3  PRO  75           HB2      PRO  75  15.013  -2.678   0.726
  Start of MODEL   17
11828    HB2  PRO  75           HB3      PRO  75  16.555  -1.888   1.046
  Start of MODEL   17
11829    HG2  PRO  75           HG2      PRO  75  17.763  -3.715   0.394
  Start of MODEL   17
11830    HG3  PRO  75           HG3      PRO  75  16.255  -4.598   0.670
  Start of MODEL   17
11831    HD2  PRO  75           HD2      PRO  75  17.618  -4.217  -1.803
  Start of MODEL   17
11832    HD3  PRO  75           HD3      PRO  75  16.043  -4.987  -1.551
  Start of MODEL   17
11833    HA   THR  76           HA       THR  76  18.951   0.833  -1.177
  Start of MODEL   17
11834    HB   THR  76           HB       THR  76  18.904   2.562  -2.996
  Start of MODEL   17
11835    HG1  THR  76           HG1      THR  76  16.291   1.547  -3.490
  Start of MODEL   17
11836   HG22  THR  76          HG21      THR  76  18.723   0.986  -4.897
  Start of MODEL   17
11837   HG21  THR  76          HG22      THR  76  17.972  -0.193  -3.820
  Start of MODEL   17
11838   HG23  THR  76          HG23      THR  76  19.641   0.302  -3.552
  Start of MODEL   17
11839    H    THR  76           HN       THR  76  16.034   0.719  -1.325
  Start of MODEL   17
11840    HA   HIS  77           HA       HIS  77  18.032   4.237   1.185
  Start of MODEL   17
11841    HB3  HIS  77           HB2      HIS  77  20.483   4.333   1.362
  Start of MODEL   17
11842    HB2  HIS  77           HB3      HIS  77  19.750   5.901   1.620
  Start of MODEL   17
11843    HD1  HIS  77           HD1      HIS  77  22.064   4.106  -0.688
  Start of MODEL   17
11844    HD2  HIS  77           HD2      HIS  77  20.464   7.896  -0.178
  Start of MODEL   17
11845    HE1  HIS  77           HE1      HIS  77  23.437   5.608  -2.144
  Start of MODEL   17
11846    HE2  HIS  77           HE2      HIS  77  22.644   7.913  -1.536
  Start of MODEL   17
11847    H    HIS  77           HN       HIS  77  19.575   3.308  -1.040
  Start of MODEL   17
11848    HA   VAL  78           HA       VAL  78  16.424   7.285  -1.666
  Start of MODEL   17
11849    HB   VAL  78           HB       VAL  78  15.716   7.138  -4.043
  Start of MODEL   17
11850    H    VAL  78           HN       VAL  78  17.740   4.734  -2.047
  Start of MODEL   17
11851    HA   ASN  79           HA       ASN  79  12.815   4.416  -1.377
  Start of MODEL   17
11852    HB3  ASN  79           HB2      ASN  79  12.733   1.986  -0.968
  Start of MODEL   17
11853    HB2  ASN  79           HB3      ASN  79  14.471   1.952  -0.725
  Start of MODEL   17
11854   HD21  ASN  79          HD21      ASN  79  12.927   3.759  -3.297
  Start of MODEL   17
11855   HD22  ASN  79          HD22      ASN  79  13.561   2.773  -4.569
  Start of MODEL   17
11856    H    ASN  79           HN       ASN  79  15.742   4.116  -1.106
  Start of MODEL   17
11857    HA   ASN  80           HA       ASN  80  13.754   4.248   3.067
  Start of MODEL   17
11858    HB3  ASN  80           HB2      ASN  80  16.182   6.027   2.729
  Start of MODEL   17
11859    HB2  ASN  80           HB3      ASN  80  16.239   4.277   2.596
  Start of MODEL   17
11860   HD21  ASN  80          HD21      ASN  80  15.915   6.952   4.771
  Start of MODEL   17
11861   HD22  ASN  80          HD22      ASN  80  16.065   6.043   6.221
  Start of MODEL   17
11862    H    ASN  80           HN       ASN  80  14.664   5.624   0.625
  Start of MODEL   17
11863    HA2  GLY  81           HA2      GLY  81  12.306   7.929   4.997
  Start of MODEL   17
11864    H    GLY  81           HN       GLY  81  12.157   5.419   4.082
  Start of MODEL   17
11865    HA3  GLY  81           HA1      GLY  81  11.809   8.180   3.336
  Start of MODEL   17
11866    HA   ASN  82           HA       ASN  82   8.112   7.572   5.696
  Start of MODEL   17
11867    HB3  ASN  82           HB2      ASN  82   6.556   9.502   5.369
  Start of MODEL   17
11868    HB2  ASN  82           HB3      ASN  82   7.766  10.239   4.332
  Start of MODEL   17
11869   HD21  ASN  82          HD21      ASN  82   9.590  11.111   5.202
  Start of MODEL   17
11870   HD22  ASN  82          HD22      ASN  82   9.747  11.423   6.894
  Start of MODEL   17
11871    H    ASN  82           HN       ASN  82   9.863   9.062   3.962
  Start of MODEL   17
11872    HA   TYR  83           HA       TYR  83   5.808   6.332   2.189
  Start of MODEL   17
11873    HB3  TYR  83           HB2      TYR  83   5.085   3.897   2.735
  Start of MODEL   17
11874    HB2  TYR  83           HB3      TYR  83   6.135   4.050   4.151
  Start of MODEL   17
11875    HD1  TYR  83           HD1      TYR  83   6.007   3.238   0.706
  Start of MODEL   17
11876    HD2  TYR  83           HD2      TYR  83   8.590   4.677   3.756
  Start of MODEL   17
11877    HE1  TYR  83           HE1      TYR  83   7.961   2.611  -0.650
  Start of MODEL   17
11878    HE2  TYR  83           HE2      TYR  83  10.541   4.054   2.401
  Start of MODEL   17
11879    HH   TYR  83           HH       TYR  83  11.157   2.699   0.594
  Start of MODEL   17
11880    H    TYR  83           HN       TYR  83   6.758   6.149   4.939
  Start of MODEL   17
11881    HA   THR  84           HA       THR  84   1.981   6.765   4.280
  Start of MODEL   17
11882    HB   THR  84           HB       THR  84   2.075   9.165   2.430
  Start of MODEL   17
11883    HG1  THR  84           HG1      THR  84   3.829   8.655   4.091
  Start of MODEL   17
11884   HG22  THR  84          HG21      THR  84   0.614  10.201   4.130
  Start of MODEL   17
11885   HG21  THR  84          HG22      THR  84   0.611   8.688   5.046
  Start of MODEL   17
11886   HG23  THR  84          HG23      THR  84  -0.124   8.754   3.447
  Start of MODEL   17
11887    H    THR  84           HN       THR  84   3.826   7.169   2.022
  Start of MODEL   17
11888    HA   LEU  85           HA       LEU  85  -0.410   5.345   0.872
  Start of MODEL   17
11889    HB3  LEU  85           HB2      LEU  85  -1.524   3.841   3.256
  Start of MODEL   17
11890    HB2  LEU  85           HB3      LEU  85  -0.231   3.261   2.217
  Start of MODEL   17
11891    HG   LEU  85           HG       LEU  85  -3.104   3.705   1.364
  Start of MODEL   17
11892   HD13  LEU  85          HD11      LEU  85  -1.538   4.064  -0.444
  Start of MODEL   17
11893   HD12  LEU  85          HD12      LEU  85  -2.438   2.545  -0.647
  Start of MODEL   17
11894   HD11  LEU  85          HD13      LEU  85  -0.763   2.518  -0.047
  Start of MODEL   17
11895   HD22  LEU  85          HD21      LEU  85  -3.288   1.332   1.275
  Start of MODEL   17
11896   HD21  LEU  85          HD22      LEU  85  -2.756   1.804   2.896
  Start of MODEL   17
11897   HD23  LEU  85          HD23      LEU  85  -1.598   1.135   1.745
  Start of MODEL   17
11898    H    LEU  85           HN       LEU  85   0.169   5.670   3.723
  Start of MODEL   17
11899    HA   LEU  86           HA       LEU  86  -3.889   7.810   1.782
  Start of MODEL   17
11900    HB3  LEU  86           HB2      LEU  86  -4.177   9.469  -0.031
  Start of MODEL   17
11901    HB2  LEU  86           HB3      LEU  86  -2.919   8.691  -0.950
  Start of MODEL   17
11902    HG   LEU  86           HG       LEU  86  -2.296  10.844   0.125
  Start of MODEL   17
11903   HD12  LEU  86          HD11      LEU  86  -1.707  10.887   2.469
  Start of MODEL   17
11904   HD11  LEU  86          HD12      LEU  86  -2.427   9.291   2.668
  Start of MODEL   17
11905   HD13  LEU  86          HD13      LEU  86  -3.435  10.663   2.197
  Start of MODEL   17
11906   HD22  LEU  86          HD21      LEU  86  -0.081  10.128   0.853
  Start of MODEL   17
11907   HD21  LEU  86          HD22      LEU  86  -0.581   9.296  -0.621
  Start of MODEL   17
11908   HD23  LEU  86          HD23      LEU  86  -0.649   8.462   0.932
  Start of MODEL   17
11909    H    LEU  86           HN       LEU  86  -1.840   6.606   0.058
  Start of MODEL   17
11910    HA   ALA  87           HA       ALA  87  -6.578   5.995  -1.155
  Start of MODEL   17
11911    HB1  ALA  87           HB1      ALA  87  -7.813   5.494   1.559
  Start of MODEL   17
11912    HB3  ALA  87           HB2      ALA  87  -6.715   4.406   0.728
  Start of MODEL   17
11913    HB2  ALA  87           HB3      ALA  87  -8.317   4.702   0.066
  Start of MODEL   17
11914    H    ALA  87           HN       ALA  87  -5.931   7.260   1.418
  Start of MODEL   17
11915    HA   ALA  88           HA       ALA  88  -9.506   9.254  -0.883
  Start of MODEL   17
11916    HB1  ALA  88           HB1      ALA  88  -8.346   9.393  -3.670
  Start of MODEL   17
11917    HB3  ALA  88           HB2      ALA  88  -7.751  10.271  -2.260
  Start of MODEL   17
11918    HB2  ALA  88           HB3      ALA  88  -9.353  10.627  -2.910
  Start of MODEL   17
11919    H    ALA  88           HN       ALA  88  -7.840   7.270  -2.293
  Start of MODEL   17
11920    HA   ASN  89           HA       ASN  89 -12.740   7.763  -3.506
  Start of MODEL   17
11921    HB3  ASN  89           HB2      ASN  89 -12.301   5.988  -1.787
  Start of MODEL   17
11922    HB2  ASN  89           HB3      ASN  89 -14.010   6.158  -2.147
  Start of MODEL   17
11923   HD21  ASN  89          HD21      ASN  89 -11.525   6.711   0.206
  Start of MODEL   17
11924   HD22  ASN  89          HD22      ASN  89 -12.570   6.994   1.541
  Start of MODEL   17
11925    H    ASN  89           HN       ASN  89 -11.666   9.206  -1.243
  Start of MODEL   17
11926    HA   PRO  90           HA       PRO  90 -16.208  10.593  -3.193
  Start of MODEL   17
11927    HB3  PRO  90           HB2      PRO  90 -18.270   9.556  -3.584
  Start of MODEL   17
11928    HB2  PRO  90           HB3      PRO  90 -17.929   8.272  -2.414
  Start of MODEL   17
11929    HG2  PRO  90           HG2      PRO  90 -17.520   7.225  -4.476
  Start of MODEL   17
11930    HG3  PRO  90           HG3      PRO  90 -16.748   8.675  -5.146
  Start of MODEL   17
11931    HD2  PRO  90           HD2      PRO  90 -15.695   6.719  -3.158
  Start of MODEL   17
11932    HD3  PRO  90           HD3      PRO  90 -14.841   7.531  -4.491
  Start of MODEL   17
11933    HA   CYS  91           HA       CYS  91 -17.745   9.842   1.272
  Start of MODEL   17
11934    HB3  CYS  91           HB2      CYS  91 -15.982   7.438   1.727
  Start of MODEL   17
11935    HB2  CYS  91           HB3      CYS  91 -17.734   7.467   1.608
  Start of MODEL   17
11936    H    CYS  91           HN       CYS  91 -16.193   8.243  -0.508
  Start of MODEL   17
11937    HA2  GLY  92           HA2      GLY  92 -13.577  11.972   1.573
  Start of MODEL   17
11938    H    GLY  92           HN       GLY  92 -14.306   9.584   0.630
  Start of MODEL   17
11939    HA3  GLY  92           HA1      GLY  92 -13.610  10.978   3.028
  Start of MODEL   17
11940    HA   GLN  93           HA       GLN  93  -9.904   9.426   1.540
  Start of MODEL   17
11941    HB3  GLN  93           HB2      GLN  93  -9.119  12.131   2.659
  Start of MODEL   17
11942    HB2  GLN  93           HB3      GLN  93  -9.451  11.762   0.981
  Start of MODEL   17
11943    HG2  GLN  93           HG2      GLN  93  -7.429  10.066   1.368
  Start of MODEL   17
11944    HG3  GLN  93           HG3      GLN  93  -7.213  11.726   0.833
  Start of MODEL   17
11945   HE21  GLN  93          HE21      GLN  93  -5.186  11.892   1.661
  Start of MODEL   17
11946   HE22  GLN  93          HE22      GLN  93  -4.864  11.968   3.362
  Start of MODEL   17
11947    H    GLN  93           HN       GLN  93 -11.459  10.997   3.395
  Start of MODEL   17
11948    HA   ALA  94           HA       ALA  94  -8.295   8.302   5.459
  Start of MODEL   17
11949    HB1  ALA  94           HB1      ALA  94  -8.435   5.857   3.718
  Start of MODEL   17
11950    HB3  ALA  94           HB2      ALA  94  -9.624   6.341   4.935
  Start of MODEL   17
11951    HB2  ALA  94           HB3      ALA  94  -7.994   5.834   5.412
  Start of MODEL   17
11952    H    ALA  94           HN       ALA  94  -8.587   8.073   2.540
  Start of MODEL   17
11953    HA   SER  95           HA       SER  95  -4.176   7.322   4.266
  Start of MODEL   17
11954    HB3  SER  95           HB2      SER  95  -4.270   9.721   4.228
  Start of MODEL   17
11955    HB2  SER  95           HB3      SER  95  -2.825   9.251   5.121
  Start of MODEL   17
11956    HG   SER  95           HG       SER  95  -5.315   9.953   6.278
  Start of MODEL   17
11957    H    SER  95           HN       SER  95  -6.208   7.898   6.237
  Start of MODEL   17
11958    HA   ALA  96           HA       ALA  96  -2.024   6.363   8.055
  Start of MODEL   17
11959    HB1  ALA  96           HB1      ALA  96  -2.070   3.895   6.292
  Start of MODEL   17
11960    HB3  ALA  96           HB2      ALA  96  -3.256   4.291   7.531
  Start of MODEL   17
11961    HB2  ALA  96           HB3      ALA  96  -1.595   3.911   7.990
  Start of MODEL   17
11962    H    ALA  96           HN       ALA  96  -2.285   6.517   5.187
  Start of MODEL   17
11963    HA   SER  97           HA       SER  97   1.926   6.298   6.295
  Start of MODEL   17
11964    HB3  SER  97           HB2      SER  97   1.873   8.506   6.969
  Start of MODEL   17
11965    HB2  SER  97           HB3      SER  97   3.270   7.886   7.854
  Start of MODEL   17
11966    HG   SER  97           HG       SER  97   1.249   9.095   8.872
  Start of MODEL   17
11967    H    SER  97           HN       SER  97   0.177   6.174   8.600
  Start of MODEL   17
11968    HA   ILE  98           HA       ILE  98   4.654   3.903   8.755
  Start of MODEL   17
11969    HB   ILE  98           HB       ILE  98   3.897   2.083   7.545
  Start of MODEL   17
11970   HD12  ILE  98          HD11      ILE  98   7.361   0.798   7.655
  Start of MODEL   17
11971   HD11  ILE  98          HD12      ILE  98   5.871   1.031   8.643
  Start of MODEL   17
11972   HD13  ILE  98          HD13      ILE  98   7.000   2.375   8.341
  Start of MODEL   17
11973    H    ILE  98           HN       ILE  98   3.907   5.466   6.440
  Start of MODEL   17
11974    HA   MET  99           HA       MET  99   8.279   5.860   7.430
  Start of MODEL   17
11975    HB3  MET  99           HB2      MET  99   8.694   5.390  10.399
  Start of MODEL   17
11976    HB2  MET  99           HB3      MET  99   7.998   6.844   9.694
  Start of MODEL   17
11977    HG2  MET  99           HG2      MET  99  10.319   7.205  10.302
  Start of MODEL   17
11978    HG3  MET  99           HG3      MET  99  10.811   5.843   9.295
  Start of MODEL   17
11979    HE3  MET  99           HE1      MET  99  12.119   8.715   9.012
  Start of MODEL   17
11980    HE2  MET  99           HE2      MET  99  12.137   8.897   7.254
  Start of MODEL   17
11981    HE1  MET  99           HE3      MET  99  12.557   7.344   7.985
  Start of MODEL   17
11982    H    MET  99           HN       MET  99   6.654   4.326   9.306
  Start of MODEL   17
11983    HA   ALA 100           HA       ALA 100  10.220   1.996   7.371
  Start of MODEL   17
11984    HB1  ALA 100           HB1      ALA 100   9.656   2.554   4.472
  Start of MODEL   17
11985    HB3  ALA 100           HB2      ALA 100   8.603   1.673   5.577
  Start of MODEL   17
11986    HB2  ALA 100           HB3      ALA 100  10.185   1.017   5.153
  Start of MODEL   17
11987    H    ALA 100           HN       ALA 100   9.234   4.432   6.126
  Start of MODEL   17
11988    HA   ALA 101           HA       ALA 101  14.105   3.381   6.063
  Start of MODEL   17
11989    HB2  ALA 101           HB1      ALA 101  15.663   3.342   7.980
  Start of MODEL   17
11990    HB1  ALA 101           HB2      ALA 101  14.412   2.598   8.976
  Start of MODEL   17
11991    HB3  ALA 101           HB3      ALA 101  14.191   4.238   8.355
  Start of MODEL   17
11992    H    ALA 101           HN       ALA 101  12.231   2.073   7.889
  Start of MODEL   17
11993    HA   PHE 102           HA       PHE 102  14.723  -0.931   5.450
  Start of MODEL   17
11994    HB3  PHE 102           HB2      PHE 102  15.151  -1.436   3.090
  Start of MODEL   17
11995    HB2  PHE 102           HB3      PHE 102  15.226   0.284   2.738
  Start of MODEL   17
11996    HD1  PHE 102           HD1      PHE 102  12.839  -1.629   4.841
  Start of MODEL   17
11997    HD2  PHE 102           HD2      PHE 102  13.405   0.754   1.369
  Start of MODEL   17
11998    HE1  PHE 102           HE1      PHE 102  10.414  -1.607   4.456
  Start of MODEL   17
11999    HE2  PHE 102           HE2      PHE 102  10.983   0.783   0.987
  Start of MODEL   17
12000    HZ   PHE 102           HZ       PHE 102   9.490  -0.370   2.497
  Start of MODEL   17
12001    H    PHE 102           HN       PHE 102  14.407   1.807   4.653
  Start of MODEL   17
12002    HA   MET 103           HA       MET 103  19.246  -0.334   5.360
  Start of MODEL   17
12003    HB3  MET 103           HB2      MET 103  20.609   0.926   3.764
  Start of MODEL   17
12004    HB2  MET 103           HB3      MET 103  19.314   2.069   3.503
  Start of MODEL   17
12005    HG2  MET 103           HG2      MET 103  17.977   0.327   2.422
  Start of MODEL   17
12006    HG3  MET 103           HG3      MET 103  19.496   0.641   1.596
  Start of MODEL   17
12007    HE3  MET 103           HE1      MET 103  21.599  -1.008   1.714
  Start of MODEL   17
12008    HE2  MET 103           HE2      MET 103  21.597  -2.520   2.621
  Start of MODEL   17
12009    HE1  MET 103           HE3      MET 103  21.564  -0.981   3.478
  Start of MODEL   17
12010    H    MET 103           HN       MET 103  17.149   1.648   5.075
  Start of MODEL   17
12011    HA   ASP 104           HA       ASP 104  20.171   3.031   8.050
  Start of MODEL   17
12012    HB3  ASP 104           HB2      ASP 104  22.465   2.651   9.197
  Start of MODEL   17
12013    HB2  ASP 104           HB3      ASP 104  22.452   1.072   8.419
  Start of MODEL   17
12014    H    ASP 104           HN       ASP 104  20.798   0.517   6.798
  Start of MODEL   17
12015    HA   ASN 105           HA       ASN 105  22.215   4.842   4.745
  Start of MODEL   17
12016    HB3  ASN 105           HB2      ASN 105  20.555   7.012   6.028
  Start of MODEL   17
12017    HB2  ASN 105           HB3      ASN 105  20.027   5.924   4.752
  Start of MODEL   17
12018   HD21  ASN 105          HD21      ASN 105  21.931   8.702   5.512
  Start of MODEL   17
12019   HD22  ASN 105          HD22      ASN 105  22.265   9.177   3.891
  Start of MODEL   17
12020    H    ASN 105           HN       ASN 105  20.575   4.794   7.089
  Start of MODEL   17
12021    HA   PRO 106           HA       PRO 106  25.661   6.576   7.082
  Start of MODEL   17
12022    HB3  PRO 106           HB2      PRO 106  27.417   5.484   6.110
  Start of MODEL   17
12023    HB2  PRO 106           HB3      PRO 106  27.142   6.327   4.585
  Start of MODEL   17
12024    HG2  PRO 106           HG2      PRO 106  26.502   4.260   3.849
  Start of MODEL   17
12025    HG3  PRO 106           HG3      PRO 106  26.139   3.689   5.487
  Start of MODEL   17
12026    HD2  PRO 106           HD2      PRO 106  24.447   5.249   3.595
  Start of MODEL   17
12027    HD3  PRO 106           HD3      PRO 106  23.998   3.960   4.733
  Start of MODEL   17
12028    HA   PHE 107           HA       PHE 107  25.809  10.860   6.911
  Start of MODEL   17
12029    HB3  PHE 107           HB2      PHE 107  26.839  11.756   4.863
  Start of MODEL   17
12030    HB2  PHE 107           HB3      PHE 107  26.680  10.183   4.086
  Start of MODEL   17
12031    HD1  PHE 107           HD1      PHE 107  28.280  11.870   6.978
  Start of MODEL   17
12032    HD2  PHE 107           HD2      PHE 107  28.390   8.610   4.249
  Start of MODEL   17
12033    HE1  PHE 107           HE1      PHE 107  30.474  11.214   7.854
  Start of MODEL   17
12034    HE2  PHE 107           HE2      PHE 107  30.589   7.946   5.120
  Start of MODEL   17
12035    HZ   PHE 107           HZ       PHE 107  31.638   9.247   6.926
  Start of MODEL   17
12036    H    PHE 107           HN       PHE 107  25.736   8.662   7.253
  Start of MODEL   18
12037    H1   ASP   1           H        ASP   1 -23.400   0.098  -8.380
  Start of MODEL   18
12038    H2   ASP   1           H2       ASP   1 -24.971   0.528  -7.944
  Start of MODEL   18
12039    H3   ASP   1           H3       ASP   1 -24.610   0.211  -9.557
  Start of MODEL   18
12040    HA   ASP   1           HA       ASP   1 -25.798  -1.592  -8.494
  Start of MODEL   18
12041    HB3  ASP   1           HB2      ASP   1 -24.164  -3.429  -9.019
  Start of MODEL   18
12042    HB2  ASP   1           HB3      ASP   1 -22.939  -2.192  -9.266
  Start of MODEL   18
12043    HA   ASP   2           HA       ASP   2 -24.289  -2.532  -4.557
  Start of MODEL   18
12044    HB3  ASP   2           HB2      ASP   2 -24.593  -0.807  -2.744
  Start of MODEL   18
12045    HB2  ASP   2           HB3      ASP   2 -25.257   0.277  -3.949
  Start of MODEL   18
12046    H    ASP   2           HN       ASP   2 -26.052  -0.968  -6.277
  Start of MODEL   18
12047    HA   ASP   3           HA       ASP   3 -28.461  -3.516  -3.535
  Start of MODEL   18
12048    HB3  ASP   3           HB2      ASP   3 -26.973  -6.159  -3.481
  Start of MODEL   18
12049    HB2  ASP   3           HB3      ASP   3 -27.960  -5.570  -4.816
  Start of MODEL   18
12050    H    ASP   3           HN       ASP   3 -25.731  -4.139  -4.266
  Start of MODEL   18
12051    HA   ASP   4           HA       ASP   4 -26.339  -4.602   0.560
  Start of MODEL   18
12052    HB3  ASP   4           HB2      ASP   4 -23.907  -4.247   1.133
  Start of MODEL   18
12053    HB2  ASP   4           HB3      ASP   4 -23.597  -3.979  -0.575
  Start of MODEL   18
12054    H    ASP   4           HN       ASP   4 -25.442  -4.266  -2.131
  Start of MODEL   18
12055    HA   ASP   5           HA       ASP   5 -26.845  -0.289   1.080
  Start of MODEL   18
12056    HB3  ASP   5           HB2      ASP   5 -27.891  -1.534   3.638
  Start of MODEL   18
12057    HB2  ASP   5           HB3      ASP   5 -28.842  -1.341   2.178
  Start of MODEL   18
12058    H    ASP   5           HN       ASP   5 -26.921  -3.069   1.897
  Start of MODEL   18
12059    HA   VAL   6           HA       VAL   6 -23.860  -0.578   4.734
  Start of MODEL   18
12060    HB   VAL   6           HB       VAL   6 -22.080  -2.405   5.035
  Start of MODEL   18
12061    H    VAL   6           HN       VAL   6 -24.959  -2.393   2.855
  Start of MODEL   18
12062    HA   SER   7           HA       SER   7 -21.080   0.797   1.774
  Start of MODEL   18
12063    HB3  SER   7           HB2      SER   7 -22.703   2.429   1.314
  Start of MODEL   18
12064    HB2  SER   7           HB3      SER   7 -21.220   3.334   1.653
  Start of MODEL   18
12065    HG   SER   7           HG       SER   7 -23.568   3.074   3.195
  Start of MODEL   18
12066    H    SER   7           HN       SER   7 -22.944   1.128   3.947
  Start of MODEL   18
12067    HA   PHE   8           HA       PHE   8 -18.072   1.134   4.904
  Start of MODEL   18
12068    HB3  PHE   8           HB2      PHE   8 -16.120  -0.240   4.132
  Start of MODEL   18
12069    HB2  PHE   8           HB3      PHE   8 -16.996  -0.572   2.650
  Start of MODEL   18
12070    HD1  PHE   8           HD1      PHE   8 -19.413  -1.685   2.986
  Start of MODEL   18
12071    HD2  PHE   8           HD2      PHE   8 -16.261  -1.722   5.841
  Start of MODEL   18
12072    HE1  PHE   8           HE1      PHE   8 -20.390  -3.657   4.034
  Start of MODEL   18
12073    HE2  PHE   8           HE2      PHE   8 -17.250  -3.690   6.899
  Start of MODEL   18
12074    HZ   PHE   8           HZ       PHE   8 -19.322  -4.670   5.999
  Start of MODEL   18
12075    H    PHE   8           HN       PHE   8 -19.188   0.315   2.370
  Start of MODEL   18
12076    HA   CYS   9           HA       CYS   9 -16.036   4.479   2.908
  Start of MODEL   18
12077    HB3  CYS   9           HB2      CYS   9 -15.502   4.762   5.884
  Start of MODEL   18
12078    HB2  CYS   9           HB3      CYS   9 -16.953   5.352   5.089
  Start of MODEL   18
12079    H    CYS   9           HN       CYS   9 -16.786   2.795   5.141
  Start of MODEL   18
12080    HA   ALA  10           HA       ALA  10 -11.989   2.947   3.049
  Start of MODEL   18
12081    HB2  ALA  10           HB1      ALA  10 -10.275   4.342   2.045
  Start of MODEL   18
12082    HB1  ALA  10           HB2      ALA  10 -11.232   5.782   2.355
  Start of MODEL   18
12083    HB3  ALA  10           HB3      ALA  10 -11.810   4.570   1.199
  Start of MODEL   18
12084    H    ALA  10           HN       ALA  10 -13.567   5.392   3.317
  Start of MODEL   18
12085    HA   SER  11           HA       SER  11  -9.775   4.230   6.486
  Start of MODEL   18
12086    HB3  SER  11           HB2      SER  11 -10.958   1.519   7.164
  Start of MODEL   18
12087    HB2  SER  11           HB3      SER  11 -11.546   3.081   7.712
  Start of MODEL   18
12088    HG   SER  11           HG       SER  11  -9.749   1.477   8.749
  Start of MODEL   18
12089    H    SER  11           HN       SER  11 -11.072   2.280   4.765
  Start of MODEL   18
12090    HA   VAL  12           HA       VAL  12  -6.371   1.748   5.277
  Start of MODEL   18
12091    HB   VAL  12           HB       VAL  12  -5.417   4.628   5.478
  Start of MODEL   18
12092    H    VAL  12           HN       VAL  12  -7.607   3.983   6.740
  Start of MODEL   18
12093    HA   GLN  13           HA       GLN  13  -3.847   1.638   8.784
  Start of MODEL   18
12094    HB3  GLN  13           HB2      GLN  13  -5.600   0.248   9.740
  Start of MODEL   18
12095    HB2  GLN  13           HB3      GLN  13  -4.037  -0.535   9.974
  Start of MODEL   18
12096    HG2  GLN  13           HG2      GLN  13  -5.936  -1.295   7.797
  Start of MODEL   18
12097    HG3  GLN  13           HG3      GLN  13  -4.438  -2.099   8.256
  Start of MODEL   18
12098   HE21  GLN  13          HE21      GLN  13  -5.070  -1.698  11.171
  Start of MODEL   18
12099   HE22  GLN  13          HE22      GLN  13  -6.274  -2.871  11.513
  Start of MODEL   18
12100    H    GLN  13           HN       GLN  13  -5.274   0.443   6.548
  Start of MODEL   18
12101    HA   LEU  14           HA       LEU  14  -0.579  -0.385   6.769
  Start of MODEL   18
12102    HB3  LEU  14           HB2      LEU  14   1.444   1.209   7.039
  Start of MODEL   18
12103    HB2  LEU  14           HB3      LEU  14   0.296   2.313   7.773
  Start of MODEL   18
12104    HG   LEU  14           HG       LEU  14  -1.062   2.101   5.603
  Start of MODEL   18
12105   HD13  LEU  14          HD11      LEU  14   0.300   4.078   6.092
  Start of MODEL   18
12106   HD12  LEU  14          HD12      LEU  14   0.351   3.636   4.383
  Start of MODEL   18
12107   HD11  LEU  14          HD13      LEU  14   1.717   3.254   5.426
  Start of MODEL   18
12108   HD21  LEU  14          HD21      LEU  14   0.016   0.062   4.865
  Start of MODEL   18
12109   HD23  LEU  14          HD22      LEU  14   1.538   0.936   4.671
  Start of MODEL   18
12110   HD22  LEU  14          HD23      LEU  14   0.145   1.346   3.661
  Start of MODEL   18
12111    H    LEU  14           HN       LEU  14  -1.756   1.482   8.688
  Start of MODEL   18
12112    HA   HIS  15           HA       HIS  15   1.810  -1.582  10.251
  Start of MODEL   18
12113    HB3  HIS  15           HB2      HIS  15   2.270  -4.086   9.850
  Start of MODEL   18
12114    HB2  HIS  15           HB3      HIS  15   1.381  -3.872   8.347
  Start of MODEL   18
12115    HD1  HIS  15           HD1      HIS  15   0.946  -4.060  12.024
  Start of MODEL   18
12116    HD2  HIS  15           HD2      HIS  15  -1.425  -3.415   8.672
  Start of MODEL   18
12117    HE1  HIS  15           HE1      HIS  15  -1.395  -4.261  12.818
  Start of MODEL   18
12118    HE2  HIS  15           HE2      HIS  15  -2.779  -4.184  10.754
  Start of MODEL   18
12119    H    HIS  15           HN       HIS  15   1.439  -1.411   7.371
  Start of MODEL   18
12120    HA   THR  16           HA       THR  16   6.002  -1.075   9.705
  Start of MODEL   18
12121    HB   THR  16           HB       THR  16   6.152  -3.486  11.510
  Start of MODEL   18
12122    HG1  THR  16           HG1      THR  16   5.622  -2.211  13.168
  Start of MODEL   18
12123   HG21  THR  16          HG21      THR  16   7.794  -0.947  11.320
  Start of MODEL   18
12124   HG23  THR  16          HG22      THR  16   8.272  -2.514  10.680
  Start of MODEL   18
12125   HG22  THR  16          HG23      THR  16   8.094  -2.294  12.424
  Start of MODEL   18
12126    H    THR  16           HN       THR  16   3.855  -2.232  10.921
  Start of MODEL   18
12127    HA   ALA  17           HA       ALA  17   6.831  -3.864   6.474
  Start of MODEL   18
12128    HB1  ALA  17           HB1      ALA  17   7.939  -1.705   5.883
  Start of MODEL   18
12129    HB3  ALA  17           HB2      ALA  17   8.675  -3.137   5.208
  Start of MODEL   18
12130    HB2  ALA  17           HB3      ALA  17   9.418  -2.331   6.615
  Start of MODEL   18
12131    H    ALA  17           HN       ALA  17   7.467  -1.742   8.225
  Start of MODEL   18
12132    HA   VAL  18           HA       VAL  18   9.118  -6.758   8.575
  Start of MODEL   18
12133    HB   VAL  18           HB       VAL  18   8.829  -9.053   7.647
  Start of MODEL   18
12134    H    VAL  18           HN       VAL  18   7.970  -5.777   6.106
  Start of MODEL   18
12135    HA   GLU  19           HA       GLU  19  13.165  -6.581   7.163
  Start of MODEL   18
12136    HB3  GLU  19           HB2      GLU  19  13.139  -7.958   9.856
  Start of MODEL   18
12137    HB2  GLU  19           HB3      GLU  19  13.407  -6.254   9.546
  Start of MODEL   18
12138    HG2  GLU  19           HG2      GLU  19  15.475  -7.414  10.141
  Start of MODEL   18
12139    HG3  GLU  19           HG3      GLU  19  15.279  -8.477   8.757
  Start of MODEL   18
12140    H    GLU  19           HN       GLU  19  11.066  -7.274   8.932
  Start of MODEL   18
12141    HA   MET  20           HA       MET  20  14.805 -10.219   5.630
  Start of MODEL   18
12142    HB3  MET  20           HB2      MET  20  12.528 -11.186   5.750
  Start of MODEL   18
12143    HB2  MET  20           HB3      MET  20  13.274 -11.592   4.222
  Start of MODEL   18
12144    HG2  MET  20           HG2      MET  20  11.177  -9.487   4.643
  Start of MODEL   18
12145    HG3  MET  20           HG3      MET  20  11.958  -9.863   3.105
  Start of MODEL   18
12146    HE1  MET  20           HE1      MET  20   9.613 -10.313   1.907
  Start of MODEL   18
12147    HE3  MET  20           HE2      MET  20   8.779  -9.894   3.405
  Start of MODEL   18
12148    HE2  MET  20           HE3      MET  20   8.371 -11.384   2.560
  Start of MODEL   18
12149    H    MET  20           HN       MET  20  13.588  -7.750   5.474
  Start of MODEL   18
12150    HA   HIS  21           HA       HIS  21  16.283  -8.830   1.917
  Start of MODEL   18
12151    HB3  HIS  21           HB2      HIS  21  16.317 -10.190  -0.247
  Start of MODEL   18
12152    HB2  HIS  21           HB3      HIS  21  15.355 -11.384   0.614
  Start of MODEL   18
12153    HD1  HIS  21           HD1      HIS  21  18.778 -10.092   0.277
  Start of MODEL   18
12154    HD2  HIS  21           HD2      HIS  21  16.698 -12.719   2.716
  Start of MODEL   18
12155    HE1  HIS  21           HE1      HIS  21  20.536 -11.416   1.499
  Start of MODEL   18
12156    HE2  HIS  21           HE2      HIS  21  19.203 -12.638   3.240
  Start of MODEL   18
12157    H    HIS  21           HN       HIS  21  14.705 -10.949   2.957
  Start of MODEL   18
12158    HA   HIS  22           HA       HIS  22  12.790  -7.599  -0.673
  Start of MODEL   18
12159    HB3  HIS  22           HB2      HIS  22  10.541  -8.619  -1.262
  Start of MODEL   18
12160    HB2  HIS  22           HB3      HIS  22  11.039 -10.048  -0.368
  Start of MODEL   18
12161    HD1  HIS  22           HD1      HIS  22  11.215 -11.684  -2.285
  Start of MODEL   18
12162    HD2  HIS  22           HD2      HIS  22  13.336  -8.190  -2.945
  Start of MODEL   18
12163    HE1  HIS  22           HE1      HIS  22  12.486 -12.067  -4.398
  Start of MODEL   18
12164    HE2  HIS  22           HE2      HIS  22  13.356  -9.789  -4.953
  Start of MODEL   18
12165    H    HIS  22           HN       HIS  22  13.114 -10.031   0.898
  Start of MODEL   18
12166    HA   TRP  23           HA       TRP  23  10.808  -6.151   2.837
  Start of MODEL   18
12167    HB3  TRP  23           HB2      TRP  23  10.649  -3.610   2.700
  Start of MODEL   18
12168    HB2  TRP  23           HB3      TRP  23  11.495  -3.752   1.158
  Start of MODEL   18
12169    HD1  TRP  23           HD1      TRP  23  14.064  -4.640   1.267
  Start of MODEL   18
12170    HE1  TRP  23           HE1      TRP  23  15.783  -4.583   3.190
  Start of MODEL   18
12171    HE3  TRP  23           HE3      TRP  23  10.921  -3.788   5.139
  Start of MODEL   18
12172    HZ2  TRP  23           HZ2      TRP  23  15.797  -4.220   5.958
  Start of MODEL   18
12173    HZ3  TRP  23           HZ3      TRP  23  11.845  -3.593   7.421
  Start of MODEL   18
12174    HH2  TRP  23           HH2      TRP  23  14.240  -3.809   7.812
  Start of MODEL   18
12175    H    TRP  23           HN       TRP  23  11.919  -5.884   0.209
  Start of MODEL   18
12176    HA   CYS  24           HA       CYS  24   6.776  -5.744   1.329
  Start of MODEL   18
12177    HB3  CYS  24           HB2      CYS  24   6.941  -7.975   3.380
  Start of MODEL   18
12178    HB2  CYS  24           HB3      CYS  24   6.987  -8.149   1.637
  Start of MODEL   18
12179    H    CYS  24           HN       CYS  24   8.862  -6.390   3.289
  Start of MODEL   18
12180    HA   ILE  25           HA       ILE  25   5.242  -3.482   4.779
  Start of MODEL   18
12181    HB   ILE  25           HB       ILE  25   4.514  -1.851   2.318
  Start of MODEL   18
12182   HD12  ILE  25          HD11      ILE  25   7.653   0.212   2.783
  Start of MODEL   18
12183   HD11  ILE  25          HD12      ILE  25   6.081   0.646   3.460
  Start of MODEL   18
12184   HD13  ILE  25          HD13      ILE  25   6.196   0.081   1.796
  Start of MODEL   18
12185    H    ILE  25           HN       ILE  25   5.546  -4.136   1.936
  Start of MODEL   18
12186    HA   PRO  26           HA       PRO  26   1.271  -5.538   3.935
  Start of MODEL   18
12187    HB3  PRO  26           HB2      PRO  26   1.194  -6.994   5.683
  Start of MODEL   18
12188    HB2  PRO  26           HB3      PRO  26   0.923  -5.668   6.809
  Start of MODEL   18
12189    HG2  PRO  26           HG2      PRO  26   3.028  -6.194   7.549
  Start of MODEL   18
12190    HG3  PRO  26           HG3      PRO  26   3.454  -6.993   6.026
  Start of MODEL   18
12191    HD2  PRO  26           HD2      PRO  26   3.579  -4.093   6.749
  Start of MODEL   18
12192    HD3  PRO  26           HD3      PRO  26   4.698  -5.082   5.781
  Start of MODEL   18
12193    HA   PHE  27           HA       PHE  27  -1.372  -2.432   5.525
  Start of MODEL   18
12194    HB3  PHE  27           HB2      PHE  27  -0.317  -1.316   3.584
  Start of MODEL   18
12195    HB2  PHE  27           HB3      PHE  27  -2.005  -0.864   3.775
  Start of MODEL   18
12196    HD1  PHE  27           HD1      PHE  27  -3.700  -1.731   2.185
  Start of MODEL   18
12197    HD2  PHE  27           HD2      PHE  27   0.472  -2.348   1.621
  Start of MODEL   18
12198    HE1  PHE  27           HE1      PHE  27  -4.106  -2.282  -0.171
  Start of MODEL   18
12199    HE2  PHE  27           HE2      PHE  27   0.067  -2.899  -0.736
  Start of MODEL   18
12200    HZ   PHE  27           HZ       PHE  27  -2.222  -2.866  -1.634
  Start of MODEL   18
12201    H    PHE  27           HN       PHE  27  -0.603  -4.493   3.610
  Start of MODEL   18
12202    HA   SER  28           HA       SER  28  -5.284  -3.631   3.842
  Start of MODEL   18
12203    HB3  SER  28           HB2      SER  28  -6.718  -4.199   5.795
  Start of MODEL   18
12204    HB2  SER  28           HB3      SER  28  -5.542  -3.422   6.859
  Start of MODEL   18
12205    HG   SER  28           HG       SER  28  -4.130  -5.008   5.426
  Start of MODEL   18
12206    H    SER  28           HN       SER  28  -3.624  -1.899   5.421
  Start of MODEL   18
12207    HA   VAL  29           HA       VAL  29  -7.606   0.051   4.033
  Start of MODEL   18
12208    HB   VAL  29           HB       VAL  29  -6.201   0.702   2.155
  Start of MODEL   18
12209    H    VAL  29           HN       VAL  29  -6.754  -2.505   2.910
  Start of MODEL   18
12210    HA   ASP  30           HA       ASP  30 -11.230  -2.024   2.892
  Start of MODEL   18
12211    HB3  ASP  30           HB2      ASP  30 -11.265  -2.469   5.383
  Start of MODEL   18
12212    HB2  ASP  30           HB3      ASP  30 -12.837  -2.363   4.625
  Start of MODEL   18
12213    H    ASP  30           HN       ASP  30  -9.726  -0.150   4.557
  Start of MODEL   18
12214    HA2  GLY  31           HA2      GLY  31 -14.743   0.790   2.475
  Start of MODEL   18
12215    H    GLY  31           HN       GLY  31 -13.379  -1.511   2.343
  Start of MODEL   18
12216    HA3  GLY  31           HA1      GLY  31 -13.482   1.167   1.302
  Start of MODEL   18
12217    HA   GLN  32           HA       GLN  32 -16.368  -1.617  -0.611
  Start of MODEL   18
12218    HB3  GLN  32           HB2      GLN  32 -18.920  -0.097  -0.023
  Start of MODEL   18
12219    HB2  GLN  32           HB3      GLN  32 -18.314  -1.391   0.999
  Start of MODEL   18
12220    HG2  GLN  32           HG2      GLN  32 -19.077  -1.600  -1.904
  Start of MODEL   18
12221    HG3  GLN  32           HG3      GLN  32 -18.373  -2.904  -0.950
  Start of MODEL   18
12222   HE21  GLN  32          HE21      GLN  32 -21.123  -1.018  -1.585
  Start of MODEL   18
12223   HE22  GLN  32          HE22      GLN  32 -22.250  -1.955  -0.656
  Start of MODEL   18
12224    H    GLN  32           HN       GLN  32 -16.480   0.686   1.125
  Start of MODEL   18
12225    HA   PRO  33           HA       PRO  33 -17.045   1.794  -3.896
  Start of MODEL   18
12226    HB3  PRO  33           HB2      PRO  33 -17.381   4.092  -3.556
  Start of MODEL   18
12227    HB2  PRO  33           HB3      PRO  33 -16.146   4.150  -2.293
  Start of MODEL   18
12228    HG2  PRO  33           HG2      PRO  33 -18.063   4.369  -1.003
  Start of MODEL   18
12229    HG3  PRO  33           HG3      PRO  33 -19.024   3.352  -2.095
  Start of MODEL   18
12230    HD2  PRO  33           HD2      PRO  33 -17.030   2.549  -0.018
  Start of MODEL   18
12231    HD3  PRO  33           HD3      PRO  33 -18.584   1.804  -0.443
  Start of MODEL   18
12232    HA   ALA  34           HA       ALA  34 -12.952   0.597  -3.262
  Start of MODEL   18
12233    HB1  ALA  34           HB1      ALA  34 -13.709  -0.688  -5.174
  Start of MODEL   18
12234    HB3  ALA  34           HB2      ALA  34 -12.002  -0.252  -5.301
  Start of MODEL   18
12235    HB2  ALA  34           HB3      ALA  34 -13.218   0.617  -6.254
  Start of MODEL   18
12236    H    ALA  34           HN       ALA  34 -15.176   1.282  -4.852
  Start of MODEL   18
12237    HA   PRO  35           HA       PRO  35 -10.939   4.570  -3.718
  Start of MODEL   18
12238    HB3  PRO  35           HB2      PRO  35 -10.886   4.417  -1.369
  Start of MODEL   18
12239    HB2  PRO  35           HB3      PRO  35  -9.172   4.294  -1.784
  Start of MODEL   18
12240    HG2  PRO  35           HG2      PRO  35  -9.164   1.986  -1.600
  Start of MODEL   18
12241    HG3  PRO  35           HG3      PRO  35 -10.271   2.386  -0.288
  Start of MODEL   18
12242    HD2  PRO  35           HD2      PRO  35 -10.931   0.703  -2.352
  Start of MODEL   18
12243    HD3  PRO  35           HD3      PRO  35 -12.136   1.704  -1.515
  Start of MODEL   18
12244    HA   SER  36           HA       SER  36  -7.301   3.176  -5.771
  Start of MODEL   18
12245    HB3  SER  36           HB2      SER  36  -6.452   4.958  -7.183
  Start of MODEL   18
12246    HB2  SER  36           HB3      SER  36  -7.298   6.169  -6.220
  Start of MODEL   18
12247    HG   SER  36           HG       SER  36  -8.837   5.871  -7.593
  Start of MODEL   18
12248    H    SER  36           HN       SER  36  -9.073   5.224  -4.731
  Start of MODEL   18
12249    HA   LEU  37           HA       LEU  37  -4.534   4.392  -2.641
  Start of MODEL   18
12250    HB3  LEU  37           HB2      LEU  37  -2.782   2.708  -2.370
  Start of MODEL   18
12251    HB2  LEU  37           HB3      LEU  37  -3.235   1.981  -3.891
  Start of MODEL   18
12252    HG   LEU  37           HG       LEU  37  -5.385   1.318  -2.952
  Start of MODEL   18
12253   HD13  LEU  37          HD11      LEU  37  -3.441  -0.147  -2.731
  Start of MODEL   18
12254   HD12  LEU  37          HD12      LEU  37  -4.532  -0.303  -1.352
  Start of MODEL   18
12255   HD11  LEU  37          HD13      LEU  37  -3.042   0.620  -1.198
  Start of MODEL   18
12256   HD21  LEU  37          HD21      LEU  37  -4.328   2.646  -0.486
  Start of MODEL   18
12257   HD23  LEU  37          HD22      LEU  37  -5.729   1.571  -0.517
  Start of MODEL   18
12258   HD22  LEU  37          HD23      LEU  37  -5.776   3.107  -1.394
  Start of MODEL   18
12259    H    LEU  37           HN       LEU  37  -5.127   3.019  -5.143
  Start of MODEL   18
12260    HA   ARG  38           HA       ARG  38  -0.978   5.920  -4.617
  Start of MODEL   18
12261    HB3  ARG  38           HB2      ARG  38  -2.416   8.247  -3.321
  Start of MODEL   18
12262    HB2  ARG  38           HB3      ARG  38  -2.552   7.718  -4.983
  Start of MODEL   18
12263    HG2  ARG  38           HG2      ARG  38  -1.203   9.682  -4.967
  Start of MODEL   18
12264    HG3  ARG  38           HG3      ARG  38  -0.183   9.041  -3.686
  Start of MODEL   18
12265    HD2  ARG  38           HD2      ARG  38   0.705   8.993  -6.081
  Start of MODEL   18
12266    HD3  ARG  38           HD3      ARG  38   0.876   7.521  -5.120
  Start of MODEL   18
12267    HE   ARG  38           HE       ARG  38  -1.464   7.765  -6.800
  Start of MODEL   18
12268   HH11  ARG  38          HH11      ARG  38   1.927   6.577  -6.665
  Start of MODEL   18
12269   HH12  ARG  38          HH12      ARG  38   1.600   5.244  -7.670
  Start of MODEL   18
12270   HH21  ARG  38          HH21      ARG  38  -1.823   5.799  -8.172
  Start of MODEL   18
12271   HH22  ARG  38          HH22      ARG  38  -0.497   4.782  -8.488
  Start of MODEL   18
12272    H    ARG  38           HN       ARG  38  -2.949   5.764  -2.468
  Start of MODEL   18
12273    HA   TRP  39           HA       TRP  39   1.530   6.034  -1.089
  Start of MODEL   18
12274    HB3  TRP  39           HB2      TRP  39   3.701   5.006  -1.649
  Start of MODEL   18
12275    HB2  TRP  39           HB3      TRP  39   3.254   4.977  -3.346
  Start of MODEL   18
12276    HD1  TRP  39           HD1      TRP  39   1.629   3.071  -4.163
  Start of MODEL   18
12277    HE1  TRP  39           HE1      TRP  39   0.797   0.911  -3.076
  Start of MODEL   18
12278    HE3  TRP  39           HE3      TRP  39   2.995   4.042   0.669
  Start of MODEL   18
12279    HZ2  TRP  39           HZ2      TRP  39   0.711  -0.245  -0.476
  Start of MODEL   18
12280    HZ3  TRP  39           HZ3      TRP  39   2.509   2.358   2.393
  Start of MODEL   18
12281    HH2  TRP  39           HH2      TRP  39   1.394   0.267   1.841
  Start of MODEL   18
12282    H    TRP  39           HN       TRP  39   0.994   5.801  -3.936
  Start of MODEL   18
12283    HA   LEU  40           HA       LEU  40   4.015   9.409  -2.174
  Start of MODEL   18
12284    HB3  LEU  40           HB2      LEU  40   3.723  11.295  -0.620
  Start of MODEL   18
12285    HB2  LEU  40           HB3      LEU  40   2.600  10.353   0.344
  Start of MODEL   18
12286    HG   LEU  40           HG       LEU  40   1.046  10.324  -1.581
  Start of MODEL   18
12287   HD13  LEU  40          HD11      LEU  40   0.886  12.097   0.117
  Start of MODEL   18
12288   HD12  LEU  40          HD12      LEU  40   0.430  12.685  -1.479
  Start of MODEL   18
12289   HD11  LEU  40          HD13      LEU  40   2.016  13.077  -0.816
  Start of MODEL   18
12290   HD22  LEU  40          HD21      LEU  40   2.602  10.452  -3.383
  Start of MODEL   18
12291   HD21  LEU  40          HD22      LEU  40   3.190  12.006  -2.799
  Start of MODEL   18
12292   HD23  LEU  40          HD23      LEU  40   1.548  11.876  -3.462
  Start of MODEL   18
12293    H    LEU  40           HN       LEU  40   2.352   7.838  -0.359
  Start of MODEL   18
12294    HA   PHE  41           HA       PHE  41   7.111   8.357   0.651
  Start of MODEL   18
12295    HB3  PHE  41           HB2      PHE  41   8.335   8.877  -2.079
  Start of MODEL   18
12296    HB2  PHE  41           HB3      PHE  41   7.824   7.315  -1.457
  Start of MODEL   18
12297    HD1  PHE  41           HD1      PHE  41  10.457   9.738  -1.578
  Start of MODEL   18
12298    HD2  PHE  41           HD2      PHE  41   9.051   6.282   0.464
  Start of MODEL   18
12299    HE1  PHE  41           HE1      PHE  41  12.694   9.365  -0.669
  Start of MODEL   18
12300    HE2  PHE  41           HE2      PHE  41  11.297   5.900   1.377
  Start of MODEL   18
12301    HZ   PHE  41           HZ       PHE  41  13.113   7.432   0.832
  Start of MODEL   18
12302    H    PHE  41           HN       PHE  41   6.028   9.588  -1.768
  Start of MODEL   18
12303    HA   ASN  42           HA       ASN  42   7.929  11.896   3.081
  Start of MODEL   18
12304    HB3  ASN  42           HB2      ASN  42   9.929  13.139   2.114
  Start of MODEL   18
12305    HB2  ASN  42           HB3      ASN  42   9.933  11.969   0.802
  Start of MODEL   18
12306   HD21  ASN  42          HD21      ASN  42  12.014  12.485   2.676
  Start of MODEL   18
12307   HD22  ASN  42          HD22      ASN  42  12.290  11.021   3.548
  Start of MODEL   18
12308    H    ASN  42           HN       ASN  42   7.331   9.957   2.076
  Start of MODEL   18
12309    HA2  GLY  43           HA2      GLY  43   4.246  13.562   0.653
  Start of MODEL   18
12310    H    GLY  43           HN       GLY  43   5.790  11.917   1.243
  Start of MODEL   18
12311    HA3  GLY  43           HA1      GLY  43   5.511  14.773   0.800
  Start of MODEL   18
12312    HA   SER  44           HA       SER  44   6.397  13.990  -3.492
  Start of MODEL   18
12313    HB3  SER  44           HB2      SER  44   8.634  12.051  -2.861
  Start of MODEL   18
12314    HB2  SER  44           HB3      SER  44   8.764  13.763  -2.470
  Start of MODEL   18
12315    HG   SER  44           HG       SER  44   9.004  12.485  -4.862
  Start of MODEL   18
12316    H    SER  44           HN       SER  44   7.031  12.644  -0.968
  Start of MODEL   18
12317    HA   VAL  45           HA       VAL  45   4.186  10.741  -4.885
  Start of MODEL   18
12318    HB   VAL  45           HB       VAL  45   5.233  11.937  -7.467
  Start of MODEL   18
12319    H    VAL  45           HN       VAL  45   6.069  12.816  -5.338
  Start of MODEL   18
12320    HA   LEU  46           HA       LEU  46   7.042   7.609  -5.901
  Start of MODEL   18
12321    HB3  LEU  46           HB2      LEU  46   5.148   6.425  -3.854
  Start of MODEL   18
12322    HB2  LEU  46           HB3      LEU  46   6.676   7.194  -3.488
  Start of MODEL   18
12323    HG   LEU  46           HG       LEU  46   6.377   4.647  -5.081
  Start of MODEL   18
12324   HD12  LEU  46          HD11      LEU  46   8.795   4.443  -4.766
  Start of MODEL   18
12325   HD11  LEU  46          HD12      LEU  46   8.821   6.032  -3.997
  Start of MODEL   18
12326   HD13  LEU  46          HD13      LEU  46   8.366   5.880  -5.696
  Start of MODEL   18
12327   HD21  LEU  46          HD21      LEU  46   5.722   4.315  -2.756
  Start of MODEL   18
12328   HD23  LEU  46          HD22      LEU  46   7.225   5.064  -2.215
  Start of MODEL   18
12329   HD22  LEU  46          HD23      LEU  46   7.267   3.534  -3.088
  Start of MODEL   18
12330    H    LEU  46           HN       LEU  46   4.600   8.658  -4.713
  Start of MODEL   18
12331    HA   ASN  47           HA       ASN  47   4.134   5.784  -8.552
  Start of MODEL   18
12332    HB3  ASN  47           HB2      ASN  47   5.357   7.175 -10.178
  Start of MODEL   18
12333    HB2  ASN  47           HB3      ASN  47   5.033   5.592 -10.860
  Start of MODEL   18
12334   HD21  ASN  47          HD21      ASN  47   7.477   7.746  -9.725
  Start of MODEL   18
12335   HD22  ASN  47          HD22      ASN  47   8.834   6.859 -10.320
  Start of MODEL   18
12336    H    ASN  47           HN       ASN  47   6.815   6.523  -7.742
  Start of MODEL   18
12337    HA   GLU  48           HA       GLU  48   5.230   1.690  -7.732
  Start of MODEL   18
12338    HB3  GLU  48           HB2      GLU  48   3.434   0.164  -8.145
  Start of MODEL   18
12339    HB2  GLU  48           HB3      GLU  48   2.784   1.159  -9.431
  Start of MODEL   18
12340    HG2  GLU  48           HG2      GLU  48   1.650   1.073  -7.059
  Start of MODEL   18
12341    HG3  GLU  48           HG3      GLU  48   2.849   2.308  -6.691
  Start of MODEL   18
12342    H    GLU  48           HN       GLU  48   3.607   3.664  -8.977
  Start of MODEL   18
12343    HA   THR  49           HA       THR  49   7.066   0.787 -11.639
  Start of MODEL   18
12344    HB   THR  49           HB       THR  49   9.460   0.187 -11.349
  Start of MODEL   18
12345    HG1  THR  49           HG1      THR  49  10.173   0.707  -9.037
  Start of MODEL   18
12346   HG22  THR  49          HG21      THR  49  10.241   2.357 -10.495
  Start of MODEL   18
12347   HG21  THR  49          HG22      THR  49   8.643   2.657  -9.812
  Start of MODEL   18
12348   HG23  THR  49          HG23      THR  49   8.851   2.548 -11.559
  Start of MODEL   18
12349    H    THR  49           HN       THR  49   7.019   1.008  -8.751
  Start of MODEL   18
12350    HA   SER  50           HA       SER  50   6.894  -3.601 -11.414
  Start of MODEL   18
12351    HB3  SER  50           HB2      SER  50   8.365  -4.926 -12.833
  Start of MODEL   18
12352    HB2  SER  50           HB3      SER  50   9.552  -3.621 -12.861
  Start of MODEL   18
12353    HG   SER  50           HG       SER  50   6.885  -3.440 -13.797
  Start of MODEL   18
12354    H    SER  50           HN       SER  50   8.592  -1.432 -12.166
  Start of MODEL   18
12355    HA   PHE  51           HA       PHE  51  10.475  -4.409  -8.634
  Start of MODEL   18
12356    HB3  PHE  51           HB2      PHE  51  12.383  -3.069  -7.941
  Start of MODEL   18
12357    HB2  PHE  51           HB3      PHE  51  11.647  -1.620  -8.624
  Start of MODEL   18
12358    HD1  PHE  51           HD1      PHE  51  12.743  -5.047  -9.610
  Start of MODEL   18
12359    HD2  PHE  51           HD2      PHE  51  12.206  -0.988 -10.779
  Start of MODEL   18
12360    HE1  PHE  51           HE1      PHE  51  13.805  -5.531 -11.778
  Start of MODEL   18
12361    HE2  PHE  51           HE2      PHE  51  13.268  -1.465 -12.943
  Start of MODEL   18
12362    HZ   PHE  51           HZ       PHE  51  14.064  -3.736 -13.448
  Start of MODEL   18
12363    H    PHE  51           HN       PHE  51   9.511  -2.019  -9.997
  Start of MODEL   18
12364    HA   ILE  52           HA       ILE  52   8.517  -2.028  -5.253
  Start of MODEL   18
12365    HB   ILE  52           HB       ILE  52   8.168   0.703  -6.551
  Start of MODEL   18
12366   HD12  ILE  52          HD11      ILE  52  11.481   1.936  -5.239
  Start of MODEL   18
12367   HD11  ILE  52          HD12      ILE  52   9.935   2.078  -4.392
  Start of MODEL   18
12368   HD13  ILE  52          HD13      ILE  52  10.036   2.458  -6.108
  Start of MODEL   18
12369    H    ILE  52           HN       ILE  52   9.111  -1.199  -8.023
  Start of MODEL   18
12370    HA   PHE  53           HA       PHE  53   4.527  -1.811  -7.039
  Start of MODEL   18
12371    HB3  PHE  53           HB2      PHE  53   5.441  -3.499  -8.501
  Start of MODEL   18
12372    HB2  PHE  53           HB3      PHE  53   3.813  -3.961  -8.027
  Start of MODEL   18
12373    HD1  PHE  53           HD1      PHE  53   7.380  -4.742  -7.545
  Start of MODEL   18
12374    HD2  PHE  53           HD2      PHE  53   3.361  -5.965  -6.879
  Start of MODEL   18
12375    HE1  PHE  53           HE1      PHE  53   8.171  -6.978  -6.903
  Start of MODEL   18
12376    HE2  PHE  53           HE2      PHE  53   4.144  -8.200  -6.235
  Start of MODEL   18
12377    HZ   PHE  53           HZ       PHE  53   6.551  -8.709  -6.245
  Start of MODEL   18
12378    H    PHE  53           HN       PHE  53   6.540  -3.118  -5.400
  Start of MODEL   18
12379    HA   THR  54           HA       THR  54   2.030  -2.917  -3.754
  Start of MODEL   18
12380    HB   THR  54           HB       THR  54   0.024  -1.742  -5.704
  Start of MODEL   18
12381    HG1  THR  54           HG1      THR  54   2.258  -0.649  -4.877
  Start of MODEL   18
12382   HG21  THR  54          HG21      THR  54   0.246  -1.653  -2.692
  Start of MODEL   18
12383   HG23  THR  54          HG22      THR  54  -0.851  -2.684  -3.605
  Start of MODEL   18
12384   HG22  THR  54          HG23      THR  54  -1.041  -0.927  -3.658
  Start of MODEL   18
12385    H    THR  54           HN       THR  54   2.412  -2.259  -6.561
  Start of MODEL   18
12386    HA   GLU  55           HA       GLU  55   0.142  -6.458  -5.543
  Start of MODEL   18
12387    HB3  GLU  55           HB2      GLU  55   1.752  -7.515  -3.206
  Start of MODEL   18
12388    HB2  GLU  55           HB3      GLU  55   2.313  -7.420  -4.865
  Start of MODEL   18
12389    HG2  GLU  55           HG2      GLU  55   0.036  -9.116  -3.860
  Start of MODEL   18
12390    HG3  GLU  55           HG3      GLU  55   0.563  -8.998  -5.539
  Start of MODEL   18
12391    H    GLU  55           HN       GLU  55   1.597  -5.034  -3.455
  Start of MODEL   18
12392    HA   PHE  56           HA       PHE  56  -2.990  -6.501  -2.515
  Start of MODEL   18
12393    HB3  PHE  56           HB2      PHE  56  -5.178  -6.416  -3.686
  Start of MODEL   18
12394    HB2  PHE  56           HB3      PHE  56  -4.352  -6.651  -5.214
  Start of MODEL   18
12395    HD1  PHE  56           HD1      PHE  56  -5.192  -4.305  -2.600
  Start of MODEL   18
12396    HD2  PHE  56           HD2      PHE  56  -2.930  -4.858  -6.153
  Start of MODEL   18
12397    HE1  PHE  56           HE1      PHE  56  -4.939  -1.885  -2.819
  Start of MODEL   18
12398    HE2  PHE  56           HE2      PHE  56  -2.671  -2.433  -6.377
  Start of MODEL   18
12399    HZ   PHE  56           HZ       PHE  56  -3.675  -0.934  -4.709
  Start of MODEL   18
12400    H    PHE  56           HN       PHE  56  -1.908  -6.898  -5.197
  Start of MODEL   18
12401    HA   LEU  57           HA       LEU  57  -4.035 -10.695  -2.911
  Start of MODEL   18
12402    HB3  LEU  57           HB2      LEU  57  -2.521 -10.497  -0.937
  Start of MODEL   18
12403    HB2  LEU  57           HB3      LEU  57  -3.700 -11.774  -0.770
  Start of MODEL   18
12404    HG   LEU  57           HG       LEU  57  -4.220  -9.153   0.544
  Start of MODEL   18
12405   HD11  LEU  57          HD11      LEU  57  -4.933 -12.002   1.199
  Start of MODEL   18
12406   HD13  LEU  57          HD12      LEU  57  -6.002 -10.824   0.470
  Start of MODEL   18
12407   HD12  LEU  57          HD13      LEU  57  -5.436 -10.595   2.135
  Start of MODEL   18
12408   HD21  LEU  57          HD21      LEU  57  -1.947  -9.757   1.202
  Start of MODEL   18
12409   HD23  LEU  57          HD22      LEU  57  -2.501 -11.373   1.639
  Start of MODEL   18
12410   HD22  LEU  57          HD23      LEU  57  -3.071  -9.972   2.547
  Start of MODEL   18
12411    H    LEU  57           HN       LEU  57  -4.277  -8.113  -1.582
  Start of MODEL   18
12412    HA   GLU  58           HA       GLU  58  -8.259 -10.820  -2.690
  Start of MODEL   18
12413    HB3  GLU  58           HB2      GLU  58  -7.620 -13.724  -2.425
  Start of MODEL   18
12414    HB2  GLU  58           HB3      GLU  58  -7.552 -12.852  -3.958
  Start of MODEL   18
12415    HG2  GLU  58           HG2      GLU  58 -10.010 -13.141  -2.252
  Start of MODEL   18
12416    HG3  GLU  58           HG3      GLU  58  -9.919 -12.419  -3.859
  Start of MODEL   18
12417    H    GLU  58           HN       GLU  58  -5.754 -12.143  -2.426
  Start of MODEL   18
12418    HA   PRO  59           HA       PRO  59  -9.083 -11.263   1.736
  Start of MODEL   18
12419    HB3  PRO  59           HB2      PRO  59  -9.697  -9.007   1.559
  Start of MODEL   18
12420    HB2  PRO  59           HB3      PRO  59 -11.285  -9.746   1.781
  Start of MODEL   18
12421    HG2  PRO  59           HG2      PRO  59 -11.786  -9.643  -0.481
  Start of MODEL   18
12422    HG3  PRO  59           HG3      PRO  59 -10.794  -8.185  -0.315
  Start of MODEL   18
12423    HD2  PRO  59           HD2      PRO  59 -10.250 -10.238  -2.048
  Start of MODEL   18
12424    HD3  PRO  59           HD3      PRO  59  -9.015  -9.137  -1.404
  Start of MODEL   18
12425    HA   ALA  60           HA       ALA  60 -12.327 -14.185   1.496
  Start of MODEL   18
12426    HB1  ALA  60           HB1      ALA  60 -12.646 -13.167   4.332
  Start of MODEL   18
12427    HB3  ALA  60           HB2      ALA  60 -11.628 -14.516   3.831
  Start of MODEL   18
12428    HB2  ALA  60           HB3      ALA  60 -13.385 -14.636   3.696
  Start of MODEL   18
12429    H    ALA  60           HN       ALA  60 -11.030 -12.051   2.937
  Start of MODEL   18
12430    HA   ALA  61           HA       ALA  61 -15.514 -11.915  -0.119
  Start of MODEL   18
12431    HB1  ALA  61           HB1      ALA  61 -16.119 -14.196  -0.772
  Start of MODEL   18
12432    HB3  ALA  61           HB2      ALA  61 -17.512 -13.132  -0.606
  Start of MODEL   18
12433    HB2  ALA  61           HB3      ALA  61 -17.150 -14.309   0.656
  Start of MODEL   18
12434    H    ALA  61           HN       ALA  61 -14.485 -14.190   0.970
  Start of MODEL   18
12435    HA   ASN  62           HA       ASN  62 -18.292 -11.271   3.647
  Start of MODEL   18
12436    HB3  ASN  62           HB2      ASN  62 -16.290 -12.490   5.563
  Start of MODEL   18
12437    HB2  ASN  62           HB3      ASN  62 -17.826 -13.197   5.091
  Start of MODEL   18
12438   HD21  ASN  62          HD21      ASN  62 -19.297 -10.625   5.277
  Start of MODEL   18
12439   HD22  ASN  62          HD22      ASN  62 -19.431 -10.316   6.962
  Start of MODEL   18
12440    H    ASN  62           HN       ASN  62 -16.030 -12.948   3.132
  Start of MODEL   18
12441    HA   GLU  63           HA       GLU  63 -14.811  -8.443   5.245
  Start of MODEL   18
12442    HB3  GLU  63           HB2      GLU  63 -12.494  -8.241   4.498
  Start of MODEL   18
12443    HB2  GLU  63           HB3      GLU  63 -12.753  -9.513   3.320
  Start of MODEL   18
12444    HG2  GLU  63           HG2      GLU  63 -12.843  -9.893   6.283
  Start of MODEL   18
12445    HG3  GLU  63           HG3      GLU  63 -13.040 -11.142   5.052
  Start of MODEL   18
12446    H    GLU  63           HN       GLU  63 -14.847 -10.816   3.635
  Start of MODEL   18
12447    HA   THR  64           HA       THR  64 -14.862  -5.986   1.611
  Start of MODEL   18
12448    HB   THR  64           HB       THR  64 -15.800  -3.964   3.691
  Start of MODEL   18
12449    HG1  THR  64           HG1      THR  64 -16.882  -6.286   3.205
  Start of MODEL   18
12450   HG23  THR  64          HG21      THR  64 -15.347  -3.129   1.404
  Start of MODEL   18
12451   HG22  THR  64          HG22      THR  64 -17.067  -3.057   1.791
  Start of MODEL   18
12452   HG21  THR  64          HG23      THR  64 -16.449  -4.342   0.753
  Start of MODEL   18
12453    H    THR  64           HN       THR  64 -14.874  -6.376   4.517
  Start of MODEL   18
12454    HA   VAL  65           HA       VAL  65 -11.259  -3.956   3.613
  Start of MODEL   18
12455    HB   VAL  65           HB       VAL  65 -10.413  -6.517   4.966
  Start of MODEL   18
12456    H    VAL  65           HN       VAL  65 -12.772  -6.442   3.668
  Start of MODEL   18
12457    HA   ARG  66           HA       ARG  66  -9.089  -5.909   0.390
  Start of MODEL   18
12458    HB3  ARG  66           HB2      ARG  66  -8.788  -2.907   0.301
  Start of MODEL   18
12459    HB2  ARG  66           HB3      ARG  66 -10.020  -3.834  -0.505
  Start of MODEL   18
12460    HG2  ARG  66           HG2      ARG  66  -7.113  -3.908  -1.191
  Start of MODEL   18
12461    HG3  ARG  66           HG3      ARG  66  -8.411  -4.797  -2.010
  Start of MODEL   18
12462    HD2  ARG  66           HD2      ARG  66  -9.546  -2.671  -2.500
  Start of MODEL   18
12463    HD3  ARG  66           HD3      ARG  66  -8.231  -1.798  -1.726
  Start of MODEL   18
12464    HE   ARG  66           HE       ARG  66  -7.150  -3.392  -3.685
  Start of MODEL   18
12465   HH11  ARG  66          HH11      ARG  66  -9.182  -0.513  -3.408
  Start of MODEL   18
12466   HH12  ARG  66          HH12      ARG  66  -8.878   0.009  -4.997
  Start of MODEL   18
12467   HH21  ARG  66          HH21      ARG  66  -6.768  -2.644  -5.923
  Start of MODEL   18
12468   HH22  ARG  66          HH22      ARG  66  -7.479  -1.189  -6.414
  Start of MODEL   18
12469    H    ARG  66           HN       ARG  66  -9.808  -3.719   2.169
  Start of MODEL   18
12470    HA   HIS  67           HA       HIS  67  -5.336  -5.580   2.687
  Start of MODEL   18
12471    HB3  HIS  67           HB2      HIS  67  -4.549  -7.817   3.312
  Start of MODEL   18
12472    HB2  HIS  67           HB3      HIS  67  -5.671  -8.543   2.172
  Start of MODEL   18
12473    HD1  HIS  67           HD1      HIS  67  -5.580  -6.976   5.586
  Start of MODEL   18
12474    HD2  HIS  67           HD2      HIS  67  -8.282  -8.843   3.041
  Start of MODEL   18
12475    HE1  HIS  67           HE1      HIS  67  -7.569  -7.514   6.996
  Start of MODEL   18
12476    HE2  HIS  67           HE2      HIS  67  -9.034  -8.921   5.500
  Start of MODEL   18
12477    H    HIS  67           HN       HIS  67  -7.289  -6.951   0.966
  Start of MODEL   18
12478    HA2  GLY  68           HA2      GLY  68  -2.146  -7.262  -0.040
  Start of MODEL   18
12479    H    GLY  68           HN       GLY  68  -3.035  -5.889   2.223
  Start of MODEL   18
12480    HA3  GLY  68           HA1      GLY  68  -2.392  -5.569  -0.446
  Start of MODEL   18
12481    HA   CYS  69           HA       CYS  69   1.441  -4.960   1.461
  Start of MODEL   18
12482    HB3  CYS  69           HB2      CYS  69   2.119  -7.542   0.056
  Start of MODEL   18
12483    HB2  CYS  69           HB3      CYS  69   1.938  -7.257   1.783
  Start of MODEL   18
12484    H    CYS  69           HN       CYS  69  -0.014  -6.031  -0.815
  Start of MODEL   18
12485    HA   LEU  70           HA       LEU  70   3.429  -3.106  -2.011
  Start of MODEL   18
12486    HB3  LEU  70           HB2      LEU  70   4.414  -1.477   0.356
  Start of MODEL   18
12487    HB2  LEU  70           HB3      LEU  70   2.994  -1.066  -0.584
  Start of MODEL   18
12488    HG   LEU  70           HG       LEU  70   5.778  -1.239  -1.738
  Start of MODEL   18
12489   HD12  LEU  70          HD11      LEU  70   4.829   0.082  -3.560
  Start of MODEL   18
12490   HD11  LEU  70          HD12      LEU  70   3.242  -0.064  -2.810
  Start of MODEL   18
12491   HD13  LEU  70          HD13      LEU  70   4.077  -1.507  -3.401
  Start of MODEL   18
12492   HD23  LEU  70          HD21      LEU  70   4.282   1.197  -0.798
  Start of MODEL   18
12493   HD22  LEU  70          HD22      LEU  70   5.782   1.201  -1.728
  Start of MODEL   18
12494   HD21  LEU  70          HD23      LEU  70   5.765   0.534  -0.098
  Start of MODEL   18
12495    H    LEU  70           HN       LEU  70   2.829  -3.418   0.831
  Start of MODEL   18
12496    HA   ARG  71           HA       ARG  71   7.090  -5.057  -0.802
  Start of MODEL   18
12497    HB3  ARG  71           HB2      ARG  71   5.747  -7.010  -0.959
  Start of MODEL   18
12498    HB2  ARG  71           HB3      ARG  71   7.222  -7.316  -1.861
  Start of MODEL   18
12499    HG2  ARG  71           HG2      ARG  71   4.638  -6.473  -3.136
  Start of MODEL   18
12500    HG3  ARG  71           HG3      ARG  71   6.100  -7.040  -3.942
  Start of MODEL   18
12501    HD2  ARG  71           HD2      ARG  71   4.352  -8.654  -2.088
  Start of MODEL   18
12502    HD3  ARG  71           HD3      ARG  71   4.401  -8.789  -3.841
  Start of MODEL   18
12503    HE   ARG  71           HE       ARG  71   6.974  -9.179  -2.779
  Start of MODEL   18
12504   HH11  ARG  71          HH11      ARG  71   3.838 -10.812  -3.085
  Start of MODEL   18
12505   HH12  ARG  71          HH12      ARG  71   4.483 -12.369  -2.958
  Start of MODEL   18
12506   HH21  ARG  71          HH21      ARG  71   7.855 -11.387  -2.577
  Start of MODEL   18
12507   HH22  ARG  71          HH22      ARG  71   6.768 -12.695  -2.653
  Start of MODEL   18
12508    H    ARG  71           HN       ARG  71   4.971  -4.422  -2.699
  Start of MODEL   18
12509    HA   LEU  72           HA       LEU  72   9.511  -3.853  -4.082
  Start of MODEL   18
12510    HB3  LEU  72           HB2      LEU  72  11.617  -2.878  -3.151
  Start of MODEL   18
12511    HB2  LEU  72           HB3      LEU  72  11.114  -3.412  -1.561
  Start of MODEL   18
12512    HG   LEU  72           HG       LEU  72   9.421  -1.574  -3.201
  Start of MODEL   18
12513   HD13  LEU  72          HD11      LEU  72   8.295  -2.553  -1.313
  Start of MODEL   18
12514   HD12  LEU  72          HD12      LEU  72   8.550  -0.828  -1.030
  Start of MODEL   18
12515   HD11  LEU  72          HD13      LEU  72   9.578  -2.014  -0.229
  Start of MODEL   18
12516   HD23  LEU  72          HD21      LEU  72  11.563  -0.702  -1.273
  Start of MODEL   18
12517   HD22  LEU  72          HD22      LEU  72  10.387   0.328  -2.128
  Start of MODEL   18
12518   HD21  LEU  72          HD23      LEU  72  11.615  -0.546  -3.033
  Start of MODEL   18
12519    H    LEU  72           HN       LEU  72   9.029  -4.809  -1.374
  Start of MODEL   18
12520    HA   ASN  73           HA       ASN  73  11.589  -7.632  -4.734
  Start of MODEL   18
12521    HB3  ASN  73           HB2      ASN  73  11.533  -6.200  -7.413
  Start of MODEL   18
12522    HB2  ASN  73           HB3      ASN  73  10.297  -7.316  -6.851
  Start of MODEL   18
12523   HD21  ASN  73          HD21      ASN  73  11.976  -7.522  -9.238
  Start of MODEL   18
12524   HD22  ASN  73          HD22      ASN  73  12.838  -8.991  -9.073
  Start of MODEL   18
12525    H    ASN  73           HN       ASN  73  10.270  -5.185  -5.390
  Start of MODEL   18
12526    HA   GLN  74           HA       GLN  74  15.376  -5.258  -4.939
  Start of MODEL   18
12527    HB3  GLN  74           HB2      GLN  74  16.265  -3.462  -6.404
  Start of MODEL   18
12528    HB2  GLN  74           HB3      GLN  74  14.642  -3.146  -6.987
  Start of MODEL   18
12529    HG2  GLN  74           HG2      GLN  74  16.150  -5.713  -7.392
  Start of MODEL   18
12530    HG3  GLN  74           HG3      GLN  74  14.541  -5.335  -8.005
  Start of MODEL   18
12531   HE21  GLN  74          HE21      GLN  74  16.945  -6.021  -9.456
  Start of MODEL   18
12532   HE22  GLN  74          HE22      GLN  74  17.234  -4.733 -10.568
  Start of MODEL   18
12533    H    GLN  74           HN       GLN  74  12.705  -4.458  -5.829
  Start of MODEL   18
12534    HA   PRO  75           HA       PRO  75  14.096  -2.036  -1.962
  Start of MODEL   18
12535    HB3  PRO  75           HB2      PRO  75  14.553  -3.035   0.047
  Start of MODEL   18
12536    HB2  PRO  75           HB3      PRO  75  16.236  -3.328  -0.398
  Start of MODEL   18
12537    HG2  PRO  75           HG2      PRO  75  15.394  -5.516  -0.468
  Start of MODEL   18
12538    HG3  PRO  75           HG3      PRO  75  13.801  -4.963  -1.012
  Start of MODEL   18
12539    HD2  PRO  75           HD2      PRO  75  16.355  -5.157  -2.569
  Start of MODEL   18
12540    HD3  PRO  75           HD3      PRO  75  14.725  -5.729  -3.000
  Start of MODEL   18
12541    HA   THR  76           HA       THR  76  17.935   0.041  -2.542
  Start of MODEL   18
12542    HB   THR  76           HB       THR  76  17.221   2.125  -3.835
  Start of MODEL   18
12543    HG1  THR  76           HG1      THR  76  14.820   1.128  -4.481
  Start of MODEL   18
12544   HG23  THR  76          HG21      THR  76  17.993   0.076  -4.952
  Start of MODEL   18
12545   HG22  THR  76          HG22      THR  76  16.667   0.816  -5.851
  Start of MODEL   18
12546   HG21  THR  76          HG23      THR  76  16.368  -0.601  -4.843
  Start of MODEL   18
12547    H    THR  76           HN       THR  76  15.108  -0.080  -1.837
  Start of MODEL   18
12548    HA   HIS  77           HA       HIS  77  18.065   2.877   0.747
  Start of MODEL   18
12549    HB3  HIS  77           HB2      HIS  77  20.456   2.413   0.673
  Start of MODEL   18
12550    HB2  HIS  77           HB3      HIS  77  20.193   4.112   0.952
  Start of MODEL   18
12551    HD1  HIS  77           HD1      HIS  77  21.453   1.805  -1.749
  Start of MODEL   18
12552    HD2  HIS  77           HD2      HIS  77  21.318   5.855  -0.857
  Start of MODEL   18
12553    HE1  HIS  77           HE1      HIS  77  23.087   2.885  -3.289
  Start of MODEL   18
12554    HE2  HIS  77           HE2      HIS  77  23.224   5.234  -2.491
  Start of MODEL   18
12555    H    HIS  77           HN       HIS  77  19.030   1.762  -1.692
  Start of MODEL   18
12556    HA   VAL  78           HA       VAL  78  17.144   6.583  -1.667
  Start of MODEL   18
12557    HB   VAL  78           HB       VAL  78  16.111   6.862  -3.868
  Start of MODEL   18
12558    H    VAL  78           HN       VAL  78  17.470   3.792  -2.301
  Start of MODEL   18
12559    HA   ASN  79           HA       ASN  79  12.983   5.285  -0.755
  Start of MODEL   18
12560    HB3  ASN  79           HB2      ASN  79  11.822   2.972  -0.656
  Start of MODEL   18
12561    HB2  ASN  79           HB3      ASN  79  13.330   2.379  -1.343
  Start of MODEL   18
12562   HD21  ASN  79          HD21      ASN  79  13.866   2.931  -3.367
  Start of MODEL   18
12563   HD22  ASN  79          HD22      ASN  79  12.744   3.629  -4.494
  Start of MODEL   18
12564    H    ASN  79           HN       ASN  79  15.436   3.757  -0.871
  Start of MODEL   18
12565    HA   ASN  80           HA       ASN  80  13.714   3.708   3.419
  Start of MODEL   18
12566    HB3  ASN  80           HB2      ASN  80  16.119   3.300   3.308
  Start of MODEL   18
12567    HB2  ASN  80           HB3      ASN  80  15.761   4.189   4.775
  Start of MODEL   18
12568   HD21  ASN  80          HD21      ASN  80  17.991   4.728   4.837
  Start of MODEL   18
12569   HD22  ASN  80          HD22      ASN  80  18.618   5.985   3.830
  Start of MODEL   18
12570    H    ASN  80           HN       ASN  80  15.069   5.134   1.274
  Start of MODEL   18
12571    HA2  GLY  81           HA2      GLY  81  12.334   7.502   4.955
  Start of MODEL   18
12572    H    GLY  81           HN       GLY  81  11.933   5.149   3.303
  Start of MODEL   18
12573    HA3  GLY  81           HA1      GLY  81  11.705   7.795   3.337
  Start of MODEL   18
12574    HA   ASN  82           HA       ASN  82   8.194   6.914   5.831
  Start of MODEL   18
12575    HB3  ASN  82           HB2      ASN  82   7.581   9.758   5.010
  Start of MODEL   18
12576    HB2  ASN  82           HB3      ASN  82   8.510   9.323   6.444
  Start of MODEL   18
12577   HD21  ASN  82          HD21      ASN  82   7.489   8.665   8.221
  Start of MODEL   18
12578   HD22  ASN  82          HD22      ASN  82   5.779   8.572   8.415
  Start of MODEL   18
12579    H    ASN  82           HN       ASN  82   9.778   8.631   4.099
  Start of MODEL   18
12580    HA   TYR  83           HA       TYR  83   5.678   6.426   2.241
  Start of MODEL   18
12581    HB3  TYR  83           HB2      TYR  83   4.662   4.114   2.400
  Start of MODEL   18
12582    HB2  TYR  83           HB3      TYR  83   5.518   3.927   3.924
  Start of MODEL   18
12583    HD1  TYR  83           HD1      TYR  83   5.682   3.422   0.461
  Start of MODEL   18
12584    HD2  TYR  83           HD2      TYR  83   8.118   4.305   3.828
  Start of MODEL   18
12585    HE1  TYR  83           HE1      TYR  83   7.643   2.609  -0.754
  Start of MODEL   18
12586    HE2  TYR  83           HE2      TYR  83  10.094   3.495   2.610
  Start of MODEL   18
12587    HH   TYR  83           HH       TYR  83  10.690   2.182   0.806
  Start of MODEL   18
12588    H    TYR  83           HN       TYR  83   6.591   5.780   4.932
  Start of MODEL   18
12589    HA   THR  84           HA       THR  84   1.924   7.159   4.314
  Start of MODEL   18
12590    HB   THR  84           HB       THR  84   2.204   9.515   2.419
  Start of MODEL   18
12591    HG1  THR  84           HG1      THR  84   3.549   8.860   4.722
  Start of MODEL   18
12592   HG21  THR  84          HG21      THR  84   0.610   9.168   4.974
  Start of MODEL   18
12593   HG23  THR  84          HG22      THR  84  -0.066   9.196   3.347
  Start of MODEL   18
12594   HG22  THR  84          HG23      THR  84   0.693  10.643   4.008
  Start of MODEL   18
12595    H    THR  84           HN       THR  84   3.890   7.556   2.186
  Start of MODEL   18
12596    HA   LEU  85           HA       LEU  85  -0.287   5.625   0.890
  Start of MODEL   18
12597    HB3  LEU  85           HB2      LEU  85  -1.365   4.184   3.322
  Start of MODEL   18
12598    HB2  LEU  85           HB3      LEU  85  -0.042   3.645   2.307
  Start of MODEL   18
12599    HG   LEU  85           HG       LEU  85  -2.933   3.868   1.466
  Start of MODEL   18
12600   HD13  LEU  85          HD11      LEU  85  -1.485   4.331  -0.386
  Start of MODEL   18
12601   HD12  LEU  85          HD12      LEU  85  -2.120   2.671  -0.528
  Start of MODEL   18
12602   HD11  LEU  85          HD13      LEU  85  -0.474   2.956   0.062
  Start of MODEL   18
12603   HD22  LEU  85          HD21      LEU  85  -2.903   1.483   1.400
  Start of MODEL   18
12604   HD21  LEU  85          HD22      LEU  85  -2.420   2.033   3.014
  Start of MODEL   18
12605   HD23  LEU  85          HD23      LEU  85  -1.204   1.446   1.876
  Start of MODEL   18
12606    H    LEU  85           HN       LEU  85   0.168   6.125   3.730
  Start of MODEL   18
12607    HA   LEU  86           HA       LEU  86  -3.949   7.937   1.466
  Start of MODEL   18
12608    HB3  LEU  86           HB2      LEU  86  -4.272   9.338  -0.586
  Start of MODEL   18
12609    HB2  LEU  86           HB3      LEU  86  -2.855   8.603  -1.280
  Start of MODEL   18
12610    HG   LEU  86           HG       LEU  86  -2.479  10.891  -0.472
  Start of MODEL   18
12611   HD11  LEU  86          HD11      LEU  86  -2.915   9.745   2.244
  Start of MODEL   18
12612   HD13  LEU  86          HD12      LEU  86  -3.953  10.914   1.419
  Start of MODEL   18
12613   HD12  LEU  86          HD13      LEU  86  -2.313  11.366   1.895
  Start of MODEL   18
12614   HD23  LEU  86          HD21      LEU  86  -0.880   8.801   0.991
  Start of MODEL   18
12615   HD22  LEU  86          HD22      LEU  86  -0.379  10.469   0.719
  Start of MODEL   18
12616   HD21  LEU  86          HD23      LEU  86  -0.590   9.371  -0.650
  Start of MODEL   18
12617    H    LEU  86           HN       LEU  86  -1.746   6.754  -0.059
  Start of MODEL   18
12618    HA   ALA  87           HA       ALA  87  -6.430   5.647  -1.345
  Start of MODEL   18
12619    HB3  ALA  87           HB1      ALA  87  -6.378   4.086   0.563
  Start of MODEL   18
12620    HB2  ALA  87           HB2      ALA  87  -8.012   4.236  -0.073
  Start of MODEL   18
12621    HB1  ALA  87           HB3      ALA  87  -7.561   5.080   1.405
  Start of MODEL   18
12622    H    ALA  87           HN       ALA  87  -5.884   7.115   1.157
  Start of MODEL   18
12623    HA   ALA  88           HA       ALA  88  -9.700   8.490  -1.005
  Start of MODEL   18
12624    HB2  ALA  88           HB1      ALA  88  -9.646  10.012  -2.894
  Start of MODEL   18
12625    HB1  ALA  88           HB2      ALA  88  -8.563   8.926  -3.762
  Start of MODEL   18
12626    HB3  ALA  88           HB3      ALA  88  -8.015   9.722  -2.287
  Start of MODEL   18
12627    H    ALA  88           HN       ALA  88  -7.914   6.687  -2.484
  Start of MODEL   18
12628    HA   ASN  89           HA       ASN  89 -12.828   7.131  -3.653
  Start of MODEL   18
12629    HB3  ASN  89           HB2      ASN  89 -12.629   5.046  -2.273
  Start of MODEL   18
12630    HB2  ASN  89           HB3      ASN  89 -14.295   5.415  -2.592
  Start of MODEL   18
12631   HD21  ASN  89          HD21      ASN  89 -13.552   3.670  -0.694
  Start of MODEL   18
12632   HD22  ASN  89          HD22      ASN  89 -13.927   4.267   0.882
  Start of MODEL   18
12633    H    ASN  89           HN       ASN  89 -11.732   8.061  -1.146
  Start of MODEL   18
12634    HA   PRO  90           HA       PRO  90 -16.113  10.101  -3.190
  Start of MODEL   18
12635    HB3  PRO  90           HB2      PRO  90 -18.259   9.271  -3.429
  Start of MODEL   18
12636    HB2  PRO  90           HB3      PRO  90 -17.968   7.908  -2.338
  Start of MODEL   18
12637    HG2  PRO  90           HG2      PRO  90 -17.751   6.910  -4.462
  Start of MODEL   18
12638    HG3  PRO  90           HG3      PRO  90 -16.962   8.348  -5.138
  Start of MODEL   18
12639    HD2  PRO  90           HD2      PRO  90 -15.857   6.225  -3.393
  Start of MODEL   18
12640    HD3  PRO  90           HD3      PRO  90 -15.055   7.131  -4.697
  Start of MODEL   18
12641    HA   CYS  91           HA       CYS  91 -17.467   9.386   1.337
  Start of MODEL   18
12642    HB3  CYS  91           HB2      CYS  91 -15.546   7.095   1.837
  Start of MODEL   18
12643    HB2  CYS  91           HB3      CYS  91 -17.302   7.003   1.757
  Start of MODEL   18
12644    H    CYS  91           HN       CYS  91 -16.093   7.746  -0.514
  Start of MODEL   18
12645    HA2  GLY  92           HA2      GLY  92 -13.273  11.468   1.377
  Start of MODEL   18
12646    H    GLY  92           HN       GLY  92 -13.954   8.833   0.855
  Start of MODEL   18
12647    HA3  GLY  92           HA1      GLY  92 -13.169  10.580   2.890
  Start of MODEL   18
12648    HA   GLN  93           HA       GLN  93  -9.414   9.468   0.874
  Start of MODEL   18
12649    HB3  GLN  93           HB2      GLN  93  -8.645  12.286   1.685
  Start of MODEL   18
12650    HB2  GLN  93           HB3      GLN  93  -9.088  11.779   0.063
  Start of MODEL   18
12651    HG2  GLN  93           HG2      GLN  93  -6.698  10.791   1.607
  Start of MODEL   18
12652    HG3  GLN  93           HG3      GLN  93  -7.122  10.340  -0.043
  Start of MODEL   18
12653   HE21  GLN  93          HE21      GLN  93  -5.884  12.841   2.022
  Start of MODEL   18
12654   HE22  GLN  93          HE22      GLN  93  -5.287  13.850   0.771
  Start of MODEL   18
12655    H    GLN  93           HN       GLN  93 -10.939  11.498   2.318
  Start of MODEL   18
12656    HA   ALA  94           HA       ALA  94  -8.059   8.653   4.945
  Start of MODEL   18
12657    HB1  ALA  94           HB1      ALA  94  -7.910   6.114   3.349
  Start of MODEL   18
12658    HB3  ALA  94           HB2      ALA  94  -9.258   6.612   4.376
  Start of MODEL   18
12659    HB2  ALA  94           HB3      ALA  94  -7.685   6.216   5.088
  Start of MODEL   18
12660    H    ALA  94           HN       ALA  94  -8.374   8.122   2.079
  Start of MODEL   18
12661    HA   SER  95           HA       SER  95  -3.787   7.848   4.122
  Start of MODEL   18
12662    HB3  SER  95           HB2      SER  95  -3.981  10.189   3.877
  Start of MODEL   18
12663    HB2  SER  95           HB3      SER  95  -2.695   9.960   5.063
  Start of MODEL   18
12664    HG   SER  95           HG       SER  95  -5.420  10.503   5.624
  Start of MODEL   18
12665    H    SER  95           HN       SER  95  -6.001   8.290   5.903
  Start of MODEL   18
12666    HA   ALA  96           HA       ALA  96  -1.830   7.041   8.019
  Start of MODEL   18
12667    HB3  ALA  96           HB1      ALA  96  -3.175   5.011   7.636
  Start of MODEL   18
12668    HB2  ALA  96           HB2      ALA  96  -1.543   4.584   8.150
  Start of MODEL   18
12669    HB1  ALA  96           HB3      ALA  96  -1.996   4.453   6.448
  Start of MODEL   18
12670    H    ALA  96           HN       ALA  96  -2.079   6.965   5.135
  Start of MODEL   18
12671    HA   SER  97           HA       SER  97   2.186   6.416   6.337
  Start of MODEL   18
12672    HB3  SER  97           HB2      SER  97   2.220   8.655   7.072
  Start of MODEL   18
12673    HB2  SER  97           HB3      SER  97   3.665   7.926   7.769
  Start of MODEL   18
12674    HG   SER  97           HG       SER  97   2.904   8.541   9.622
  Start of MODEL   18
12675    H    SER  97           HN       SER  97   0.396   6.376   8.629
  Start of MODEL   18
12676    HA   ILE  98           HA       ILE  98   4.755   4.011   9.040
  Start of MODEL   18
12677    HB   ILE  98           HB       ILE  98   3.235   2.448   7.806
  Start of MODEL   18
12678   HD11  ILE  98          HD11      ILE  98   7.065   1.888   7.599
  Start of MODEL   18
12679   HD13  ILE  98          HD12      ILE  98   6.286   0.804   6.445
  Start of MODEL   18
12680   HD12  ILE  98          HD13      ILE  98   6.866   0.177   7.985
  Start of MODEL   18
12681    H    ILE  98           HN       ILE  98   4.092   5.335   6.551
  Start of MODEL   18
12682    HA   MET  99           HA       MET  99   8.437   4.881   6.875
  Start of MODEL   18
12683    HB3  MET  99           HB2      MET  99   9.337   5.005   9.754
  Start of MODEL   18
12684    HB2  MET  99           HB3      MET  99   8.518   6.316   8.908
  Start of MODEL   18
12685    HG2  MET  99           HG2      MET  99  11.168   5.098   8.204
  Start of MODEL   18
12686    HG3  MET  99           HG3      MET  99  10.341   6.334   7.259
  Start of MODEL   18
12687    HE2  MET  99           HE1      MET  99  13.168   8.472   8.572
  Start of MODEL   18
12688    HE1  MET  99           HE2      MET  99  12.140   7.971   7.218
  Start of MODEL   18
12689    HE3  MET  99           HE3      MET  99  13.222   6.803   7.976
  Start of MODEL   18
12690    H    MET  99           HN       MET  99   7.011   3.813   9.199
  Start of MODEL   18
12691    HA   ALA 100           HA       ALA 100  10.674   1.199   7.292
  Start of MODEL   18
12692    HB3  ALA 100           HB1      ALA 100   9.082   0.675   5.506
  Start of MODEL   18
12693    HB2  ALA 100           HB2      ALA 100  10.690   0.066   5.117
  Start of MODEL   18
12694    HB1  ALA 100           HB3      ALA 100  10.091   1.537   4.348
  Start of MODEL   18
12695    H    ALA 100           HN       ALA 100   9.795   3.612   5.886
  Start of MODEL   18
12696    HA   ALA 101           HA       ALA 101  14.467   2.991   6.125
  Start of MODEL   18
12697    HB1  ALA 101           HB1      ALA 101  14.898   1.788   8.851
  Start of MODEL   18
12698    HB3  ALA 101           HB2      ALA 101  14.386   3.447   8.527
  Start of MODEL   18
12699    HB2  ALA 101           HB3      ALA 101  15.990   2.904   8.033
  Start of MODEL   18
12700    H    ALA 101           HN       ALA 101  12.739   1.271   7.724
  Start of MODEL   18
12701    HA   PHE 102           HA       PHE 102  17.002  -0.367   5.207
  Start of MODEL   18
12702    HB3  PHE 102           HB2      PHE 102  15.162  -1.655   4.463
  Start of MODEL   18
12703    HB2  PHE 102           HB3      PHE 102  16.241  -1.505   3.064
  Start of MODEL   18
12704    HD1  PHE 102           HD1      PHE 102  13.019  -0.346   4.371
  Start of MODEL   18
12705    HD2  PHE 102           HD2      PHE 102  15.671  -0.558   1.055
  Start of MODEL   18
12706    HE1  PHE 102           HE1      PHE 102  11.234   0.468   2.892
  Start of MODEL   18
12707    HE2  PHE 102           HE2      PHE 102  13.882   0.255  -0.423
  Start of MODEL   18
12708    HZ   PHE 102           HZ       PHE 102  11.621   0.607   0.470
  Start of MODEL   18
12709    H    PHE 102           HN       PHE 102  15.495   1.945   4.551
  Start of MODEL   18
12710    HA   MET 103           HA       MET 103  19.339   1.558   2.131
  Start of MODEL   18
12711    HB3  MET 103           HB2      MET 103  21.729   1.559   2.827
  Start of MODEL   18
12712    HB2  MET 103           HB3      MET 103  21.306   0.603   4.230
  Start of MODEL   18
12713    HG2  MET 103           HG2      MET 103  20.306   3.389   3.710
  Start of MODEL   18
12714    HG3  MET 103           HG3      MET 103  20.023   2.414   5.152
  Start of MODEL   18
12715    HE1  MET 103           HE1      MET 103  20.934   4.329   6.738
  Start of MODEL   18
12716    HE3  MET 103           HE2      MET 103  21.176   5.350   5.322
  Start of MODEL   18
12717    HE2  MET 103           HE3      MET 103  22.477   5.152   6.496
  Start of MODEL   18
12718    H    MET 103           HN       MET 103  18.884  -0.050   4.528
  Start of MODEL   18
12719    HA   ASP 104           HA       ASP 104  20.655  -2.293   0.545
  Start of MODEL   18
12720    HB3  ASP 104           HB2      ASP 104  19.011  -1.462  -1.246
  Start of MODEL   18
12721    HB2  ASP 104           HB3      ASP 104  20.293  -2.532  -1.789
  Start of MODEL   18
12722    H    ASP 104           HN       ASP 104  20.059   0.550   0.292
  Start of MODEL   18
12723    HA   ASN 105           HA       ASN 105  24.677  -1.120  -0.577
  Start of MODEL   18
12724    HB3  ASN 105           HB2      ASN 105  26.209  -2.686   0.576
  Start of MODEL   18
12725    HB2  ASN 105           HB3      ASN 105  24.881  -3.805   0.840
  Start of MODEL   18
12726   HD21  ASN 105          HD21      ASN 105  23.452  -3.447   2.474
  Start of MODEL   18
12727   HD22  ASN 105          HD22      ASN 105  23.659  -2.239   3.676
  Start of MODEL   18
12728    H    ASN 105           HN       ASN 105  22.554  -3.092  -0.118
  Start of MODEL   18
12729    HA   PRO 106           HA       PRO 106  24.243  -3.617  -4.309
  Start of MODEL   18
12730    HB3  PRO 106           HB2      PRO 106  24.034  -1.781  -5.590
  Start of MODEL   18
12731    HB2  PRO 106           HB3      PRO 106  25.734  -2.139  -5.896
  Start of MODEL   18
12732    HG2  PRO 106           HG2      PRO 106  26.470  -0.470  -4.421
  Start of MODEL   18
12733    HG3  PRO 106           HG3      PRO 106  24.914   0.269  -4.841
  Start of MODEL   18
12734    HD2  PRO 106           HD2      PRO 106  25.637  -0.359  -2.294
  Start of MODEL   18
12735    HD3  PRO 106           HD3      PRO 106  23.947  -0.350  -2.845
  Start of MODEL   18
12736    HA   PHE 107           HA       PHE 107  28.238  -5.208  -4.767
  Start of MODEL   18
12737    HB3  PHE 107           HB2      PHE 107  27.612  -7.429  -5.907
  Start of MODEL   18
12738    HB2  PHE 107           HB3      PHE 107  26.040  -6.604  -6.102
  Start of MODEL   18
12739    HD1  PHE 107           HD1      PHE 107  24.404  -6.672  -4.496
  Start of MODEL   18
12740    HD2  PHE 107           HD2      PHE 107  28.385  -7.752  -3.448
  Start of MODEL   18
12741    HE1  PHE 107           HE1      PHE 107  23.622  -7.400  -2.277
  Start of MODEL   18
12742    HE2  PHE 107           HE2      PHE 107  27.610  -8.483  -1.232
  Start of MODEL   18
12743    HZ   PHE 107           HZ       PHE 107  25.233  -8.320  -0.646
  Start of MODEL   18
12744    H    PHE 107           HN       PHE 107  25.751  -4.320  -5.992
  Start of MODEL   19
12745    H1   ASP   1           H        ASP   1 -25.093  -2.716  -8.472
  Start of MODEL   19
12746    H2   ASP   1           H2       ASP   1 -24.942  -1.432  -7.399
  Start of MODEL   19
12747    H3   ASP   1           H3       ASP   1 -25.367  -2.949  -6.838
  Start of MODEL   19
12748    HA   ASP   1           HA       ASP   1 -23.287  -3.883  -7.372
  Start of MODEL   19
12749    HB3  ASP   1           HB2      ASP   1 -21.400  -2.408  -8.068
  Start of MODEL   19
12750    HB2  ASP   1           HB3      ASP   1 -22.550  -1.093  -8.289
  Start of MODEL   19
12751    HA   ASP   2           HA       ASP   2 -22.018  -1.488  -3.767
  Start of MODEL   19
12752    HB3  ASP   2           HB2      ASP   2 -21.435   0.893  -3.277
  Start of MODEL   19
12753    HB2  ASP   2           HB3      ASP   2 -22.137   1.369  -4.816
  Start of MODEL   19
12754    H    ASP   2           HN       ASP   2 -23.108  -0.459  -6.281
  Start of MODEL   19
12755    HA   ASP   3           HA       ASP   3 -26.111  -0.189  -2.758
  Start of MODEL   19
12756    HB3  ASP   3           HB2      ASP   3 -27.934  -1.964  -3.013
  Start of MODEL   19
12757    HB2  ASP   3           HB3      ASP   3 -26.719  -2.913  -3.858
  Start of MODEL   19
12758    H    ASP   3           HN       ASP   3 -24.293  -2.309  -3.585
  Start of MODEL   19
12759    HA   ASP   4           HA       ASP   4 -25.787  -2.395   0.950
  Start of MODEL   19
12760    HB3  ASP   4           HB2      ASP   4 -23.531  -2.045   2.364
  Start of MODEL   19
12761    HB2  ASP   4           HB3      ASP   4 -22.813  -2.098   0.759
  Start of MODEL   19
12762    H    ASP   4           HN       ASP   4 -24.065  -1.311  -1.096
  Start of MODEL   19
12763    HA   ASP   5           HA       ASP   5 -26.867   1.546   1.904
  Start of MODEL   19
12764    HB3  ASP   5           HB2      ASP   5 -28.517   1.597   3.804
  Start of MODEL   19
12765    HB2  ASP   5           HB3      ASP   5 -28.266  -0.136   3.987
  Start of MODEL   19
12766    H    ASP   5           HN       ASP   5 -26.805  -1.250   2.297
  Start of MODEL   19
12767    HA   VAL   6           HA       VAL   6 -24.178   1.952   5.405
  Start of MODEL   19
12768    HB   VAL   6           HB       VAL   6 -22.519   0.232   6.442
  Start of MODEL   19
12769    H    VAL   6           HN       VAL   6 -25.011  -0.365   3.892
  Start of MODEL   19
12770    HA   SER   7           HA       SER   7 -21.413   2.105   2.071
  Start of MODEL   19
12771    HB3  SER   7           HB2      SER   7 -22.673   3.954   1.378
  Start of MODEL   19
12772    HB2  SER   7           HB3      SER   7 -21.043   4.606   1.588
  Start of MODEL   19
12773    HG   SER   7           HG       SER   7 -23.133   5.614   2.560
  Start of MODEL   19
12774    H    SER   7           HN       SER   7 -23.094   3.225   4.091
  Start of MODEL   19
12775    HA   PHE   8           HA       PHE   8 -18.374   2.051   5.157
  Start of MODEL   19
12776    HB3  PHE   8           HB2      PHE   8 -16.679   0.359   4.565
  Start of MODEL   19
12777    HB2  PHE   8           HB3      PHE   8 -17.458   0.149   3.004
  Start of MODEL   19
12778    HD1  PHE   8           HD1      PHE   8 -18.408  -1.988   2.938
  Start of MODEL   19
12779    HD2  PHE   8           HD2      PHE   8 -18.864   0.400   6.439
  Start of MODEL   19
12780    HE1  PHE   8           HE1      PHE   8 -19.913  -3.661   3.884
  Start of MODEL   19
12781    HE2  PHE   8           HE2      PHE   8 -20.368  -1.289   7.392
  Start of MODEL   19
12782    HZ   PHE   8           HZ       PHE   8 -20.772  -3.423   6.119
  Start of MODEL   19
12783    H    PHE   8           HN       PHE   8 -19.733   1.200   2.849
  Start of MODEL   19
12784    HA   CYS   9           HA       CYS   9 -15.917   5.108   3.299
  Start of MODEL   19
12785    HB3  CYS   9           HB2      CYS   9 -15.427   5.222   6.295
  Start of MODEL   19
12786    HB2  CYS   9           HB3      CYS   9 -16.857   5.911   5.545
  Start of MODEL   19
12787    H    CYS   9           HN       CYS   9 -16.924   3.444   5.445
  Start of MODEL   19
12788    HA   ALA  10           HA       ALA  10 -12.233   2.871   3.537
  Start of MODEL   19
12789    HB3  ALA  10           HB1      ALA  10 -12.016   4.016   1.379
  Start of MODEL   19
12790    HB2  ALA  10           HB2      ALA  10 -10.449   3.728   2.159
  Start of MODEL   19
12791    HB1  ALA  10           HB3      ALA  10 -11.152   5.329   2.191
  Start of MODEL   19
12792    H    ALA  10           HN       ALA  10 -13.426   5.520   3.340
  Start of MODEL   19
12793    HA   SER  11           HA       SER  11  -9.550   4.488   6.477
  Start of MODEL   19
12794    HB3  SER  11           HB2      SER  11  -9.500   2.998   8.454
  Start of MODEL   19
12795    HB2  SER  11           HB3      SER  11 -10.427   1.792   7.561
  Start of MODEL   19
12796    HG   SER  11           HG       SER  11 -12.132   2.796   8.097
  Start of MODEL   19
12797    H    SER  11           HN       SER  11 -11.077   2.387   5.158
  Start of MODEL   19
12798    HA   VAL  12           HA       VAL  12  -6.336   1.880   5.097
  Start of MODEL   19
12799    HB   VAL  12           HB       VAL  12  -5.146   4.652   5.479
  Start of MODEL   19
12800    H    VAL  12           HN       VAL  12  -7.324   4.094   6.751
  Start of MODEL   19
12801    HA   GLN  13           HA       GLN  13  -3.960   1.311   8.647
  Start of MODEL   19
12802    HB3  GLN  13           HB2      GLN  13  -4.267  -0.937   9.622
  Start of MODEL   19
12803    HB2  GLN  13           HB3      GLN  13  -5.226  -1.397   8.226
  Start of MODEL   19
12804    HG2  GLN  13           HG2      GLN  13  -5.948   0.849  10.102
  Start of MODEL   19
12805    HG3  GLN  13           HG3      GLN  13  -6.937   0.192   8.804
  Start of MODEL   19
12806   HE21  GLN  13          HE21      GLN  13  -6.125  -2.585   9.499
  Start of MODEL   19
12807   HE22  GLN  13          HE22      GLN  13  -7.016  -2.946  10.921
  Start of MODEL   19
12808    H    GLN  13           HN       GLN  13  -5.468   0.366   6.348
  Start of MODEL   19
12809    HA   LEU  14           HA       LEU  14  -0.738  -0.604   6.502
  Start of MODEL   19
12810    HB3  LEU  14           HB2      LEU  14   1.241   1.015   6.690
  Start of MODEL   19
12811    HB2  LEU  14           HB3      LEU  14   0.134   2.098   7.513
  Start of MODEL   19
12812    HG   LEU  14           HG       LEU  14  -1.337   1.973   5.430
  Start of MODEL   19
12813   HD12  LEU  14          HD11      LEU  14   0.071   3.471   4.129
  Start of MODEL   19
12814   HD11  LEU  14          HD12      LEU  14   1.458   2.985   5.092
  Start of MODEL   19
12815   HD13  LEU  14          HD13      LEU  14   0.138   3.891   5.847
  Start of MODEL   19
12816   HD21  LEU  14          HD21      LEU  14  -0.426  -0.081   4.560
  Start of MODEL   19
12817   HD23  LEU  14          HD22      LEU  14   1.145   0.698   4.336
  Start of MODEL   19
12818   HD22  LEU  14          HD23      LEU  14  -0.251   1.233   3.397
  Start of MODEL   19
12819    H    LEU  14           HN       LEU  14  -1.938   1.270   8.375
  Start of MODEL   19
12820    HA   HIS  15           HA       HIS  15   1.481  -1.898  10.031
  Start of MODEL   19
12821    HB3  HIS  15           HB2      HIS  15   2.006  -4.318   9.531
  Start of MODEL   19
12822    HB2  HIS  15           HB3      HIS  15   1.507  -4.026   7.875
  Start of MODEL   19
12823    HD1  HIS  15           HD1      HIS  15   0.196  -4.800  11.199
  Start of MODEL   19
12824    HD2  HIS  15           HD2      HIS  15  -1.309  -3.535   7.545
  Start of MODEL   19
12825    HE1  HIS  15           HE1      HIS  15  -2.267  -5.222  11.296
  Start of MODEL   19
12826    HE2  HIS  15           HE2      HIS  15  -3.017  -4.848   8.942
  Start of MODEL   19
12827    H    HIS  15           HN       HIS  15   1.341  -1.502   7.141
  Start of MODEL   19
12828    HA   THR  16           HA       THR  16   5.676  -1.328   9.494
  Start of MODEL   19
12829    HB   THR  16           HB       THR  16   5.778  -3.572  11.519
  Start of MODEL   19
12830    HG1  THR  16           HG1      THR  16   5.857  -1.000  12.454
  Start of MODEL   19
12831   HG22  THR  16          HG21      THR  16   7.782  -2.379  12.286
  Start of MODEL   19
12832   HG21  THR  16          HG22      THR  16   7.550  -1.168  11.025
  Start of MODEL   19
12833   HG23  THR  16          HG23      THR  16   7.939  -2.831  10.587
  Start of MODEL   19
12834    H    THR  16           HN       THR  16   3.539  -2.639  10.711
  Start of MODEL   19
12835    HA   ALA  17           HA       ALA  17   6.739  -4.243   6.440
  Start of MODEL   19
12836    HB1  ALA  17           HB1      ALA  17   8.008  -2.175   5.863
  Start of MODEL   19
12837    HB3  ALA  17           HB2      ALA  17   8.836  -3.663   5.449
  Start of MODEL   19
12838    HB2  ALA  17           HB3      ALA  17   9.321  -2.747   6.889
  Start of MODEL   19
12839    H    ALA  17           HN       ALA  17   7.139  -2.028   8.088
  Start of MODEL   19
12840    HA   VAL  18           HA       VAL  18   8.660  -7.071   9.009
  Start of MODEL   19
12841    HB   VAL  18           HB       VAL  18   8.329  -9.413   8.208
  Start of MODEL   19
12842    H    VAL  18           HN       VAL  18   7.673  -6.239   6.417
  Start of MODEL   19
12843    HA   GLU  19           HA       GLU  19  12.691  -7.044   7.786
  Start of MODEL   19
12844    HB3  GLU  19           HB2      GLU  19  14.110  -7.857   9.651
  Start of MODEL   19
12845    HB2  GLU  19           HB3      GLU  19  12.660  -8.461  10.444
  Start of MODEL   19
12846    HG2  GLU  19           HG2      GLU  19  13.276  -5.595   9.762
  Start of MODEL   19
12847    HG3  GLU  19           HG3      GLU  19  11.762  -6.164  10.461
  Start of MODEL   19
12848    H    GLU  19           HN       GLU  19  10.555  -7.816   9.456
  Start of MODEL   19
12849    HA   MET  20           HA       MET  20  14.384 -10.570   6.234
  Start of MODEL   19
12850    HB3  MET  20           HB2      MET  20  12.152 -11.600   6.130
  Start of MODEL   19
12851    HB2  MET  20           HB3      MET  20  12.987 -11.869   4.616
  Start of MODEL   19
12852    HG2  MET  20           HG2      MET  20  10.826  -9.835   5.085
  Start of MODEL   19
12853    HG3  MET  20           HG3      MET  20  11.695 -10.077   3.572
  Start of MODEL   19
12854    HE3  MET  20           HE1      MET  20   8.483 -10.166   3.784
  Start of MODEL   19
12855    HE2  MET  20           HE2      MET  20   8.137 -11.555   2.758
  Start of MODEL   19
12856    HE1  MET  20           HE3      MET  20   9.376 -10.395   2.281
  Start of MODEL   19
12857    H    MET  20           HN       MET  20  12.988  -8.151   6.058
  Start of MODEL   19
12858    HA   HIS  21           HA       HIS  21  16.242  -8.853   2.890
  Start of MODEL   19
12859    HB3  HIS  21           HB2      HIS  21  16.710 -10.105   0.691
  Start of MODEL   19
12860    HB2  HIS  21           HB3      HIS  21  15.810 -11.435   1.413
  Start of MODEL   19
12861    HD1  HIS  21           HD1      HIS  21  17.001 -12.785   3.281
  Start of MODEL   19
12862    HD2  HIS  21           HD2      HIS  21  19.164  -9.483   1.961
  Start of MODEL   19
12863    HE1  HIS  21           HE1      HIS  21  19.265 -13.002   4.303
  Start of MODEL   19
12864    HE2  HIS  21           HE2      HIS  21  20.433 -10.857   3.720
  Start of MODEL   19
12865    H    HIS  21           HN       HIS  21  14.741 -11.146   3.587
  Start of MODEL   19
12866    HA   HIS  22           HA       HIS  22  13.093  -7.526   0.076
  Start of MODEL   19
12867    HB3  HIS  22           HB2      HIS  22  11.186  -8.551  -1.134
  Start of MODEL   19
12868    HB2  HIS  22           HB3      HIS  22  11.319  -9.986  -0.128
  Start of MODEL   19
12869    HD1  HIS  22           HD1      HIS  22  12.116 -11.770  -1.704
  Start of MODEL   19
12870    HD2  HIS  22           HD2      HIS  22  14.215  -8.214  -2.165
  Start of MODEL   19
12871    HE1  HIS  22           HE1      HIS  22  13.934 -12.265  -3.355
  Start of MODEL   19
12872    HE2  HIS  22           HE2      HIS  22  15.276 -10.153  -3.496
  Start of MODEL   19
12873    H    HIS  22           HN       HIS  22  13.192 -10.001   1.658
  Start of MODEL   19
12874    HA   TRP  23           HA       TRP  23  10.628  -6.585   3.466
  Start of MODEL   19
12875    HB3  TRP  23           HB2      TRP  23  10.368  -4.137   3.713
  Start of MODEL   19
12876    HB2  TRP  23           HB3      TRP  23  11.067  -3.942   2.112
  Start of MODEL   19
12877    HD1  TRP  23           HD1      TRP  23  13.694  -4.432   1.846
  Start of MODEL   19
12878    HE1  TRP  23           HE1      TRP  23  15.618  -4.339   3.544
  Start of MODEL   19
12879    HE3  TRP  23           HE3      TRP  23  10.972  -4.559   6.156
  Start of MODEL   19
12880    HZ2  TRP  23           HZ2      TRP  23  15.939  -4.302   6.351
  Start of MODEL   19
12881    HZ3  TRP  23           HZ3      TRP  23  12.154  -4.477   8.298
  Start of MODEL   19
12882    HH2  TRP  23           HH2      TRP  23  14.591  -4.351   8.395
  Start of MODEL   19
12883    H    TRP  23           HN       TRP  23  11.972  -5.946   1.001
  Start of MODEL   19
12884    HA   CYS  24           HA       CYS  24   6.741  -6.100   1.582
  Start of MODEL   19
12885    HB3  CYS  24           HB2      CYS  24   6.540  -8.247   3.717
  Start of MODEL   19
12886    HB2  CYS  24           HB3      CYS  24   6.829  -8.521   2.007
  Start of MODEL   19
12887    H    CYS  24           HN       CYS  24   8.608  -6.879   3.698
  Start of MODEL   19
12888    HA   ILE  25           HA       ILE  25   5.043  -3.712   4.877
  Start of MODEL   19
12889    HB   ILE  25           HB       ILE  25   4.541  -2.076   2.369
  Start of MODEL   19
12890   HD13  ILE  25          HD11      ILE  25   6.323  -0.222   1.886
  Start of MODEL   19
12891   HD12  ILE  25          HD12      ILE  25   7.726  -0.109   2.949
  Start of MODEL   19
12892   HD11  ILE  25          HD13      ILE  25   6.138   0.391   3.529
  Start of MODEL   19
12893    H    ILE  25           HN       ILE  25   5.568  -4.390   2.069
  Start of MODEL   19
12894    HA   PRO  26           HA       PRO  26   1.106  -5.692   3.587
  Start of MODEL   19
12895    HB3  PRO  26           HB2      PRO  26   0.754  -7.182   5.274
  Start of MODEL   19
12896    HB2  PRO  26           HB3      PRO  26   0.579  -5.887   6.457
  Start of MODEL   19
12897    HG2  PRO  26           HG2      PRO  26   2.603  -6.717   7.199
  Start of MODEL   19
12898    HG3  PRO  26           HG3      PRO  26   3.029  -7.355   5.600
  Start of MODEL   19
12899    HD2  PRO  26           HD2      PRO  26   3.267  -4.560   6.654
  Start of MODEL   19
12900    HD3  PRO  26           HD3      PRO  26   4.398  -5.494   5.655
  Start of MODEL   19
12901    HA   PHE  27           HA       PHE  27  -1.540  -2.554   5.076
  Start of MODEL   19
12902    HB3  PHE  27           HB2      PHE  27  -0.514  -1.445   3.107
  Start of MODEL   19
12903    HB2  PHE  27           HB3      PHE  27  -2.190  -0.993   3.351
  Start of MODEL   19
12904    HD1  PHE  27           HD1      PHE  27  -3.954  -1.692   1.753
  Start of MODEL   19
12905    HD2  PHE  27           HD2      PHE  27   0.179  -2.587   1.126
  Start of MODEL   19
12906    HE1  PHE  27           HE1      PHE  27  -4.413  -2.170  -0.591
  Start of MODEL   19
12907    HE2  PHE  27           HE2      PHE  27  -0.299  -3.063  -1.231
  Start of MODEL   19
12908    HZ   PHE  27           HZ       PHE  27  -2.592  -2.858  -2.092
  Start of MODEL   19
12909    H    PHE  27           HN       PHE  27  -0.734  -4.605   3.169
  Start of MODEL   19
12910    HA   SER  28           HA       SER  28  -5.497  -3.821   3.700
  Start of MODEL   19
12911    HB3  SER  28           HB2      SER  28  -6.715  -4.478   5.744
  Start of MODEL   19
12912    HB2  SER  28           HB3      SER  28  -5.483  -3.671   6.720
  Start of MODEL   19
12913    HG   SER  28           HG       SER  28  -4.271  -5.237   4.997
  Start of MODEL   19
12914    H    SER  28           HN       SER  28  -3.717  -2.145   5.219
  Start of MODEL   19
12915    HA   VAL  29           HA       VAL  29  -7.769  -0.174   4.300
  Start of MODEL   19
12916    HB   VAL  29           HB       VAL  29  -6.391   0.584   2.389
  Start of MODEL   19
12917    H    VAL  29           HN       VAL  29  -6.969  -2.615   2.916
  Start of MODEL   19
12918    HA   ASP  30           HA       ASP  30 -11.492  -2.039   3.137
  Start of MODEL   19
12919    HB3  ASP  30           HB2      ASP  30 -11.247  -2.708   5.538
  Start of MODEL   19
12920    HB2  ASP  30           HB3      ASP  30 -12.911  -2.523   5.005
  Start of MODEL   19
12921    H    ASP  30           HN       ASP  30  -9.882  -0.225   4.765
  Start of MODEL   19
12922    HA2  GLY  31           HA2      GLY  31 -15.020   0.673   2.973
  Start of MODEL   19
12923    H    GLY  31           HN       GLY  31 -13.449  -1.475   2.494
  Start of MODEL   19
12924    HA3  GLY  31           HA1      GLY  31 -13.790   1.287   1.860
  Start of MODEL   19
12925    HA   GLN  32           HA       GLN  32 -16.431  -1.648  -0.232
  Start of MODEL   19
12926    HB3  GLN  32           HB2      GLN  32 -18.970  -0.018   0.086
  Start of MODEL   19
12927    HB2  GLN  32           HB3      GLN  32 -18.512  -1.450   0.991
  Start of MODEL   19
12928    HG2  GLN  32           HG2      GLN  32 -19.144  -1.253  -1.928
  Start of MODEL   19
12929    HG3  GLN  32           HG3      GLN  32 -18.360  -2.646  -1.186
  Start of MODEL   19
12930   HE21  GLN  32          HE21      GLN  32 -20.797  -2.616  -2.530
  Start of MODEL   19
12931   HE22  GLN  32          HE22      GLN  32 -22.029  -3.094  -1.391
  Start of MODEL   19
12932    H    GLN  32           HN       GLN  32 -16.692   0.733   1.335
  Start of MODEL   19
12933    HA   PRO  33           HA       PRO  33 -16.764   1.218  -4.017
  Start of MODEL   19
12934    HB3  PRO  33           HB2      PRO  33 -17.232   3.508  -4.083
  Start of MODEL   19
12935    HB2  PRO  33           HB3      PRO  33 -16.125   3.839  -2.747
  Start of MODEL   19
12936    HG2  PRO  33           HG2      PRO  33 -18.173   4.135  -1.678
  Start of MODEL   19
12937    HG3  PRO  33           HG3      PRO  33 -18.967   2.895  -2.668
  Start of MODEL   19
12938    HD2  PRO  33           HD2      PRO  33 -17.136   2.564  -0.326
  Start of MODEL   19
12939    HD3  PRO  33           HD3      PRO  33 -18.611   1.669  -0.754
  Start of MODEL   19
12940    HA   ALA  34           HA       ALA  34 -12.644   0.282  -3.013
  Start of MODEL   19
12941    HB1  ALA  34           HB1      ALA  34 -13.105  -1.105  -4.970
  Start of MODEL   19
12942    HB3  ALA  34           HB2      ALA  34 -11.449  -0.490  -4.980
  Start of MODEL   19
12943    HB2  ALA  34           HB3      ALA  34 -12.674   0.239  -6.026
  Start of MODEL   19
12944    H    ALA  34           HN       ALA  34 -14.807   0.663  -4.739
  Start of MODEL   19
12945    HA   PRO  35           HA       PRO  35 -11.321   4.535  -3.205
  Start of MODEL   19
12946    HB3  PRO  35           HB2      PRO  35 -11.072   4.429  -0.926
  Start of MODEL   19
12947    HB2  PRO  35           HB3      PRO  35  -9.372   4.357  -1.395
  Start of MODEL   19
12948    HG2  PRO  35           HG2      PRO  35  -9.264   2.065  -1.134
  Start of MODEL   19
12949    HG3  PRO  35           HG3      PRO  35 -10.442   2.455   0.130
  Start of MODEL   19
12950    HD2  PRO  35           HD2      PRO  35 -10.978   0.683  -1.844
  Start of MODEL   19
12951    HD3  PRO  35           HD3      PRO  35 -12.239   1.719  -1.143
  Start of MODEL   19
12952    HA   SER  36           HA       SER  36  -7.926   4.112  -5.850
  Start of MODEL   19
12953    HB3  SER  36           HB2      SER  36  -7.424   6.277  -6.778
  Start of MODEL   19
12954    HB2  SER  36           HB3      SER  36  -8.142   7.094  -5.386
  Start of MODEL   19
12955    HG   SER  36           HG       SER  36  -9.384   5.617  -7.445
  Start of MODEL   19
12956    H    SER  36           HN       SER  36  -9.815   5.548  -4.320
  Start of MODEL   19
12957    HA   LEU  37           HA       LEU  37  -5.019   4.403  -2.505
  Start of MODEL   19
12958    HB3  LEU  37           HB2      LEU  37  -3.589   2.382  -2.589
  Start of MODEL   19
12959    HB2  LEU  37           HB3      LEU  37  -4.389   1.892  -4.062
  Start of MODEL   19
12960    HG   LEU  37           HG       LEU  37  -6.521   1.697  -2.780
  Start of MODEL   19
12961   HD11  LEU  37          HD11      LEU  37  -4.221   0.103  -1.658
  Start of MODEL   19
12962   HD13  LEU  37          HD12      LEU  37  -5.017  -0.202  -3.199
  Start of MODEL   19
12963   HD12  LEU  37          HD13      LEU  37  -5.921  -0.377  -1.699
  Start of MODEL   19
12964   HD22  LEU  37          HD21      LEU  37  -6.357   1.675  -0.299
  Start of MODEL   19
12965   HD21  LEU  37          HD22      LEU  37  -6.035   3.261  -0.989
  Start of MODEL   19
12966   HD23  LEU  37          HD23      LEU  37  -4.695   2.248  -0.447
  Start of MODEL   19
12967    H    LEU  37           HN       LEU  37  -6.311   3.202  -4.778
  Start of MODEL   19
12968    HA   ARG  38           HA       ARG  38  -1.409   5.465  -4.800
  Start of MODEL   19
12969    HB3  ARG  38           HB2      ARG  38  -2.913   7.818  -3.690
  Start of MODEL   19
12970    HB2  ARG  38           HB3      ARG  38  -2.867   7.263  -5.353
  Start of MODEL   19
12971    HG2  ARG  38           HG2      ARG  38  -0.688   8.706  -3.861
  Start of MODEL   19
12972    HG3  ARG  38           HG3      ARG  38  -0.470   7.964  -5.446
  Start of MODEL   19
12973    HD2  ARG  38           HD2      ARG  38  -1.033  10.424  -5.434
  Start of MODEL   19
12974    HD3  ARG  38           HD3      ARG  38  -2.048   9.406  -6.455
  Start of MODEL   19
12975    HE   ARG  38           HE       ARG  38  -3.254   9.647  -3.932
  Start of MODEL   19
12976   HH11  ARG  38          HH11      ARG  38  -2.520  11.710  -6.701
  Start of MODEL   19
12977   HH12  ARG  38          HH12      ARG  38  -3.938  12.644  -6.571
  Start of MODEL   19
12978   HH21  ARG  38          HH21      ARG  38  -5.247  10.953  -3.752
  Start of MODEL   19
12979   HH22  ARG  38          HH22      ARG  38  -5.492  12.223  -4.841
  Start of MODEL   19
12980    H    ARG  38           HN       ARG  38  -3.191   5.449  -2.503
  Start of MODEL   19
12981    HA   TRP  39           HA       TRP  39   1.117   5.939  -1.288
  Start of MODEL   19
12982    HB3  TRP  39           HB2      TRP  39   3.384   5.050  -1.819
  Start of MODEL   19
12983    HB2  TRP  39           HB3      TRP  39   2.881   4.921  -3.499
  Start of MODEL   19
12984    HD1  TRP  39           HD1      TRP  39   1.498   2.886  -4.251
  Start of MODEL   19
12985    HE1  TRP  39           HE1      TRP  39   0.879   0.682  -3.129
  Start of MODEL   19
12986    HE3  TRP  39           HE3      TRP  39   2.698   4.093   0.570
  Start of MODEL   19
12987    HZ2  TRP  39           HZ2      TRP  39   0.865  -0.420  -0.505
  Start of MODEL   19
12988    HZ3  TRP  39           HZ3      TRP  39   2.358   2.406   2.326
  Start of MODEL   19
12989    HH2  TRP  39           HH2      TRP  39   1.462   0.197   1.801
  Start of MODEL   19
12990    H    TRP  39           HN       TRP  39   0.702   5.781  -4.165
  Start of MODEL   19
12991    HA   LEU  40           HA       LEU  40   3.521   9.455  -2.267
  Start of MODEL   19
12992    HB3  LEU  40           HB2      LEU  40   2.319  10.080   0.444
  Start of MODEL   19
12993    HB2  LEU  40           HB3      LEU  40   1.435  10.284  -1.056
  Start of MODEL   19
12994    HG   LEU  40           HG       LEU  40   4.006  11.728  -0.517
  Start of MODEL   19
12995   HD11  LEU  40          HD11      LEU  40   1.774  12.089  -2.483
  Start of MODEL   19
12996   HD13  LEU  40          HD12      LEU  40   3.426  11.563  -2.824
  Start of MODEL   19
12997   HD12  LEU  40          HD13      LEU  40   3.120  13.210  -2.264
  Start of MODEL   19
12998   HD21  LEU  40          HD21      LEU  40   2.385  12.326   1.213
  Start of MODEL   19
12999   HD23  LEU  40          HD22      LEU  40   1.175  12.657  -0.027
  Start of MODEL   19
13000   HD22  LEU  40          HD23      LEU  40   2.626  13.656   0.081
  Start of MODEL   19
13001    H    LEU  40           HN       LEU  40   2.095   7.605  -0.477
  Start of MODEL   19
13002    HA   PHE  41           HA       PHE  41   6.609   8.321   0.627
  Start of MODEL   19
13003    HB3  PHE  41           HB2      PHE  41   7.747   8.318  -2.178
  Start of MODEL   19
13004    HB2  PHE  41           HB3      PHE  41   7.139   6.934  -1.287
  Start of MODEL   19
13005    HD1  PHE  41           HD1      PHE  41  10.029   8.678  -2.223
  Start of MODEL   19
13006    HD2  PHE  41           HD2      PHE  41   8.357   6.406   0.957
  Start of MODEL   19
13007    HE1  PHE  41           HE1      PHE  41  12.282   8.196  -1.379
  Start of MODEL   19
13008    HE2  PHE  41           HE2      PHE  41  10.610   5.920   1.802
  Start of MODEL   19
13009    HZ   PHE  41           HZ       PHE  41  12.595   6.791   0.564
  Start of MODEL   19
13010    H    PHE  41           HN       PHE  41   5.623   9.569  -1.831
  Start of MODEL   19
13011    HA   ASN  42           HA       ASN  42   7.614  12.051   2.633
  Start of MODEL   19
13012    HB3  ASN  42           HB2      ASN  42  10.047  11.402   0.926
  Start of MODEL   19
13013    HB2  ASN  42           HB3      ASN  42   9.750  10.733   2.521
  Start of MODEL   19
13014   HD21  ASN  42          HD21      ASN  42   9.919  12.100   4.361
  Start of MODEL   19
13015   HD22  ASN  42          HD22      ASN  42  10.792  13.577   4.266
  Start of MODEL   19
13016    H    ASN  42           HN       ASN  42   6.859  10.075   1.830
  Start of MODEL   19
13017    HA2  GLY  43           HA2      GLY  43   4.989  14.530  -0.096
  Start of MODEL   19
13018    H    GLY  43           HN       GLY  43   5.821  12.654   0.994
  Start of MODEL   19
13019    HA3  GLY  43           HA1      GLY  43   6.618  15.179  -0.139
  Start of MODEL   19
13020    HA   SER  44           HA       SER  44   6.850  13.369  -4.232
  Start of MODEL   19
13021    HB3  SER  44           HB2      SER  44   8.646  11.913  -4.767
  Start of MODEL   19
13022    HB2  SER  44           HB3      SER  44   8.485  11.038  -3.242
  Start of MODEL   19
13023    HG   SER  44           HG       SER  44   9.095  13.055  -2.209
  Start of MODEL   19
13024    H    SER  44           HN       SER  44   7.225  12.382  -1.474
  Start of MODEL   19
13025    HA   VAL  45           HA       VAL  45   3.906  10.307  -4.690
  Start of MODEL   19
13026    HB   VAL  45           HB       VAL  45   4.449  11.227  -7.537
  Start of MODEL   19
13027    H    VAL  45           HN       VAL  45   5.717  12.288  -5.673
  Start of MODEL   19
13028    HA   LEU  46           HA       LEU  46   6.851   7.229  -5.380
  Start of MODEL   19
13029    HB3  LEU  46           HB2      LEU  46   4.485   5.807  -4.196
  Start of MODEL   19
13030    HB2  LEU  46           HB3      LEU  46   5.796   6.516  -3.278
  Start of MODEL   19
13031    HG   LEU  46           HG       LEU  46   6.162   4.272  -5.255
  Start of MODEL   19
13032   HD13  LEU  46          HD11      LEU  46   8.175   5.538  -4.859
  Start of MODEL   19
13033   HD12  LEU  46          HD12      LEU  46   8.297   3.941  -4.122
  Start of MODEL   19
13034   HD11  LEU  46          HD13      LEU  46   7.976   5.353  -3.117
  Start of MODEL   19
13035   HD21  LEU  46          HD21      LEU  46   4.714   3.498  -3.493
  Start of MODEL   19
13036   HD23  LEU  46          HD22      LEU  46   5.795   4.137  -2.268
  Start of MODEL   19
13037   HD22  LEU  46          HD23      LEU  46   6.313   2.786  -3.290
  Start of MODEL   19
13038    H    LEU  46           HN       LEU  46   4.288   8.208  -4.574
  Start of MODEL   19
13039    HA   ASN  47           HA       ASN  47   4.991   5.916  -9.085
  Start of MODEL   19
13040    HB3  ASN  47           HB2      ASN  47   6.768   5.854 -10.888
  Start of MODEL   19
13041    HB2  ASN  47           HB3      ASN  47   7.900   6.469  -9.695
  Start of MODEL   19
13042   HD21  ASN  47          HD21      ASN  47   5.156   7.217 -11.655
  Start of MODEL   19
13043   HD22  ASN  47          HD22      ASN  47   5.223   8.924 -11.488
  Start of MODEL   19
13044    H    ASN  47           HN       ASN  47   7.124   6.889  -7.442
  Start of MODEL   19
13045    HA   GLU  48           HA       GLU  48   6.219   1.865  -8.148
  Start of MODEL   19
13046    HB3  GLU  48           HB2      GLU  48   4.578   0.274  -9.057
  Start of MODEL   19
13047    HB2  GLU  48           HB3      GLU  48   3.823   1.583  -9.956
  Start of MODEL   19
13048    HG2  GLU  48           HG2      GLU  48   4.025   1.366  -6.961
  Start of MODEL   19
13049    HG3  GLU  48           HG3      GLU  48   3.306   2.713  -7.844
  Start of MODEL   19
13050    H    GLU  48           HN       GLU  48   4.610   3.824  -9.441
  Start of MODEL   19
13051    HA   THR  49           HA       THR  49   7.657   0.042 -11.955
  Start of MODEL   19
13052    HB   THR  49           HB       THR  49   9.061   1.968 -11.499
  Start of MODEL   19
13053    HG1  THR  49           HG1      THR  49  10.154   0.952 -12.941
  Start of MODEL   19
13054   HG21  THR  49          HG21      THR  49  10.416   0.299  -9.376
  Start of MODEL   19
13055   HG23  THR  49          HG22      THR  49   9.404   1.718  -9.121
  Start of MODEL   19
13056   HG22  THR  49          HG23      THR  49  10.968   1.886  -9.917
  Start of MODEL   19
13057    H    THR  49           HN       THR  49   7.152   0.055  -9.202
  Start of MODEL   19
13058    HA   SER  50           HA       SER  50   8.938  -3.919 -10.891
  Start of MODEL   19
13059    HB3  SER  50           HB2      SER  50  10.812  -5.019 -11.949
  Start of MODEL   19
13060    HB2  SER  50           HB3      SER  50  11.619  -3.472 -12.210
  Start of MODEL   19
13061    HG   SER  50           HG       SER  50   9.194  -3.237 -13.192
  Start of MODEL   19
13062    H    SER  50           HN       SER  50   9.896  -1.539 -12.090
  Start of MODEL   19
13063    HA   PHE  51           HA       PHE  51  12.355  -3.136  -7.730
  Start of MODEL   19
13064    HB3  PHE  51           HB2      PHE  51  13.048  -0.974  -6.711
  Start of MODEL   19
13065    HB2  PHE  51           HB3      PHE  51  12.093  -0.126  -7.911
  Start of MODEL   19
13066    HD1  PHE  51           HD1      PHE  51  14.963  -2.431  -7.569
  Start of MODEL   19
13067    HD2  PHE  51           HD2      PHE  51  13.017   0.518  -9.928
  Start of MODEL   19
13068    HE1  PHE  51           HE1      PHE  51  16.930  -2.325  -9.047
  Start of MODEL   19
13069    HE2  PHE  51           HE2      PHE  51  14.977   0.629 -11.411
  Start of MODEL   19
13070    HZ   PHE  51           HZ       PHE  51  16.935  -0.792 -10.970
  Start of MODEL   19
13071    H    PHE  51           HN       PHE  51  11.078  -1.515  -9.746
  Start of MODEL   19
13072    HA   ILE  52           HA       ILE  52   8.757  -1.813  -5.131
  Start of MODEL   19
13073    HB   ILE  52           HB       ILE  52   8.558   1.003  -6.247
  Start of MODEL   19
13074   HD13  ILE  52          HD11      ILE  52  10.237   2.726  -5.324
  Start of MODEL   19
13075   HD12  ILE  52          HD12      ILE  52  11.465   2.181  -4.177
  Start of MODEL   19
13076   HD11  ILE  52          HD13      ILE  52   9.779   2.285  -3.677
  Start of MODEL   19
13077    H    ILE  52           HN       ILE  52   9.498  -1.049  -7.875
  Start of MODEL   19
13078    HA   PHE  53           HA       PHE  53   4.844  -1.442  -7.097
  Start of MODEL   19
13079    HB3  PHE  53           HB2      PHE  53   5.582  -2.940  -8.734
  Start of MODEL   19
13080    HB2  PHE  53           HB3      PHE  53   4.173  -3.743  -8.054
  Start of MODEL   19
13081    HD1  PHE  53           HD1      PHE  53   7.641  -4.072  -8.805
  Start of MODEL   19
13082    HD2  PHE  53           HD2      PHE  53   4.543  -5.537  -6.298
  Start of MODEL   19
13083    HE1  PHE  53           HE1      PHE  53   8.961  -6.091  -8.357
  Start of MODEL   19
13084    HE2  PHE  53           HE2      PHE  53   5.856  -7.554  -5.844
  Start of MODEL   19
13085    HZ   PHE  53           HZ       PHE  53   8.113  -7.826  -6.936
  Start of MODEL   19
13086    H    PHE  53           HN       PHE  53   6.768  -2.777  -5.398
  Start of MODEL   19
13087    HA   THR  54           HA       THR  54   2.207  -2.574  -3.890
  Start of MODEL   19
13088    HB   THR  54           HB       THR  54   0.161  -1.712  -5.954
  Start of MODEL   19
13089    HG1  THR  54           HG1      THR  54   1.705  -0.150  -5.916
  Start of MODEL   19
13090   HG21  THR  54          HG21      THR  54   0.265  -1.462  -2.946
  Start of MODEL   19
13091   HG23  THR  54          HG22      THR  54  -0.690  -2.636  -3.846
  Start of MODEL   19
13092   HG22  THR  54          HG23      THR  54  -1.052  -0.914  -3.982
  Start of MODEL   19
13093    H    THR  54           HN       THR  54   2.714  -1.756  -6.601
  Start of MODEL   19
13094    HA   GLU  55           HA       GLU  55   0.841  -6.477  -5.481
  Start of MODEL   19
13095    HB3  GLU  55           HB2      GLU  55   1.347  -8.203  -3.774
  Start of MODEL   19
13096    HB2  GLU  55           HB3      GLU  55   1.873  -6.933  -2.680
  Start of MODEL   19
13097    HG2  GLU  55           HG2      GLU  55   3.548  -6.306  -4.467
  Start of MODEL   19
13098    HG3  GLU  55           HG3      GLU  55   3.819  -7.779  -3.541
  Start of MODEL   19
13099    H    GLU  55           HN       GLU  55   1.947  -4.695  -3.497
  Start of MODEL   19
13100    HA   PHE  56           HA       PHE  56  -2.774  -6.649  -2.946
  Start of MODEL   19
13101    HB3  PHE  56           HB2      PHE  56  -4.745  -6.796  -4.516
  Start of MODEL   19
13102    HB2  PHE  56           HB3      PHE  56  -3.604  -6.907  -5.845
  Start of MODEL   19
13103    HD1  PHE  56           HD1      PHE  56  -4.992  -4.711  -3.282
  Start of MODEL   19
13104    HD2  PHE  56           HD2      PHE  56  -2.421  -4.987  -6.657
  Start of MODEL   19
13105    HE1  PHE  56           HE1      PHE  56  -4.955  -2.268  -3.440
  Start of MODEL   19
13106    HE2  PHE  56           HE2      PHE  56  -2.373  -2.529  -6.824
  Start of MODEL   19
13107    HZ   PHE  56           HZ       PHE  56  -3.643  -1.165  -5.210
  Start of MODEL   19
13108    H    PHE  56           HN       PHE  56  -1.138  -7.423  -5.254
  Start of MODEL   19
13109    HA   LEU  57           HA       LEU  57  -3.675 -10.896  -3.323
  Start of MODEL   19
13110    HB3  LEU  57           HB2      LEU  57  -2.177 -10.697  -1.367
  Start of MODEL   19
13111    HB2  LEU  57           HB3      LEU  57  -3.378 -11.943  -1.164
  Start of MODEL   19
13112    HG   LEU  57           HG       LEU  57  -3.867  -9.284   0.066
  Start of MODEL   19
13113   HD12  LEU  57          HD11      LEU  57  -4.993 -10.679   1.761
  Start of MODEL   19
13114   HD11  LEU  57          HD12      LEU  57  -4.570 -12.106   0.809
  Start of MODEL   19
13115   HD13  LEU  57          HD13      LEU  57  -5.653 -10.897   0.136
  Start of MODEL   19
13116   HD22  LEU  57          HD21      LEU  57  -2.683 -10.045   2.078
  Start of MODEL   19
13117   HD21  LEU  57          HD22      LEU  57  -1.606  -9.789   0.704
  Start of MODEL   19
13118   HD23  LEU  57          HD23      LEU  57  -2.076 -11.426   1.160
  Start of MODEL   19
13119    H    LEU  57           HN       LEU  57  -3.990  -8.291  -2.050
  Start of MODEL   19
13120    HA   GLU  58           HA       GLU  58  -7.847 -11.156  -3.442
  Start of MODEL   19
13121    HB3  GLU  58           HB2      GLU  58  -8.722 -13.409  -3.397
  Start of MODEL   19
13122    HB2  GLU  58           HB3      GLU  58  -7.257 -13.962  -2.592
  Start of MODEL   19
13123    HG2  GLU  58           HG2      GLU  58  -5.934 -13.419  -4.537
  Start of MODEL   19
13124    HG3  GLU  58           HG3      GLU  58  -7.271 -14.483  -4.974
  Start of MODEL   19
13125    H    GLU  58           HN       GLU  58  -5.385 -12.349  -2.907
  Start of MODEL   19
13126    HA   PRO  59           HA       PRO  59  -9.215 -10.639   0.866
  Start of MODEL   19
13127    HB3  PRO  59           HB2      PRO  59 -10.398  -8.693   0.670
  Start of MODEL   19
13128    HB2  PRO  59           HB3      PRO  59 -11.625  -9.491  -0.313
  Start of MODEL   19
13129    HG2  PRO  59           HG2      PRO  59 -10.736  -8.146  -1.961
  Start of MODEL   19
13130    HG3  PRO  59           HG3      PRO  59  -9.157  -8.061  -1.161
  Start of MODEL   19
13131    HD2  PRO  59           HD2      PRO  59 -10.295 -10.241  -2.873
  Start of MODEL   19
13132    HD3  PRO  59           HD3      PRO  59  -8.665  -9.523  -2.864
  Start of MODEL   19
13133    HA   ALA  60           HA       ALA  60 -12.088 -13.909   0.917
  Start of MODEL   19
13134    HB2  ALA  60           HB1      ALA  60 -12.902 -14.325   3.174
  Start of MODEL   19
13135    HB1  ALA  60           HB2      ALA  60 -12.425 -12.701   3.662
  Start of MODEL   19
13136    HB3  ALA  60           HB3      ALA  60 -11.195 -13.886   3.216
  Start of MODEL   19
13137    H    ALA  60           HN       ALA  60 -10.929 -11.550   2.086
  Start of MODEL   19
13138    HA   ALA  61           HA       ALA  61 -15.673 -12.151  -0.461
  Start of MODEL   19
13139    HB3  ALA  61           HB1      ALA  61 -17.441 -13.734  -0.895
  Start of MODEL   19
13140    HB2  ALA  61           HB2      ALA  61 -16.754 -14.837   0.298
  Start of MODEL   19
13141    HB1  ALA  61           HB3      ALA  61 -15.865 -14.475  -1.183
  Start of MODEL   19
13142    H    ALA  61           HN       ALA  61 -14.318 -14.292   0.776
  Start of MODEL   19
13143    HA   ASN  62           HA       ASN  62 -18.226 -11.879   3.325
  Start of MODEL   19
13144    HB3  ASN  62           HB2      ASN  62 -16.141 -13.043   5.179
  Start of MODEL   19
13145    HB2  ASN  62           HB3      ASN  62 -17.629 -13.816   4.642
  Start of MODEL   19
13146   HD21  ASN  62          HD21      ASN  62 -19.597 -13.058   5.442
  Start of MODEL   19
13147   HD22  ASN  62          HD22      ASN  62 -19.696 -12.167   6.916
  Start of MODEL   19
13148    H    ASN  62           HN       ASN  62 -15.627 -13.047   2.781
  Start of MODEL   19
13149    HA   GLU  63           HA       GLU  63 -15.544  -8.633   4.961
  Start of MODEL   19
13150    HB3  GLU  63           HB2      GLU  63 -13.482  -9.988   5.309
  Start of MODEL   19
13151    HB2  GLU  63           HB3      GLU  63 -13.188  -8.265   5.127
  Start of MODEL   19
13152    HG2  GLU  63           HG2      GLU  63 -12.801 -10.332   2.972
  Start of MODEL   19
13153    HG3  GLU  63           HG3      GLU  63 -12.457  -8.612   2.835
  Start of MODEL   19
13154    H    GLU  63           HN       GLU  63 -14.989 -10.807   3.095
  Start of MODEL   19
13155    HA   THR  64           HA       THR  64 -14.940  -6.017   1.467
  Start of MODEL   19
13156    HB   THR  64           HB       THR  64 -15.807  -4.018   3.580
  Start of MODEL   19
13157    HG1  THR  64           HG1      THR  64 -16.937  -6.132   3.690
  Start of MODEL   19
13158   HG22  THR  64          HG21      THR  64 -17.196  -3.180   1.733
  Start of MODEL   19
13159   HG21  THR  64          HG22      THR  64 -16.615  -4.482   0.696
  Start of MODEL   19
13160   HG23  THR  64          HG23      THR  64 -15.498  -3.239   1.261
  Start of MODEL   19
13161    H    THR  64           HN       THR  64 -14.789  -6.494   4.356
  Start of MODEL   19
13162    HA   VAL  65           HA       VAL  65 -11.258  -4.098   3.341
  Start of MODEL   19
13163    HB   VAL  65           HB       VAL  65 -10.430  -6.730   4.564
  Start of MODEL   19
13164    H    VAL  65           HN       VAL  65 -12.703  -6.639   3.157
  Start of MODEL   19
13165    HA   ARG  66           HA       ARG  66  -8.938  -5.915   0.086
  Start of MODEL   19
13166    HB3  ARG  66           HB2      ARG  66  -7.855  -4.104  -1.146
  Start of MODEL   19
13167    HB2  ARG  66           HB3      ARG  66  -8.113  -3.009   0.194
  Start of MODEL   19
13168    HG2  ARG  66           HG2      ARG  66 -10.223  -4.201  -1.599
  Start of MODEL   19
13169    HG3  ARG  66           HG3      ARG  66 -10.571  -3.240  -0.161
  Start of MODEL   19
13170    HD2  ARG  66           HD2      ARG  66 -10.696  -1.847  -2.152
  Start of MODEL   19
13171    HD3  ARG  66           HD3      ARG  66  -9.342  -1.345  -1.150
  Start of MODEL   19
13172    HE   ARG  66           HE       ARG  66  -8.498  -3.219  -3.054
  Start of MODEL   19
13173   HH11  ARG  66          HH11      ARG  66  -9.402   0.196  -2.814
  Start of MODEL   19
13174   HH12  ARG  66          HH12      ARG  66  -8.551   0.668  -4.205
  Start of MODEL   19
13175   HH21  ARG  66          HH21      ARG  66  -7.371  -2.552  -5.026
  Start of MODEL   19
13176   HH22  ARG  66          HH22      ARG  66  -7.402  -0.910  -5.478
  Start of MODEL   19
13177    H    ARG  66           HN       ARG  66  -9.660  -3.805   1.980
  Start of MODEL   19
13178    HA   HIS  67           HA       HIS  67  -5.104  -5.817   2.259
  Start of MODEL   19
13179    HB3  HIS  67           HB2      HIS  67  -4.377  -8.124   2.714
  Start of MODEL   19
13180    HB2  HIS  67           HB3      HIS  67  -5.569  -8.717   1.567
  Start of MODEL   19
13181    HD1  HIS  67           HD1      HIS  67  -5.187  -7.777   5.106
  Start of MODEL   19
13182    HD2  HIS  67           HD2      HIS  67  -8.252  -8.522   2.414
  Start of MODEL   19
13183    HE1  HIS  67           HE1      HIS  67  -7.221  -8.161   6.492
  Start of MODEL   19
13184    HE2  HIS  67           HE2      HIS  67  -9.061  -8.673   4.811
  Start of MODEL   19
13185    H    HIS  67           HN       HIS  67  -6.915  -6.861   0.187
  Start of MODEL   19
13186    HA2  GLY  68           HA2      GLY  68  -1.993  -7.215  -0.525
  Start of MODEL   19
13187    H    GLY  68           HN       GLY  68  -2.968  -5.824   1.750
  Start of MODEL   19
13188    HA3  GLY  68           HA1      GLY  68  -2.162  -5.482  -0.804
  Start of MODEL   19
13189    HA   CYS  69           HA       CYS  69   1.509  -4.962   1.352
  Start of MODEL   19
13190    HB3  CYS  69           HB2      CYS  69   2.218  -7.470  -0.176
  Start of MODEL   19
13191    HB2  CYS  69           HB3      CYS  69   1.864  -7.309   1.543
  Start of MODEL   19
13192    H    CYS  69           HN       CYS  69   0.156  -5.681  -1.078
  Start of MODEL   19
13193    HA   LEU  70           HA       LEU  70   3.686  -3.062  -1.926
  Start of MODEL   19
13194    HB3  LEU  70           HB2      LEU  70   4.713  -1.567   0.504
  Start of MODEL   19
13195    HB2  LEU  70           HB3      LEU  70   3.253  -1.117  -0.347
  Start of MODEL   19
13196    HG   LEU  70           HG       LEU  70   6.032  -1.115  -1.533
  Start of MODEL   19
13197   HD13  LEU  70          HD11      LEU  70   4.347  -1.491  -3.232
  Start of MODEL   19
13198   HD12  LEU  70          HD12      LEU  70   4.973   0.161  -3.348
  Start of MODEL   19
13199   HD11  LEU  70          HD13      LEU  70   3.404  -0.134  -2.612
  Start of MODEL   19
13200   HD22  LEU  70          HD21      LEU  70   5.816   1.319  -1.463
  Start of MODEL   19
13201   HD21  LEU  70          HD22      LEU  70   5.808   0.616   0.153
  Start of MODEL   19
13202   HD23  LEU  70          HD23      LEU  70   4.297   1.154  -0.590
  Start of MODEL   19
13203    H    LEU  70           HN       LEU  70   3.059  -3.495   0.886
  Start of MODEL   19
13204    HA   ARG  71           HA       ARG  71   7.174  -5.444  -0.826
  Start of MODEL   19
13205    HB3  ARG  71           HB2      ARG  71   7.663  -7.097  -2.698
  Start of MODEL   19
13206    HB2  ARG  71           HB3      ARG  71   6.210  -6.503  -3.475
  Start of MODEL   19
13207    HG2  ARG  71           HG2      ARG  71   6.302  -7.776  -0.755
  Start of MODEL   19
13208    HG3  ARG  71           HG3      ARG  71   4.858  -7.253  -1.620
  Start of MODEL   19
13209    HD2  ARG  71           HD2      ARG  71   5.361  -8.895  -3.418
  Start of MODEL   19
13210    HD3  ARG  71           HD3      ARG  71   6.804  -9.361  -2.549
  Start of MODEL   19
13211    HE   ARG  71           HE       ARG  71   5.275 -10.026  -0.699
  Start of MODEL   19
13212   HH11  ARG  71          HH11      ARG  71   4.036 -10.094  -4.081
  Start of MODEL   19
13213   HH12  ARG  71          HH12      ARG  71   3.066 -11.438  -3.796
  Start of MODEL   19
13214   HH21  ARG  71          HH21      ARG  71   3.919 -11.869  -0.390
  Start of MODEL   19
13215   HH22  ARG  71          HH22      ARG  71   2.977 -12.474  -1.699
  Start of MODEL   19
13216    H    ARG  71           HN       ARG  71   5.195  -4.383  -2.693
  Start of MODEL   19
13217    HA   LEU  72           HA       LEU  72  10.005  -3.196  -3.198
  Start of MODEL   19
13218    HB3  LEU  72           HB2      LEU  72  11.994  -2.796  -1.805
  Start of MODEL   19
13219    HB2  LEU  72           HB3      LEU  72  11.370  -3.900  -0.588
  Start of MODEL   19
13220    HG   LEU  72           HG       LEU  72   9.445  -2.341  -0.246
  Start of MODEL   19
13221   HD13  LEU  72          HD11      LEU  72  11.337  -2.312   1.200
  Start of MODEL   19
13222   HD12  LEU  72          HD12      LEU  72  10.672  -0.693   0.994
  Start of MODEL   19
13223   HD11  LEU  72          HD13      LEU  72  12.177  -1.155   0.161
  Start of MODEL   19
13224   HD21  LEU  72          HD21      LEU  72   9.484  -1.233  -2.410
  Start of MODEL   19
13225   HD23  LEU  72          HD22      LEU  72  11.056  -0.525  -2.022
  Start of MODEL   19
13226   HD22  LEU  72          HD23      LEU  72   9.627  -0.064  -1.096
  Start of MODEL   19
13227    H    LEU  72           HN       LEU  72   9.062  -4.541  -0.841
  Start of MODEL   19
13228    HA   ASN  73           HA       ASN  73  11.138  -7.227  -4.596
  Start of MODEL   19
13229    HB3  ASN  73           HB2      ASN  73  11.596  -5.302  -6.876
  Start of MODEL   19
13230    HB2  ASN  73           HB3      ASN  73  10.108  -6.185  -6.569
  Start of MODEL   19
13231   HD21  ASN  73          HD21      ASN  73  11.825  -6.173  -8.855
  Start of MODEL   19
13232   HD22  ASN  73          HD22      ASN  73  12.324  -7.804  -9.144
  Start of MODEL   19
13233    H    ASN  73           HN       ASN  73  10.548  -4.450  -4.775
  Start of MODEL   19
13234    HA   GLN  74           HA       GLN  74  15.284  -5.829  -4.004
  Start of MODEL   19
13235    HB3  GLN  74           HB2      GLN  74  15.529  -4.007  -6.416
  Start of MODEL   19
13236    HB2  GLN  74           HB3      GLN  74  15.744  -5.757  -6.428
  Start of MODEL   19
13237    HG2  GLN  74           HG2      GLN  74  17.440  -3.787  -4.906
  Start of MODEL   19
13238    HG3  GLN  74           HG3      GLN  74  17.652  -5.532  -4.922
  Start of MODEL   19
13239   HE21  GLN  74          HE21      GLN  74  19.729  -5.338  -5.721
  Start of MODEL   19
13240   HE22  GLN  74          HE22      GLN  74  20.047  -4.855  -7.343
  Start of MODEL   19
13241    H    GLN  74           HN       GLN  74  13.094  -4.378  -5.194
  Start of MODEL   19
13242    HA   PRO  75           HA       PRO  75  14.460  -2.058  -1.708
  Start of MODEL   19
13243    HB3  PRO  75           HB2      PRO  75  14.403  -2.840   0.436
  Start of MODEL   19
13244    HB2  PRO  75           HB3      PRO  75  16.080  -3.384   0.349
  Start of MODEL   19
13245    HG2  PRO  75           HG2      PRO  75  15.046  -5.454   0.370
  Start of MODEL   19
13246    HG3  PRO  75           HG3      PRO  75  13.572  -4.823  -0.386
  Start of MODEL   19
13247    HD2  PRO  75           HD2      PRO  75  16.181  -5.564  -1.641
  Start of MODEL   19
13248    HD3  PRO  75           HD3      PRO  75  14.514  -5.889  -2.188
  Start of MODEL   19
13249    HA   THR  76           HA       THR  76  18.593  -0.588  -1.823
  Start of MODEL   19
13250    HB   THR  76           HB       THR  76  18.401   1.397  -3.507
  Start of MODEL   19
13251    HG1  THR  76           HG1      THR  76  15.825   0.228  -3.644
  Start of MODEL   19
13252   HG23  THR  76          HG21      THR  76  19.258  -0.824  -4.148
  Start of MODEL   19
13253   HG22  THR  76          HG22      THR  76  18.268  -0.137  -5.438
  Start of MODEL   19
13254   HG21  THR  76          HG23      THR  76  17.606  -1.390  -4.388
  Start of MODEL   19
13255    H    THR  76           HN       THR  76  15.682  -0.339  -1.778
  Start of MODEL   19
13256    HA   HIS  77           HA       HIS  77  18.330   2.332   1.176
  Start of MODEL   19
13257    HB3  HIS  77           HB2      HIS  77  20.719   2.036   1.301
  Start of MODEL   19
13258    HB2  HIS  77           HB3      HIS  77  20.334   3.697   1.702
  Start of MODEL   19
13259    HD1  HIS  77           HD1      HIS  77  22.350   1.658  -0.649
  Start of MODEL   19
13260    HD2  HIS  77           HD2      HIS  77  21.195   5.627  -0.171
  Start of MODEL   19
13261    HE1  HIS  77           HE1      HIS  77  23.777   2.973  -2.209
  Start of MODEL   19
13262    HE2  HIS  77           HE2      HIS  77  23.180   5.365  -1.802
  Start of MODEL   19
13263    H    HIS  77           HN       HIS  77  19.626   1.372  -1.093
  Start of MODEL   19
13264    HA   VAL  78           HA       VAL  78  17.315   6.205  -1.149
  Start of MODEL   19
13265    HB   VAL  78           HB       VAL  78  16.243   6.383  -3.369
  Start of MODEL   19
13266    H    VAL  78           HN       VAL  78  17.846   3.450  -1.839
  Start of MODEL   19
13267    HA   ASN  79           HA       ASN  79  13.066   4.126  -0.760
  Start of MODEL   19
13268    HB3  ASN  79           HB2      ASN  79  12.550   1.819  -0.003
  Start of MODEL   19
13269    HB2  ASN  79           HB3      ASN  79  14.264   1.515   0.192
  Start of MODEL   19
13270   HD21  ASN  79          HD21      ASN  79  12.937   3.325  -2.522
  Start of MODEL   19
13271   HD22  ASN  79          HD22      ASN  79  13.337   2.134  -3.698
  Start of MODEL   19
13272    H    ASN  79           HN       ASN  79  15.832   3.265  -0.544
  Start of MODEL   19
13273    HA   ASN  80           HA       ASN  80  13.720   4.379   3.780
  Start of MODEL   19
13274    HB3  ASN  80           HB2      ASN  80  15.415   5.922   4.875
  Start of MODEL   19
13275    HB2  ASN  80           HB3      ASN  80  16.171   6.084   3.299
  Start of MODEL   19
13276   HD21  ASN  80          HD21      ASN  80  17.490   4.526   2.569
  Start of MODEL   19
13277   HD22  ASN  80          HD22      ASN  80  17.837   3.072   3.452
  Start of MODEL   19
13278    H    ASN  80           HN       ASN  80  15.104   5.138   1.306
  Start of MODEL   19
13279    HA2  GLY  81           HA2      GLY  81  11.933   8.211   4.796
  Start of MODEL   19
13280    H    GLY  81           HN       GLY  81  12.034   5.549   4.460
  Start of MODEL   19
13281    HA3  GLY  81           HA1      GLY  81  11.469   8.015   3.111
  Start of MODEL   19
13282    HA   ASN  82           HA       ASN  82   7.839   7.520   5.728
  Start of MODEL   19
13283    HB3  ASN  82           HB2      ASN  82   6.330   9.451   5.589
  Start of MODEL   19
13284    HB2  ASN  82           HB3      ASN  82   7.342  10.166   4.347
  Start of MODEL   19
13285   HD21  ASN  82          HD21      ASN  82   7.033   9.522   7.758
  Start of MODEL   19
13286   HD22  ASN  82          HD22      ASN  82   8.333  10.544   8.227
  Start of MODEL   19
13287    H    ASN  82           HN       ASN  82   9.573   9.062   4.009
  Start of MODEL   19
13288    HA   TYR  83           HA       TYR  83   5.889   6.170   1.963
  Start of MODEL   19
13289    HB3  TYR  83           HB2      TYR  83   5.119   3.706   2.443
  Start of MODEL   19
13290    HB2  TYR  83           HB3      TYR  83   6.217   3.812   3.826
  Start of MODEL   19
13291    HD1  TYR  83           HD1      TYR  83   6.069   3.982   0.149
  Start of MODEL   19
13292    HD2  TYR  83           HD2      TYR  83   8.561   3.566   3.574
  Start of MODEL   19
13293    HE1  TYR  83           HE1      TYR  83   7.969   3.356  -1.300
  Start of MODEL   19
13294    HE2  TYR  83           HE2      TYR  83  10.450   2.955   2.107
  Start of MODEL   19
13295    HH   TYR  83           HH       TYR  83  10.790   2.036  -0.070
  Start of MODEL   19
13296    H    TYR  83           HN       TYR  83   6.982   5.787   4.604
  Start of MODEL   19
13297    HA   THR  84           HA       THR  84   2.032   6.690   3.985
  Start of MODEL   19
13298    HB   THR  84           HB       THR  84   2.299   9.009   2.078
  Start of MODEL   19
13299    HG1  THR  84           HG1      THR  84   3.933   8.556   3.752
  Start of MODEL   19
13300   HG21  THR  84          HG21      THR  84   0.607   8.699   4.581
  Start of MODEL   19
13301   HG23  THR  84          HG22      THR  84  -0.005   8.690   2.929
  Start of MODEL   19
13302   HG22  THR  84          HG23      THR  84   0.722  10.154   3.590
  Start of MODEL   19
13303    H    THR  84           HN       THR  84   3.923   7.077   1.773
  Start of MODEL   19
13304    HA   LEU  85           HA       LEU  85  -0.457   5.406   0.647
  Start of MODEL   19
13305    HB3  LEU  85           HB2      LEU  85  -1.554   3.916   3.039
  Start of MODEL   19
13306    HB2  LEU  85           HB3      LEU  85  -0.245   3.353   2.019
  Start of MODEL   19
13307    HG   LEU  85           HG       LEU  85  -3.127   3.706   1.180
  Start of MODEL   19
13308   HD12  LEU  85          HD11      LEU  85  -2.376   2.620  -0.885
  Start of MODEL   19
13309   HD11  LEU  85          HD12      LEU  85  -0.708   2.747  -0.275
  Start of MODEL   19
13310   HD13  LEU  85          HD13      LEU  85  -1.634   4.210  -0.629
  Start of MODEL   19
13311   HD21  LEU  85          HD21      LEU  85  -2.656   1.802   2.655
  Start of MODEL   19
13312   HD23  LEU  85          HD22      LEU  85  -1.460   1.225   1.489
  Start of MODEL   19
13313   HD22  LEU  85          HD23      LEU  85  -3.167   1.330   1.038
  Start of MODEL   19
13314    H    LEU  85           HN       LEU  85   0.103   5.843   3.484
  Start of MODEL   19
13315    HA   LEU  86           HA       LEU  86  -3.962   7.896   1.470
  Start of MODEL   19
13316    HB3  LEU  86           HB2      LEU  86  -4.334   9.300  -0.566
  Start of MODEL   19
13317    HB2  LEU  86           HB3      LEU  86  -3.047   8.445  -1.370
  Start of MODEL   19
13318    HG   LEU  86           HG       LEU  86  -2.446  10.711  -0.633
  Start of MODEL   19
13319   HD12  LEU  86          HD11      LEU  86  -1.968  11.168   1.695
  Start of MODEL   19
13320   HD11  LEU  86          HD12      LEU  86  -2.682   9.618   2.136
  Start of MODEL   19
13321   HD13  LEU  86          HD13      LEU  86  -3.682  10.872   1.397
  Start of MODEL   19
13322   HD22  LEU  86          HD21      LEU  86  -0.262  10.141   0.338
  Start of MODEL   19
13323   HD21  LEU  86          HD22      LEU  86  -0.686   9.100  -1.022
  Start of MODEL   19
13324   HD23  LEU  86          HD23      LEU  86  -0.839   8.498   0.627
  Start of MODEL   19
13325    H    LEU  86           HN       LEU  86  -1.982   6.517  -0.207
  Start of MODEL   19
13326    HA   ALA  87           HA       ALA  87  -6.752   5.759  -1.179
  Start of MODEL   19
13327    HB2  ALA  87           HB1      ALA  87  -8.394   4.550   0.235
  Start of MODEL   19
13328    HB1  ALA  87           HB2      ALA  87  -7.878   5.504   1.613
  Start of MODEL   19
13329    HB3  ALA  87           HB3      ALA  87  -6.756   4.376   0.862
  Start of MODEL   19
13330    H    ALA  87           HN       ALA  87  -6.042   7.386   1.177
  Start of MODEL   19
13331    HA   ALA  88           HA       ALA  88  -9.709   8.974  -1.211
  Start of MODEL   19
13332    HB3  ALA  88           HB1      ALA  88  -8.239   9.599  -3.091
  Start of MODEL   19
13333    HB2  ALA  88           HB2      ALA  88  -9.939   9.854  -3.470
  Start of MODEL   19
13334    HB1  ALA  88           HB3      ALA  88  -9.094   8.452  -4.124
  Start of MODEL   19
13335    H    ALA  88           HN       ALA  88  -8.110   6.839  -2.407
  Start of MODEL   19
13336    HA   ASN  89           HA       ASN  89 -13.257   6.625  -2.410
  Start of MODEL   19
13337    HB3  ASN  89           HB2      ASN  89 -13.061   6.863   0.616
  Start of MODEL   19
13338    HB2  ASN  89           HB3      ASN  89 -12.616   5.472  -0.350
  Start of MODEL   19
13339   HD21  ASN  89          HD21      ASN  89 -14.236   4.032  -1.088
  Start of MODEL   19
13340   HD22  ASN  89          HD22      ASN  89 -15.812   4.117  -0.422
  Start of MODEL   19
13341    H    ASN  89           HN       ASN  89 -11.725   8.541  -0.778
  Start of MODEL   19
13342    HA   PRO  90           HA       PRO  90 -16.360   9.933  -2.707
  Start of MODEL   19
13343    HB3  PRO  90           HB2      PRO  90 -18.237   8.790  -3.233
  Start of MODEL   19
13344    HB2  PRO  90           HB3      PRO  90 -18.494   8.401  -1.531
  Start of MODEL   19
13345    HG2  PRO  90           HG2      PRO  90 -17.533   6.340  -1.735
  Start of MODEL   19
13346    HG3  PRO  90           HG3      PRO  90 -17.865   6.543  -3.462
  Start of MODEL   19
13347    HD2  PRO  90           HD2      PRO  90 -15.384   6.090  -2.559
  Start of MODEL   19
13348    HD3  PRO  90           HD3      PRO  90 -15.672   7.200  -3.921
  Start of MODEL   19
13349    HA   CYS  91           HA       CYS  91 -17.571   9.890   1.977
  Start of MODEL   19
13350    HB3  CYS  91           HB2      CYS  91 -15.740   7.556   2.478
  Start of MODEL   19
13351    HB2  CYS  91           HB3      CYS  91 -17.483   7.610   2.642
  Start of MODEL   19
13352    H    CYS  91           HN       CYS  91 -16.321   8.027   0.274
  Start of MODEL   19
13353    HA2  GLY  92           HA2      GLY  92 -13.329  11.993   1.551
  Start of MODEL   19
13354    H    GLY  92           HN       GLY  92 -14.124   9.446   1.121
  Start of MODEL   19
13355    HA3  GLY  92           HA1      GLY  92 -13.201  11.236   3.134
  Start of MODEL   19
13356    HA   GLN  93           HA       GLN  93  -9.671   9.497   1.329
  Start of MODEL   19
13357    HB3  GLN  93           HB2      GLN  93  -8.558  12.262   1.825
  Start of MODEL   19
13358    HB2  GLN  93           HB3      GLN  93  -9.259  11.707   0.313
  Start of MODEL   19
13359    HG2  GLN  93           HG2      GLN  93  -6.759  10.629   1.592
  Start of MODEL   19
13360    HG3  GLN  93           HG3      GLN  93  -7.477  10.049   0.088
  Start of MODEL   19
13361   HE21  GLN  93          HE21      GLN  93  -5.704  10.581  -1.145
  Start of MODEL   19
13362   HE22  GLN  93          HE22      GLN  93  -5.283  12.228  -1.488
  Start of MODEL   19
13363    H    GLN  93           HN       GLN  93 -10.901  11.560   2.980
  Start of MODEL   19
13364    HA   ALA  94           HA       ALA  94  -7.805   8.841   5.189
  Start of MODEL   19
13365    HB1  ALA  94           HB1      ALA  94  -7.849   6.239   3.696
  Start of MODEL   19
13366    HB3  ALA  94           HB2      ALA  94  -9.020   6.765   4.916
  Start of MODEL   19
13367    HB2  ALA  94           HB3      ALA  94  -7.351   6.397   5.371
  Start of MODEL   19
13368    H    ALA  94           HN       ALA  94  -8.429   8.206   2.402
  Start of MODEL   19
13369    HA   SER  95           HA       SER  95  -3.579   8.087   4.011
  Start of MODEL   19
13370    HB3  SER  95           HB2      SER  95  -3.921  10.452   3.827
  Start of MODEL   19
13371    HB2  SER  95           HB3      SER  95  -2.492  10.215   4.830
  Start of MODEL   19
13372    HG   SER  95           HG       SER  95  -4.494  10.238   6.499
  Start of MODEL   19
13373    H    SER  95           HN       SER  95  -5.698   8.484   5.944
  Start of MODEL   19
13374    HA   ALA  96           HA       ALA  96  -1.618   7.076   7.832
  Start of MODEL   19
13375    HB3  ALA  96           HB1      ALA  96  -3.065   5.093   7.581
  Start of MODEL   19
13376    HB2  ALA  96           HB2      ALA  96  -1.431   4.611   8.039
  Start of MODEL   19
13377    HB1  ALA  96           HB3      ALA  96  -1.963   4.441   6.371
  Start of MODEL   19
13378    H    ALA  96           HN       ALA  96  -2.156   6.769   4.966
  Start of MODEL   19
13379    HA   SER  97           HA       SER  97   2.284   6.391   5.995
  Start of MODEL   19
13380    HB3  SER  97           HB2      SER  97   3.907   7.894   7.090
  Start of MODEL   19
13381    HB2  SER  97           HB3      SER  97   2.776   8.114   8.426
  Start of MODEL   19
13382    HG   SER  97           HG       SER  97   2.557   8.944   5.737
  Start of MODEL   19
13383    H    SER  97           HN       SER  97   0.607   6.614   8.374
  Start of MODEL   19
13384    HA   ILE  98           HA       ILE  98   4.550   3.520   8.326
  Start of MODEL   19
13385    HB   ILE  98           HB       ILE  98   3.723   1.791   7.009
  Start of MODEL   19
13386   HD13  ILE  98          HD11      ILE  98   6.738   1.917   7.999
  Start of MODEL   19
13387   HD12  ILE  98          HD12      ILE  98   7.125   0.311   7.336
  Start of MODEL   19
13388   HD11  ILE  98          HD13      ILE  98   5.575   0.602   8.208
  Start of MODEL   19
13389    H    ILE  98           HN       ILE  98   3.803   5.009   5.955
  Start of MODEL   19
13390    HA   MET  99           HA       MET  99   8.413   5.178   7.269
  Start of MODEL   19
13391    HB3  MET  99           HB2      MET  99   8.619   4.708  10.249
  Start of MODEL   19
13392    HB2  MET  99           HB3      MET  99   7.847   6.123   9.544
  Start of MODEL   19
13393    HG2  MET  99           HG2      MET  99  10.164   6.545  10.267
  Start of MODEL   19
13394    HG3  MET  99           HG3      MET  99  10.721   5.333   9.109
  Start of MODEL   19
13395    HE3  MET  99           HE1      MET  99  11.889   8.257   9.101
  Start of MODEL   19
13396    HE2  MET  99           HE2      MET  99  11.842   8.652   7.382
  Start of MODEL   19
13397    HE1  MET  99           HE3      MET  99  12.343   7.043   7.897
  Start of MODEL   19
13398    H    MET  99           HN       MET  99   6.558   3.665   8.969
  Start of MODEL   19
13399    HA   ALA 100           HA       ALA 100  10.482   1.347   7.507
  Start of MODEL   19
13400    HB1  ALA 100           HB1      ALA 100  10.488   2.082   4.580
  Start of MODEL   19
13401    HB3  ALA 100           HB2      ALA 100   9.280   1.073   5.390
  Start of MODEL   19
13402    HB2  ALA 100           HB3      ALA 100  10.945   0.514   5.243
  Start of MODEL   19
13403    H    ALA 100           HN       ALA 100   9.752   3.881   6.239
  Start of MODEL   19
13404    HA   ALA 101           HA       ALA 101  14.593   2.676   6.649
  Start of MODEL   19
13405    HB2  ALA 101           HB1      ALA 101  15.781   2.358   8.759
  Start of MODEL   19
13406    HB1  ALA 101           HB2      ALA 101  14.469   1.319   9.334
  Start of MODEL   19
13407    HB3  ALA 101           HB3      ALA 101  14.170   3.031   9.001
  Start of MODEL   19
13408    H    ALA 101           HN       ALA 101  12.629   0.679   7.404
  Start of MODEL   19
13409    HA   PHE 102           HA       PHE 102  17.308  -0.707   6.078
  Start of MODEL   19
13410    HB3  PHE 102           HB2      PHE 102  15.796  -0.267   3.484
  Start of MODEL   19
13411    HB2  PHE 102           HB3      PHE 102  15.414  -1.472   4.708
  Start of MODEL   19
13412    HD1  PHE 102           HD1      PHE 102  17.556  -2.964   5.325
  Start of MODEL   19
13413    HD2  PHE 102           HD2      PHE 102  16.849  -1.043   1.615
  Start of MODEL   19
13414    HE1  PHE 102           HE1      PHE 102  19.036  -4.603   4.201
  Start of MODEL   19
13415    HE2  PHE 102           HE2      PHE 102  18.293  -2.642   0.479
  Start of MODEL   19
13416    HZ   PHE 102           HZ       PHE 102  19.410  -4.438   1.766
  Start of MODEL   19
13417    H    PHE 102           HN       PHE 102  16.140   1.823   5.574
  Start of MODEL   19
13418    HA   MET 103           HA       MET 103  19.938   2.178   4.075
  Start of MODEL   19
13419    HB3  MET 103           HB2      MET 103  21.692   3.060   5.587
  Start of MODEL   19
13420    HB2  MET 103           HB3      MET 103  21.133   1.961   6.845
  Start of MODEL   19
13421    HG2  MET 103           HG2      MET 103  20.439   4.357   7.055
  Start of MODEL   19
13422    HG3  MET 103           HG3      MET 103  19.366   3.987   5.706
  Start of MODEL   19
13423    HE2  MET 103           HE1      MET 103  17.006   4.152   8.875
  Start of MODEL   19
13424    HE1  MET 103           HE2      MET 103  17.334   4.820   7.276
  Start of MODEL   19
13425    HE3  MET 103           HE3      MET 103  18.472   5.092   8.594
  Start of MODEL   19
13426    H    MET 103           HN       MET 103  19.162   0.468   6.315
  Start of MODEL   19
13427    HA   ASP 104           HA       ASP 104  22.790  -1.108   3.501
  Start of MODEL   19
13428    HB3  ASP 104           HB2      ASP 104  21.272  -1.893   1.681
  Start of MODEL   19
13429    HB2  ASP 104           HB3      ASP 104  22.958  -1.915   1.200
  Start of MODEL   19
13430    H    ASP 104           HN       ASP 104  20.703   0.672   2.610
  Start of MODEL   19
13431    HA   ASN 105           HA       ASN 105  25.700   1.827   2.293
  Start of MODEL   19
13432    HB3  ASN 105           HB2      ASN 105  26.891  -0.057   4.341
  Start of MODEL   19
13433    HB2  ASN 105           HB3      ASN 105  26.092   1.472   4.652
  Start of MODEL   19
13434   HD21  ASN 105          HD21      ASN 105  29.006  -0.043   3.606
  Start of MODEL   19
13435   HD22  ASN 105          HD22      ASN 105  29.994   1.356   3.597
  Start of MODEL   19
13436    H    ASN 105           HN       ASN 105  24.900  -0.861   3.142
  Start of MODEL   19
13437    HA   PRO 106           HA       PRO 106  27.755  -0.328  -1.095
  Start of MODEL   19
13438    HB3  PRO 106           HB2      PRO 106  28.685   1.396  -2.354
  Start of MODEL   19
13439    HB2  PRO 106           HB3      PRO 106  29.478   2.113  -0.946
  Start of MODEL   19
13440    HG2  PRO 106           HG2      PRO 106  27.701   3.602  -1.267
  Start of MODEL   19
13441    HG3  PRO 106           HG3      PRO 106  26.618   2.312  -1.818
  Start of MODEL   19
13442    HD2  PRO 106           HD2      PRO 106  27.450   3.021   0.964
  Start of MODEL   19
13443    HD3  PRO 106           HD3      PRO 106  25.869   2.487   0.347
  Start of MODEL   19
13444    HA   PHE 107           HA       PHE 107  30.695  -3.209   0.084
  Start of MODEL   19
13445    HB3  PHE 107           HB2      PHE 107  32.201  -0.673   0.850
  Start of MODEL   19
13446    HB2  PHE 107           HB3      PHE 107  32.275  -1.427  -0.735
  Start of MODEL   19
13447    HD1  PHE 107           HD1      PHE 107  33.643  -1.348   2.553
  Start of MODEL   19
13448    HD2  PHE 107           HD2      PHE 107  33.229  -3.771  -0.920
  Start of MODEL   19
13449    HE1  PHE 107           HE1      PHE 107  35.518  -2.748   3.308
  Start of MODEL   19
13450    HE2  PHE 107           HE2      PHE 107  35.105  -5.168  -0.176
  Start of MODEL   19
13451    HZ   PHE 107           HZ       PHE 107  36.302  -4.624   1.879
  Start of MODEL   19
13452    H    PHE 107           HN       PHE 107  29.034  -1.918  -0.602
  Start of MODEL   20
13453    H1   ASP   1           H        ASP   1 -29.506   7.839  -7.381
  Start of MODEL   20
13454    H2   ASP   1           H2       ASP   1 -30.231   7.377  -8.855
  Start of MODEL   20
13455    H3   ASP   1           H3       ASP   1 -28.878   6.540  -8.251
  Start of MODEL   20
13456    HA   ASP   1           HA       ASP   1 -31.475   6.714  -6.892
  Start of MODEL   20
13457    HB3  ASP   1           HB2      ASP   1 -30.233   4.255  -8.177
  Start of MODEL   20
13458    HB2  ASP   1           HB3      ASP   1 -31.290   5.317  -9.084
  Start of MODEL   20
13459    HA   ASP   2           HA       ASP   2 -28.663   4.403  -4.147
  Start of MODEL   20
13460    HB3  ASP   2           HB2      ASP   2 -31.189   5.285  -2.727
  Start of MODEL   20
13461    HB2  ASP   2           HB3      ASP   2 -29.813   6.317  -3.103
  Start of MODEL   20
13462    H    ASP   2           HN       ASP   2 -31.189   4.373  -5.505
  Start of MODEL   20
13463    HA   ASP   3           HA       ASP   3 -30.826   0.511  -3.905
  Start of MODEL   20
13464    HB3  ASP   3           HB2      ASP   3 -30.276   0.400  -6.366
  Start of MODEL   20
13465    HB2  ASP   3           HB3      ASP   3 -30.144  -1.133  -5.516
  Start of MODEL   20
13466    H    ASP   3           HN       ASP   3 -28.833   2.315  -5.070
  Start of MODEL   20
13467    HA   ASP   4           HA       ASP   4 -26.848  -1.070  -2.170
  Start of MODEL   20
13468    HB3  ASP   4           HB2      ASP   4 -25.162   1.269  -3.075
  Start of MODEL   20
13469    HB2  ASP   4           HB3      ASP   4 -25.295  -0.276  -3.907
  Start of MODEL   20
13470    H    ASP   4           HN       ASP   4 -27.525   1.360  -3.641
  Start of MODEL   20
13471    HA   ASP   5           HA       ASP   5 -27.321   1.357   1.446
  Start of MODEL   20
13472    HB3  ASP   5           HB2      ASP   5 -27.219  -1.541   2.308
  Start of MODEL   20
13473    HB2  ASP   5           HB3      ASP   5 -28.662  -0.596   1.973
  Start of MODEL   20
13474    H    ASP   5           HN       ASP   5 -26.593  -1.072  -0.022
  Start of MODEL   20
13475    HA   VAL   6           HA       VAL   6 -23.518   0.332   3.539
  Start of MODEL   20
13476    HB   VAL   6           HB       VAL   6 -21.953  -1.646   3.705
  Start of MODEL   20
13477    H    VAL   6           HN       VAL   6 -24.828  -1.206   1.497
  Start of MODEL   20
13478    HA   SER   7           HA       SER   7 -20.463   1.426   0.749
  Start of MODEL   20
13479    HB3  SER   7           HB2      SER   7 -21.534   4.104   1.722
  Start of MODEL   20
13480    HB2  SER   7           HB3      SER   7 -22.003   3.331   0.209
  Start of MODEL   20
13481    HG   SER   7           HG       SER   7 -20.032   4.965   0.560
  Start of MODEL   20
13482    H    SER   7           HN       SER   7 -22.572   1.988   2.681
  Start of MODEL   20
13483    HA   PHE   8           HA       PHE   8 -18.393   1.498   4.590
  Start of MODEL   20
13484    HB3  PHE   8           HB2      PHE   8 -16.363  -0.005   4.439
  Start of MODEL   20
13485    HB2  PHE   8           HB3      PHE   8 -16.869  -0.393   2.798
  Start of MODEL   20
13486    HD1  PHE   8           HD1      PHE   8 -18.582  -1.980   2.389
  Start of MODEL   20
13487    HD2  PHE   8           HD2      PHE   8 -17.857  -0.603   6.345
  Start of MODEL   20
13488    HE1  PHE   8           HE1      PHE   8 -20.066  -3.730   3.264
  Start of MODEL   20
13489    HE2  PHE   8           HE2      PHE   8 -19.333  -2.355   7.230
  Start of MODEL   20
13490    HZ   PHE   8           HZ       PHE   8 -20.440  -3.925   5.688
  Start of MODEL   20
13491    H    PHE   8           HN       PHE   8 -18.961   0.571   1.981
  Start of MODEL   20
13492    HA   CYS   9           HA       CYS   9 -15.892   4.737   3.367
  Start of MODEL   20
13493    HB3  CYS   9           HB2      CYS   9 -15.645   4.886   6.367
  Start of MODEL   20
13494    HB2  CYS   9           HB3      CYS   9 -17.167   5.268   5.577
  Start of MODEL   20
13495    H    CYS   9           HN       CYS   9 -17.015   2.893   5.285
  Start of MODEL   20
13496    HA   ALA  10           HA       ALA  10 -12.052   2.943   3.907
  Start of MODEL   20
13497    HB3  ALA  10           HB1      ALA  10 -11.911   4.111   1.768
  Start of MODEL   20
13498    HB2  ALA  10           HB2      ALA  10 -10.347   4.028   2.577
  Start of MODEL   20
13499    HB1  ALA  10           HB3      ALA  10 -11.266   5.531   2.590
  Start of MODEL   20
13500    H    ALA  10           HN       ALA  10 -13.578   5.408   3.657
  Start of MODEL   20
13501    HA   SER  11           HA       SER  11  -9.433   4.842   6.779
  Start of MODEL   20
13502    HB3  SER  11           HB2      SER  11  -9.417   3.542   8.862
  Start of MODEL   20
13503    HB2  SER  11           HB3      SER  11 -10.229   2.196   8.059
  Start of MODEL   20
13504    HG   SER  11           HG       SER  11 -12.020   3.335   7.894
  Start of MODEL   20
13505    H    SER  11           HN       SER  11 -10.802   2.598   5.509
  Start of MODEL   20
13506    HA   VAL  12           HA       VAL  12  -6.223   2.199   5.454
  Start of MODEL   20
13507    HB   VAL  12           HB       VAL  12  -5.072   5.009   5.667
  Start of MODEL   20
13508    H    VAL  12           HN       VAL  12  -7.186   4.487   7.019
  Start of MODEL   20
13509    HA   GLN  13           HA       GLN  13  -3.743   1.798   8.993
  Start of MODEL   20
13510    HB3  GLN  13           HB2      GLN  13  -4.057  -0.400   9.998
  Start of MODEL   20
13511    HB2  GLN  13           HB3      GLN  13  -4.951  -0.930   8.585
  Start of MODEL   20
13512    HG2  GLN  13           HG2      GLN  13  -5.785   1.157  10.579
  Start of MODEL   20
13513    HG3  GLN  13           HG3      GLN  13  -6.655   0.811   9.082
  Start of MODEL   20
13514   HE21  GLN  13          HE21      GLN  13  -7.495   0.501  11.865
  Start of MODEL   20
13515   HE22  GLN  13          HE22      GLN  13  -7.967  -1.150  12.020
  Start of MODEL   20
13516    H    GLN  13           HN       GLN  13  -5.240   0.781   6.704
  Start of MODEL   20
13517    HA   LEU  14           HA       LEU  14  -0.658  -0.223   6.747
  Start of MODEL   20
13518    HB3  LEU  14           HB2      LEU  14   1.506   1.182   7.038
  Start of MODEL   20
13519    HB2  LEU  14           HB3      LEU  14   0.448   2.374   7.782
  Start of MODEL   20
13520    HG   LEU  14           HG       LEU  14  -0.944   2.240   5.619
  Start of MODEL   20
13521   HD11  LEU  14          HD11      LEU  14   1.889   3.254   5.445
  Start of MODEL   20
13522   HD13  LEU  14          HD12      LEU  14   0.489   4.145   6.069
  Start of MODEL   20
13523   HD12  LEU  14          HD13      LEU  14   0.559   3.676   4.367
  Start of MODEL   20
13524   HD22  LEU  14          HD21      LEU  14   0.224   1.434   3.665
  Start of MODEL   20
13525   HD21  LEU  14          HD22      LEU  14  -0.009   0.139   4.845
  Start of MODEL   20
13526   HD23  LEU  14          HD23      LEU  14   1.571   0.909   4.677
  Start of MODEL   20
13527    H    LEU  14           HN       LEU  14  -1.656   1.728   8.622
  Start of MODEL   20
13528    HA   HIS  15           HA       HIS  15   1.385  -2.065  10.143
  Start of MODEL   20
13529    HB3  HIS  15           HB2      HIS  15   1.608  -4.438   9.459
  Start of MODEL   20
13530    HB2  HIS  15           HB3      HIS  15   1.422  -3.987   7.777
  Start of MODEL   20
13531    HD1  HIS  15           HD1      HIS  15  -0.431  -5.737  10.047
  Start of MODEL   20
13532    HD2  HIS  15           HD2      HIS  15  -1.373  -2.466   7.674
  Start of MODEL   20
13533    HE1  HIS  15           HE1      HIS  15  -2.928  -5.780   9.802
  Start of MODEL   20
13534    HE2  HIS  15           HE2      HIS  15  -3.481  -3.803   8.334
  Start of MODEL   20
13535    H    HIS  15           HN       HIS  15   1.359  -1.352   7.292
  Start of MODEL   20
13536    HA   THR  16           HA       THR  16   5.601  -1.426   9.584
  Start of MODEL   20
13537    HB   THR  16           HB       THR  16   5.653  -3.504  11.782
  Start of MODEL   20
13538    HG1  THR  16           HG1      THR  16   4.560  -2.080  12.869
  Start of MODEL   20
13539   HG22  THR  16          HG21      THR  16   7.678  -2.305  12.476
  Start of MODEL   20
13540   HG21  THR  16          HG22      THR  16   7.446  -1.146  11.167
  Start of MODEL   20
13541   HG23  THR  16          HG23      THR  16   7.832  -2.821  10.789
  Start of MODEL   20
13542    H    THR  16           HN       THR  16   3.418  -2.566  10.861
  Start of MODEL   20
13543    HA   ALA  17           HA       ALA  17   6.623  -4.381   6.595
  Start of MODEL   20
13544    HB2  ALA  17           HB1      ALA  17   9.248  -2.985   7.064
  Start of MODEL   20
13545    HB1  ALA  17           HB2      ALA  17   7.949  -2.345   6.080
  Start of MODEL   20
13546    HB3  ALA  17           HB3      ALA  17   8.739  -3.853   5.609
  Start of MODEL   20
13547    H    ALA  17           HN       ALA  17   7.025  -2.194   8.237
  Start of MODEL   20
13548    HA   VAL  18           HA       VAL  18   8.593  -7.431   8.913
  Start of MODEL   20
13549    HB   VAL  18           HB       VAL  18   8.102  -9.684   7.959
  Start of MODEL   20
13550    H    VAL  18           HN       VAL  18   7.448  -6.368   6.464
  Start of MODEL   20
13551    HA   GLU  19           HA       GLU  19  12.460  -7.484   7.228
  Start of MODEL   20
13552    HB3  GLU  19           HB2      GLU  19  14.042  -8.203   8.916
  Start of MODEL   20
13553    HB2  GLU  19           HB3      GLU  19  12.758  -9.020   9.791
  Start of MODEL   20
13554    HG2  GLU  19           HG2      GLU  19  12.987  -6.061   9.295
  Start of MODEL   20
13555    HG3  GLU  19           HG3      GLU  19  11.637  -6.855  10.112
  Start of MODEL   20
13556    H    GLU  19           HN       GLU  19  10.468  -8.522   9.028
  Start of MODEL   20
13557    HA   MET  20           HA       MET  20  14.219 -11.087   5.700
  Start of MODEL   20
13558    HB3  MET  20           HB2      MET  20  11.973 -11.972   5.529
  Start of MODEL   20
13559    HB2  MET  20           HB3      MET  20  12.721 -12.155   3.957
  Start of MODEL   20
13560    HG2  MET  20           HG2      MET  20  10.816  -9.959   4.677
  Start of MODEL   20
13561    HG3  MET  20           HG3      MET  20  11.499 -10.291   3.085
  Start of MODEL   20
13562    HE3  MET  20           HE1      MET  20   8.384  -9.967   3.562
  Start of MODEL   20
13563    HE2  MET  20           HE2      MET  20   7.731 -11.317   2.640
  Start of MODEL   20
13564    HE1  MET  20           HE3      MET  20   9.063 -10.359   1.981
  Start of MODEL   20
13565    H    MET  20           HN       MET  20  13.138  -8.550   5.595
  Start of MODEL   20
13566    HA   HIS  21           HA       HIS  21  16.296  -9.553   2.345
  Start of MODEL   20
13567    HB3  HIS  21           HB2      HIS  21  15.311 -11.507   0.286
  Start of MODEL   20
13568    HB2  HIS  21           HB3      HIS  21  16.360 -12.036   1.592
  Start of MODEL   20
13569    HD1  HIS  21           HD1      HIS  21  16.561 -10.957  -1.787
  Start of MODEL   20
13570    HD2  HIS  21           HD2      HIS  21  18.826 -10.248   1.616
  Start of MODEL   20
13571    HE1  HIS  21           HE1      HIS  21  18.789 -10.160  -2.612
  Start of MODEL   20
13572    HE2  HIS  21           HE2      HIS  21  20.165  -9.811  -0.541
  Start of MODEL   20
13573    H    HIS  21           HN       HIS  21  14.468 -11.614   2.979
  Start of MODEL   20
13574    HA   HIS  22           HA       HIS  22  13.191  -7.714  -0.276
  Start of MODEL   20
13575    HB3  HIS  22           HB2      HIS  22  12.785  -9.276  -2.099
  Start of MODEL   20
13576    HB2  HIS  22           HB3      HIS  22  11.296  -8.424  -1.777
  Start of MODEL   20
13577    HD1  HIS  22           HD1      HIS  22  12.587 -11.773  -2.249
  Start of MODEL   20
13578    HD2  HIS  22           HD2      HIS  22   9.317 -10.067  -0.341
  Start of MODEL   20
13579    HE1  HIS  22           HE1      HIS  22  10.930 -13.615  -1.991
  Start of MODEL   20
13580    HE2  HIS  22           HE2      HIS  22   8.917 -12.557  -0.958
  Start of MODEL   20
13581    H    HIS  22           HN       HIS  22  13.247 -10.454   0.739
  Start of MODEL   20
13582    HA   TRP  23           HA       TRP  23  10.651  -6.940   3.012
  Start of MODEL   20
13583    HB3  TRP  23           HB2      TRP  23  10.262  -4.489   3.220
  Start of MODEL   20
13584    HB2  TRP  23           HB3      TRP  23  10.947  -4.305   1.610
  Start of MODEL   20
13585    HD1  TRP  23           HD1      TRP  23  13.578  -4.745   1.328
  Start of MODEL   20
13586    HE1  TRP  23           HE1      TRP  23  15.506  -4.619   3.045
  Start of MODEL   20
13587    HE3  TRP  23           HE3      TRP  23  10.862  -4.863   5.644
  Start of MODEL   20
13588    HZ2  TRP  23           HZ2      TRP  23  15.831  -4.556   5.833
  Start of MODEL   20
13589    HZ3  TRP  23           HZ3      TRP  23  12.046  -4.757   7.790
  Start of MODEL   20
13590    HH2  TRP  23           HH2      TRP  23  14.485  -4.604   7.884
  Start of MODEL   20
13591    H    TRP  23           HN       TRP  23  11.831  -6.241   0.477
  Start of MODEL   20
13592    HA   CYS  24           HA       CYS  24   6.609  -6.108   1.533
  Start of MODEL   20
13593    HB3  CYS  24           HB2      CYS  24   6.550  -8.314   3.620
  Start of MODEL   20
13594    HB2  CYS  24           HB3      CYS  24   6.728  -8.533   1.889
  Start of MODEL   20
13595    H    CYS  24           HN       CYS  24   8.575  -6.586   3.634
  Start of MODEL   20
13596    HA   ILE  25           HA       ILE  25   5.071  -3.749   4.925
  Start of MODEL   20
13597    HB   ILE  25           HB       ILE  25   4.667  -2.053   2.434
  Start of MODEL   20
13598   HD11  ILE  25          HD11      ILE  25   6.222   0.369   3.583
  Start of MODEL   20
13599   HD13  ILE  25          HD12      ILE  25   6.540  -0.306   1.985
  Start of MODEL   20
13600   HD12  ILE  25          HD13      ILE  25   7.849  -0.163   3.157
  Start of MODEL   20
13601    H    ILE  25           HN       ILE  25   5.501  -4.383   2.093
  Start of MODEL   20
13602    HA   PRO  26           HA       PRO  26   1.053  -5.512   3.670
  Start of MODEL   20
13603    HB3  PRO  26           HB2      PRO  26   0.710  -7.056   5.312
  Start of MODEL   20
13604    HB2  PRO  26           HB3      PRO  26   0.549  -5.788   6.525
  Start of MODEL   20
13605    HG2  PRO  26           HG2      PRO  26   2.554  -6.635   7.273
  Start of MODEL   20
13606    HG3  PRO  26           HG3      PRO  26   2.958  -7.314   5.687
  Start of MODEL   20
13607    HD2  PRO  26           HD2      PRO  26   3.324  -4.523   6.705
  Start of MODEL   20
13608    HD3  PRO  26           HD3      PRO  26   4.392  -5.513   5.683
  Start of MODEL   20
13609    HA   PHE  27           HA       PHE  27  -1.386  -2.341   5.474
  Start of MODEL   20
13610    HB3  PHE  27           HB2      PHE  27  -0.448  -1.272   3.483
  Start of MODEL   20
13611    HB2  PHE  27           HB3      PHE  27  -2.134  -0.824   3.688
  Start of MODEL   20
13612    HD1  PHE  27           HD1      PHE  27  -3.845  -1.671   2.173
  Start of MODEL   20
13613    HD2  PHE  27           HD2      PHE  27   0.277  -2.490   1.570
  Start of MODEL   20
13614    HE1  PHE  27           HE1      PHE  27  -4.323  -2.328  -0.147
  Start of MODEL   20
13615    HE2  PHE  27           HE2      PHE  27  -0.189  -3.148  -0.746
  Start of MODEL   20
13616    HZ   PHE  27           HZ       PHE  27  -2.494  -3.073  -1.609
  Start of MODEL   20
13617    H    PHE  27           HN       PHE  27  -0.930  -4.513   3.600
  Start of MODEL   20
13618    HA   SER  28           HA       SER  28  -5.445  -3.530   4.439
  Start of MODEL   20
13619    HB3  SER  28           HB2      SER  28  -5.288  -4.605   6.511
  Start of MODEL   20
13620    HB2  SER  28           HB3      SER  28  -6.677  -3.542   6.722
  Start of MODEL   20
13621    HG   SER  28           HG       SER  28  -5.657  -2.507   8.196
  Start of MODEL   20
13622    H    SER  28           HN       SER  28  -3.564  -1.782   5.735
  Start of MODEL   20
13623    HA   VAL  29           HA       VAL  29  -7.773   0.139   4.386
  Start of MODEL   20
13624    HB   VAL  29           HB       VAL  29  -6.146   0.789   2.554
  Start of MODEL   20
13625    H    VAL  29           HN       VAL  29  -6.722  -2.369   3.323
  Start of MODEL   20
13626    HA   ASP  30           HA       ASP  30 -11.179  -1.856   2.518
  Start of MODEL   20
13627    HB3  ASP  30           HB2      ASP  30 -11.180  -2.451   4.943
  Start of MODEL   20
13628    HB2  ASP  30           HB3      ASP  30 -12.770  -2.420   4.190
  Start of MODEL   20
13629    H    ASP  30           HN       ASP  30 -10.007   0.283   4.100
  Start of MODEL   20
13630    HA2  GLY  31           HA2      GLY  31 -14.922   0.686   2.372
  Start of MODEL   20
13631    H    GLY  31           HN       GLY  31 -13.374  -1.505   2.004
  Start of MODEL   20
13632    HA3  GLY  31           HA1      GLY  31 -13.809   1.145   1.081
  Start of MODEL   20
13633    HA   GLN  32           HA       GLN  32 -16.801  -1.756  -0.596
  Start of MODEL   20
13634    HB3  GLN  32           HB2      GLN  32 -18.991   0.349  -0.496
  Start of MODEL   20
13635    HB2  GLN  32           HB3      GLN  32 -18.791  -0.837   0.773
  Start of MODEL   20
13636    HG2  GLN  32           HG2      GLN  32 -19.087  -2.611  -1.015
  Start of MODEL   20
13637    HG3  GLN  32           HG3      GLN  32 -20.503  -1.669  -0.575
  Start of MODEL   20
13638   HE21  GLN  32          HE21      GLN  32 -19.795  -3.175  -2.980
  Start of MODEL   20
13639   HE22  GLN  32          HE22      GLN  32 -19.990  -2.066  -4.285
  Start of MODEL   20
13640    H    GLN  32           HN       GLN  32 -16.659   0.724   0.874
  Start of MODEL   20
13641    HA   PRO  33           HA       PRO  33 -16.612   1.238  -4.320
  Start of MODEL   20
13642    HB3  PRO  33           HB2      PRO  33 -17.612   3.326  -4.055
  Start of MODEL   20
13643    HB2  PRO  33           HB3      PRO  33 -15.948   3.856  -3.768
  Start of MODEL   20
13644    HG2  PRO  33           HG2      PRO  33 -16.211   3.851  -1.469
  Start of MODEL   20
13645    HG3  PRO  33           HG3      PRO  33 -17.875   4.243  -1.946
  Start of MODEL   20
13646    HD2  PRO  33           HD2      PRO  33 -17.271   2.134  -0.375
  Start of MODEL   20
13647    HD3  PRO  33           HD3      PRO  33 -18.624   2.119  -1.526
  Start of MODEL   20
13648    HA   ALA  34           HA       ALA  34 -12.523   0.169  -3.306
  Start of MODEL   20
13649    HB2  ALA  34           HB1      ALA  34 -11.317  -0.420  -5.319
  Start of MODEL   20
13650    HB1  ALA  34           HB2      ALA  34 -12.575   0.331  -6.304
  Start of MODEL   20
13651    HB3  ALA  34           HB3      ALA  34 -12.948  -1.098  -5.332
  Start of MODEL   20
13652    H    ALA  34           HN       ALA  34 -14.682   0.653  -5.008
  Start of MODEL   20
13653    HA   PRO  35           HA       PRO  35 -10.962   4.337  -3.464
  Start of MODEL   20
13654    HB3  PRO  35           HB2      PRO  35 -10.933   4.202  -1.160
  Start of MODEL   20
13655    HB2  PRO  35           HB3      PRO  35  -9.197   4.174  -1.496
  Start of MODEL   20
13656    HG2  PRO  35           HG2      PRO  35  -9.048   1.900  -1.227
  Start of MODEL   20
13657    HG3  PRO  35           HG3      PRO  35 -10.316   2.241  -0.051
  Start of MODEL   20
13658    HD2  PRO  35           HD2      PRO  35 -10.632   0.484  -2.168
  Start of MODEL   20
13659    HD3  PRO  35           HD3      PRO  35 -11.986   1.365  -1.428
  Start of MODEL   20
13660    HA   SER  36           HA       SER  36  -7.405   3.448  -5.761
  Start of MODEL   20
13661    HB3  SER  36           HB2      SER  36  -8.122   5.029  -7.303
  Start of MODEL   20
13662    HB2  SER  36           HB3      SER  36  -6.654   5.790  -6.680
  Start of MODEL   20
13663    HG   SER  36           HG       SER  36  -7.784   7.312  -5.878
  Start of MODEL   20
13664    H    SER  36           HN       SER  36  -9.404   5.139  -4.725
  Start of MODEL   20
13665    HA   LEU  37           HA       LEU  37  -4.786   4.407  -2.426
  Start of MODEL   20
13666    HB3  LEU  37           HB2      LEU  37  -3.190   2.582  -2.160
  Start of MODEL   20
13667    HB2  LEU  37           HB3      LEU  37  -3.693   1.899  -3.693
  Start of MODEL   20
13668    HG   LEU  37           HG       LEU  37  -5.943   1.494  -2.724
  Start of MODEL   20
13669   HD12  LEU  37          HD11      LEU  37  -3.678   0.347  -1.107
  Start of MODEL   20
13670   HD11  LEU  37          HD12      LEU  37  -4.151  -0.186  -2.713
  Start of MODEL   20
13671   HD13  LEU  37          HD13      LEU  37  -5.269  -0.374  -1.364
  Start of MODEL   20
13672   HD21  LEU  37          HD21      LEU  37  -5.955   3.248  -1.040
  Start of MODEL   20
13673   HD23  LEU  37          HD22      LEU  37  -4.617   2.461  -0.200
  Start of MODEL   20
13674   HD22  LEU  37          HD23      LEU  37  -6.191   1.676  -0.272
  Start of MODEL   20
13675    H    LEU  37           HN       LEU  37  -5.627   2.957  -4.784
  Start of MODEL   20
13676    HA   ARG  38           HA       ARG  38  -1.362   5.806  -4.691
  Start of MODEL   20
13677    HB3  ARG  38           HB2      ARG  38  -2.544   8.214  -3.278
  Start of MODEL   20
13678    HB2  ARG  38           HB3      ARG  38  -3.002   7.635  -4.862
  Start of MODEL   20
13679    HG2  ARG  38           HG2      ARG  38  -1.534   9.563  -5.028
  Start of MODEL   20
13680    HG3  ARG  38           HG3      ARG  38  -0.294   8.706  -4.109
  Start of MODEL   20
13681    HD2  ARG  38           HD2      ARG  38   0.070   8.682  -6.553
  Start of MODEL   20
13682    HD3  ARG  38           HD3      ARG  38  -0.057   7.072  -5.841
  Start of MODEL   20
13683    HE   ARG  38           HE       ARG  38  -2.491   8.220  -6.931
  Start of MODEL   20
13684   HH11  ARG  38          HH11      ARG  38   0.175   5.923  -7.411
  Start of MODEL   20
13685   HH12  ARG  38          HH12      ARG  38  -0.593   5.083  -8.668
  Start of MODEL   20
13686   HH21  ARG  38          HH21      ARG  38  -3.552   7.032  -8.630
  Start of MODEL   20
13687   HH22  ARG  38          HH22      ARG  38  -2.775   5.731  -9.394
  Start of MODEL   20
13688    H    ARG  38           HN       ARG  38  -3.214   5.779  -2.421
  Start of MODEL   20
13689    HA   TRP  39           HA       TRP  39   1.329   6.016  -1.291
  Start of MODEL   20
13690    HB3  TRP  39           HB2      TRP  39   3.550   5.112  -1.934
  Start of MODEL   20
13691    HB2  TRP  39           HB3      TRP  39   2.984   4.974  -3.592
  Start of MODEL   20
13692    HD1  TRP  39           HD1      TRP  39   1.565   2.886  -4.224
  Start of MODEL   20
13693    HE1  TRP  39           HE1      TRP  39   0.893   0.771  -2.987
  Start of MODEL   20
13694    HE3  TRP  39           HE3      TRP  39   2.864   4.316   0.511
  Start of MODEL   20
13695    HZ2  TRP  39           HZ2      TRP  39   0.875  -0.187  -0.291
  Start of MODEL   20
13696    HZ3  TRP  39           HZ3      TRP  39   2.490   2.743   2.363
  Start of MODEL   20
13697    HH2  TRP  39           HH2      TRP  39   1.528   0.539   1.975
  Start of MODEL   20
13698    H    TRP  39           HN       TRP  39   0.709   5.738  -4.111
  Start of MODEL   20
13699    HA   LEU  40           HA       LEU  40   3.642   9.501  -2.415
  Start of MODEL   20
13700    HB3  LEU  40           HB2      LEU  40   2.354  10.258   0.224
  Start of MODEL   20
13701    HB2  LEU  40           HB3      LEU  40   1.486  10.300  -1.296
  Start of MODEL   20
13702    HG   LEU  40           HG       LEU  40   3.938  11.957  -0.778
  Start of MODEL   20
13703   HD13  LEU  40          HD11      LEU  40   3.531  11.519  -3.094
  Start of MODEL   20
13704   HD12  LEU  40          HD12      LEU  40   3.081  13.188  -2.725
  Start of MODEL   20
13705   HD11  LEU  40          HD13      LEU  40   1.832  11.942  -2.911
  Start of MODEL   20
13706   HD22  LEU  40          HD21      LEU  40   2.414  13.796  -0.449
  Start of MODEL   20
13707   HD21  LEU  40          HD22      LEU  40   2.084  12.532   0.743
  Start of MODEL   20
13708   HD23  LEU  40          HD23      LEU  40   1.033  12.724  -0.656
  Start of MODEL   20
13709    H    LEU  40           HN       LEU  40   2.292   7.696  -0.544
  Start of MODEL   20
13710    HA   PHE  41           HA       PHE  41   6.744   8.517   0.518
  Start of MODEL   20
13711    HB3  PHE  41           HB2      PHE  41   7.865   8.500  -2.290
  Start of MODEL   20
13712    HB2  PHE  41           HB3      PHE  41   7.150   7.141  -1.438
  Start of MODEL   20
13713    HD1  PHE  41           HD1      PHE  41  10.156   8.770  -2.241
  Start of MODEL   20
13714    HD2  PHE  41           HD2      PHE  41   8.283   6.399   0.745
  Start of MODEL   20
13715    HE1  PHE  41           HE1      PHE  41  12.363   8.124  -1.375
  Start of MODEL   20
13716    HE2  PHE  41           HE2      PHE  41  10.483   5.745   1.613
  Start of MODEL   20
13717    HZ   PHE  41           HZ       PHE  41  12.528   6.520   0.472
  Start of MODEL   20
13718    H    PHE  41           HN       PHE  41   5.736   9.782  -1.934
  Start of MODEL   20
13719    HA   ASN  42           HA       ASN  42   8.429  11.934   2.593
  Start of MODEL   20
13720    HB3  ASN  42           HB2      ASN  42  10.522  12.741   1.497
  Start of MODEL   20
13721    HB2  ASN  42           HB3      ASN  42  10.190  11.662   0.150
  Start of MODEL   20
13722   HD21  ASN  42          HD21      ASN  42  12.127  10.662   0.433
  Start of MODEL   20
13723   HD22  ASN  42          HD22      ASN  42  12.439   9.537   1.692
  Start of MODEL   20
13724    H    ASN  42           HN       ASN  42   7.425  10.070   1.760
  Start of MODEL   20
13725    HA2  GLY  43           HA2      GLY  43   5.022  14.240   0.317
  Start of MODEL   20
13726    H    GLY  43           HN       GLY  43   6.193  12.264   0.774
  Start of MODEL   20
13727    HA3  GLY  43           HA1      GLY  43   6.547  15.114   0.250
  Start of MODEL   20
13728    HA   SER  44           HA       SER  44   6.368  13.893  -4.020
  Start of MODEL   20
13729    HB3  SER  44           HB2      SER  44   8.808  13.931  -3.783
  Start of MODEL   20
13730    HB2  SER  44           HB3      SER  44   8.343  12.844  -5.082
  Start of MODEL   20
13731    HG   SER  44           HG       SER  44   8.619  11.626  -2.591
  Start of MODEL   20
13732    H    SER  44           HN       SER  44   7.304  12.615  -1.536
  Start of MODEL   20
13733    HA   VAL  45           HA       VAL  45   3.954  10.642  -4.989
  Start of MODEL   20
13734    HB   VAL  45           HB       VAL  45   4.769  11.631  -7.744
  Start of MODEL   20
13735    H    VAL  45           HN       VAL  45   5.802  12.670  -5.749
  Start of MODEL   20
13736    HA   LEU  46           HA       LEU  46   6.837   7.501  -5.772
  Start of MODEL   20
13737    HB3  LEU  46           HB2      LEU  46   4.814   6.304  -3.876
  Start of MODEL   20
13738    HB2  LEU  46           HB3      LEU  46   6.242   7.183  -3.390
  Start of MODEL   20
13739    HG   LEU  46           HG       LEU  46   6.260   4.564  -4.888
  Start of MODEL   20
13740   HD11  LEU  46          HD11      LEU  46   8.497   6.167  -3.665
  Start of MODEL   20
13741   HD13  LEU  46          HD12      LEU  46   8.216   5.900  -5.388
  Start of MODEL   20
13742   HD12  LEU  46          HD13      LEU  46   8.648   4.549  -4.343
  Start of MODEL   20
13743   HD22  LEU  46          HD21      LEU  46   7.050   3.615  -2.757
  Start of MODEL   20
13744   HD21  LEU  46          HD22      LEU  46   5.422   4.271  -2.626
  Start of MODEL   20
13745   HD23  LEU  46          HD23      LEU  46   6.790   5.173  -1.977
  Start of MODEL   20
13746    H    LEU  46           HN       LEU  46   4.338   8.554  -4.747
  Start of MODEL   20
13747    HA   ASN  47           HA       ASN  47   4.133   5.693  -8.702
  Start of MODEL   20
13748    HB3  ASN  47           HB2      ASN  47   5.379   5.468 -10.930
  Start of MODEL   20
13749    HB2  ASN  47           HB3      ASN  47   6.697   6.349 -10.174
  Start of MODEL   20
13750   HD21  ASN  47          HD21      ASN  47   3.485   6.575 -11.455
  Start of MODEL   20
13751   HD22  ASN  47          HD22      ASN  47   3.408   8.298 -11.458
  Start of MODEL   20
13752    H    ASN  47           HN       ASN  47   6.609   6.874  -7.807
  Start of MODEL   20
13753    HA   GLU  48           HA       GLU  48   5.540   1.678  -7.898
  Start of MODEL   20
13754    HB3  GLU  48           HB2      GLU  48   4.011   0.025  -8.775
  Start of MODEL   20
13755    HB2  GLU  48           HB3      GLU  48   3.336   1.196  -9.899
  Start of MODEL   20
13756    HG2  GLU  48           HG2      GLU  48   3.226   1.489  -6.912
  Start of MODEL   20
13757    HG3  GLU  48           HG3      GLU  48   2.414   2.468  -8.110
  Start of MODEL   20
13758    H    GLU  48           HN       GLU  48   3.836   3.548  -9.116
  Start of MODEL   20
13759    HA   THR  49           HA       THR  49   7.831   0.800 -11.526
  Start of MODEL   20
13760    HB   THR  49           HB       THR  49  10.230   0.840 -10.639
  Start of MODEL   20
13761    HG1  THR  49           HG1      THR  49   9.213   1.877  -8.286
  Start of MODEL   20
13762   HG23  THR  49          HG21      THR  49   9.137   2.877 -11.513
  Start of MODEL   20
13763   HG22  THR  49          HG22      THR  49  10.189   3.255 -10.146
  Start of MODEL   20
13764   HG21  THR  49          HG23      THR  49   8.444   3.179  -9.917
  Start of MODEL   20
13765    H    THR  49           HN       THR  49   7.104   0.518  -8.695
  Start of MODEL   20
13766    HA   SER  50           HA       SER  50   8.955  -3.428 -10.904
  Start of MODEL   20
13767    HB3  SER  50           HB2      SER  50  10.913  -4.261 -12.056
  Start of MODEL   20
13768    HB2  SER  50           HB3      SER  50  11.691  -2.678 -11.956
  Start of MODEL   20
13769    HG   SER  50           HG       SER  50  10.717  -2.216 -13.727
  Start of MODEL   20
13770    H    SER  50           HN       SER  50  10.095  -0.841 -11.445
  Start of MODEL   20
13771    HA   PHE  51           HA       PHE  51  11.997  -3.060  -7.456
  Start of MODEL   20
13772    HB3  PHE  51           HB2      PHE  51  13.038  -1.039  -6.434
  Start of MODEL   20
13773    HB2  PHE  51           HB3      PHE  51  12.135  -0.034  -7.557
  Start of MODEL   20
13774    HD1  PHE  51           HD1      PHE  51  15.014  -2.157  -7.102
  Start of MODEL   20
13775    HD2  PHE  51           HD2      PHE  51  12.657  -0.098  -9.978
  Start of MODEL   20
13776    HE1  PHE  51           HE1      PHE  51  16.837  -2.362  -8.734
  Start of MODEL   20
13777    HE2  PHE  51           HE2      PHE  51  14.482  -0.295 -11.616
  Start of MODEL   20
13778    HZ   PHE  51           HZ       PHE  51  16.569  -1.429 -10.998
  Start of MODEL   20
13779    H    PHE  51           HN       PHE  51  10.560  -1.137  -9.149
  Start of MODEL   20
13780    HA   ILE  52           HA       ILE  52   8.625  -1.439  -4.799
  Start of MODEL   20
13781    HB   ILE  52           HB       ILE  52   8.407   1.299  -6.096
  Start of MODEL   20
13782   HD12  ILE  52          HD11      ILE  52  11.277   2.600  -4.037
  Start of MODEL   20
13783   HD11  ILE  52          HD12      ILE  52   9.577   2.763  -3.603
  Start of MODEL   20
13784   HD13  ILE  52          HD13      ILE  52  10.099   3.075  -5.261
  Start of MODEL   20
13785    H    ILE  52           HN       ILE  52   9.472  -0.665  -7.512
  Start of MODEL   20
13786    HA   PHE  53           HA       PHE  53   4.800  -1.447  -7.033
  Start of MODEL   20
13787    HB3  PHE  53           HB2      PHE  53   5.696  -4.337  -7.236
  Start of MODEL   20
13788    HB2  PHE  53           HB3      PHE  53   6.145  -3.069  -8.364
  Start of MODEL   20
13789    HD1  PHE  53           HD1      PHE  53   4.271  -1.897  -9.630
  Start of MODEL   20
13790    HD2  PHE  53           HD2      PHE  53   3.792  -5.607  -7.623
  Start of MODEL   20
13791    HE1  PHE  53           HE1      PHE  53   2.280  -2.372 -11.000
  Start of MODEL   20
13792    HE2  PHE  53           HE2      PHE  53   1.805  -6.099  -8.988
  Start of MODEL   20
13793    HZ   PHE  53           HZ       PHE  53   1.084  -4.511 -10.724
  Start of MODEL   20
13794    H    PHE  53           HN       PHE  53   6.778  -2.706  -5.291
  Start of MODEL   20
13795    HA   THR  54           HA       THR  54   2.328  -2.918  -3.729
  Start of MODEL   20
13796    HB   THR  54           HB       THR  54   0.133  -1.828  -5.498
  Start of MODEL   20
13797    HG1  THR  54           HG1      THR  54   1.620  -0.278  -5.549
  Start of MODEL   20
13798   HG21  THR  54          HG21      THR  54   0.588  -1.794  -2.515
  Start of MODEL   20
13799   HG23  THR  54          HG22      THR  54  -0.504  -2.877  -3.380
  Start of MODEL   20
13800   HG22  THR  54          HG23      THR  54  -0.820  -1.141  -3.353
  Start of MODEL   20
13801    H    THR  54           HN       THR  54   2.668  -1.793  -6.378
  Start of MODEL   20
13802    HA   GLU  55           HA       GLU  55   0.587  -6.329  -5.830
  Start of MODEL   20
13803    HB3  GLU  55           HB2      GLU  55   1.588  -8.450  -4.996
  Start of MODEL   20
13804    HB2  GLU  55           HB3      GLU  55   2.415  -7.537  -3.740
  Start of MODEL   20
13805    HG2  GLU  55           HG2      GLU  55   2.761  -7.143  -6.705
  Start of MODEL   20
13806    HG3  GLU  55           HG3      GLU  55   3.634  -6.284  -5.438
  Start of MODEL   20
13807    H    GLU  55           HN       GLU  55   1.949  -5.072  -3.591
  Start of MODEL   20
13808    HA   PHE  56           HA       PHE  56  -2.605  -6.812  -2.871
  Start of MODEL   20
13809    HB3  PHE  56           HB2      PHE  56  -4.738  -6.660  -4.093
  Start of MODEL   20
13810    HB2  PHE  56           HB3      PHE  56  -3.869  -6.681  -5.617
  Start of MODEL   20
13811    HD1  PHE  56           HD1      PHE  56  -4.968  -4.669  -2.848
  Start of MODEL   20
13812    HD2  PHE  56           HD2      PHE  56  -2.462  -4.759  -6.282
  Start of MODEL   20
13813    HE1  PHE  56           HE1      PHE  56  -4.860  -2.225  -2.828
  Start of MODEL   20
13814    HE2  PHE  56           HE2      PHE  56  -2.336  -2.305  -6.259
  Start of MODEL   20
13815    HZ   PHE  56           HZ       PHE  56  -3.539  -1.033  -4.541
  Start of MODEL   20
13816    H    PHE  56           HN       PHE  56  -1.418  -6.732  -5.545
  Start of MODEL   20
13817    HA   LEU  57           HA       LEU  57  -3.659 -10.898  -3.987
  Start of MODEL   20
13818    HB3  LEU  57           HB2      LEU  57  -2.677 -11.208  -1.698
  Start of MODEL   20
13819    HB2  LEU  57           HB3      LEU  57  -3.993 -12.307  -2.033
  Start of MODEL   20
13820    HG   LEU  57           HG       LEU  57  -4.530  -9.850  -0.432
  Start of MODEL   20
13821   HD13  LEU  57          HD11      LEU  57  -6.412 -11.186  -1.240
  Start of MODEL   20
13822   HD12  LEU  57          HD12      LEU  57  -6.295 -11.255   0.522
  Start of MODEL   20
13823   HD11  LEU  57          HD13      LEU  57  -5.724 -12.603  -0.470
  Start of MODEL   20
13824   HD21  LEU  57          HD21      LEU  57  -2.601 -10.888   0.629
  Start of MODEL   20
13825   HD23  LEU  57          HD22      LEU  57  -3.420 -12.451   0.609
  Start of MODEL   20
13826   HD22  LEU  57          HD23      LEU  57  -4.052 -11.139   1.600
  Start of MODEL   20
13827    H    LEU  57           HN       LEU  57  -3.911  -8.570  -2.251
  Start of MODEL   20
13828    HA   GLU  58           HA       GLU  58  -7.901 -10.409  -4.286
  Start of MODEL   20
13829    HB3  GLU  58           HB2      GLU  58  -8.930 -12.280  -5.496
  Start of MODEL   20
13830    HB2  GLU  58           HB3      GLU  58  -7.562 -13.277  -4.978
  Start of MODEL   20
13831    HG2  GLU  58           HG2      GLU  58  -7.296 -10.818  -6.700
  Start of MODEL   20
13832    HG3  GLU  58           HG3      GLU  58  -6.037 -11.975  -6.292
  Start of MODEL   20
13833    H    GLU  58           HN       GLU  58  -5.709 -12.280  -3.845
  Start of MODEL   20
13834    HA   PRO  59           HA       PRO  59  -9.228 -12.161  -0.361
  Start of MODEL   20
13835    HB3  PRO  59           HB2      PRO  59  -8.939 -10.013   0.453
  Start of MODEL   20
13836    HB2  PRO  59           HB3      PRO  59 -10.704 -10.091   0.459
  Start of MODEL   20
13837    HG2  PRO  59           HG2      PRO  59 -10.895  -8.806  -1.439
  Start of MODEL   20
13838    HG3  PRO  59           HG3      PRO  59  -9.349  -8.157  -0.859
  Start of MODEL   20
13839    HD2  PRO  59           HD2      PRO  59  -9.791  -9.459  -3.300
  Start of MODEL   20
13840    HD3  PRO  59           HD3      PRO  59  -8.206  -9.145  -2.556
  Start of MODEL   20
13841    HA   ALA  60           HA       ALA  60 -13.176 -13.617  -1.332
  Start of MODEL   20
13842    HB2  ALA  60           HB1      ALA  60 -14.464 -14.234   0.684
  Start of MODEL   20
13843    HB1  ALA  60           HB2      ALA  60 -13.349 -13.279   1.661
  Start of MODEL   20
13844    HB3  ALA  60           HB3      ALA  60 -12.768 -14.720   0.821
  Start of MODEL   20
13845    H    ALA  60           HN       ALA  60 -11.277 -12.677   0.532
  Start of MODEL   20
13846    HA   ALA  61           HA       ALA  61 -15.308  -9.910  -1.836
  Start of MODEL   20
13847    HB3  ALA  61           HB1      ALA  61 -16.136 -11.227  -3.720
  Start of MODEL   20
13848    HB2  ALA  61           HB2      ALA  61 -17.401 -10.187  -3.067
  Start of MODEL   20
13849    HB1  ALA  61           HB3      ALA  61 -17.394 -11.911  -2.695
  Start of MODEL   20
13850    H    ALA  61           HN       ALA  61 -15.097 -12.707  -1.931
  Start of MODEL   20
13851    HA   ASN  62           HA       ASN  62 -18.462 -10.972   1.638
  Start of MODEL   20
13852    HB3  ASN  62           HB2      ASN  62 -16.272 -12.701   2.797
  Start of MODEL   20
13853    HB2  ASN  62           HB3      ASN  62 -17.742 -13.300   2.053
  Start of MODEL   20
13854   HD21  ASN  62          HD21      ASN  62 -19.523 -11.361   3.251
  Start of MODEL   20
13855   HD22  ASN  62          HD22      ASN  62 -19.618 -11.773   4.917
  Start of MODEL   20
13856    H    ASN  62           HN       ASN  62 -16.222 -12.184   0.378
  Start of MODEL   20
13857    HA   GLU  63           HA       GLU  63 -15.209  -8.494   3.838
  Start of MODEL   20
13858    HB3  GLU  63           HB2      GLU  63 -12.735  -8.340   3.517
  Start of MODEL   20
13859    HB2  GLU  63           HB3      GLU  63 -12.869  -9.562   2.259
  Start of MODEL   20
13860    HG2  GLU  63           HG2      GLU  63 -13.666 -10.047   5.093
  Start of MODEL   20
13861    HG3  GLU  63           HG3      GLU  63 -13.508 -11.225   3.784
  Start of MODEL   20
13862    H    GLU  63           HN       GLU  63 -15.040 -10.379   1.621
  Start of MODEL   20
13863    HA   THR  64           HA       THR  64 -14.754  -5.482   0.687
  Start of MODEL   20
13864    HB   THR  64           HB       THR  64 -15.593  -3.279   1.712
  Start of MODEL   20
13865    HG1  THR  64           HG1      THR  64 -15.479  -3.456   3.850
  Start of MODEL   20
13866   HG23  THR  64          HG21      THR  64 -17.045  -4.760   0.382
  Start of MODEL   20
13867   HG22  THR  64          HG22      THR  64 -17.944  -4.036   1.715
  Start of MODEL   20
13868   HG21  THR  64          HG23      THR  64 -17.399  -5.710   1.824
  Start of MODEL   20
13869    H    THR  64           HN       THR  64 -15.053  -6.321   3.455
  Start of MODEL   20
13870    HA   VAL  65           HA       VAL  65 -11.080  -3.908   2.823
  Start of MODEL   20
13871    HB   VAL  65           HB       VAL  65 -10.466  -6.613   4.028
  Start of MODEL   20
13872    H    VAL  65           HN       VAL  65 -12.581  -6.393   2.363
  Start of MODEL   20
13873    HA   ARG  66           HA       ARG  66  -8.589  -5.642  -0.324
  Start of MODEL   20
13874    HB3  ARG  66           HB2      ARG  66  -6.853  -3.936  -0.968
  Start of MODEL   20
13875    HB2  ARG  66           HB3      ARG  66  -7.554  -2.868   0.225
  Start of MODEL   20
13876    HG2  ARG  66           HG2      ARG  66  -8.968  -3.944  -2.198
  Start of MODEL   20
13877    HG3  ARG  66           HG3      ARG  66  -9.658  -2.852  -0.990
  Start of MODEL   20
13878    HD2  ARG  66           HD2      ARG  66  -8.162  -1.108  -1.569
  Start of MODEL   20
13879    HD3  ARG  66           HD3      ARG  66  -7.140  -2.196  -2.505
  Start of MODEL   20
13880    HE   ARG  66           HE       ARG  66  -9.823  -2.002  -3.432
  Start of MODEL   20
13881   HH11  ARG  66          HH11      ARG  66  -6.715  -0.328  -3.549
  Start of MODEL   20
13882   HH12  ARG  66          HH12      ARG  66  -6.849   0.178  -5.164
  Start of MODEL   20
13883   HH21  ARG  66          HH21      ARG  66  -9.959  -1.421  -5.735
  Start of MODEL   20
13884   HH22  ARG  66          HH22      ARG  66  -8.749  -0.482  -6.452
  Start of MODEL   20
13885    H    ARG  66           HN       ARG  66  -9.337  -3.630   1.623
  Start of MODEL   20
13886    HA   HIS  67           HA       HIS  67  -5.298  -6.550   2.324
  Start of MODEL   20
13887    HB3  HIS  67           HB2      HIS  67  -5.006  -9.045   2.472
  Start of MODEL   20
13888    HB2  HIS  67           HB3      HIS  67  -6.294  -9.222   1.285
  Start of MODEL   20
13889    HD1  HIS  67           HD1      HIS  67  -5.724  -8.150   4.848
  Start of MODEL   20
13890    HD2  HIS  67           HD2      HIS  67  -8.882  -9.045   2.303
  Start of MODEL   20
13891    HE1  HIS  67           HE1      HIS  67  -7.756  -8.265   6.313
  Start of MODEL   20
13892    HE2  HIS  67           HE2      HIS  67  -9.562  -9.139   4.792
  Start of MODEL   20
13893    H    HIS  67           HN       HIS  67  -7.216  -7.131   0.202
  Start of MODEL   20
13894    HA2  GLY  68           HA2      GLY  68  -2.051  -7.670  -0.378
  Start of MODEL   20
13895    H    GLY  68           HN       GLY  68  -3.239  -6.259   1.760
  Start of MODEL   20
13896    HA3  GLY  68           HA1      GLY  68  -2.426  -6.005  -0.819
  Start of MODEL   20
13897    HA   CYS  69           HA       CYS  69   1.196  -5.142   1.402
  Start of MODEL   20
13898    HB3  CYS  69           HB2      CYS  69   2.143  -7.615  -0.031
  Start of MODEL   20
13899    HB2  CYS  69           HB3      CYS  69   1.730  -7.443   1.668
  Start of MODEL   20
13900    H    CYS  69           HN       CYS  69   0.035  -6.298  -1.004
  Start of MODEL   20
13901    HA   LEU  70           HA       LEU  70   3.306  -3.085  -1.876
  Start of MODEL   20
13902    HB3  LEU  70           HB2      LEU  70   4.149  -1.610   0.645
  Start of MODEL   20
13903    HB2  LEU  70           HB3      LEU  70   2.838  -1.132  -0.409
  Start of MODEL   20
13904    HG   LEU  70           HG       LEU  70   5.729  -1.261  -1.268
  Start of MODEL   20
13905   HD11  LEU  70          HD11      LEU  70   3.307  -0.071  -2.575
  Start of MODEL   20
13906   HD13  LEU  70          HD12      LEU  70   4.214  -1.489  -3.122
  Start of MODEL   20
13907   HD12  LEU  70          HD13      LEU  70   4.965   0.111  -3.129
  Start of MODEL   20
13908   HD23  LEU  70          HD21      LEU  70   4.085   1.114  -0.429
  Start of MODEL   20
13909   HD22  LEU  70          HD22      LEU  70   5.691   1.181  -1.152
  Start of MODEL   20
13910   HD21  LEU  70          HD23      LEU  70   5.471   0.450   0.441
  Start of MODEL   20
13911    H    LEU  70           HN       LEU  70   2.605  -3.532   0.906
  Start of MODEL   20
13912    HA   ARG  71           HA       ARG  71   6.718  -5.354  -0.580
  Start of MODEL   20
13913    HB3  ARG  71           HB2      ARG  71   5.657  -6.858  -2.976
  Start of MODEL   20
13914    HB2  ARG  71           HB3      ARG  71   5.289  -7.191  -1.292
  Start of MODEL   20
13915    HG2  ARG  71           HG2      ARG  71   7.875  -7.619  -2.751
  Start of MODEL   20
13916    HG3  ARG  71           HG3      ARG  71   7.790  -7.594  -0.993
  Start of MODEL   20
13917    HD2  ARG  71           HD2      ARG  71   7.665  -9.878  -1.862
  Start of MODEL   20
13918    HD3  ARG  71           HD3      ARG  71   6.189  -9.427  -1.018
  Start of MODEL   20
13919    HE   ARG  71           HE       ARG  71   5.840  -8.904  -3.749
  Start of MODEL   20
13920   HH11  ARG  71          HH11      ARG  71   6.213 -11.713  -1.597
  Start of MODEL   20
13921   HH12  ARG  71          HH12      ARG  71   5.331 -12.745  -2.623
  Start of MODEL   20
13922   HH21  ARG  71          HH21      ARG  71   4.679 -10.366  -5.110
  Start of MODEL   20
13923   HH22  ARG  71          HH22      ARG  71   4.470 -11.991  -4.622
  Start of MODEL   20
13924    H    ARG  71           HN       ARG  71   4.731  -4.548  -2.523
  Start of MODEL   20
13925    HA   LEU  72           HA       LEU  72   9.407  -3.330  -3.229
  Start of MODEL   20
13926    HB3  LEU  72           HB2      LEU  72  11.514  -2.996  -1.968
  Start of MODEL   20
13927    HB2  LEU  72           HB3      LEU  72  10.942  -4.096  -0.722
  Start of MODEL   20
13928    HG   LEU  72           HG       LEU  72   9.022  -2.499  -0.322
  Start of MODEL   20
13929   HD13  LEU  72          HD11      LEU  72  10.911  -2.420   1.152
  Start of MODEL   20
13930   HD12  LEU  72          HD12      LEU  72  10.292  -0.793   0.836
  Start of MODEL   20
13931   HD11  LEU  72          HD13      LEU  72  11.774  -1.343   0.039
  Start of MODEL   20
13932   HD22  LEU  72          HD21      LEU  72   9.236  -0.224  -1.183
  Start of MODEL   20
13933   HD21  LEU  72          HD22      LEU  72   9.013  -1.411  -2.475
  Start of MODEL   20
13934   HD23  LEU  72          HD23      LEU  72  10.621  -0.751  -2.142
  Start of MODEL   20
13935    H    LEU  72           HN       LEU  72   8.613  -4.649  -0.827
  Start of MODEL   20
13936    HA   ASN  73           HA       ASN  73  10.071  -7.266  -4.925
  Start of MODEL   20
13937    HB3  ASN  73           HB2      ASN  73  10.165  -7.072  -7.299
  Start of MODEL   20
13938    HB2  ASN  73           HB3      ASN  73  10.745  -5.412  -7.212
  Start of MODEL   20
13939   HD21  ASN  73          HD21      ASN  73   7.929  -7.471  -6.924
  Start of MODEL   20
13940   HD22  ASN  73          HD22      ASN  73   6.791  -6.179  -6.967
  Start of MODEL   20
13941    H    ASN  73           HN       ASN  73   9.815  -4.447  -4.876
  Start of MODEL   20
13942    HA   GLN  74           HA       GLN  74  14.496  -6.427  -4.977
  Start of MODEL   20
13943    HB3  GLN  74           HB2      GLN  74  14.839  -4.234  -7.000
  Start of MODEL   20
13944    HB2  GLN  74           HB3      GLN  74  14.077  -5.713  -7.551
  Start of MODEL   20
13945    HG2  GLN  74           HG2      GLN  74  16.022  -7.004  -7.042
  Start of MODEL   20
13946    HG3  GLN  74           HG3      GLN  74  16.498  -5.622  -8.016
  Start of MODEL   20
13947   HE21  GLN  74          HE21      GLN  74  17.788  -4.008  -7.050
  Start of MODEL   20
13948   HE22  GLN  74          HE22      GLN  74  18.577  -4.275  -5.551
  Start of MODEL   20
13949    H    GLN  74           HN       GLN  74  12.284  -4.649  -5.672
  Start of MODEL   20
13950    HA   PRO  75           HA       PRO  75  14.234  -2.807  -2.213
  Start of MODEL   20
13951    HB3  PRO  75           HB2      PRO  75  14.755  -3.683  -0.152
  Start of MODEL   20
13952    HB2  PRO  75           HB3      PRO  75  16.255  -4.404  -0.742
  Start of MODEL   20
13953    HG2  PRO  75           HG2      PRO  75  14.924  -6.300  -0.511
  Start of MODEL   20
13954    HG3  PRO  75           HG3      PRO  75  13.451  -5.426  -0.966
  Start of MODEL   20
13955    HD2  PRO  75           HD2      PRO  75  15.680  -6.404  -2.715
  Start of MODEL   20
13956    HD3  PRO  75           HD3      PRO  75  13.919  -6.492  -2.961
  Start of MODEL   20
13957    HA   THR  76           HA       THR  76  18.254  -1.226  -3.011
  Start of MODEL   20
13958    HB   THR  76           HB       THR  76  17.753   0.783  -4.562
  Start of MODEL   20
13959    HG1  THR  76           HG1      THR  76  15.237  -0.493  -4.664
  Start of MODEL   20
13960   HG22  THR  76          HG21      THR  76  17.305  -0.700  -6.490
  Start of MODEL   20
13961   HG21  THR  76          HG22      THR  76  16.881  -2.001  -5.379
  Start of MODEL   20
13962   HG23  THR  76          HG23      THR  76  18.530  -1.378  -5.416
  Start of MODEL   20
13963    H    THR  76           HN       THR  76  15.408  -1.055  -2.386
  Start of MODEL   20
13964    HA   HIS  77           HA       HIS  77  18.675   1.887  -0.198
  Start of MODEL   20
13965    HB3  HIS  77           HB2      HIS  77  20.949   1.857  -0.827
  Start of MODEL   20
13966    HB2  HIS  77           HB3      HIS  77  20.489   3.518  -0.507
  Start of MODEL   20
13967    HD1  HIS  77           HD1      HIS  77  21.341   1.243  -3.382
  Start of MODEL   20
13968    HD2  HIS  77           HD2      HIS  77  20.929   5.295  -2.563
  Start of MODEL   20
13969    HE1  HIS  77           HE1      HIS  77  22.313   2.447  -5.375
  Start of MODEL   20
13970    HE2  HIS  77           HE2      HIS  77  22.414   4.821  -4.596
  Start of MODEL   20
13971    H    HIS  77           HN       HIS  77  19.250   0.869  -2.714
  Start of MODEL   20
13972    HA   VAL  78           HA       VAL  78  16.531   5.458  -1.971
  Start of MODEL   20
13973    HB   VAL  78           HB       VAL  78  14.845   5.562  -3.762
  Start of MODEL   20
13974    H    VAL  78           HN       VAL  78  17.009   2.737  -2.827
  Start of MODEL   20
13975    HA   ASN  79           HA       ASN  79  12.830   2.910  -0.415
  Start of MODEL   20
13976    HB3  ASN  79           HB2      ASN  79  12.967   0.662   0.707
  Start of MODEL   20
13977    HB2  ASN  79           HB3      ASN  79  14.654   0.599   0.220
  Start of MODEL   20
13978   HD21  ASN  79          HD21      ASN  79  12.014   1.915  -1.684
  Start of MODEL   20
13979   HD22  ASN  79          HD22      ASN  79  12.126   0.736  -2.945
  Start of MODEL   20
13980    H    ASN  79           HN       ASN  79  15.603   2.435  -0.981
  Start of MODEL   20
13981    HA   ASN  80           HA       ASN  80  13.913   3.969   3.673
  Start of MODEL   20
13982    HB3  ASN  80           HB2      ASN  80  16.437   3.988   3.404
  Start of MODEL   20
13983    HB2  ASN  80           HB3      ASN  80  15.841   5.088   4.628
  Start of MODEL   20
13984   HD21  ASN  80          HD21      ASN  80  17.389   4.871   1.491
  Start of MODEL   20
13985   HD22  ASN  80          HD22      ASN  80  17.854   6.516   1.437
  Start of MODEL   20
13986    H    ASN  80           HN       ASN  80  14.763   4.655   0.955
  Start of MODEL   20
13987    HA2  GLY  81           HA2      GLY  81  12.376   7.956   4.682
  Start of MODEL   20
13988    H    GLY  81           HN       GLY  81  12.459   5.296   4.516
  Start of MODEL   20
13989    HA3  GLY  81           HA1      GLY  81  11.808   7.702   3.037
  Start of MODEL   20
13990    HA   ASN  82           HA       ASN  82   8.270   7.051   5.640
  Start of MODEL   20
13991    HB3  ASN  82           HB2      ASN  82   7.761   9.896   4.731
  Start of MODEL   20
13992    HB2  ASN  82           HB3      ASN  82   8.500   9.436   6.260
  Start of MODEL   20
13993   HD21  ASN  82          HD21      ASN  82   7.215   8.706   7.935
  Start of MODEL   20
13994   HD22  ASN  82          HD22      ASN  82   5.496   8.784   7.859
  Start of MODEL   20
13995    H    ASN  82           HN       ASN  82   9.876   8.755   3.897
  Start of MODEL   20
13996    HA   TYR  83           HA       TYR  83   5.861   6.328   1.992
  Start of MODEL   20
13997    HB3  TYR  83           HB2      TYR  83   5.005   3.967   2.129
  Start of MODEL   20
13998    HB2  TYR  83           HB3      TYR  83   5.649   3.853   3.757
  Start of MODEL   20
13999    HD1  TYR  83           HD1      TYR  83   6.331   3.185   0.343
  Start of MODEL   20
14000    HD2  TYR  83           HD2      TYR  83   8.261   4.269   3.992
  Start of MODEL   20
14001    HE1  TYR  83           HE1      TYR  83   8.449   2.376  -0.537
  Start of MODEL   20
14002    HE2  TYR  83           HE2      TYR  83  10.389   3.458   3.094
  Start of MODEL   20
14003    HH   TYR  83           HH       TYR  83  11.212   1.968   1.436
  Start of MODEL   20
14004    H    TYR  83           HN       TYR  83   6.707   5.826   4.744
  Start of MODEL   20
14005    HA   THR  84           HA       THR  84   2.084   7.319   4.129
  Start of MODEL   20
14006    HB   THR  84           HB       THR  84   2.328   9.389   1.937
  Start of MODEL   20
14007    HG1  THR  84           HG1      THR  84   3.672   9.144   4.329
  Start of MODEL   20
14008   HG23  THR  84          HG21      THR  84   0.060   9.195   2.875
  Start of MODEL   20
14009   HG22  THR  84          HG22      THR  84   0.799  10.721   3.347
  Start of MODEL   20
14010   HG21  THR  84          HG23      THR  84   0.710   9.395   4.501
  Start of MODEL   20
14011    H    THR  84           HN       THR  84   4.112   7.650   2.057
  Start of MODEL   20
14012    HA   LEU  85           HA       LEU  85  -0.323   5.677   0.829
  Start of MODEL   20
14013    HB3  LEU  85           HB2      LEU  85  -1.280   4.258   3.330
  Start of MODEL   20
14014    HB2  LEU  85           HB3      LEU  85   0.013   3.721   2.278
  Start of MODEL   20
14015    HG   LEU  85           HG       LEU  85  -2.904   3.908   1.515
  Start of MODEL   20
14016   HD13  LEU  85          HD11      LEU  85  -1.508   4.331  -0.380
  Start of MODEL   20
14017   HD12  LEU  85          HD12      LEU  85  -2.141   2.667  -0.477
  Start of MODEL   20
14018   HD11  LEU  85          HD13      LEU  85  -0.483   2.969   0.071
  Start of MODEL   20
14019   HD22  LEU  85          HD21      LEU  85  -2.867   1.524   1.497
  Start of MODEL   20
14020   HD21  LEU  85          HD22      LEU  85  -2.369   2.112   3.089
  Start of MODEL   20
14021   HD23  LEU  85          HD23      LEU  85  -1.161   1.498   1.950
  Start of MODEL   20
14022    H    LEU  85           HN       LEU  85   0.204   6.326   3.640
  Start of MODEL   20
14023    HA   LEU  86           HA       LEU  86  -4.003   7.964   1.585
  Start of MODEL   20
14024    HB3  LEU  86           HB2      LEU  86  -4.464   9.365  -0.415
  Start of MODEL   20
14025    HB2  LEU  86           HB3      LEU  86  -3.165   8.581  -1.266
  Start of MODEL   20
14026    HG   LEU  86           HG       LEU  86  -2.694  10.888  -0.520
  Start of MODEL   20
14027   HD11  LEU  86          HD11      LEU  86  -2.680   9.734   2.233
  Start of MODEL   20
14028   HD13  LEU  86          HD12      LEU  86  -3.791  10.940   1.581
  Start of MODEL   20
14029   HD12  LEU  86          HD13      LEU  86  -2.084  11.331   1.781
  Start of MODEL   20
14030   HD23  LEU  86          HD21      LEU  86  -0.845   8.769   0.566
  Start of MODEL   20
14031   HD22  LEU  86          HD22      LEU  86  -0.409  10.454   0.283
  Start of MODEL   20
14032   HD21  LEU  86          HD23      LEU  86  -0.852   9.421  -1.075
  Start of MODEL   20
14033    H    LEU  86           HN       LEU  86  -1.886   6.745  -0.062
  Start of MODEL   20
14034    HA   ALA  87           HA       ALA  87  -6.592   5.611  -1.131
  Start of MODEL   20
14035    HB1  ALA  87           HB1      ALA  87  -7.857   5.375   1.611
  Start of MODEL   20
14036    HB3  ALA  87           HB2      ALA  87  -6.643   4.286   0.956
  Start of MODEL   20
14037    HB2  ALA  87           HB3      ALA  87  -8.242   4.349   0.229
  Start of MODEL   20
14038    H    ALA  87           HN       ALA  87  -6.086   7.352   1.201
  Start of MODEL   20
14039    HA   ALA  88           HA       ALA  88  -9.601   8.737  -1.421
  Start of MODEL   20
14040    HB2  ALA  88           HB1      ALA  88  -9.876   9.426  -3.735
  Start of MODEL   20
14041    HB1  ALA  88           HB2      ALA  88  -8.983   8.002  -4.279
  Start of MODEL   20
14042    HB3  ALA  88           HB3      ALA  88  -8.170   9.250  -3.327
  Start of MODEL   20
14043    H    ALA  88           HN       ALA  88  -7.960   6.561  -2.465
  Start of MODEL   20
14044    HA   ASN  89           HA       ASN  89 -13.213   6.380  -2.320
  Start of MODEL   20
14045    HB3  ASN  89           HB2      ASN  89 -12.795   6.689   0.692
  Start of MODEL   20
14046    HB2  ASN  89           HB3      ASN  89 -12.409   5.273  -0.256
  Start of MODEL   20
14047   HD21  ASN  89          HD21      ASN  89 -13.592   3.814   0.920
  Start of MODEL   20
14048   HD22  ASN  89          HD22      ASN  89 -15.310   3.833   0.997
  Start of MODEL   20
14049    H    ASN  89           HN       ASN  89 -11.528   8.282  -0.840
  Start of MODEL   20
14050    HA   PRO  90           HA       PRO  90 -15.956   9.972  -2.578
  Start of MODEL   20
14051    HB3  PRO  90           HB2      PRO  90 -17.973   9.158  -3.355
  Start of MODEL   20
14052    HB2  PRO  90           HB3      PRO  90 -18.053   7.903  -2.114
  Start of MODEL   20
14053    HG2  PRO  90           HG2      PRO  90 -17.410   6.655  -3.977
  Start of MODEL   20
14054    HG3  PRO  90           HG3      PRO  90 -16.420   7.976  -4.627
  Start of MODEL   20
14055    HD2  PRO  90           HD2      PRO  90 -15.807   6.046  -2.431
  Start of MODEL   20
14056    HD3  PRO  90           HD3      PRO  90 -14.737   6.732  -3.669
  Start of MODEL   20
14057    HA   CYS  91           HA       CYS  91 -17.757   9.402   1.739
  Start of MODEL   20
14058    HB3  CYS  91           HB2      CYS  91 -15.952   7.065   2.392
  Start of MODEL   20
14059    HB2  CYS  91           HB3      CYS  91 -17.684   7.004   2.143
  Start of MODEL   20
14060    H    CYS  91           HN       CYS  91 -16.074   7.766   0.091
  Start of MODEL   20
14061    HA2  GLY  92           HA2      GLY  92 -13.520  11.640   1.800
  Start of MODEL   20
14062    H    GLY  92           HN       GLY  92 -14.371   9.306   0.966
  Start of MODEL   20
14063    HA3  GLY  92           HA1      GLY  92 -13.551  10.761   3.329
  Start of MODEL   20
14064    HA   GLN  93           HA       GLN  93  -9.867   9.366   1.137
  Start of MODEL   20
14065    HB3  GLN  93           HB2      GLN  93  -8.818  12.182   1.544
  Start of MODEL   20
14066    HB2  GLN  93           HB3      GLN  93  -9.374  11.489   0.026
  Start of MODEL   20
14067    HG2  GLN  93           HG2      GLN  93  -7.059  10.398   1.602
  Start of MODEL   20
14068    HG3  GLN  93           HG3      GLN  93  -7.540   9.961  -0.033
  Start of MODEL   20
14069   HE21  GLN  93          HE21      GLN  93  -6.021  12.323   1.966
  Start of MODEL   20
14070   HE22  GLN  93          HE22      GLN  93  -5.289  13.237   0.717
  Start of MODEL   20
14071    H    GLN  93           HN       GLN  93 -11.173  11.716   2.301
  Start of MODEL   20
14072    HA   ALA  94           HA       ALA  94  -8.138   8.911   5.137
  Start of MODEL   20
14073    HB1  ALA  94           HB1      ALA  94  -8.164   6.228   3.797
  Start of MODEL   20
14074    HB3  ALA  94           HB2      ALA  94  -9.333   6.808   4.997
  Start of MODEL   20
14075    HB2  ALA  94           HB3      ALA  94  -7.652   6.469   5.451
  Start of MODEL   20
14076    H    ALA  94           HN       ALA  94  -8.666   8.099   2.355
  Start of MODEL   20
14077    HA   SER  95           HA       SER  95  -3.937   7.875   4.098
  Start of MODEL   20
14078    HB3  SER  95           HB2      SER  95  -4.076  10.260   3.913
  Start of MODEL   20
14079    HB2  SER  95           HB3      SER  95  -2.639   9.882   4.860
  Start of MODEL   20
14080    HG   SER  95           HG       SER  95  -5.174  10.639   5.921
  Start of MODEL   20
14081    H    SER  95           HN       SER  95  -6.012   8.466   6.018
  Start of MODEL   20
14082    HA   ALA  96           HA       ALA  96  -1.678   7.202   7.912
  Start of MODEL   20
14083    HB1  ALA  96           HB1      ALA  96  -1.886   4.599   6.382
  Start of MODEL   20
14084    HB3  ALA  96           HB2      ALA  96  -3.017   5.149   7.619
  Start of MODEL   20
14085    HB2  ALA  96           HB3      ALA  96  -1.353   4.755   8.054
  Start of MODEL   20
14086    H    ALA  96           HN       ALA  96  -2.037   7.158   5.059
  Start of MODEL   20
14087    HA   SER  97           HA       SER  97   2.233   6.486   5.964
  Start of MODEL   20
14088    HB3  SER  97           HB2      SER  97   3.710   8.202   6.865
  Start of MODEL   20
14089    HB2  SER  97           HB3      SER  97   2.694   8.357   8.299
  Start of MODEL   20
14090    HG   SER  97           HG       SER  97   1.763   9.843   7.159
  Start of MODEL   20
14091    H    SER  97           HN       SER  97   0.584   6.594   8.368
  Start of MODEL   20
14092    HA   ILE  98           HA       ILE  98   4.665   4.169   8.789
  Start of MODEL   20
14093    HB   ILE  98           HB       ILE  98   3.182   2.540   7.551
  Start of MODEL   20
14094   HD11  ILE  98          HD11      ILE  98   6.987   2.004   7.945
  Start of MODEL   20
14095   HD13  ILE  98          HD12      ILE  98   6.434   0.808   6.770
  Start of MODEL   20
14096   HD12  ILE  98          HD13      ILE  98   6.745   0.325   8.440
  Start of MODEL   20
14097    H    ILE  98           HN       ILE  98   3.919   5.153   6.137
  Start of MODEL   20
14098    HA   MET  99           HA       MET  99   8.435   5.067   6.766
  Start of MODEL   20
14099    HB3  MET  99           HB2      MET  99   9.150   5.309   9.688
  Start of MODEL   20
14100    HB2  MET  99           HB3      MET  99   8.335   6.563   8.753
  Start of MODEL   20
14101    HG2  MET  99           HG2      MET  99  11.050   5.414   8.181
  Start of MODEL   20
14102    HG3  MET  99           HG3      MET  99  10.238   6.656   7.237
  Start of MODEL   20
14103    HE2  MET  99           HE1      MET  99  12.989   8.795   8.708
  Start of MODEL   20
14104    HE1  MET  99           HE2      MET  99  12.021   8.320   7.299
  Start of MODEL   20
14105    HE3  MET  99           HE3      MET  99  13.078   7.142   8.069
  Start of MODEL   20
14106    H    MET  99           HN       MET  99   6.888   4.105   9.074
  Start of MODEL   20
14107    HA   ALA 100           HA       ALA 100  11.109   1.731   7.701
  Start of MODEL   20
14108    HB2  ALA 100           HB1      ALA 100  11.147   0.230   5.736
  Start of MODEL   20
14109    HB1  ALA 100           HB2      ALA 100  10.323   1.455   4.777
  Start of MODEL   20
14110    HB3  ALA 100           HB3      ALA 100   9.497   0.700   6.136
  Start of MODEL   20
14111    H    ALA 100           HN       ALA 100  10.102   3.899   6.044
  Start of MODEL   20
14112    HA   ALA 101           HA       ALA 101  14.607   3.243   5.564
  Start of MODEL   20
14113    HB2  ALA 101           HB1      ALA 101  16.375   3.610   7.203
  Start of MODEL   20
14114    HB1  ALA 101           HB2      ALA 101  15.534   2.565   8.349
  Start of MODEL   20
14115    HB3  ALA 101           HB3      ALA 101  14.807   4.091   7.853
  Start of MODEL   20
14116    H    ALA 101           HN       ALA 101  13.310   1.433   7.450
  Start of MODEL   20
14117    HA   PHE 102           HA       PHE 102  17.343  -0.046   4.856
  Start of MODEL   20
14118    HB3  PHE 102           HB2      PHE 102  15.295  -0.153   2.630
  Start of MODEL   20
14119    HB2  PHE 102           HB3      PHE 102  15.215  -1.057   4.140
  Start of MODEL   20
14120    HD1  PHE 102           HD1      PHE 102  17.025  -2.638   4.644
  Start of MODEL   20
14121    HD2  PHE 102           HD2      PHE 102  16.490  -0.985   0.803
  Start of MODEL   20
14122    HE1  PHE 102           HE1      PHE 102  18.392  -4.482   3.677
  Start of MODEL   20
14123    HE2  PHE 102           HE2      PHE 102  17.840  -2.792  -0.194
  Start of MODEL   20
14124    HZ   PHE 102           HZ       PHE 102  18.793  -4.545   1.247
  Start of MODEL   20
14125    H    PHE 102           HN       PHE 102  15.817   2.196   4.092
  Start of MODEL   20
14126    HA   MET 103           HA       MET 103  19.317   1.758   1.493
  Start of MODEL   20
14127    HB3  MET 103           HB2      MET 103  20.227   3.369   3.008
  Start of MODEL   20
14128    HB2  MET 103           HB3      MET 103  21.553   2.715   2.070
  Start of MODEL   20
14129    HG2  MET 103           HG2      MET 103  20.886   2.066   4.925
  Start of MODEL   20
14130    HG3  MET 103           HG3      MET 103  22.131   1.247   3.984
  Start of MODEL   20
14131    HE2  MET 103           HE1      MET 103  22.289   5.774   4.915
  Start of MODEL   20
14132    HE1  MET 103           HE2      MET 103  20.909   4.751   5.326
  Start of MODEL   20
14133    HE3  MET 103           HE3      MET 103  21.293   5.090   3.639
  Start of MODEL   20
14134    H    MET 103           HN       MET 103  19.188   0.566   4.139
  Start of MODEL   20
14135    HA   ASP 104           HA       ASP 104  21.432  -1.969   0.672
  Start of MODEL   20
14136    HB3  ASP 104           HB2      ASP 104  19.539  -1.672  -1.263
  Start of MODEL   20
14137    HB2  ASP 104           HB3      ASP 104  20.788  -2.890  -1.368
  Start of MODEL   20
14138    H    ASP 104           HN       ASP 104  19.820   0.309  -0.006
  Start of MODEL   20
14139    HA   ASN 105           HA       ASN 105  24.889   0.235  -0.666
  Start of MODEL   20
14140    HB3  ASN 105           HB2      ASN 105  25.565  -1.240   1.876
  Start of MODEL   20
14141    HB2  ASN 105           HB3      ASN 105  25.031   0.425   1.717
  Start of MODEL   20
14142   HD21  ASN 105          HD21      ASN 105  27.670  -1.745   1.473
  Start of MODEL   20
14143   HD22  ASN 105          HD22      ASN 105  28.922  -0.577   1.269
  Start of MODEL   20
14144    H    ASN 105           HN       ASN 105  23.563  -2.090   0.506
  Start of MODEL   20
14145    HA   PRO 106           HA       PRO 106  27.139  -3.098  -2.634
  Start of MODEL   20
14146    HB3  PRO 106           HB2      PRO 106  26.288  -2.916  -4.714
  Start of MODEL   20
14147    HB2  PRO 106           HB3      PRO 106  27.470  -1.643  -4.944
  Start of MODEL   20
14148    HG2  PRO 106           HG2      PRO 106  25.701  -0.158  -5.093
  Start of MODEL   20
14149    HG3  PRO 106           HG3      PRO 106  24.558  -1.405  -4.569
  Start of MODEL   20
14150    HD2  PRO 106           HD2      PRO 106  26.018   0.622  -2.956
  Start of MODEL   20
14151    HD3  PRO 106           HD3      PRO 106  24.447  -0.157  -2.653
  Start of MODEL   20
14152    HA   PHE 107           HA       PHE 107  30.806  -0.693  -2.865
  Start of MODEL   20
14153    HB3  PHE 107           HB2      PHE 107  31.518  -3.293  -4.129
  Start of MODEL   20
14154    HB2  PHE 107           HB3      PHE 107  31.460  -3.044  -2.382
  Start of MODEL   20
14155    HD1  PHE 107           HD1      PHE 107  33.081  -1.470  -1.299
  Start of MODEL   20
14156    HD2  PHE 107           HD2      PHE 107  33.487  -2.699  -5.343
  Start of MODEL   20
14157    HE1  PHE 107           HE1      PHE 107  35.427  -0.746  -1.276
  Start of MODEL   20
14158    HE2  PHE 107           HE2      PHE 107  35.830  -1.980  -5.335
  Start of MODEL   20
14159    HZ   PHE 107           HZ       PHE 107  36.811  -1.000  -3.296
  Start of MODEL   20
14160    H    PHE 107           HN       PHE 107  29.188  -2.877  -3.906
  Start of MODEL   21
14161    H1   ASP   1           H        ASP   1 -26.049   4.706   0.300
  Start of MODEL   21
14162    H2   ASP   1           H2       ASP   1 -26.984   3.869  -0.843
  Start of MODEL   21
14163    H3   ASP   1           H3       ASP   1 -26.217   3.041   0.385
  Start of MODEL   21
14164    HA   ASP   1           HA       ASP   1 -27.492   3.907   2.061
  Start of MODEL   21
14165    HB3  ASP   1           HB2      ASP   1 -27.987   6.147   1.512
  Start of MODEL   21
14166    HB2  ASP   1           HB3      ASP   1 -29.554   5.355   1.475
  Start of MODEL   21
14167    HA   ASP   2           HA       ASP   2 -30.730   1.224   0.528
  Start of MODEL   21
14168    HB3  ASP   2           HB2      ASP   2 -32.131   3.058  -1.445
  Start of MODEL   21
14169    HB2  ASP   2           HB3      ASP   2 -32.465   2.968   0.273
  Start of MODEL   21
14170    H    ASP   2           HN       ASP   2 -29.844   3.808  -0.586
  Start of MODEL   21
14171    HA   ASP   3           HA       ASP   3 -29.609   0.781  -4.198
  Start of MODEL   21
14172    HB3  ASP   3           HB2      ASP   3 -28.767   3.074  -4.599
  Start of MODEL   21
14173    HB2  ASP   3           HB3      ASP   3 -27.652   1.867  -5.222
  Start of MODEL   21
14174    H    ASP   3           HN       ASP   3 -29.311   2.716  -2.186
  Start of MODEL   21
14175    HA   ASP   4           HA       ASP   4 -26.825  -1.628  -1.413
  Start of MODEL   21
14176    HB3  ASP   4           HB2      ASP   4 -24.583   0.425  -1.695
  Start of MODEL   21
14177    HB2  ASP   4           HB3      ASP   4 -25.019  -0.718  -2.957
  Start of MODEL   21
14178    H    ASP   4           HN       ASP   4 -27.423   1.156  -1.577
  Start of MODEL   21
14179    HA   ASP   5           HA       ASP   5 -27.595   0.171   2.343
  Start of MODEL   21
14180    HB3  ASP   5           HB2      ASP   5 -27.103  -2.695   3.112
  Start of MODEL   21
14181    HB2  ASP   5           HB3      ASP   5 -28.605  -2.047   2.473
  Start of MODEL   21
14182    H    ASP   5           HN       ASP   5 -26.584  -2.005   0.755
  Start of MODEL   21
14183    HA   VAL   6           HA       VAL   6 -23.940  -0.567   4.875
  Start of MODEL   21
14184    HB   VAL   6           HB       VAL   6 -21.945  -2.141   4.765
  Start of MODEL   21
14185    H    VAL   6           HN       VAL   6 -24.642  -1.766   2.363
  Start of MODEL   21
14186    HA   SER   7           HA       SER   7 -21.538   2.206   2.557
  Start of MODEL   21
14187    HB3  SER   7           HB2      SER   7 -22.551   3.865   4.853
  Start of MODEL   21
14188    HB2  SER   7           HB3      SER   7 -23.555   3.546   3.458
  Start of MODEL   21
14189    HG   SER   7           HG       SER   7 -22.210   4.715   2.201
  Start of MODEL   21
14190    H    SER   7           HN       SER   7 -23.278   1.405   4.723
  Start of MODEL   21
14191    HA   PHE   8           HA       PHE   8 -18.342   2.020   5.574
  Start of MODEL   21
14192    HB3  PHE   8           HB2      PHE   8 -16.602   0.353   4.982
  Start of MODEL   21
14193    HB2  PHE   8           HB3      PHE   8 -17.456   0.018   3.486
  Start of MODEL   21
14194    HD1  PHE   8           HD1      PHE   8 -18.662  -1.903   3.458
  Start of MODEL   21
14195    HD2  PHE   8           HD2      PHE   8 -18.299   0.250   7.104
  Start of MODEL   21
14196    HE1  PHE   8           HE1      PHE   8 -20.027  -3.590   4.588
  Start of MODEL   21
14197    HE2  PHE   8           HE2      PHE   8 -19.666  -1.441   8.243
  Start of MODEL   21
14198    HZ   PHE   8           HZ       PHE   8 -20.531  -3.358   6.980
  Start of MODEL   21
14199    H    PHE   8           HN       PHE   8 -19.576   1.319   3.013
  Start of MODEL   21
14200    HA   CYS   9           HA       CYS   9 -16.132   4.911   3.200
  Start of MODEL   21
14201    HB3  CYS   9           HB2      CYS   9 -15.186   5.498   6.008
  Start of MODEL   21
14202    HB2  CYS   9           HB3      CYS   9 -16.807   5.945   5.474
  Start of MODEL   21
14203    H    CYS   9           HN       CYS   9 -16.885   3.535   5.628
  Start of MODEL   21
14204    HA   ALA  10           HA       ALA  10 -12.233   3.074   3.222
  Start of MODEL   21
14205    HB2  ALA  10           HB1      ALA  10 -10.439   4.292   2.164
  Start of MODEL   21
14206    HB1  ALA  10           HB2      ALA  10 -11.219   5.817   2.554
  Start of MODEL   21
14207    HB3  ALA  10           HB3      ALA  10 -11.985   4.702   1.404
  Start of MODEL   21
14208    H    ALA  10           HN       ALA  10 -13.534   5.667   3.563
  Start of MODEL   21
14209    HA   SER  11           HA       SER  11  -9.794   4.090   6.648
  Start of MODEL   21
14210    HB3  SER  11           HB2      SER  11 -10.094   2.487   8.367
  Start of MODEL   21
14211    HB2  SER  11           HB3      SER  11 -10.349   1.182   7.211
  Start of MODEL   21
14212    HG   SER  11           HG       SER  11 -12.313   1.565   7.193
  Start of MODEL   21
14213    H    SER  11           HN       SER  11 -11.124   2.272   4.778
  Start of MODEL   21
14214    HA   VAL  12           HA       VAL  12  -6.344   1.808   5.171
  Start of MODEL   21
14215    HB   VAL  12           HB       VAL  12  -5.488   4.714   5.423
  Start of MODEL   21
14216    H    VAL  12           HN       VAL  12  -7.601   3.933   6.763
  Start of MODEL   21
14217    HA   GLN  13           HA       GLN  13  -3.883   1.620   8.742
  Start of MODEL   21
14218    HB3  GLN  13           HB2      GLN  13  -4.160  -0.565   9.872
  Start of MODEL   21
14219    HB2  GLN  13           HB3      GLN  13  -5.132  -1.121   8.521
  Start of MODEL   21
14220    HG2  GLN  13           HG2      GLN  13  -6.822   0.549   9.007
  Start of MODEL   21
14221    HG3  GLN  13           HG3      GLN  13  -6.523  -0.467  10.414
  Start of MODEL   21
14222   HE21  GLN  13          HE21      GLN  13  -7.685   2.146  10.304
  Start of MODEL   21
14223   HE22  GLN  13          HE22      GLN  13  -6.700   3.191  11.260
  Start of MODEL   21
14224    H    GLN  13           HN       GLN  13  -5.289   0.474   6.458
  Start of MODEL   21
14225    HA   LEU  14           HA       LEU  14  -0.610  -0.458   6.739
  Start of MODEL   21
14226    HB3  LEU  14           HB2      LEU  14   1.457   1.104   7.135
  Start of MODEL   21
14227    HB2  LEU  14           HB3      LEU  14   0.248   2.239   7.709
  Start of MODEL   21
14228    HG   LEU  14           HG       LEU  14  -0.912   1.804   5.408
  Start of MODEL   21
14229   HD13  LEU  14          HD11      LEU  14   0.175   3.910   6.000
  Start of MODEL   21
14230   HD12  LEU  14          HD12      LEU  14   0.494   3.461   4.329
  Start of MODEL   21
14231   HD11  LEU  14          HD13      LEU  14   1.745   3.231   5.555
  Start of MODEL   21
14232   HD22  LEU  14          HD21      LEU  14   0.474   1.033   3.660
  Start of MODEL   21
14233   HD21  LEU  14          HD22      LEU  14   0.664  -0.154   4.986
  Start of MODEL   21
14234   HD23  LEU  14          HD23      LEU  14   1.891   1.058   4.695
  Start of MODEL   21
14235    H    LEU  14           HN       LEU  14  -1.773   1.434   8.637
  Start of MODEL   21
14236    HA   HIS  15           HA       HIS  15   1.750  -1.847  10.184
  Start of MODEL   21
14237    HB3  HIS  15           HB2      HIS  15   2.086  -4.331   9.679
  Start of MODEL   21
14238    HB2  HIS  15           HB3      HIS  15   1.355  -4.028   8.108
  Start of MODEL   21
14239    HD1  HIS  15           HD1      HIS  15   0.492  -4.970  11.487
  Start of MODEL   21
14240    HD2  HIS  15           HD2      HIS  15  -1.440  -3.027   8.364
  Start of MODEL   21
14241    HE1  HIS  15           HE1      HIS  15  -1.944  -5.038  12.054
  Start of MODEL   21
14242    HE2  HIS  15           HE2      HIS  15  -3.102  -4.002  10.094
  Start of MODEL   21
14243    H    HIS  15           HN       HIS  15   1.358  -1.517   7.315
  Start of MODEL   21
14244    HA   THR  16           HA       THR  16   5.821  -1.200   9.333
  Start of MODEL   21
14245    HB   THR  16           HB       THR  16   6.201  -3.368  11.387
  Start of MODEL   21
14246    HG1  THR  16           HG1      THR  16   4.861  -0.969  11.470
  Start of MODEL   21
14247   HG21  THR  16          HG21      THR  16   7.689  -0.780  10.830
  Start of MODEL   21
14248   HG23  THR  16          HG22      THR  16   8.263  -2.392  10.405
  Start of MODEL   21
14249   HG22  THR  16          HG23      THR  16   8.077  -1.939  12.101
  Start of MODEL   21
14250    H    THR  16           HN       THR  16   3.832  -2.607  10.695
  Start of MODEL   21
14251    HA   ALA  17           HA       ALA  17   7.040  -3.982   6.238
  Start of MODEL   21
14252    HB1  ALA  17           HB1      ALA  17   8.154  -1.774   5.758
  Start of MODEL   21
14253    HB3  ALA  17           HB2      ALA  17   8.968  -3.214   5.164
  Start of MODEL   21
14254    HB2  ALA  17           HB3      ALA  17   9.563  -2.404   6.619
  Start of MODEL   21
14255    H    ALA  17           HN       ALA  17   7.332  -1.800   7.941
  Start of MODEL   21
14256    HA   VAL  18           HA       VAL  18   9.448  -6.718   8.575
  Start of MODEL   21
14257    HB   VAL  18           HB       VAL  18   8.850  -9.064   8.008
  Start of MODEL   21
14258    H    VAL  18           HN       VAL  18   7.756  -5.964   6.338
  Start of MODEL   21
14259    HA   GLU  19           HA       GLU  19  12.713  -7.205   5.792
  Start of MODEL   21
14260    HB3  GLU  19           HB2      GLU  19  13.898  -7.854   8.494
  Start of MODEL   21
14261    HB2  GLU  19           HB3      GLU  19  13.847  -6.272   7.727
  Start of MODEL   21
14262    HG2  GLU  19           HG2      GLU  19  15.362  -8.686   6.751
  Start of MODEL   21
14263    HG3  GLU  19           HG3      GLU  19  15.258  -7.140   5.914
  Start of MODEL   21
14264    H    GLU  19           HN       GLU  19  11.444  -7.538   8.368
  Start of MODEL   21
14265    HA   MET  20           HA       MET  20  14.179 -11.278   5.041
  Start of MODEL   21
14266    HB3  MET  20           HB2      MET  20  11.904 -11.901   5.635
  Start of MODEL   21
14267    HB2  MET  20           HB3      MET  20  12.252 -12.587   4.060
  Start of MODEL   21
14268    HG2  MET  20           HG2      MET  20  10.669 -10.086   4.556
  Start of MODEL   21
14269    HG3  MET  20           HG3      MET  20  11.001 -10.808   2.983
  Start of MODEL   21
14270    HE2  MET  20           HE1      MET  20   7.190 -11.441   3.556
  Start of MODEL   21
14271    HE1  MET  20           HE2      MET  20   8.406 -10.760   2.476
  Start of MODEL   21
14272    HE3  MET  20           HE3      MET  20   8.130 -10.039   4.058
  Start of MODEL   21
14273    H    MET  20           HN       MET  20  13.314  -8.730   4.481
  Start of MODEL   21
14274    HA   HIS  21           HA       HIS  21  15.269 -11.203   0.873
  Start of MODEL   21
14275    HB3  HIS  21           HB2      HIS  21  14.142 -12.678  -0.985
  Start of MODEL   21
14276    HB2  HIS  21           HB3      HIS  21  13.281 -13.388   0.375
  Start of MODEL   21
14277    HD1  HIS  21           HD1      HIS  21  15.760 -14.513  -1.575
  Start of MODEL   21
14278    HD2  HIS  21           HD2      HIS  21  15.774 -13.649   2.482
  Start of MODEL   21
14279    HE1  HIS  21           HE1      HIS  21  17.630 -15.849  -0.620
  Start of MODEL   21
14280    HE2  HIS  21           HE2      HIS  21  17.832 -14.997   1.726
  Start of MODEL   21
14281    H    HIS  21           HN       HIS  21  13.463 -12.498   2.567
  Start of MODEL   21
14282    HA   HIS  22           HA       HIS  22  12.109  -8.602  -0.835
  Start of MODEL   21
14283    HB3  HIS  22           HB2      HIS  22   9.712  -8.947  -1.506
  Start of MODEL   21
14284    HB2  HIS  22           HB3      HIS  22   9.725 -10.476  -0.635
  Start of MODEL   21
14285    HD1  HIS  22           HD1      HIS  22   9.585 -12.191  -2.489
  Start of MODEL   21
14286    HD2  HIS  22           HD2      HIS  22  12.440  -9.258  -3.228
  Start of MODEL   21
14287    HE1  HIS  22           HE1      HIS  22  10.730 -12.885  -4.578
  Start of MODEL   21
14288    HE2  HIS  22           HE2      HIS  22  12.142 -10.906  -5.180
  Start of MODEL   21
14289    H    HIS  22           HN       HIS  22  11.775 -10.917   0.928
  Start of MODEL   21
14290    HA   TRP  23           HA       TRP  23  10.589  -6.769   2.759
  Start of MODEL   21
14291    HB3  TRP  23           HB2      TRP  23  10.555  -4.237   2.432
  Start of MODEL   21
14292    HB2  TRP  23           HB3      TRP  23  11.200  -4.547   0.825
  Start of MODEL   21
14293    HD1  TRP  23           HD1      TRP  23  13.712  -5.703   0.740
  Start of MODEL   21
14294    HE1  TRP  23           HE1      TRP  23  15.684  -5.413   2.387
  Start of MODEL   21
14295    HE3  TRP  23           HE3      TRP  23  11.156  -3.935   4.782
  Start of MODEL   21
14296    HZ2  TRP  23           HZ2      TRP  23  16.087  -4.550   5.043
  Start of MODEL   21
14297    HZ3  TRP  23           HZ3      TRP  23  12.400  -3.398   6.839
  Start of MODEL   21
14298    HH2  TRP  23           HH2      TRP  23  14.820  -3.704   6.959
  Start of MODEL   21
14299    H    TRP  23           HN       TRP  23  11.368  -6.719  -0.019
  Start of MODEL   21
14300    HA   CYS  24           HA       CYS  24   6.505  -6.111   1.499
  Start of MODEL   21
14301    HB3  CYS  24           HB2      CYS  24   6.436  -8.173   3.715
  Start of MODEL   21
14302    HB2  CYS  24           HB3      CYS  24   6.597  -8.525   2.005
  Start of MODEL   21
14303    H    CYS  24           HN       CYS  24   8.615  -6.848   3.395
  Start of MODEL   21
14304    HA   ILE  25           HA       ILE  25   5.128  -3.606   4.851
  Start of MODEL   21
14305    HB   ILE  25           HB       ILE  25   4.606  -1.907   2.374
  Start of MODEL   21
14306   HD12  ILE  25          HD11      ILE  25   7.930  -0.134   2.872
  Start of MODEL   21
14307   HD11  ILE  25          HD12      ILE  25   6.433   0.412   3.629
  Start of MODEL   21
14308   HD13  ILE  25          HD13      ILE  25   6.437  -0.061   1.932
  Start of MODEL   21
14309    H    ILE  25           HN       ILE  25   5.544  -4.308   2.027
  Start of MODEL   21
14310    HA   PRO  26           HA       PRO  26   1.128  -5.386   3.540
  Start of MODEL   21
14311    HB3  PRO  26           HB2      PRO  26   1.032  -7.161   4.946
  Start of MODEL   21
14312    HB2  PRO  26           HB3      PRO  26   0.633  -6.081   6.281
  Start of MODEL   21
14313    HG2  PRO  26           HG2      PRO  26   2.683  -6.648   7.091
  Start of MODEL   21
14314    HG3  PRO  26           HG3      PRO  26   3.244  -7.225   5.512
  Start of MODEL   21
14315    HD2  PRO  26           HD2      PRO  26   3.268  -4.464   6.657
  Start of MODEL   21
14316    HD3  PRO  26           HD3      PRO  26   4.477  -5.294   5.649
  Start of MODEL   21
14317    HA   PHE  27           HA       PHE  27  -1.656  -2.744   5.712
  Start of MODEL   21
14318    HB3  PHE  27           HB2      PHE  27  -0.611  -1.227   4.159
  Start of MODEL   21
14319    HB2  PHE  27           HB3      PHE  27  -2.345  -0.957   4.151
  Start of MODEL   21
14320    HD1  PHE  27           HD1      PHE  27  -3.692  -1.537   2.189
  Start of MODEL   21
14321    HD2  PHE  27           HD2      PHE  27   0.531  -2.053   2.223
  Start of MODEL   21
14322    HE1  PHE  27           HE1      PHE  27  -3.710  -1.765  -0.226
  Start of MODEL   21
14323    HE2  PHE  27           HE2      PHE  27   0.510  -2.282  -0.212
  Start of MODEL   21
14324    HZ   PHE  27           HZ       PHE  27  -1.619  -2.137  -1.443
  Start of MODEL   21
14325    H    PHE  27           HN       PHE  27  -0.884  -4.509   3.551
  Start of MODEL   21
14326    HA   SER  28           HA       SER  28  -5.526  -3.886   4.003
  Start of MODEL   21
14327    HB3  SER  28           HB2      SER  28  -7.023  -4.326   5.931
  Start of MODEL   21
14328    HB2  SER  28           HB3      SER  28  -5.876  -3.504   6.990
  Start of MODEL   21
14329    HG   SER  28           HG       SER  28  -4.791  -5.256   7.093
  Start of MODEL   21
14330    H    SER  28           HN       SER  28  -3.852  -2.264   5.734
  Start of MODEL   21
14331    HA   VAL  29           HA       VAL  29  -7.721  -0.139   4.083
  Start of MODEL   21
14332    HB   VAL  29           HB       VAL  29  -6.289   0.518   2.261
  Start of MODEL   21
14333    H    VAL  29           HN       VAL  29  -6.939  -2.723   3.005
  Start of MODEL   21
14334    HA   ASP  30           HA       ASP  30 -11.479  -2.052   3.155
  Start of MODEL   21
14335    HB3  ASP  30           HB2      ASP  30 -11.323  -2.733   5.459
  Start of MODEL   21
14336    HB2  ASP  30           HB3      ASP  30 -12.929  -2.091   5.171
  Start of MODEL   21
14337    H    ASP  30           HN       ASP  30  -9.718  -0.235   4.626
  Start of MODEL   21
14338    HA2  GLY  31           HA2      GLY  31 -14.933   0.791   3.205
  Start of MODEL   21
14339    H    GLY  31           HN       GLY  31 -13.578  -1.494   2.727
  Start of MODEL   21
14340    HA3  GLY  31           HA1      GLY  31 -13.878   1.191   1.847
  Start of MODEL   21
14341    HA   GLN  32           HA       GLN  32 -17.111  -1.455   0.294
  Start of MODEL   21
14342    HB3  GLN  32           HB2      GLN  32 -19.169   0.765   0.750
  Start of MODEL   21
14343    HB2  GLN  32           HB3      GLN  32 -18.963  -0.646   1.755
  Start of MODEL   21
14344    HG2  GLN  32           HG2      GLN  32 -19.479  -2.002  -0.369
  Start of MODEL   21
14345    HG3  GLN  32           HG3      GLN  32 -20.791  -1.209   0.488
  Start of MODEL   21
14346   HE21  GLN  32          HE21      GLN  32 -20.556  -2.074  -2.288
  Start of MODEL   21
14347   HE22  GLN  32          HE22      GLN  32 -20.861  -0.668  -3.244
  Start of MODEL   21
14348    H    GLN  32           HN       GLN  32 -16.715   1.054   1.674
  Start of MODEL   21
14349    HA   PRO  33           HA       PRO  33 -16.932   1.306  -3.521
  Start of MODEL   21
14350    HB3  PRO  33           HB2      PRO  33 -17.238   3.594  -3.668
  Start of MODEL   21
14351    HB2  PRO  33           HB3      PRO  33 -15.843   3.887  -2.624
  Start of MODEL   21
14352    HG2  PRO  33           HG2      PRO  33 -17.489   4.570  -1.166
  Start of MODEL   21
14353    HG3  PRO  33           HG3      PRO  33 -18.710   3.527  -1.912
  Start of MODEL   21
14354    HD2  PRO  33           HD2      PRO  33 -16.587   2.836   0.075
  Start of MODEL   21
14355    HD3  PRO  33           HD3      PRO  33 -18.280   2.299  -0.011
  Start of MODEL   21
14356    HA   ALA  34           HA       ALA  34 -12.758   0.288  -2.880
  Start of MODEL   21
14357    HB3  ALA  34           HB1      ALA  34 -13.383  -1.187  -4.705
  Start of MODEL   21
14358    HB2  ALA  34           HB2      ALA  34 -11.743  -0.583  -4.933
  Start of MODEL   21
14359    HB1  ALA  34           HB3      ALA  34 -13.078   0.094  -5.877
  Start of MODEL   21
14360    H    ALA  34           HN       ALA  34 -15.015   0.864  -4.528
  Start of MODEL   21
14361    HA   PRO  35           HA       PRO  35 -11.119   4.397  -3.557
  Start of MODEL   21
14362    HB3  PRO  35           HB2      PRO  35 -10.940   4.351  -1.246
  Start of MODEL   21
14363    HB2  PRO  35           HB3      PRO  35  -9.232   4.343  -1.709
  Start of MODEL   21
14364    HG2  PRO  35           HG2      PRO  35  -9.034   2.056  -1.384
  Start of MODEL   21
14365    HG3  PRO  35           HG3      PRO  35 -10.181   2.443  -0.097
  Start of MODEL   21
14366    HD2  PRO  35           HD2      PRO  35 -10.685   0.604  -2.068
  Start of MODEL   21
14367    HD3  PRO  35           HD3      PRO  35 -11.961   1.525  -1.243
  Start of MODEL   21
14368    HA   SER  36           HA       SER  36  -7.523   3.504  -5.874
  Start of MODEL   21
14369    HB3  SER  36           HB2      SER  36  -7.619   6.543  -5.801
  Start of MODEL   21
14370    HB2  SER  36           HB3      SER  36  -8.433   5.537  -6.996
  Start of MODEL   21
14371    HG   SER  36           HG       SER  36  -6.675   5.576  -8.069
  Start of MODEL   21
14372    H    SER  36           HN       SER  36  -9.292   5.303  -4.467
  Start of MODEL   21
14373    HA   LEU  37           HA       LEU  37  -4.634   4.161  -2.657
  Start of MODEL   21
14374    HB3  LEU  37           HB2      LEU  37  -3.087   2.223  -2.563
  Start of MODEL   21
14375    HB2  LEU  37           HB3      LEU  37  -3.792   1.615  -4.045
  Start of MODEL   21
14376    HG   LEU  37           HG       LEU  37  -5.961   1.349  -2.869
  Start of MODEL   21
14377   HD13  LEU  37          HD11      LEU  37  -5.311  -0.586  -1.595
  Start of MODEL   21
14378   HD12  LEU  37          HD12      LEU  37  -3.682   0.023  -1.422
  Start of MODEL   21
14379   HD11  LEU  37          HD13      LEU  37  -4.272  -0.474  -3.016
  Start of MODEL   21
14380   HD23  LEU  37          HD21      LEU  37  -5.926   1.497  -0.378
  Start of MODEL   21
14381   HD22  LEU  37          HD22      LEU  37  -5.756   3.057  -1.181
  Start of MODEL   21
14382   HD21  LEU  37          HD23      LEU  37  -4.335   2.255  -0.503
  Start of MODEL   21
14383    H    LEU  37           HN       LEU  37  -5.607   2.923  -5.111
  Start of MODEL   21
14384    HA   ARG  38           HA       ARG  38  -1.077   5.475  -4.848
  Start of MODEL   21
14385    HB3  ARG  38           HB2      ARG  38  -2.431   7.800  -3.474
  Start of MODEL   21
14386    HB2  ARG  38           HB3      ARG  38  -2.656   7.289  -5.135
  Start of MODEL   21
14387    HG2  ARG  38           HG2      ARG  38  -0.122   8.415  -3.982
  Start of MODEL   21
14388    HG3  ARG  38           HG3      ARG  38  -0.347   7.902  -5.653
  Start of MODEL   21
14389    HD2  ARG  38           HD2      ARG  38  -1.886  10.079  -4.246
  Start of MODEL   21
14390    HD3  ARG  38           HD3      ARG  38  -0.583  10.329  -5.404
  Start of MODEL   21
14391    HE   ARG  38           HE       ARG  38  -2.755   8.744  -6.410
  Start of MODEL   21
14392   HH11  ARG  38          HH11      ARG  38  -1.672  12.077  -5.915
  Start of MODEL   21
14393   HH12  ARG  38          HH12      ARG  38  -2.545  12.683  -7.252
  Start of MODEL   21
14394   HH21  ARG  38          HH21      ARG  38  -3.949   9.589  -8.222
  Start of MODEL   21
14395   HH22  ARG  38          HH22      ARG  38  -3.863  11.254  -8.566
  Start of MODEL   21
14396    H    ARG  38           HN       ARG  38  -2.923   5.361  -2.577
  Start of MODEL   21
14397    HA   TRP  39           HA       TRP  39   1.526   5.727  -1.373
  Start of MODEL   21
14398    HB3  TRP  39           HB2      TRP  39   3.838   4.995  -2.007
  Start of MODEL   21
14399    HB2  TRP  39           HB3      TRP  39   3.285   4.840  -3.666
  Start of MODEL   21
14400    HD1  TRP  39           HD1      TRP  39   2.060   2.644  -4.307
  Start of MODEL   21
14401    HE1  TRP  39           HE1      TRP  39   1.412   0.519  -3.030
  Start of MODEL   21
14402    HE3  TRP  39           HE3      TRP  39   3.024   4.262   0.446
  Start of MODEL   21
14403    HZ2  TRP  39           HZ2      TRP  39   1.298  -0.347  -0.333
  Start of MODEL   21
14404    HZ3  TRP  39           HZ3      TRP  39   2.616   2.720   2.321
  Start of MODEL   21
14405    HH2  TRP  39           HH2      TRP  39   1.772   0.463   1.934
  Start of MODEL   21
14406    H    TRP  39           HN       TRP  39   1.026   5.598  -4.226
  Start of MODEL   21
14407    HA   LEU  40           HA       LEU  40   3.677   9.422  -2.146
  Start of MODEL   21
14408    HB3  LEU  40           HB2      LEU  40   2.443   9.703   0.583
  Start of MODEL   21
14409    HB2  LEU  40           HB3      LEU  40   1.533   9.895  -0.896
  Start of MODEL   21
14410    HG   LEU  40           HG       LEU  40   3.892  11.629  -0.306
  Start of MODEL   21
14411   HD13  LEU  40          HD11      LEU  40   3.167  11.537  -2.598
  Start of MODEL   21
14412   HD12  LEU  40          HD12      LEU  40   2.762  13.098  -1.883
  Start of MODEL   21
14413   HD11  LEU  40          HD13      LEU  40   1.506  11.874  -2.113
  Start of MODEL   21
14414   HD22  LEU  40          HD21      LEU  40   2.294  13.285   0.502
  Start of MODEL   21
14415   HD21  LEU  40          HD22      LEU  40   2.320  11.862   1.545
  Start of MODEL   21
14416   HD23  LEU  40          HD23      LEU  40   0.997  12.098   0.400
  Start of MODEL   21
14417    H    LEU  40           HN       LEU  40   2.467   7.339  -0.461
  Start of MODEL   21
14418    HA   PHE  41           HA       PHE  41   6.860   8.444   0.702
  Start of MODEL   21
14419    HB3  PHE  41           HB2      PHE  41   8.047   8.722  -2.075
  Start of MODEL   21
14420    HB2  PHE  41           HB3      PHE  41   7.514   7.234  -1.315
  Start of MODEL   21
14421    HD1  PHE  41           HD1      PHE  41  10.300   9.200  -2.033
  Start of MODEL   21
14422    HD2  PHE  41           HD2      PHE  41   8.665   6.688   0.971
  Start of MODEL   21
14423    HE1  PHE  41           HE1      PHE  41  12.548   8.827  -1.124
  Start of MODEL   21
14424    HE2  PHE  41           HE2      PHE  41  10.915   6.305   1.886
  Start of MODEL   21
14425    HZ   PHE  41           HZ       PHE  41  12.885   7.354   0.763
  Start of MODEL   21
14426    H    PHE  41           HN       PHE  41   5.766   9.678  -1.709
  Start of MODEL   21
14427    HA   ASN  42           HA       ASN  42   7.987  11.930   3.022
  Start of MODEL   21
14428    HB3  ASN  42           HB2      ASN  42   9.932  13.090   1.944
  Start of MODEL   21
14429    HB2  ASN  42           HB3      ASN  42   9.760  11.986   0.589
  Start of MODEL   21
14430   HD21  ASN  42          HD21      ASN  42  11.749  11.174   0.837
  Start of MODEL   21
14431   HD22  ASN  42          HD22      ASN  42  12.193  10.115   2.130
  Start of MODEL   21
14432    H    ASN  42           HN       ASN  42   7.216  10.017   2.050
  Start of MODEL   21
14433    HA2  GLY  43           HA2      GLY  43   4.403  14.015   0.728
  Start of MODEL   21
14434    H    GLY  43           HN       GLY  43   5.818  12.066   0.902
  Start of MODEL   21
14435    HA3  GLY  43           HA1      GLY  43   5.861  15.000   0.713
  Start of MODEL   21
14436    HA   SER  44           HA       SER  44   5.793  13.895  -3.690
  Start of MODEL   21
14437    HB3  SER  44           HB2      SER  44   7.839  13.065  -4.650
  Start of MODEL   21
14438    HB2  SER  44           HB3      SER  44   8.241  12.195  -3.167
  Start of MODEL   21
14439    HG   SER  44           HG       SER  44   9.334  13.992  -2.865
  Start of MODEL   21
14440    H    SER  44           HN       SER  44   6.798  12.657  -1.194
  Start of MODEL   21
14441    HA   VAL  45           HA       VAL  45   3.598  10.330  -4.331
  Start of MODEL   21
14442    HB   VAL  45           HB       VAL  45   3.641  11.667  -7.063
  Start of MODEL   21
14443    H    VAL  45           HN       VAL  45   4.808  12.740  -5.155
  Start of MODEL   21
14444    HA   LEU  46           HA       LEU  46   6.648   7.746  -5.965
  Start of MODEL   21
14445    HB3  LEU  46           HB2      LEU  46   5.121   6.216  -3.859
  Start of MODEL   21
14446    HB2  LEU  46           HB3      LEU  46   6.558   7.173  -3.582
  Start of MODEL   21
14447    HG   LEU  46           HG       LEU  46   6.459   4.671  -5.269
  Start of MODEL   21
14448   HD12  LEU  46          HD11      LEU  46   8.902   4.789  -5.173
  Start of MODEL   21
14449   HD11  LEU  46          HD12      LEU  46   8.789   6.332  -4.319
  Start of MODEL   21
14450   HD13  LEU  46          HD13      LEU  46   8.208   6.195  -5.979
  Start of MODEL   21
14451   HD22  LEU  46          HD21      LEU  46   7.664   3.627  -3.418
  Start of MODEL   21
14452   HD21  LEU  46          HD22      LEU  46   6.059   4.172  -2.928
  Start of MODEL   21
14453   HD23  LEU  46          HD23      LEU  46   7.487   5.104  -2.471
  Start of MODEL   21
14454    H    LEU  46           HN       LEU  46   4.179   8.332  -4.544
  Start of MODEL   21
14455    HA   ASN  47           HA       ASN  47   3.735   5.765  -8.588
  Start of MODEL   21
14456    HB3  ASN  47           HB2      ASN  47   5.978   6.565 -10.468
  Start of MODEL   21
14457    HB2  ASN  47           HB3      ASN  47   4.654   7.635 -10.045
  Start of MODEL   21
14458   HD21  ASN  47          HD21      ASN  47   3.995   7.754 -12.183
  Start of MODEL   21
14459   HD22  ASN  47          HD22      ASN  47   3.149   6.465 -12.957
  Start of MODEL   21
14460    H    ASN  47           HN       ASN  47   6.174   7.199  -7.975
  Start of MODEL   21
14461    HA   GLU  48           HA       GLU  48   5.695   1.975  -7.746
  Start of MODEL   21
14462    HB3  GLU  48           HB2      GLU  48   4.231   0.154  -8.496
  Start of MODEL   21
14463    HB2  GLU  48           HB3      GLU  48   3.257   1.319  -9.382
  Start of MODEL   21
14464    HG2  GLU  48           HG2      GLU  48   3.671   1.243  -6.407
  Start of MODEL   21
14465    HG3  GLU  48           HG3      GLU  48   2.717   2.446  -7.277
  Start of MODEL   21
14466    H    GLU  48           HN       GLU  48   3.695   3.661  -8.602
  Start of MODEL   21
14467    HA   THR  49           HA       THR  49   7.458   0.830 -11.581
  Start of MODEL   21
14468    HB   THR  49           HB       THR  49   9.924   0.645 -11.094
  Start of MODEL   21
14469    HG1  THR  49           HG1      THR  49   9.644   1.645  -8.577
  Start of MODEL   21
14470   HG22  THR  49          HG21      THR  49  10.217   3.005 -10.435
  Start of MODEL   21
14471   HG21  THR  49          HG22      THR  49   8.524   3.071  -9.940
  Start of MODEL   21
14472   HG23  THR  49          HG23      THR  49   8.937   2.831 -11.636
  Start of MODEL   21
14473    H    THR  49           HN       THR  49   7.032   0.525  -8.705
  Start of MODEL   21
14474    HA   SER  50           HA       SER  50   8.177  -3.468 -11.401
  Start of MODEL   21
14475    HB3  SER  50           HB2      SER  50  10.001  -4.395 -12.736
  Start of MODEL   21
14476    HB2  SER  50           HB3      SER  50  10.805  -2.820 -12.733
  Start of MODEL   21
14477    HG   SER  50           HG       SER  50   8.276  -2.479 -13.511
  Start of MODEL   21
14478    H    SER  50           HN       SER  50   9.359  -0.968 -12.034
  Start of MODEL   21
14479    HA   PHE  51           HA       PHE  51  11.538  -3.772  -8.285
  Start of MODEL   21
14480    HB3  PHE  51           HB2      PHE  51  12.971  -2.084  -7.176
  Start of MODEL   21
14481    HB2  PHE  51           HB3      PHE  51  12.171  -0.825  -8.103
  Start of MODEL   21
14482    HD1  PHE  51           HD1      PHE  51  14.057  -3.977  -8.589
  Start of MODEL   21
14483    HD2  PHE  51           HD2      PHE  51  13.078  -0.121 -10.069
  Start of MODEL   21
14484    HE1  PHE  51           HE1      PHE  51  15.708  -4.255 -10.382
  Start of MODEL   21
14485    HE2  PHE  51           HE2      PHE  51  14.723  -0.395 -11.871
  Start of MODEL   21
14486    HZ   PHE  51           HZ       PHE  51  16.037  -2.461 -12.030
  Start of MODEL   21
14487    H    PHE  51           HN       PHE  51  10.365  -1.495  -9.724
  Start of MODEL   21
14488    HA   ILE  52           HA       ILE  52   8.930  -1.775  -5.079
  Start of MODEL   21
14489    HB   ILE  52           HB       ILE  52   8.654   1.005  -6.275
  Start of MODEL   21
14490   HD11  ILE  52          HD11      ILE  52  10.350   2.296  -4.028
  Start of MODEL   21
14491   HD13  ILE  52          HD12      ILE  52  10.518   2.697  -5.737
  Start of MODEL   21
14492   HD12  ILE  52          HD13      ILE  52  11.921   2.146  -4.816
  Start of MODEL   21
14493    H    ILE  52           HN       ILE  52   9.565  -0.902  -7.823
  Start of MODEL   21
14494    HA   PHE  53           HA       PHE  53   4.849  -1.483  -6.719
  Start of MODEL   21
14495    HB3  PHE  53           HB2      PHE  53   5.726  -2.736  -8.540
  Start of MODEL   21
14496    HB2  PHE  53           HB3      PHE  53   4.261  -3.551  -8.006
  Start of MODEL   21
14497    HD1  PHE  53           HD1      PHE  53   7.936  -3.769  -8.061
  Start of MODEL   21
14498    HD2  PHE  53           HD2      PHE  53   4.288  -5.749  -7.149
  Start of MODEL   21
14499    HE1  PHE  53           HE1      PHE  53   9.139  -5.899  -7.846
  Start of MODEL   21
14500    HE2  PHE  53           HE2      PHE  53   5.484  -7.875  -6.934
  Start of MODEL   21
14501    HZ   PHE  53           HZ       PHE  53   7.973  -7.925  -7.344
  Start of MODEL   21
14502    H    PHE  53           HN       PHE  53   6.956  -2.867  -5.312
  Start of MODEL   21
14503    HA   THR  54           HA       THR  54   2.549  -3.467  -3.650
  Start of MODEL   21
14504    HB   THR  54           HB       THR  54   0.416  -2.179  -5.349
  Start of MODEL   21
14505    HG1  THR  54           HG1      THR  54   1.886  -0.677  -5.103
  Start of MODEL   21
14506   HG21  THR  54          HG21      THR  54   0.676  -2.592  -2.370
  Start of MODEL   21
14507   HG23  THR  54          HG22      THR  54  -0.360  -3.523  -3.455
  Start of MODEL   21
14508   HG22  THR  54          HG23      THR  54  -0.662  -1.802  -3.204
  Start of MODEL   21
14509    H    THR  54           HN       THR  54   2.775  -2.219  -6.255
  Start of MODEL   21
14510    HA   GLU  55           HA       GLU  55   0.501  -6.738  -5.748
  Start of MODEL   21
14511    HB3  GLU  55           HB2      GLU  55   1.175  -8.967  -4.776
  Start of MODEL   21
14512    HB2  GLU  55           HB3      GLU  55   2.273  -8.101  -3.713
  Start of MODEL   21
14513    HG2  GLU  55           HG2      GLU  55   2.403  -7.995  -6.717
  Start of MODEL   21
14514    HG3  GLU  55           HG3      GLU  55   3.566  -7.326  -5.573
  Start of MODEL   21
14515    H    GLU  55           HN       GLU  55   2.127  -5.597  -3.602
  Start of MODEL   21
14516    HA   PHE  56           HA       PHE  56  -2.403  -7.143  -2.572
  Start of MODEL   21
14517    HB3  PHE  56           HB2      PHE  56  -4.656  -7.169  -3.652
  Start of MODEL   21
14518    HB2  PHE  56           HB3      PHE  56  -3.859  -7.381  -5.208
  Start of MODEL   21
14519    HD1  PHE  56           HD1      PHE  56  -4.428  -5.044  -2.424
  Start of MODEL   21
14520    HD2  PHE  56           HD2      PHE  56  -2.765  -5.579  -6.301
  Start of MODEL   21
14521    HE1  PHE  56           HE1      PHE  56  -4.197  -2.606  -2.655
  Start of MODEL   21
14522    HE2  PHE  56           HE2      PHE  56  -2.526  -3.152  -6.540
  Start of MODEL   21
14523    HZ   PHE  56           HZ       PHE  56  -3.245  -1.650  -4.663
  Start of MODEL   21
14524    H    PHE  56           HN       PHE  56  -1.371  -7.835  -5.229
  Start of MODEL   21
14525    HA   LEU  57           HA       LEU  57  -3.031 -11.374  -2.384
  Start of MODEL   21
14526    HB3  LEU  57           HB2      LEU  57  -1.982 -10.911  -0.203
  Start of MODEL   21
14527    HB2  LEU  57           HB3      LEU  57  -3.222 -12.128  -0.060
  Start of MODEL   21
14528    HG   LEU  57           HG       LEU  57  -3.861  -9.317   0.676
  Start of MODEL   21
14529   HD12  LEU  57          HD11      LEU  57  -5.400 -10.454   2.238
  Start of MODEL   21
14530   HD11  LEU  57          HD12      LEU  57  -4.846 -12.004   1.604
  Start of MODEL   21
14531   HD13  LEU  57          HD13      LEU  57  -5.699 -10.879   0.551
  Start of MODEL   21
14532   HD22  LEU  57          HD21      LEU  57  -3.166  -9.809   2.973
  Start of MODEL   21
14533   HD21  LEU  57          HD22      LEU  57  -1.799  -9.816   1.857
  Start of MODEL   21
14534   HD23  LEU  57          HD23      LEU  57  -2.481 -11.341   2.430
  Start of MODEL   21
14535    H    LEU  57           HN       LEU  57  -3.333  -8.677  -1.372
  Start of MODEL   21
14536    HA   GLU  58           HA       GLU  58  -6.963 -12.127  -3.258
  Start of MODEL   21
14537    HB3  GLU  58           HB2      GLU  58  -7.913 -14.291  -2.742
  Start of MODEL   21
14538    HB2  GLU  58           HB3      GLU  58  -6.803 -14.477  -1.394
  Start of MODEL   21
14539    HG2  GLU  58           HG2      GLU  58  -4.916 -14.511  -2.906
  Start of MODEL   21
14540    HG3  GLU  58           HG3      GLU  58  -6.097 -15.725  -3.389
  Start of MODEL   21
14541    H    GLU  58           HN       GLU  58  -4.850 -12.892  -1.589
  Start of MODEL   21
14542    HA   PRO  59           HA       PRO  59  -9.492 -10.254  -0.060
  Start of MODEL   21
14543    HB3  PRO  59           HB2      PRO  59  -9.523  -8.341  -1.382
  Start of MODEL   21
14544    HB2  PRO  59           HB3      PRO  59 -11.142  -8.939  -1.741
  Start of MODEL   21
14545    HG2  PRO  59           HG2      PRO  59 -10.536  -9.730  -3.809
  Start of MODEL   21
14546    HG3  PRO  59           HG3      PRO  59  -9.280  -8.490  -3.671
  Start of MODEL   21
14547    HD2  PRO  59           HD2      PRO  59  -8.850 -11.237  -3.952
  Start of MODEL   21
14548    HD3  PRO  59           HD3      PRO  59  -7.650 -10.049  -3.408
  Start of MODEL   21
14549    HA   ALA  60           HA       ALA  60 -12.606 -13.202  -0.733
  Start of MODEL   21
14550    HB3  ALA  60           HB1      ALA  60 -11.815 -13.811   1.503
  Start of MODEL   21
14551    HB2  ALA  60           HB2      ALA  60 -13.572 -13.924   1.384
  Start of MODEL   21
14552    HB1  ALA  60           HB3      ALA  60 -12.833 -12.547   2.196
  Start of MODEL   21
14553    H    ALA  60           HN       ALA  60 -11.258 -11.199   0.862
  Start of MODEL   21
14554    HA   ALA  61           HA       ALA  61 -16.033 -10.602  -1.289
  Start of MODEL   21
14555    HB1  ALA  61           HB1      ALA  61 -17.115 -13.349  -1.809
  Start of MODEL   21
14556    HB3  ALA  61           HB2      ALA  61 -16.296 -12.329  -2.999
  Start of MODEL   21
14557    HB2  ALA  61           HB3      ALA  61 -17.863 -11.837  -2.327
  Start of MODEL   21
14558    H    ALA  61           HN       ALA  61 -14.798 -13.193  -1.063
  Start of MODEL   21
14559    HA   ASN  62           HA       ASN  62 -18.182 -12.098   2.527
  Start of MODEL   21
14560    HB3  ASN  62           HB2      ASN  62 -17.050 -13.410   4.345
  Start of MODEL   21
14561    HB2  ASN  62           HB3      ASN  62 -15.593 -13.405   3.346
  Start of MODEL   21
14562   HD21  ASN  62          HD21      ASN  62 -18.755 -14.715   3.706
  Start of MODEL   21
14563   HD22  ASN  62          HD22      ASN  62 -18.579 -15.971   2.541
  Start of MODEL   21
14564    H    ASN  62           HN       ASN  62 -15.527 -12.198   1.277
  Start of MODEL   21
14565    HA   GLU  63           HA       GLU  63 -16.017  -8.674   4.453
  Start of MODEL   21
14566    HB3  GLU  63           HB2      GLU  63 -13.981 -10.176   4.638
  Start of MODEL   21
14567    HB2  GLU  63           HB3      GLU  63 -13.645  -8.465   4.880
  Start of MODEL   21
14568    HG2  GLU  63           HG2      GLU  63 -13.180  -9.967   2.303
  Start of MODEL   21
14569    HG3  GLU  63           HG3      GLU  63 -12.721  -8.305   2.641
  Start of MODEL   21
14570    H    GLU  63           HN       GLU  63 -15.636 -10.119   1.972
  Start of MODEL   21
14571    HA   THR  64           HA       THR  64 -15.190  -5.704   1.312
  Start of MODEL   21
14572    HB   THR  64           HB       THR  64 -16.073  -3.396   2.235
  Start of MODEL   21
14573    HG1  THR  64           HG1      THR  64 -15.985  -4.194   4.452
  Start of MODEL   21
14574   HG21  THR  64          HG21      THR  64 -17.895  -5.798   1.965
  Start of MODEL   21
14575   HG23  THR  64          HG22      THR  64 -17.316  -4.788   0.641
  Start of MODEL   21
14576   HG22  THR  64          HG23      THR  64 -18.405  -4.114   1.854
  Start of MODEL   21
14577    H    THR  64           HN       THR  64 -15.431  -6.411   4.128
  Start of MODEL   21
14578    HA   VAL  65           HA       VAL  65 -11.540  -4.040   3.180
  Start of MODEL   21
14579    HB   VAL  65           HB       VAL  65 -10.862  -6.714   4.403
  Start of MODEL   21
14580    H    VAL  65           HN       VAL  65 -13.046  -6.510   2.754
  Start of MODEL   21
14581    HA   ARG  66           HA       ARG  66  -9.132  -5.879   0.030
  Start of MODEL   21
14582    HB3  ARG  66           HB2      ARG  66  -8.796  -2.879   0.132
  Start of MODEL   21
14583    HB2  ARG  66           HB3      ARG  66  -9.944  -3.758  -0.842
  Start of MODEL   21
14584    HG2  ARG  66           HG2      ARG  66  -6.979  -3.824  -1.214
  Start of MODEL   21
14585    HG3  ARG  66           HG3      ARG  66  -8.177  -4.693  -2.181
  Start of MODEL   21
14586    HD2  ARG  66           HD2      ARG  66  -9.249  -2.518  -2.720
  Start of MODEL   21
14587    HD3  ARG  66           HD3      ARG  66  -7.941  -1.703  -1.871
  Start of MODEL   21
14588    HE   ARG  66           HE       ARG  66  -6.904  -3.437  -3.768
  Start of MODEL   21
14589   HH11  ARG  66          HH11      ARG  66  -8.533  -0.274  -3.540
  Start of MODEL   21
14590   HH12  ARG  66          HH12      ARG  66  -8.018   0.262  -5.061
  Start of MODEL   21
14591   HH21  ARG  66          HH21      ARG  66  -6.229  -2.642  -5.976
  Start of MODEL   21
14592   HH22  ARG  66          HH22      ARG  66  -6.709  -1.084  -6.433
  Start of MODEL   21
14593    H    ARG  66           HN       ARG  66  -9.903  -3.781   1.909
  Start of MODEL   21
14594    HA   HIS  67           HA       HIS  67  -5.304  -5.515   2.260
  Start of MODEL   21
14595    HB3  HIS  67           HB2      HIS  67  -4.590  -7.785   2.865
  Start of MODEL   21
14596    HB2  HIS  67           HB3      HIS  67  -5.657  -8.454   1.644
  Start of MODEL   21
14597    HD1  HIS  67           HD1      HIS  67  -5.572  -7.582   5.167
  Start of MODEL   21
14598    HD2  HIS  67           HD2      HIS  67  -8.465  -8.172   2.251
  Start of MODEL   21
14599    HE1  HIS  67           HE1      HIS  67  -7.723  -7.996   6.412
  Start of MODEL   21
14600    HE2  HIS  67           HE2      HIS  67  -9.401  -8.581   4.581
  Start of MODEL   21
14601    H    HIS  67           HN       HIS  67  -6.988  -6.641   0.111
  Start of MODEL   21
14602    HA2  GLY  68           HA2      GLY  68  -2.153  -6.705  -0.565
  Start of MODEL   21
14603    H    GLY  68           HN       GLY  68  -3.197  -5.226   1.682
  Start of MODEL   21
14604    HA3  GLY  68           HA1      GLY  68  -2.312  -4.967  -0.809
  Start of MODEL   21
14605    HA   CYS  69           HA       CYS  69   1.394  -4.666   1.284
  Start of MODEL   21
14606    HB3  CYS  69           HB2      CYS  69   2.039  -7.365   0.096
  Start of MODEL   21
14607    HB2  CYS  69           HB3      CYS  69   1.603  -6.997   1.763
  Start of MODEL   21
14608    H    CYS  69           HN       CYS  69   0.105  -5.703  -1.079
  Start of MODEL   21
14609    HA   LEU  70           HA       LEU  70   3.741  -3.031  -2.027
  Start of MODEL   21
14610    HB3  LEU  70           HB2      LEU  70   4.857  -1.642   0.418
  Start of MODEL   21
14611    HB2  LEU  70           HB3      LEU  70   3.447  -1.068  -0.445
  Start of MODEL   21
14612    HG   LEU  70           HG       LEU  70   6.239  -1.268  -1.587
  Start of MODEL   21
14613   HD11  LEU  70          HD11      LEU  70   3.686  -0.163  -2.714
  Start of MODEL   21
14614   HD13  LEU  70          HD12      LEU  70   4.616  -1.533  -3.341
  Start of MODEL   21
14615   HD12  LEU  70          HD13      LEU  70   5.274   0.104  -3.404
  Start of MODEL   21
14616   HD21  LEU  70          HD21      LEU  70   6.102   0.481   0.082
  Start of MODEL   21
14617   HD23  LEU  70          HD22      LEU  70   4.632   1.099  -0.666
  Start of MODEL   21
14618   HD22  LEU  70          HD23      LEU  70   6.163   1.197  -1.530
  Start of MODEL   21
14619    H    LEU  70           HN       LEU  70   2.997  -3.334   0.757
  Start of MODEL   21
14620    HA   ARG  71           HA       ARG  71   7.070  -5.648  -0.962
  Start of MODEL   21
14621    HB3  ARG  71           HB2      ARG  71   7.031  -7.471  -2.819
  Start of MODEL   21
14622    HB2  ARG  71           HB3      ARG  71   5.497  -6.732  -3.259
  Start of MODEL   21
14623    HG2  ARG  71           HG2      ARG  71   6.257  -8.093  -0.703
  Start of MODEL   21
14624    HG3  ARG  71           HG3      ARG  71   4.880  -7.003  -0.796
  Start of MODEL   21
14625    HD2  ARG  71           HD2      ARG  71   4.358  -9.447  -1.072
  Start of MODEL   21
14626    HD3  ARG  71           HD3      ARG  71   3.767  -8.392  -2.346
  Start of MODEL   21
14627    HE   ARG  71           HE       ARG  71   5.356  -9.280  -3.815
  Start of MODEL   21
14628   HH11  ARG  71          HH11      ARG  71   5.538 -10.903  -0.687
  Start of MODEL   21
14629   HH12  ARG  71          HH12      ARG  71   6.256 -12.305  -1.326
  Start of MODEL   21
14630   HH21  ARG  71          HH21      ARG  71   6.301 -11.130  -4.628
  Start of MODEL   21
14631   HH22  ARG  71          HH22      ARG  71   6.728 -12.443  -3.616
  Start of MODEL   21
14632    H    ARG  71           HN       ARG  71   5.145  -4.424  -2.788
  Start of MODEL   21
14633    HA   LEU  72           HA       LEU  72   9.736  -3.786  -3.825
  Start of MODEL   21
14634    HB3  LEU  72           HB2      LEU  72  11.843  -2.979  -2.638
  Start of MODEL   21
14635    HB2  LEU  72           HB3      LEU  72  11.048  -3.384  -1.137
  Start of MODEL   21
14636    HG   LEU  72           HG       LEU  72   9.820  -1.492  -3.090
  Start of MODEL   21
14637   HD11  LEU  72          HD11      LEU  72   9.484  -1.797  -0.130
  Start of MODEL   21
14638   HD13  LEU  72          HD12      LEU  72   8.323  -2.261  -1.386
  Start of MODEL   21
14639   HD12  LEU  72          HD13      LEU  72   8.737  -0.556  -1.131
  Start of MODEL   21
14640   HD23  LEU  72          HD21      LEU  72  11.706  -0.710  -0.880
  Start of MODEL   21
14641   HD22  LEU  72          HD22      LEU  72  10.771   0.365  -1.945
  Start of MODEL   21
14642   HD21  LEU  72          HD23      LEU  72  12.045  -0.651  -2.616
  Start of MODEL   21
14643    H    LEU  72           HN       LEU  72   8.866  -4.582  -1.193
  Start of MODEL   21
14644    HA   ASN  73           HA       ASN  73  11.634  -7.644  -4.335
  Start of MODEL   21
14645    HB3  ASN  73           HB2      ASN  73  11.699  -6.252  -7.025
  Start of MODEL   21
14646    HB2  ASN  73           HB3      ASN  73  10.395  -7.290  -6.468
  Start of MODEL   21
14647   HD21  ASN  73          HD21      ASN  73  11.969  -7.659  -8.814
  Start of MODEL   21
14648   HD22  ASN  73          HD22      ASN  73  12.766  -9.171  -8.661
  Start of MODEL   21
14649    H    ASN  73           HN       ASN  73  10.441  -5.173  -5.070
  Start of MODEL   21
14650    HA   GLN  74           HA       GLN  74  15.585  -5.488  -4.542
  Start of MODEL   21
14651    HB3  GLN  74           HB2      GLN  74  14.735  -3.238  -6.379
  Start of MODEL   21
14652    HB2  GLN  74           HB3      GLN  74  15.306  -4.812  -6.905
  Start of MODEL   21
14653    HG2  GLN  74           HG2      GLN  74  17.029  -3.084  -7.105
  Start of MODEL   21
14654    HG3  GLN  74           HG3      GLN  74  16.925  -2.789  -5.370
  Start of MODEL   21
14655   HE21  GLN  74          HE21      GLN  74  16.766  -5.985  -6.830
  Start of MODEL   21
14656   HE22  GLN  74          HE22      GLN  74  18.268  -6.525  -6.203
  Start of MODEL   21
14657    H    GLN  74           HN       GLN  74  12.898  -4.482  -5.041
  Start of MODEL   21
14658    HA   PRO  75           HA       PRO  75  14.768  -2.466  -1.259
  Start of MODEL   21
14659    HB3  PRO  75           HB2      PRO  75  15.404  -3.992   0.363
  Start of MODEL   21
14660    HB2  PRO  75           HB3      PRO  75  16.949  -3.148   0.257
  Start of MODEL   21
14661    HG2  PRO  75           HG2      PRO  75  17.906  -4.798  -1.024
  Start of MODEL   21
14662    HG3  PRO  75           HG3      PRO  75  16.707  -5.803  -0.202
  Start of MODEL   21
14663    HD2  PRO  75           HD2      PRO  75  16.895  -5.524  -2.921
  Start of MODEL   21
14664    HD3  PRO  75           HD3      PRO  75  15.402  -5.977  -2.077
  Start of MODEL   21
14665    HA   THR  76           HA       THR  76  18.120   0.036  -2.556
  Start of MODEL   21
14666    HB   THR  76           HB       THR  76  16.971   2.058  -3.614
  Start of MODEL   21
14667    HG1  THR  76           HG1      THR  76  14.582   0.704  -3.516
  Start of MODEL   21
14668   HG21  THR  76          HG21      THR  76  16.024  -0.683  -4.472
  Start of MODEL   21
14669   HG23  THR  76          HG22      THR  76  17.557   0.057  -4.933
  Start of MODEL   21
14670   HG22  THR  76          HG23      THR  76  16.037   0.761  -5.483
  Start of MODEL   21
14671    H    THR  76           HN       THR  76  15.492  -0.418  -1.379
  Start of MODEL   21
14672    HA   HIS  77           HA       HIS  77  18.390   2.464   0.964
  Start of MODEL   21
14673    HB3  HIS  77           HB2      HIS  77  20.797   1.892   0.519
  Start of MODEL   21
14674    HB2  HIS  77           HB3      HIS  77  20.571   3.406   1.359
  Start of MODEL   21
14675    HD1  HIS  77           HD1      HIS  77  22.028   1.982  -1.705
  Start of MODEL   21
14676    HD2  HIS  77           HD2      HIS  77  21.334   5.697  -0.019
  Start of MODEL   21
14677    HE1  HIS  77           HE1      HIS  77  23.428   3.597  -3.026
  Start of MODEL   21
14678    HE2  HIS  77           HE2      HIS  77  22.759   5.841  -2.177
  Start of MODEL   21
14679    H    HIS  77           HN       HIS  77  19.253   1.695  -1.659
  Start of MODEL   21
14680    HA   VAL  78           HA       VAL  78  17.964   6.518  -1.279
  Start of MODEL   21
14681    HB   VAL  78           HB       VAL  78  16.922   6.987  -3.481
  Start of MODEL   21
14682    H    VAL  78           HN       VAL  78  18.198   3.817  -2.120
  Start of MODEL   21
14683    HA   ASN  79           HA       ASN  79  13.634   5.707  -0.897
  Start of MODEL   21
14684    HB3  ASN  79           HB2      ASN  79  12.083   3.669  -0.874
  Start of MODEL   21
14685    HB2  ASN  79           HB3      ASN  79  13.506   2.770  -1.394
  Start of MODEL   21
14686   HD21  ASN  79          HD21      ASN  79  14.229   3.031  -3.309
  Start of MODEL   21
14687   HD22  ASN  79          HD22      ASN  79  13.488   3.915  -4.617
  Start of MODEL   21
14688    H    ASN  79           HN       ASN  79  15.796   3.844  -1.108
  Start of MODEL   21
14689    HA   ASN  80           HA       ASN  80  13.735   4.214   3.316
  Start of MODEL   21
14690    HB3  ASN  80           HB2      ASN  80  16.273   4.005   3.618
  Start of MODEL   21
14691    HB2  ASN  80           HB3      ASN  80  15.423   4.635   5.013
  Start of MODEL   21
14692   HD21  ASN  80          HD21      ASN  80  17.819   5.338   2.604
  Start of MODEL   21
14693   HD22  ASN  80          HD22      ASN  80  18.290   6.848   3.277
  Start of MODEL   21
14694    H    ASN  80           HN       ASN  80  15.511   5.347   1.310
  Start of MODEL   21
14695    HA2  GLY  81           HA2      GLY  81  12.275   7.966   5.093
  Start of MODEL   21
14696    H    GLY  81           HN       GLY  81  12.162   5.333   4.292
  Start of MODEL   21
14697    HA3  GLY  81           HA1      GLY  81  11.715   7.999   3.433
  Start of MODEL   21
14698    HA   ASN  82           HA       ASN  82   8.107   7.291   5.955
  Start of MODEL   21
14699    HB3  ASN  82           HB2      ASN  82   6.689   9.326   6.080
  Start of MODEL   21
14700    HB2  ASN  82           HB3      ASN  82   7.802  10.143   4.995
  Start of MODEL   21
14701   HD21  ASN  82          HD21      ASN  82   7.252   9.092   8.230
  Start of MODEL   21
14702   HD22  ASN  82          HD22      ASN  82   8.632   9.865   8.911
  Start of MODEL   21
14703    H    ASN  82           HN       ASN  82   9.802   8.934   4.246
  Start of MODEL   21
14704    HA   TYR  83           HA       TYR  83   5.841   6.498   2.247
  Start of MODEL   21
14705    HB3  TYR  83           HB2      TYR  83   4.953   4.105   2.470
  Start of MODEL   21
14706    HB2  TYR  83           HB3      TYR  83   5.929   3.999   3.925
  Start of MODEL   21
14707    HD1  TYR  83           HD1      TYR  83   5.927   3.524   0.410
  Start of MODEL   21
14708    HD2  TYR  83           HD2      TYR  83   8.420   4.546   3.699
  Start of MODEL   21
14709    HE1  TYR  83           HE1      TYR  83   7.915   2.897  -0.899
  Start of MODEL   21
14710    HE2  TYR  83           HE2      TYR  83  10.400   3.929   2.401
  Start of MODEL   21
14711    HH   TYR  83           HH       TYR  83  10.242   3.288  -0.949
  Start of MODEL   21
14712    H    TYR  83           HN       TYR  83   6.845   5.895   4.911
  Start of MODEL   21
14713    HA   THR  84           HA       THR  84   1.999   6.936   4.239
  Start of MODEL   21
14714    HB   THR  84           HB       THR  84   2.267   9.352   2.430
  Start of MODEL   21
14715    HG1  THR  84           HG1      THR  84   3.739   8.893   4.275
  Start of MODEL   21
14716   HG21  THR  84          HG21      THR  84   0.359   8.840   4.735
  Start of MODEL   21
14717   HG23  THR  84          HG22      THR  84  -0.092   8.878   3.030
  Start of MODEL   21
14718   HG22  THR  84          HG23      THR  84   0.490  10.342   3.820
  Start of MODEL   21
14719    H    THR  84           HN       THR  84   3.975   7.487   2.154
  Start of MODEL   21
14720    HA   LEU  85           HA       LEU  85  -0.145   5.341   0.814
  Start of MODEL   21
14721    HB3  LEU  85           HB2      LEU  85  -1.282   4.012   3.279
  Start of MODEL   21
14722    HB2  LEU  85           HB3      LEU  85   0.034   3.402   2.293
  Start of MODEL   21
14723    HG   LEU  85           HG       LEU  85  -2.832   3.673   1.389
  Start of MODEL   21
14724   HD12  LEU  85          HD11      LEU  85  -2.064   2.410  -0.547
  Start of MODEL   21
14725   HD11  LEU  85          HD12      LEU  85  -0.407   2.527   0.085
  Start of MODEL   21
14726   HD13  LEU  85          HD13      LEU  85  -1.270   3.989  -0.419
  Start of MODEL   21
14727   HD23  LEU  85          HD21      LEU  85  -1.187   1.241   2.007
  Start of MODEL   21
14728   HD22  LEU  85          HD22      LEU  85  -2.870   1.281   1.454
  Start of MODEL   21
14729   HD21  LEU  85          HD23      LEU  85  -2.439   1.919   3.045
  Start of MODEL   21
14730    H    LEU  85           HN       LEU  85   0.293   5.865   3.647
  Start of MODEL   21
14731    HA   LEU  86           HA       LEU  86  -3.707   7.833   1.347
  Start of MODEL   21
14732    HB3  LEU  86           HB2      LEU  86  -4.067   9.099  -0.777
  Start of MODEL   21
14733    HB2  LEU  86           HB3      LEU  86  -2.717   8.251  -1.479
  Start of MODEL   21
14734    HG   LEU  86           HG       LEU  86  -2.223  10.570  -0.851
  Start of MODEL   21
14735   HD11  LEU  86          HD11      LEU  86  -2.503   9.606   1.952
  Start of MODEL   21
14736   HD13  LEU  86          HD12      LEU  86  -3.585  10.720   1.116
  Start of MODEL   21
14737   HD12  LEU  86          HD13      LEU  86  -1.912  11.191   1.441
  Start of MODEL   21
14738   HD23  LEU  86          HD21      LEU  86  -0.644   8.485   0.614
  Start of MODEL   21
14739   HD22  LEU  86          HD22      LEU  86  -0.110  10.127   0.269
  Start of MODEL   21
14740   HD21  LEU  86          HD23      LEU  86  -0.416   8.998  -1.059
  Start of MODEL   21
14741    H    LEU  86           HN       LEU  86  -1.625   6.437  -0.178
  Start of MODEL   21
14742    HA   ALA  87           HA       ALA  87  -6.323   5.593  -1.299
  Start of MODEL   21
14743    HB1  ALA  87           HB1      ALA  87  -7.717   5.519   1.383
  Start of MODEL   21
14744    HB3  ALA  87           HB2      ALA  87  -6.623   4.286   0.767
  Start of MODEL   21
14745    HB2  ALA  87           HB3      ALA  87  -8.167   4.560  -0.028
  Start of MODEL   21
14746    H    ALA  87           HN       ALA  87  -5.732   7.192   1.089
  Start of MODEL   21
14747    HA   ALA  88           HA       ALA  88  -8.918   9.036  -1.745
  Start of MODEL   21
14748    HB1  ALA  88           HB1      ALA  88  -8.140   8.199  -4.546
  Start of MODEL   21
14749    HB3  ALA  88           HB2      ALA  88  -7.293   9.379  -3.541
  Start of MODEL   21
14750    HB2  ALA  88           HB3      ALA  88  -8.932   9.711  -4.095
  Start of MODEL   21
14751    H    ALA  88           HN       ALA  88  -7.437   6.691  -2.658
  Start of MODEL   21
14752    HA   ASN  89           HA       ASN  89 -12.506   6.779  -2.873
  Start of MODEL   21
14753    HB3  ASN  89           HB2      ASN  89 -12.633   7.296   0.098
  Start of MODEL   21
14754    HB2  ASN  89           HB3      ASN  89 -11.716   5.974  -0.586
  Start of MODEL   21
14755   HD21  ASN  89          HD21      ASN  89 -12.808   4.193  -1.406
  Start of MODEL   21
14756   HD22  ASN  89          HD22      ASN  89 -14.461   3.910  -1.101
  Start of MODEL   21
14757    H    ASN  89           HN       ASN  89 -10.951   8.743  -1.338
  Start of MODEL   21
14758    HA   PRO  90           HA       PRO  90 -15.359  10.280  -3.235
  Start of MODEL   21
14759    HB3  PRO  90           HB2      PRO  90 -17.250   9.424  -4.238
  Start of MODEL   21
14760    HB2  PRO  90           HB3      PRO  90 -17.479   8.210  -2.978
  Start of MODEL   21
14761    HG2  PRO  90           HG2      PRO  90 -16.673   6.885  -4.716
  Start of MODEL   21
14762    HG3  PRO  90           HG3      PRO  90 -15.621   8.177  -5.327
  Start of MODEL   21
14763    HD2  PRO  90           HD2      PRO  90 -15.221   6.359  -2.986
  Start of MODEL   21
14764    HD3  PRO  90           HD3      PRO  90 -14.047   6.937  -4.189
  Start of MODEL   21
14765    HA   CYS  91           HA       CYS  91 -17.397   9.569   0.921
  Start of MODEL   21
14766    HB3  CYS  91           HB2      CYS  91 -15.566   7.290   1.684
  Start of MODEL   21
14767    HB2  CYS  91           HB3      CYS  91 -17.303   7.211   1.403
  Start of MODEL   21
14768    H    CYS  91           HN       CYS  91 -15.504   8.024  -0.591
  Start of MODEL   21
14769    HA2  GLY  92           HA2      GLY  92 -13.218  11.729   1.555
  Start of MODEL   21
14770    H    GLY  92           HN       GLY  92 -13.895   9.243   0.710
  Start of MODEL   21
14771    HA3  GLY  92           HA1      GLY  92 -13.280  10.734   3.011
  Start of MODEL   21
14772    HA   GLN  93           HA       GLN  93  -9.557   9.450   1.046
  Start of MODEL   21
14773    HB3  GLN  93           HB2      GLN  93  -8.828  12.370   1.209
  Start of MODEL   21
14774    HB2  GLN  93           HB3      GLN  93  -9.164  11.416  -0.216
  Start of MODEL   21
14775    HG2  GLN  93           HG2      GLN  93  -6.717  11.305   1.509
  Start of MODEL   21
14776    HG3  GLN  93           HG3      GLN  93  -7.086  10.106   0.269
  Start of MODEL   21
14777   HE21  GLN  93          HE21      GLN  93  -4.933  12.181   0.530
  Start of MODEL   21
14778   HE22  GLN  93          HE22      GLN  93  -4.985  13.046  -0.949
  Start of MODEL   21
14779    H    GLN  93           HN       GLN  93 -10.894  11.701   2.328
  Start of MODEL   21
14780    HA   ALA  94           HA       ALA  94  -7.793   9.035   5.019
  Start of MODEL   21
14781    HB1  ALA  94           HB1      ALA  94  -7.974   6.286   3.804
  Start of MODEL   21
14782    HB3  ALA  94           HB2      ALA  94  -9.190   7.019   4.852
  Start of MODEL   21
14783    HB2  ALA  94           HB3      ALA  94  -7.591   6.627   5.481
  Start of MODEL   21
14784    H    ALA  94           HN       ALA  94  -8.451   8.199   2.275
  Start of MODEL   21
14785    HA   SER  95           HA       SER  95  -3.748   7.713   3.969
  Start of MODEL   21
14786    HB3  SER  95           HB2      SER  95  -3.675  10.069   3.539
  Start of MODEL   21
14787    HB2  SER  95           HB3      SER  95  -2.249   9.660   4.490
  Start of MODEL   21
14788    HG   SER  95           HG       SER  95  -4.658  10.855   5.402
  Start of MODEL   21
14789    H    SER  95           HN       SER  95  -5.699   8.762   5.810
  Start of MODEL   21
14790    HA   ALA  96           HA       ALA  96  -1.776   6.944   7.859
  Start of MODEL   21
14791    HB1  ALA  96           HB1      ALA  96  -1.878   4.353   6.290
  Start of MODEL   21
14792    HB3  ALA  96           HB2      ALA  96  -3.074   4.894   7.468
  Start of MODEL   21
14793    HB2  ALA  96           HB3      ALA  96  -1.441   4.483   7.993
  Start of MODEL   21
14794    H    ALA  96           HN       ALA  96  -2.035   6.752   4.960
  Start of MODEL   21
14795    HA   SER  97           HA       SER  97   2.280   6.557   6.226
  Start of MODEL   21
14796    HB3  SER  97           HB2      SER  97   3.544   8.285   7.314
  Start of MODEL   21
14797    HB2  SER  97           HB3      SER  97   2.484   8.245   8.729
  Start of MODEL   21
14798    HG   SER  97           HG       SER  97   2.021   9.212   6.133
  Start of MODEL   21
14799    H    SER  97           HN       SER  97   0.467   6.420   8.512
  Start of MODEL   21
14800    HA   ILE  98           HA       ILE  98   4.664   4.098   8.950
  Start of MODEL   21
14801    HB   ILE  98           HB       ILE  98   3.319   2.464   7.622
  Start of MODEL   21
14802   HD13  ILE  98          HD11      ILE  98   6.654   1.031   6.609
  Start of MODEL   21
14803   HD12  ILE  98          HD12      ILE  98   7.044   0.416   8.215
  Start of MODEL   21
14804   HD11  ILE  98          HD13      ILE  98   7.158   2.146   7.880
  Start of MODEL   21
14805    H    ILE  98           HN       ILE  98   3.936   5.209   6.355
  Start of MODEL   21
14806    HA   MET  99           HA       MET  99   8.405   5.521   7.264
  Start of MODEL   21
14807    HB3  MET  99           HB2      MET  99   9.249   5.185  10.143
  Start of MODEL   21
14808    HB2  MET  99           HB3      MET  99   8.154   6.474   9.677
  Start of MODEL   21
14809    HG2  MET  99           HG2      MET  99   9.861   7.326   8.114
  Start of MODEL   21
14810    HG3  MET  99           HG3      MET  99  10.371   7.353   9.793
  Start of MODEL   21
14811    HE1  MET  99           HE1      MET  99  12.823   7.835   8.798
  Start of MODEL   21
14812    HE3  MET  99           HE2      MET  99  12.162   7.681   7.174
  Start of MODEL   21
14813    HE2  MET  99           HE3      MET  99  13.612   6.779   7.618
  Start of MODEL   21
14814    H    MET  99           HN       MET  99   6.792   4.286   9.371
  Start of MODEL   21
14815    HA   ALA 100           HA       ALA 100  10.432   1.680   7.310
  Start of MODEL   21
14816    HB3  ALA 100           HB1      ALA 100   8.851   1.433   5.466
  Start of MODEL   21
14817    HB2  ALA 100           HB2      ALA 100  10.419   0.741   5.059
  Start of MODEL   21
14818    HB1  ALA 100           HB3      ALA 100   9.948   2.312   4.405
  Start of MODEL   21
14819    H    ALA 100           HN       ALA 100   9.672   4.242   6.119
  Start of MODEL   21
14820    HA   ALA 101           HA       ALA 101  14.399   3.193   6.335
  Start of MODEL   21
14821    HB3  ALA 101           HB1      ALA 101  14.376   3.531   8.750
  Start of MODEL   21
14822    HB2  ALA 101           HB2      ALA 101  15.881   2.763   8.251
  Start of MODEL   21
14823    HB1  ALA 101           HB3      ALA 101  14.606   1.800   9.003
  Start of MODEL   21
14824    H    ALA 101           HN       ALA 101  12.447   1.660   7.850
  Start of MODEL   21
14825    HA   PHE 102           HA       PHE 102  15.336  -0.823   4.767
  Start of MODEL   21
14826    HB3  PHE 102           HB2      PHE 102  15.948  -0.625   2.344
  Start of MODEL   21
14827    HB2  PHE 102           HB3      PHE 102  15.732   1.113   2.473
  Start of MODEL   21
14828    HD1  PHE 102           HD1      PHE 102  14.026  -2.101   2.297
  Start of MODEL   21
14829    HD2  PHE 102           HD2      PHE 102  13.538   2.096   2.711
  Start of MODEL   21
14830    HE1  PHE 102           HE1      PHE 102  11.639  -2.331   1.777
  Start of MODEL   21
14831    HE2  PHE 102           HE2      PHE 102  11.149   1.870   2.193
  Start of MODEL   21
14832    HZ   PHE 102           HZ       PHE 102  10.202  -0.370   1.708
  Start of MODEL   21
14833    H    PHE 102           HN       PHE 102  14.961   2.051   4.652
  Start of MODEL   21
14834    HA   MET 103           HA       MET 103  19.748   0.539   4.828
  Start of MODEL   21
14835    HB3  MET 103           HB2      MET 103  21.101   0.594   2.732
  Start of MODEL   21
14836    HB2  MET 103           HB3      MET 103  19.628   0.912   1.831
  Start of MODEL   21
14837    HG2  MET 103           HG2      MET 103  20.274  -1.614   3.298
  Start of MODEL   21
14838    HG3  MET 103           HG3      MET 103  18.750  -1.272   2.473
  Start of MODEL   21
14839    HE1  MET 103           HE1      MET 103  19.040  -3.486   0.967
  Start of MODEL   21
14840    HE3  MET 103           HE2      MET 103  20.528  -3.821   1.847
  Start of MODEL   21
14841    HE2  MET 103           HE3      MET 103  20.519  -3.857   0.082
  Start of MODEL   21
14842    H    MET 103           HN       MET 103  17.514   1.605   3.295
  Start of MODEL   21
14843    HA   ASP 104           HA       ASP 104  20.490   4.861   4.642
  Start of MODEL   21
14844    HB3  ASP 104           HB2      ASP 104  22.501   5.448   5.966
  Start of MODEL   21
14845    HB2  ASP 104           HB3      ASP 104  22.997   3.765   5.950
  Start of MODEL   21
14846    H    ASP 104           HN       ASP 104  21.461   2.109   4.896
  Start of MODEL   21
14847    HA   ASN 105           HA       ASN 105  23.197   5.402   1.358
  Start of MODEL   21
14848    HB3  ASN 105           HB2      ASN 105  21.783   7.456   1.240
  Start of MODEL   21
14849    HB2  ASN 105           HB3      ASN 105  23.377   7.686   0.554
  Start of MODEL   21
14850   HD21  ASN 105          HD21      ASN 105  24.730   9.225   1.392
  Start of MODEL   21
14851   HD22  ASN 105          HD22      ASN 105  24.260  10.309   2.652
  Start of MODEL   21
14852    H    ASN 105           HN       ASN 105  22.030   6.452   3.782
  Start of MODEL   21
14853    HA   PRO 106           HA       PRO 106  27.224   5.662   3.246
  Start of MODEL   21
14854    HB3  PRO 106           HB2      PRO 106  27.749   3.498   2.856
  Start of MODEL   21
14855    HB2  PRO 106           HB3      PRO 106  28.414   4.092   1.339
  Start of MODEL   21
14856    HG2  PRO 106           HG2      PRO 106  26.762   2.991   0.209
  Start of MODEL   21
14857    HG3  PRO 106           HG3      PRO 106  26.074   2.443   1.741
  Start of MODEL   21
14858    HD2  PRO 106           HD2      PRO 106  25.223   4.653   0.001
  Start of MODEL   21
14859    HD3  PRO 106           HD3      PRO 106  24.340   3.816   1.296
  Start of MODEL   21
14860    HA   PHE 107           HA       PHE 107  29.131   8.004   0.107
  Start of MODEL   21
14861    HB3  PHE 107           HB2      PHE 107  31.353   8.779   1.061
  Start of MODEL   21
14862    HB2  PHE 107           HB3      PHE 107  31.071   7.512   2.280
  Start of MODEL   21
14863    HD1  PHE 107           HD1      PHE 107  29.308  10.468   0.834
  Start of MODEL   21
14864    HD2  PHE 107           HD2      PHE 107  30.084   8.061   4.252
  Start of MODEL   21
14865    HE1  PHE 107           HE1      PHE 107  27.989  12.008   2.217
  Start of MODEL   21
14866    HE2  PHE 107           HE2      PHE 107  28.756   9.592   5.638
  Start of MODEL   21
14867    HZ   PHE 107           HZ       PHE 107  27.646  11.549   4.581
  Start of MODEL   21
14868    H    PHE 107           HN       PHE 107  29.436   5.924   2.130
  Start of MODEL   22
14869    H1   ASP   1           H        ASP   1 -26.711 -11.639   2.660
  Start of MODEL   22
14870    H2   ASP   1           H2       ASP   1 -28.200 -10.944   3.034
  Start of MODEL   22
14871    H3   ASP   1           H3       ASP   1 -26.898  -9.940   2.672
  Start of MODEL   22
14872    HA   ASP   1           HA       ASP   1 -26.885 -10.768   0.419
  Start of MODEL   22
14873    HB3  ASP   1           HB2      ASP   1 -27.992 -12.966   0.897
  Start of MODEL   22
14874    HB2  ASP   1           HB3      ASP   1 -28.787 -12.080  -0.396
  Start of MODEL   22
14875    HA   ASP   2           HA       ASP   2 -28.580  -7.449  -1.707
  Start of MODEL   22
14876    HB3  ASP   2           HB2      ASP   2 -31.017  -7.889   0.052
  Start of MODEL   22
14877    HB2  ASP   2           HB3      ASP   2 -30.832  -8.583  -1.558
  Start of MODEL   22
14878    H    ASP   2           HN       ASP   2 -27.862  -9.437  -1.035
  Start of MODEL   22
14879    HA   ASP   3           HA       ASP   3 -27.449  -4.782   1.561
  Start of MODEL   22
14880    HB3  ASP   3           HB2      ASP   3 -25.671  -5.329   3.077
  Start of MODEL   22
14881    HB2  ASP   3           HB3      ASP   3 -25.023  -6.546   1.999
  Start of MODEL   22
14882    H    ASP   3           HN       ASP   3 -26.737  -7.053  -0.214
  Start of MODEL   22
14883    HA   ASP   4           HA       ASP   4 -23.965  -4.824  -1.585
  Start of MODEL   22
14884    HB3  ASP   4           HB2      ASP   4 -24.504  -4.737  -3.969
  Start of MODEL   22
14885    HB2  ASP   4           HB3      ASP   4 -26.220  -4.643  -3.570
  Start of MODEL   22
14886    H    ASP   4           HN       ASP   4 -26.791  -5.103  -1.217
  Start of MODEL   22
14887    HA   ASP   5           HA       ASP   5 -25.191  -0.441  -2.347
  Start of MODEL   22
14888    HB3  ASP   5           HB2      ASP   5 -27.680  -0.658  -2.172
  Start of MODEL   22
14889    HB2  ASP   5           HB3      ASP   5 -27.046   0.893  -1.639
  Start of MODEL   22
14890    H    ASP   5           HN       ASP   5 -26.416  -2.665  -0.939
  Start of MODEL   22
14891    HA   VAL   6           HA       VAL   6 -24.121   0.130   2.198
  Start of MODEL   22
14892    HB   VAL   6           HB       VAL   6 -22.599  -1.304   3.499
  Start of MODEL   22
14893    H    VAL   6           HN       VAL   6 -24.361  -2.010   0.391
  Start of MODEL   22
14894    HA   SER   7           HA       SER   7 -20.456   1.351   0.523
  Start of MODEL   22
14895    HB3  SER   7           HB2      SER   7 -21.892   2.948  -0.322
  Start of MODEL   22
14896    HB2  SER   7           HB3      SER   7 -20.572   3.893   0.412
  Start of MODEL   22
14897    HG   SER   7           HG       SER   7 -22.533   4.787   0.980
  Start of MODEL   22
14898    H    SER   7           HN       SER   7 -22.786   1.674   2.180
  Start of MODEL   22
14899    HA   PHE   8           HA       PHE   8 -18.527   1.714   4.420
  Start of MODEL   22
14900    HB3  PHE   8           HB2      PHE   8 -16.554   0.118   4.410
  Start of MODEL   22
14901    HB2  PHE   8           HB3      PHE   8 -17.123  -0.463   2.853
  Start of MODEL   22
14902    HD1  PHE   8           HD1      PHE   8 -18.878  -2.051   2.681
  Start of MODEL   22
14903    HD2  PHE   8           HD2      PHE   8 -17.998  -0.211   6.423
  Start of MODEL   22
14904    HE1  PHE   8           HE1      PHE   8 -20.302  -3.672   3.819
  Start of MODEL   22
14905    HE2  PHE   8           HE2      PHE   8 -19.445  -1.844   7.552
  Start of MODEL   22
14906    HZ   PHE   8           HZ       PHE   8 -20.593  -3.573   6.246
  Start of MODEL   22
14907    H    PHE   8           HN       PHE   8 -19.064   0.517   1.868
  Start of MODEL   22
14908    HA   CYS   9           HA       CYS   9 -15.905   4.573   2.555
  Start of MODEL   22
14909    HB3  CYS   9           HB2      CYS   9 -15.584   6.329   4.141
  Start of MODEL   22
14910    HB2  CYS   9           HB3      CYS   9 -15.846   5.246   5.507
  Start of MODEL   22
14911    H    CYS   9           HN       CYS   9 -17.113   3.223   4.790
  Start of MODEL   22
14912    HA   ALA  10           HA       ALA  10 -12.130   2.835   3.422
  Start of MODEL   22
14913    HB1  ALA  10           HB1      ALA  10 -11.140   5.373   2.162
  Start of MODEL   22
14914    HB3  ALA  10           HB2      ALA  10 -11.773   3.966   1.298
  Start of MODEL   22
14915    HB2  ALA  10           HB3      ALA  10 -10.282   3.841   2.237
  Start of MODEL   22
14916    H    ALA  10           HN       ALA  10 -13.516   5.371   3.068
  Start of MODEL   22
14917    HA   SER  11           HA       SER  11  -9.701   4.578   6.545
  Start of MODEL   22
14918    HB3  SER  11           HB2      SER  11 -10.553   1.831   7.525
  Start of MODEL   22
14919    HB2  SER  11           HB3      SER  11 -11.541   3.272   7.730
  Start of MODEL   22
14920    HG   SER  11           HG       SER  11 -10.514   3.255   9.528
  Start of MODEL   22
14921    H    SER  11           HN       SER  11 -10.906   2.432   4.964
  Start of MODEL   22
14922    HA   VAL  12           HA       VAL  12  -6.349   2.032   5.386
  Start of MODEL   22
14923    HB   VAL  12           HB       VAL  12  -5.316   4.893   5.521
  Start of MODEL   22
14924    H    VAL  12           HN       VAL  12  -7.495   4.300   6.850
  Start of MODEL   22
14925    HA   GLN  13           HA       GLN  13  -3.803   1.623   8.892
  Start of MODEL   22
14926    HB3  GLN  13           HB2      GLN  13  -3.912  -0.823   9.508
  Start of MODEL   22
14927    HB2  GLN  13           HB3      GLN  13  -4.983  -1.046   8.135
  Start of MODEL   22
14928    HG2  GLN  13           HG2      GLN  13  -6.551   0.583   9.157
  Start of MODEL   22
14929    HG3  GLN  13           HG3      GLN  13  -6.318  -0.897  10.087
  Start of MODEL   22
14930   HE21  GLN  13          HE21      GLN  13  -5.769   2.541   9.983
  Start of MODEL   22
14931   HE22  GLN  13          HE22      GLN  13  -5.234   2.685  11.609
  Start of MODEL   22
14932    H    GLN  13           HN       GLN  13  -5.125   0.737   6.448
  Start of MODEL   22
14933    HA   LEU  14           HA       LEU  14  -0.437  -0.156   6.665
  Start of MODEL   22
14934    HB3  LEU  14           HB2      LEU  14   1.527   1.503   6.866
  Start of MODEL   22
14935    HB2  LEU  14           HB3      LEU  14   0.369   2.595   7.596
  Start of MODEL   22
14936    HG   LEU  14           HG       LEU  14  -0.999   2.391   5.464
  Start of MODEL   22
14937   HD13  LEU  14          HD11      LEU  14   0.449   4.323   5.897
  Start of MODEL   22
14938   HD12  LEU  14          HD12      LEU  14   0.433   3.878   4.193
  Start of MODEL   22
14939   HD11  LEU  14          HD13      LEU  14   1.814   3.446   5.202
  Start of MODEL   22
14940   HD22  LEU  14          HD21      LEU  14   0.174   1.581   3.502
  Start of MODEL   22
14941   HD21  LEU  14          HD22      LEU  14  -0.026   0.304   4.709
  Start of MODEL   22
14942   HD23  LEU  14          HD23      LEU  14   1.535   1.101   4.517
  Start of MODEL   22
14943    H    LEU  14           HN       LEU  14  -1.658   1.662   8.616
  Start of MODEL   22
14944    HA   HIS  15           HA       HIS  15   1.965  -1.135  10.147
  Start of MODEL   22
14945    HB3  HIS  15           HB2      HIS  15   2.146  -3.710  10.134
  Start of MODEL   22
14946    HB2  HIS  15           HB3      HIS  15   1.185  -3.635   8.661
  Start of MODEL   22
14947    HD1  HIS  15           HD1      HIS  15   0.918  -3.504  12.318
  Start of MODEL   22
14948    HD2  HIS  15           HD2      HIS  15  -1.491  -2.597   9.062
  Start of MODEL   22
14949    HE1  HIS  15           HE1      HIS  15  -1.411  -3.323  13.235
  Start of MODEL   22
14950    HE2  HIS  15           HE2      HIS  15  -2.858  -3.079  11.209
  Start of MODEL   22
14951    H    HIS  15           HN       HIS  15   1.395  -1.326   7.316
  Start of MODEL   22
14952    HA   THR  16           HA       THR  16   6.086  -1.151   9.284
  Start of MODEL   22
14953    HB   THR  16           HB       THR  16   6.174  -3.170  11.533
  Start of MODEL   22
14954    HG1  THR  16           HG1      THR  16   5.269  -0.565  11.447
  Start of MODEL   22
14955   HG21  THR  16          HG21      THR  16   8.069  -0.954  10.705
  Start of MODEL   22
14956   HG23  THR  16          HG22      THR  16   8.315  -2.665  10.387
  Start of MODEL   22
14957   HG22  THR  16          HG23      THR  16   8.304  -2.072  12.052
  Start of MODEL   22
14958    H    THR  16           HN       THR  16   3.936  -2.023  10.790
  Start of MODEL   22
14959    HA   ALA  17           HA       ALA  17   6.820  -4.357   6.387
  Start of MODEL   22
14960    HB1  ALA  17           HB1      ALA  17   8.172  -2.424   5.625
  Start of MODEL   22
14961    HB3  ALA  17           HB2      ALA  17   8.919  -3.981   5.294
  Start of MODEL   22
14962    HB2  ALA  17           HB3      ALA  17   9.494  -2.997   6.639
  Start of MODEL   22
14963    H    ALA  17           HN       ALA  17   7.423  -2.080   7.883
  Start of MODEL   22
14964    HA   VAL  18           HA       VAL  18   8.951  -7.301   8.768
  Start of MODEL   22
14965    HB   VAL  18           HB       VAL  18   8.495  -9.607   7.931
  Start of MODEL   22
14966    H    VAL  18           HN       VAL  18   7.706  -6.375   6.307
  Start of MODEL   22
14967    HA   GLU  19           HA       GLU  19  12.746  -7.446   6.788
  Start of MODEL   22
14968    HB3  GLU  19           HB2      GLU  19  14.530  -8.202   8.339
  Start of MODEL   22
14969    HB2  GLU  19           HB3      GLU  19  13.283  -8.666   9.483
  Start of MODEL   22
14970    HG2  GLU  19           HG2      GLU  19  13.592  -5.877   8.437
  Start of MODEL   22
14971    HG3  GLU  19           HG3      GLU  19  12.593  -6.424   9.782
  Start of MODEL   22
14972    H    GLU  19           HN       GLU  19  10.950  -8.219   8.886
  Start of MODEL   22
14973    HA   MET  20           HA       MET  20  14.139 -11.170   5.364
  Start of MODEL   22
14974    HB3  MET  20           HB2      MET  20  11.825 -11.985   5.429
  Start of MODEL   22
14975    HB2  MET  20           HB3      MET  20  12.518 -12.357   3.862
  Start of MODEL   22
14976    HG2  MET  20           HG2      MET  20  10.644 -10.085   4.417
  Start of MODEL   22
14977    HG3  MET  20           HG3      MET  20  11.329 -10.512   2.851
  Start of MODEL   22
14978    HE3  MET  20           HE1      MET  20   8.202 -10.181   3.305
  Start of MODEL   22
14979    HE2  MET  20           HE2      MET  20   7.580 -11.581   2.432
  Start of MODEL   22
14980    HE1  MET  20           HE3      MET  20   8.911 -10.636   1.756
  Start of MODEL   22
14981    H    MET  20           HN       MET  20  12.941  -8.648   5.141
  Start of MODEL   22
14982    HA   HIS  21           HA       HIS  21  15.931  -9.747   1.847
  Start of MODEL   22
14983    HB3  HIS  21           HB2      HIS  21  16.119 -11.053  -0.331
  Start of MODEL   22
14984    HB2  HIS  21           HB3      HIS  21  15.063 -12.248   0.417
  Start of MODEL   22
14985    HD1  HIS  21           HD1      HIS  21  16.248 -14.035   1.649
  Start of MODEL   22
14986    HD2  HIS  21           HD2      HIS  21  18.543 -10.588   1.379
  Start of MODEL   22
14987    HE1  HIS  21           HE1      HIS  21  18.480 -14.618   2.637
  Start of MODEL   22
14988    HE2  HIS  21           HE2      HIS  21  19.880 -12.578   2.336
  Start of MODEL   22
14989    H    HIS  21           HN       HIS  21  14.292 -11.854   2.731
  Start of MODEL   22
14990    HA   HIS  22           HA       HIS  22  12.697  -8.213  -0.783
  Start of MODEL   22
14991    HB3  HIS  22           HB2      HIS  22  10.632  -9.061  -1.809
  Start of MODEL   22
14992    HB2  HIS  22           HB3      HIS  22  10.601 -10.410  -0.679
  Start of MODEL   22
14993    HD1  HIS  22           HD1      HIS  22  13.332  -9.145  -3.099
  Start of MODEL   22
14994    HD2  HIS  22           HD2      HIS  22  11.365 -12.641  -1.973
  Start of MODEL   22
14995    HE1  HIS  22           HE1      HIS  22  14.372 -10.963  -4.432
  Start of MODEL   22
14996    HE2  HIS  22           HE2      HIS  22  13.279 -13.070  -3.656
  Start of MODEL   22
14997    H    HIS  22           HN       HIS  22  12.699 -10.635   0.868
  Start of MODEL   22
14998    HA   TRP  23           HA       TRP  23  10.713  -6.723   2.710
  Start of MODEL   22
14999    HB3  TRP  23           HB2      TRP  23  10.650  -4.217   2.635
  Start of MODEL   22
15000    HB2  TRP  23           HB3      TRP  23  11.297  -4.317   1.001
  Start of MODEL   22
15001    HD1  TRP  23           HD1      TRP  23  13.865  -5.115   0.742
  Start of MODEL   22
15002    HE1  TRP  23           HE1      TRP  23  15.824  -5.100   2.441
  Start of MODEL   22
15003    HE3  TRP  23           HE3      TRP  23  11.215  -4.580   5.076
  Start of MODEL   22
15004    HZ2  TRP  23           HZ2      TRP  23  16.186  -4.889   5.203
  Start of MODEL   22
15005    HZ3  TRP  23           HZ3      TRP  23  12.441  -4.479   7.200
  Start of MODEL   22
15006    HH2  TRP  23           HH2      TRP  23  14.878  -4.633   7.258
  Start of MODEL   22
15007    H    TRP  23           HN       TRP  23  11.696  -6.458   0.016
  Start of MODEL   22
15008    HA   CYS  24           HA       CYS  24   6.647  -6.016   1.370
  Start of MODEL   22
15009    HB3  CYS  24           HB2      CYS  24   6.687  -8.222   3.445
  Start of MODEL   22
15010    HB2  CYS  24           HB3      CYS  24   6.727  -8.433   1.704
  Start of MODEL   22
15011    H    CYS  24           HN       CYS  24   8.733  -6.697   3.323
  Start of MODEL   22
15012    HA   ILE  25           HA       ILE  25   5.271  -3.638   4.822
  Start of MODEL   22
15013    HB   ILE  25           HB       ILE  25   4.739  -1.950   2.348
  Start of MODEL   22
15014   HD11  ILE  25          HD11      ILE  25   6.149   0.521   3.583
  Start of MODEL   22
15015   HD13  ILE  25          HD12      ILE  25   6.558  -0.057   1.966
  Start of MODEL   22
15016   HD12  ILE  25          HD13      ILE  25   7.816   0.111   3.193
  Start of MODEL   22
15017    H    ILE  25           HN       ILE  25   5.636  -4.241   1.979
  Start of MODEL   22
15018    HA   PRO  26           HA       PRO  26   1.227  -5.476   3.884
  Start of MODEL   22
15019    HB3  PRO  26           HB2      PRO  26   1.055  -6.932   5.602
  Start of MODEL   22
15020    HB2  PRO  26           HB3      PRO  26   0.795  -5.614   6.744
  Start of MODEL   22
15021    HG2  PRO  26           HG2      PRO  26   2.859  -6.219   7.542
  Start of MODEL   22
15022    HG3  PRO  26           HG3      PRO  26   3.294  -7.036   6.035
  Start of MODEL   22
15023    HD2  PRO  26           HD2      PRO  26   3.530  -4.148   6.760
  Start of MODEL   22
15024    HD3  PRO  26           HD3      PRO  26   4.625  -5.194   5.823
  Start of MODEL   22
15025    HA   PHE  27           HA       PHE  27  -1.322  -2.307   5.513
  Start of MODEL   22
15026    HB3  PHE  27           HB2      PHE  27  -0.288  -1.253   3.516
  Start of MODEL   22
15027    HB2  PHE  27           HB3      PHE  27  -1.953  -0.747   3.770
  Start of MODEL   22
15028    HD1  PHE  27           HD1      PHE  27  -3.717  -1.353   2.186
  Start of MODEL   22
15029    HD2  PHE  27           HD2      PHE  27   0.328  -2.573   1.607
  Start of MODEL   22
15030    HE1  PHE  27           HE1      PHE  27  -4.224  -1.931  -0.131
  Start of MODEL   22
15031    HE2  PHE  27           HE2      PHE  27  -0.192  -3.154  -0.716
  Start of MODEL   22
15032    HZ   PHE  27           HZ       PHE  27  -2.465  -2.836  -1.589
  Start of MODEL   22
15033    H    PHE  27           HN       PHE  27  -0.706  -4.458   3.664
  Start of MODEL   22
15034    HA   SER  28           HA       SER  28  -5.303  -3.546   4.126
  Start of MODEL   22
15035    HB3  SER  28           HB2      SER  28  -6.589  -3.956   6.213
  Start of MODEL   22
15036    HB2  SER  28           HB3      SER  28  -5.346  -3.090   7.123
  Start of MODEL   22
15037    HG   SER  28           HG       SER  28  -4.219  -4.889   5.523
  Start of MODEL   22
15038    H    SER  28           HN       SER  28  -3.533  -1.729   5.493
  Start of MODEL   22
15039    HA   VAL  29           HA       VAL  29  -7.742   0.044   4.299
  Start of MODEL   22
15040    HB   VAL  29           HB       VAL  29  -6.286   0.836   2.463
  Start of MODEL   22
15041    H    VAL  29           HN       VAL  29  -6.699  -2.398   3.105
  Start of MODEL   22
15042    HA   ASP  30           HA       ASP  30 -11.167  -2.163   2.888
  Start of MODEL   22
15043    HB3  ASP  30           HB2      ASP  30 -11.127  -2.675   5.326
  Start of MODEL   22
15044    HB2  ASP  30           HB3      ASP  30 -12.737  -2.625   4.631
  Start of MODEL   22
15045    H    ASP  30           HN       ASP  30  -9.911  -0.052   4.471
  Start of MODEL   22
15046    HA2  GLY  31           HA2      GLY  31 -14.988   0.135   2.518
  Start of MODEL   22
15047    H    GLY  31           HN       GLY  31 -13.281  -1.882   2.289
  Start of MODEL   22
15048    HA3  GLY  31           HA1      GLY  31 -13.792   0.798   1.404
  Start of MODEL   22
15049    HA   GLN  32           HA       GLN  32 -16.303  -2.389  -0.698
  Start of MODEL   22
15050    HB3  GLN  32           HB2      GLN  32 -18.840  -0.709  -0.435
  Start of MODEL   22
15051    HB2  GLN  32           HB3      GLN  32 -18.452  -2.019   0.659
  Start of MODEL   22
15052    HG2  GLN  32           HG2      GLN  32 -18.483  -3.594  -1.290
  Start of MODEL   22
15053    HG3  GLN  32           HG3      GLN  32 -20.031  -2.866  -0.903
  Start of MODEL   22
15054   HE21  GLN  32          HE21      GLN  32 -19.088  -4.080  -3.398
  Start of MODEL   22
15055   HE22  GLN  32          HE22      GLN  32 -19.219  -2.862  -4.606
  Start of MODEL   22
15056    H    GLN  32           HN       GLN  32 -16.636  -0.161   1.091
  Start of MODEL   22
15057    HA   PRO  33           HA       PRO  33 -16.646   1.027  -4.051
  Start of MODEL   22
15058    HB3  PRO  33           HB2      PRO  33 -17.782   2.980  -3.540
  Start of MODEL   22
15059    HB2  PRO  33           HB3      PRO  33 -16.186   3.610  -3.126
  Start of MODEL   22
15060    HG2  PRO  33           HG2      PRO  33 -16.502   3.297  -0.871
  Start of MODEL   22
15061    HG3  PRO  33           HG3      PRO  33 -18.196   3.510  -1.342
  Start of MODEL   22
15062    HD2  PRO  33           HD2      PRO  33 -17.302   1.319  -0.037
  Start of MODEL   22
15063    HD3  PRO  33           HD3      PRO  33 -18.652   1.271  -1.190
  Start of MODEL   22
15064    HA   ALA  34           HA       ALA  34 -12.399   0.433  -3.312
  Start of MODEL   22
15065    HB2  ALA  34           HB1      ALA  34 -12.562   0.672  -6.313
  Start of MODEL   22
15066    HB1  ALA  34           HB2      ALA  34 -12.789  -0.814  -5.392
  Start of MODEL   22
15067    HB3  ALA  34           HB3      ALA  34 -11.223  -0.004  -5.387
  Start of MODEL   22
15068    H    ALA  34           HN       ALA  34 -14.689   0.814  -4.931
  Start of MODEL   22
15069    HA   PRO  35           HA       PRO  35 -11.072   4.714  -3.499
  Start of MODEL   22
15070    HB3  PRO  35           HB2      PRO  35 -10.912   4.481  -1.195
  Start of MODEL   22
15071    HB2  PRO  35           HB3      PRO  35  -9.203   4.606  -1.636
  Start of MODEL   22
15072    HG2  PRO  35           HG2      PRO  35  -8.869   2.317  -1.451
  Start of MODEL   22
15073    HG3  PRO  35           HG3      PRO  35 -10.088   2.556  -0.203
  Start of MODEL   22
15074    HD2  PRO  35           HD2      PRO  35 -10.400   0.846  -2.367
  Start of MODEL   22
15075    HD3  PRO  35           HD3      PRO  35 -11.759   1.567  -1.476
  Start of MODEL   22
15076    HA   SER  36           HA       SER  36  -7.417   4.259  -5.870
  Start of MODEL   22
15077    HB3  SER  36           HB2      SER  36  -6.683   6.437  -6.645
  Start of MODEL   22
15078    HB2  SER  36           HB3      SER  36  -7.576   7.234  -5.349
  Start of MODEL   22
15079    HG   SER  36           HG       SER  36  -8.678   5.657  -7.414
  Start of MODEL   22
15080    H    SER  36           HN       SER  36  -9.285   5.781  -4.310
  Start of MODEL   22
15081    HA   LEU  37           HA       LEU  37  -4.661   4.564  -2.415
  Start of MODEL   22
15082    HB3  LEU  37           HB2      LEU  37  -3.126   2.630  -2.431
  Start of MODEL   22
15083    HB2  LEU  37           HB3      LEU  37  -3.902   2.051  -3.888
  Start of MODEL   22
15084    HG   LEU  37           HG       LEU  37  -6.009   1.758  -2.628
  Start of MODEL   22
15085   HD11  LEU  37          HD11      LEU  37  -3.621   0.435  -1.349
  Start of MODEL   22
15086   HD13  LEU  37          HD12      LEU  37  -4.349  -0.039  -2.880
  Start of MODEL   22
15087   HD12  LEU  37          HD13      LEU  37  -5.271  -0.189  -1.390
  Start of MODEL   22
15088   HD23  LEU  37          HD21      LEU  37  -4.292   2.609  -0.308
  Start of MODEL   22
15089   HD22  LEU  37          HD22      LEU  37  -5.891   1.902  -0.140
  Start of MODEL   22
15090   HD21  LEU  37          HD23      LEU  37  -5.695   3.472  -0.929
  Start of MODEL   22
15091    H    LEU  37           HN       LEU  37  -5.759   3.343  -4.792
  Start of MODEL   22
15092    HA   ARG  38           HA       ARG  38  -1.208   5.874  -4.642
  Start of MODEL   22
15093    HB3  ARG  38           HB2      ARG  38  -2.598   8.322  -3.547
  Start of MODEL   22
15094    HB2  ARG  38           HB3      ARG  38  -2.685   7.678  -5.169
  Start of MODEL   22
15095    HG2  ARG  38           HG2      ARG  38  -1.334   9.610  -5.280
  Start of MODEL   22
15096    HG3  ARG  38           HG3      ARG  38  -0.367   9.113  -3.897
  Start of MODEL   22
15097    HD2  ARG  38           HD2      ARG  38   0.679   8.852  -6.191
  Start of MODEL   22
15098    HD3  ARG  38           HD3      ARG  38   0.732   7.432  -5.148
  Start of MODEL   22
15099    HE   ARG  38           HE       ARG  38  -1.507   7.574  -6.946
  Start of MODEL   22
15100   HH11  ARG  38          HH11      ARG  38   1.909   6.441  -6.620
  Start of MODEL   22
15101   HH12  ARG  38          HH12      ARG  38   1.650   5.166  -7.721
  Start of MODEL   22
15102   HH21  ARG  38          HH21      ARG  38  -1.718   5.761  -8.420
  Start of MODEL   22
15103   HH22  ARG  38          HH22      ARG  38  -0.377   4.732  -8.697
  Start of MODEL   22
15104    H    ARG  38           HN       ARG  38  -3.167   5.980  -2.485
  Start of MODEL   22
15105    HA   TRP  39           HA       TRP  39   1.389   6.074  -1.199
  Start of MODEL   22
15106    HB3  TRP  39           HB2      TRP  39   3.563   5.095  -1.834
  Start of MODEL   22
15107    HB2  TRP  39           HB3      TRP  39   3.031   5.020  -3.507
  Start of MODEL   22
15108    HD1  TRP  39           HD1      TRP  39   1.468   3.021  -4.209
  Start of MODEL   22
15109    HE1  TRP  39           HE1      TRP  39   0.742   0.871  -3.027
  Start of MODEL   22
15110    HE3  TRP  39           HE3      TRP  39   2.923   4.212   0.540
  Start of MODEL   22
15111    HZ2  TRP  39           HZ2      TRP  39   0.761  -0.188  -0.386
  Start of MODEL   22
15112    HZ3  TRP  39           HZ3      TRP  39   2.539   2.576   2.339
  Start of MODEL   22
15113    HH2  TRP  39           HH2      TRP  39   1.490   0.428   1.887
  Start of MODEL   22
15114    H    TRP  39           HN       TRP  39   0.757   5.743  -4.004
  Start of MODEL   22
15115    HA   LEU  40           HA       LEU  40   3.702   9.567  -2.382
  Start of MODEL   22
15116    HB3  LEU  40           HB2      LEU  40   2.257  10.414   0.154
  Start of MODEL   22
15117    HB2  LEU  40           HB3      LEU  40   1.644  10.633  -1.481
  Start of MODEL   22
15118    HG   LEU  40           HG       LEU  40   4.159  11.940  -0.510
  Start of MODEL   22
15119   HD13  LEU  40          HD11      LEU  40   4.082  11.632  -2.882
  Start of MODEL   22
15120   HD12  LEU  40          HD12      LEU  40   3.791  13.332  -2.497
  Start of MODEL   22
15121   HD11  LEU  40          HD13      LEU  40   2.439  12.273  -2.934
  Start of MODEL   22
15122   HD23  LEU  40          HD21      LEU  40   1.368  13.048  -0.758
  Start of MODEL   22
15123   HD22  LEU  40          HD22      LEU  40   2.821  13.961  -0.345
  Start of MODEL   22
15124   HD21  LEU  40          HD23      LEU  40   2.215  12.717   0.751
  Start of MODEL   22
15125    H    LEU  40           HN       LEU  40   2.102   7.951  -0.540
  Start of MODEL   22
15126    HA   PHE  41           HA       PHE  41   6.578   8.551   0.701
  Start of MODEL   22
15127    HB3  PHE  41           HB2      PHE  41   7.887   8.394  -2.014
  Start of MODEL   22
15128    HB2  PHE  41           HB3      PHE  41   7.098   7.081  -1.150
  Start of MODEL   22
15129    HD1  PHE  41           HD1      PHE  41  10.148   8.801  -1.720
  Start of MODEL   22
15130    HD2  PHE  41           HD2      PHE  41   8.089   6.316   1.038
  Start of MODEL   22
15131    HE1  PHE  41           HE1      PHE  41  12.282   8.170  -0.695
  Start of MODEL   22
15132    HE2  PHE  41           HE2      PHE  41  10.215   5.686   2.069
  Start of MODEL   22
15133    HZ   PHE  41           HZ       PHE  41  12.329   6.635   1.193
  Start of MODEL   22
15134    H    PHE  41           HN       PHE  41   5.798   9.770  -1.842
  Start of MODEL   22
15135    HA   ASN  42           HA       ASN  42   8.182  12.036   2.779
  Start of MODEL   22
15136    HB3  ASN  42           HB2      ASN  42  10.250  11.299   0.665
  Start of MODEL   22
15137    HB2  ASN  42           HB3      ASN  42  10.148  10.582   2.260
  Start of MODEL   22
15138   HD21  ASN  42          HD21      ASN  42  10.749  11.859   4.102
  Start of MODEL   22
15139   HD22  ASN  42          HD22      ASN  42  11.844  13.170   3.898
  Start of MODEL   22
15140    H    ASN  42           HN       ASN  42   7.072  10.239   1.930
  Start of MODEL   22
15141    HA2  GLY  43           HA2      GLY  43   5.342  14.450  -0.084
  Start of MODEL   22
15142    H    GLY  43           HN       GLY  43   6.248  12.464   0.763
  Start of MODEL   22
15143    HA3  GLY  43           HA1      GLY  43   6.917  15.214   0.069
  Start of MODEL   22
15144    HA   SER  44           HA       SER  44   7.206  13.684  -4.094
  Start of MODEL   22
15145    HB3  SER  44           HB2      SER  44   9.578  13.531  -3.714
  Start of MODEL   22
15146    HB2  SER  44           HB3      SER  44   9.166  12.240  -4.835
  Start of MODEL   22
15147    HG   SER  44           HG       SER  44   8.993  11.276  -2.325
  Start of MODEL   22
15148    H    SER  44           HN       SER  44   7.649  12.483  -1.457
  Start of MODEL   22
15149    HA   VAL  45           HA       VAL  45   4.488  10.677  -4.985
  Start of MODEL   22
15150    HB   VAL  45           HB       VAL  45   5.295  11.751  -7.701
  Start of MODEL   22
15151    H    VAL  45           HN       VAL  45   6.438  12.577  -5.735
  Start of MODEL   22
15152    HA   LEU  46           HA       LEU  46   7.100   7.325  -5.851
  Start of MODEL   22
15153    HB3  LEU  46           HB2      LEU  46   5.032   6.345  -3.883
  Start of MODEL   22
15154    HB2  LEU  46           HB3      LEU  46   6.582   7.036  -3.449
  Start of MODEL   22
15155    HG   LEU  46           HG       LEU  46   6.235   4.491  -5.025
  Start of MODEL   22
15156   HD11  LEU  46          HD11      LEU  46   8.660   5.741  -3.756
  Start of MODEL   22
15157   HD13  LEU  46          HD12      LEU  46   8.333   5.605  -5.483
  Start of MODEL   22
15158   HD12  LEU  46          HD13      LEU  46   8.604   4.155  -4.521
  Start of MODEL   22
15159   HD22  LEU  46          HD21      LEU  46   6.900   3.358  -2.958
  Start of MODEL   22
15160   HD21  LEU  46          HD22      LEU  46   5.377   4.220  -2.775
  Start of MODEL   22
15161   HD23  LEU  46          HD23      LEU  46   6.860   4.902  -2.106
  Start of MODEL   22
15162    H    LEU  46           HN       LEU  46   4.828   8.635  -4.656
  Start of MODEL   22
15163    HA   ASN  47           HA       ASN  47   4.112   5.720  -8.580
  Start of MODEL   22
15164    HB3  ASN  47           HB2      ASN  47   6.626   5.864 -10.268
  Start of MODEL   22
15165    HB2  ASN  47           HB3      ASN  47   5.436   7.155 -10.125
  Start of MODEL   22
15166   HD21  ASN  47          HD21      ASN  47   3.417   6.884 -11.043
  Start of MODEL   22
15167   HD22  ASN  47          HD22      ASN  47   3.098   5.695 -12.247
  Start of MODEL   22
15168    H    ASN  47           HN       ASN  47   6.770   6.566  -7.819
  Start of MODEL   22
15169    HA   GLU  48           HA       GLU  48   5.121   1.575  -7.739
  Start of MODEL   22
15170    HB3  GLU  48           HB2      GLU  48   3.394   0.063  -8.507
  Start of MODEL   22
15171    HB2  GLU  48           HB3      GLU  48   2.869   1.206  -9.728
  Start of MODEL   22
15172    HG2  GLU  48           HG2      GLU  48   1.489   0.868  -7.522
  Start of MODEL   22
15173    HG3  GLU  48           HG3      GLU  48   2.660   2.003  -6.867
  Start of MODEL   22
15174    H    GLU  48           HN       GLU  48   3.600   3.612  -8.929
  Start of MODEL   22
15175    HA   THR  49           HA       THR  49   7.409   0.978 -11.501
  Start of MODEL   22
15176    HB   THR  49           HB       THR  49   9.837   0.739 -10.924
  Start of MODEL   22
15177    HG1  THR  49           HG1      THR  49   9.985   1.608  -8.521
  Start of MODEL   22
15178   HG23  THR  49          HG21      THR  49   8.879   2.924 -11.423
  Start of MODEL   22
15179   HG22  THR  49          HG22      THR  49  10.133   3.064 -10.199
  Start of MODEL   22
15180   HG21  THR  49          HG23      THR  49   8.432   3.131  -9.731
  Start of MODEL   22
15181    H    THR  49           HN       THR  49   7.056   1.097  -8.613
  Start of MODEL   22
15182    HA   SER  50           HA       SER  50   8.075  -3.360 -11.464
  Start of MODEL   22
15183    HB3  SER  50           HB2      SER  50   9.999  -4.273 -12.618
  Start of MODEL   22
15184    HB2  SER  50           HB3      SER  50  10.929  -2.808 -12.293
  Start of MODEL   22
15185    HG   SER  50           HG       SER  50   8.686  -3.171 -13.948
  Start of MODEL   22
15186    H    SER  50           HN       SER  50   9.426  -0.885 -11.798
  Start of MODEL   22
15187    HA   PHE  51           HA       PHE  51  11.154  -3.876  -8.056
  Start of MODEL   22
15188    HB3  PHE  51           HB2      PHE  51  12.675  -2.279  -6.893
  Start of MODEL   22
15189    HB2  PHE  51           HB3      PHE  51  12.026  -0.987  -7.893
  Start of MODEL   22
15190    HD1  PHE  51           HD1      PHE  51  13.996  -4.116  -7.957
  Start of MODEL   22
15191    HD2  PHE  51           HD2      PHE  51  12.756  -0.659 -10.103
  Start of MODEL   22
15192    HE1  PHE  51           HE1      PHE  51  15.664  -4.605  -9.700
  Start of MODEL   22
15193    HE2  PHE  51           HE2      PHE  51  14.414  -1.142 -11.854
  Start of MODEL   22
15194    HZ   PHE  51           HZ       PHE  51  15.886  -3.169 -11.627
  Start of MODEL   22
15195    H    PHE  51           HN       PHE  51  10.265  -1.530  -9.548
  Start of MODEL   22
15196    HA   ILE  52           HA       ILE  52   8.498  -1.780  -5.005
  Start of MODEL   22
15197    HB   ILE  52           HB       ILE  52   8.151   0.945  -6.300
  Start of MODEL   22
15198   HD12  ILE  52          HD11      ILE  52  11.325   2.237  -4.807
  Start of MODEL   22
15199   HD11  ILE  52          HD12      ILE  52   9.732   2.372  -4.057
  Start of MODEL   22
15200   HD13  ILE  52          HD13      ILE  52   9.925   2.703  -5.782
  Start of MODEL   22
15201    H    ILE  52           HN       ILE  52   9.266  -0.940  -7.720
  Start of MODEL   22
15202    HA   PHE  53           HA       PHE  53   4.598  -1.835  -7.024
  Start of MODEL   22
15203    HB3  PHE  53           HB2      PHE  53   5.539  -3.450  -8.462
  Start of MODEL   22
15204    HB2  PHE  53           HB3      PHE  53   4.095  -4.208  -7.797
  Start of MODEL   22
15205    HD1  PHE  53           HD1      PHE  53   7.722  -4.305  -7.965
  Start of MODEL   22
15206    HD2  PHE  53           HD2      PHE  53   4.281  -6.028  -6.163
  Start of MODEL   22
15207    HE1  PHE  53           HE1      PHE  53   9.075  -6.219  -7.231
  Start of MODEL   22
15208    HE2  PHE  53           HE2      PHE  53   5.633  -7.946  -5.422
  Start of MODEL   22
15209    HZ   PHE  53           HZ       PHE  53   8.031  -8.037  -5.956
  Start of MODEL   22
15210    H    PHE  53           HN       PHE  53   6.646  -2.974  -5.299
  Start of MODEL   22
15211    HA   THR  54           HA       THR  54   2.181  -3.304  -3.765
  Start of MODEL   22
15212    HB   THR  54           HB       THR  54   0.107  -1.976  -5.533
  Start of MODEL   22
15213    HG1  THR  54           HG1      THR  54   2.355  -0.950  -4.844
  Start of MODEL   22
15214   HG22  THR  54          HG21      THR  54  -0.853  -1.309  -3.389
  Start of MODEL   22
15215   HG21  THR  54          HG22      THR  54   0.465  -2.115  -2.541
  Start of MODEL   22
15216   HG23  THR  54          HG23      THR  54  -0.696  -3.064  -3.470
  Start of MODEL   22
15217    H    THR  54           HN       THR  54   2.461  -2.625  -6.595
  Start of MODEL   22
15218    HA   GLU  55           HA       GLU  55   0.367  -6.884  -5.591
  Start of MODEL   22
15219    HB3  GLU  55           HB2      GLU  55   0.719  -8.788  -4.020
  Start of MODEL   22
15220    HB2  GLU  55           HB3      GLU  55   1.421  -7.662  -2.867
  Start of MODEL   22
15221    HG2  GLU  55           HG2      GLU  55   3.159  -7.108  -4.532
  Start of MODEL   22
15222    HG3  GLU  55           HG3      GLU  55   3.187  -8.788  -4.006
  Start of MODEL   22
15223    H    GLU  55           HN       GLU  55   1.627  -5.358  -3.470
  Start of MODEL   22
15224    HA   PHE  56           HA       PHE  56  -3.301  -6.822  -3.172
  Start of MODEL   22
15225    HB3  PHE  56           HB2      PHE  56  -5.199  -6.371  -4.705
  Start of MODEL   22
15226    HB2  PHE  56           HB3      PHE  56  -4.125  -6.575  -6.075
  Start of MODEL   22
15227    HD1  PHE  56           HD1      PHE  56  -4.612  -4.501  -3.051
  Start of MODEL   22
15228    HD2  PHE  56           HD2      PHE  56  -2.996  -4.765  -6.977
  Start of MODEL   22
15229    HE1  PHE  56           HE1      PHE  56  -4.114  -2.100  -3.001
  Start of MODEL   22
15230    HE2  PHE  56           HE2      PHE  56  -2.492  -2.355  -6.939
  Start of MODEL   22
15231    HZ   PHE  56           HZ       PHE  56  -3.057  -1.014  -4.933
  Start of MODEL   22
15232    H    PHE  56           HN       PHE  56  -1.732  -7.464  -5.569
  Start of MODEL   22
15233    HA   LEU  57           HA       LEU  57  -5.099 -10.625  -4.397
  Start of MODEL   22
15234    HB3  LEU  57           HB2      LEU  57  -3.912 -11.245  -2.319
  Start of MODEL   22
15235    HB2  LEU  57           HB3      LEU  57  -5.447 -12.069  -2.448
  Start of MODEL   22
15236    HG   LEU  57           HG       LEU  57  -5.233  -9.649  -0.730
  Start of MODEL   22
15237   HD11  LEU  57          HD11      LEU  57  -6.957 -12.113  -0.666
  Start of MODEL   22
15238   HD13  LEU  57          HD12      LEU  57  -7.451 -10.523  -1.220
  Start of MODEL   22
15239   HD12  LEU  57          HD13      LEU  57  -7.061 -10.780   0.490
  Start of MODEL   22
15240   HD21  LEU  57          HD21      LEU  57  -3.408 -11.104  -0.031
  Start of MODEL   22
15241   HD23  LEU  57          HD22      LEU  57  -4.513 -12.474   0.048
  Start of MODEL   22
15242   HD22  LEU  57          HD23      LEU  57  -4.706 -11.122   1.163
  Start of MODEL   22
15243    H    LEU  57           HN       LEU  57  -4.940  -8.287  -2.665
  Start of MODEL   22
15244    HA   GLU  58           HA       GLU  58  -9.262  -9.781  -4.485
  Start of MODEL   22
15245    HB3  GLU  58           HB2      GLU  58 -10.633 -11.846  -5.012
  Start of MODEL   22
15246    HB2  GLU  58           HB3      GLU  58  -9.146 -12.749  -4.730
  Start of MODEL   22
15247    HG2  GLU  58           HG2      GLU  58  -8.053 -11.376  -6.492
  Start of MODEL   22
15248    HG3  GLU  58           HG3      GLU  58  -9.373 -12.387  -7.085
  Start of MODEL   22
15249    H    GLU  58           HN       GLU  58  -7.217 -11.750  -4.107
  Start of MODEL   22
15250    HA   PRO  59           HA       PRO  59 -10.541 -10.191  -0.181
  Start of MODEL   22
15251    HB3  PRO  59           HB2      PRO  59 -11.427  -8.119   0.213
  Start of MODEL   22
15252    HB2  PRO  59           HB3      PRO  59 -12.716  -8.380  -0.966
  Start of MODEL   22
15253    HG2  PRO  59           HG2      PRO  59 -11.488  -6.795  -2.127
  Start of MODEL   22
15254    HG3  PRO  59           HG3      PRO  59  -9.968  -7.295  -1.369
  Start of MODEL   22
15255    HD2  PRO  59           HD2      PRO  59 -11.478  -8.596  -3.601
  Start of MODEL   22
15256    HD3  PRO  59           HD3      PRO  59  -9.728  -8.259  -3.440
  Start of MODEL   22
15257    HA   ALA  60           HA       ALA  60 -13.696 -13.089  -0.851
  Start of MODEL   22
15258    HB2  ALA  60           HB1      ALA  60 -14.457 -13.967   1.317
  Start of MODEL   22
15259    HB1  ALA  60           HB2      ALA  60 -13.665 -12.625   2.134
  Start of MODEL   22
15260    HB3  ALA  60           HB3      ALA  60 -12.699 -13.822   1.267
  Start of MODEL   22
15261    H    ALA  60           HN       ALA  60 -12.056 -11.439   0.731
  Start of MODEL   22
15262    HA   ALA  61           HA       ALA  61 -17.065 -10.554  -1.248
  Start of MODEL   22
15263    HB2  ALA  61           HB1      ALA  61 -18.454 -13.211  -1.342
  Start of MODEL   22
15264    HB1  ALA  61           HB2      ALA  61 -17.640 -12.428  -2.701
  Start of MODEL   22
15265    HB3  ALA  61           HB3      ALA  61 -19.079 -11.691  -1.981
  Start of MODEL   22
15266    H    ALA  61           HN       ALA  61 -15.927 -13.091  -0.994
  Start of MODEL   22
15267    HA   ASN  62           HA       ASN  62 -19.226 -11.411   2.746
  Start of MODEL   22
15268    HB3  ASN  62           HB2      ASN  62 -18.702 -13.735   3.220
  Start of MODEL   22
15269    HB2  ASN  62           HB3      ASN  62 -18.533 -12.789   4.694
  Start of MODEL   22
15270   HD21  ASN  62          HD21      ASN  62 -16.468 -12.537   5.628
  Start of MODEL   22
15271   HD22  ASN  62          HD22      ASN  62 -15.125 -13.467   5.070
  Start of MODEL   22
15272    H    ASN  62           HN       ASN  62 -16.818 -12.452   1.475
  Start of MODEL   22
15273    HA   GLU  63           HA       GLU  63 -16.438  -8.418   4.422
  Start of MODEL   22
15274    HB3  GLU  63           HB2      GLU  63 -14.806 -10.221   4.847
  Start of MODEL   22
15275    HB2  GLU  63           HB3      GLU  63 -14.067  -8.624   4.922
  Start of MODEL   22
15276    HG2  GLU  63           HG2      GLU  63 -13.870 -10.610   2.672
  Start of MODEL   22
15277    HG3  GLU  63           HG3      GLU  63 -13.138  -9.003   2.687
  Start of MODEL   22
15278    H    GLU  63           HN       GLU  63 -16.290 -10.127   2.090
  Start of MODEL   22
15279    HA   THR  64           HA       THR  64 -14.774  -5.897   1.161
  Start of MODEL   22
15280    HB   THR  64           HB       THR  64 -15.466  -3.504   1.768
  Start of MODEL   22
15281    HG1  THR  64           HG1      THR  64 -16.020  -4.838   4.192
  Start of MODEL   22
15282   HG21  THR  64          HG21      THR  64 -17.523  -5.707   2.035
  Start of MODEL   22
15283   HG23  THR  64          HG22      THR  64 -16.953  -5.007   0.522
  Start of MODEL   22
15284   HG22  THR  64          HG23      THR  64 -17.878  -4.022   1.658
  Start of MODEL   22
15285    H    THR  64           HN       THR  64 -14.873  -6.492   4.018
  Start of MODEL   22
15286    HA   VAL  65           HA       VAL  65 -11.184  -4.222   3.336
  Start of MODEL   22
15287    HB   VAL  65           HB       VAL  65 -10.451  -6.958   4.413
  Start of MODEL   22
15288    H    VAL  65           HN       VAL  65 -12.749  -6.676   3.111
  Start of MODEL   22
15289    HA   ARG  66           HA       ARG  66  -8.924  -5.828  -0.040
  Start of MODEL   22
15290    HB3  ARG  66           HB2      ARG  66  -7.984  -2.978   0.299
  Start of MODEL   22
15291    HB2  ARG  66           HB3      ARG  66  -9.325  -3.464  -0.724
  Start of MODEL   22
15292    HG2  ARG  66           HG2      ARG  66  -6.504  -4.442  -1.099
  Start of MODEL   22
15293    HG3  ARG  66           HG3      ARG  66  -7.866  -4.635  -2.202
  Start of MODEL   22
15294    HD2  ARG  66           HD2      ARG  66  -6.589  -2.021  -1.416
  Start of MODEL   22
15295    HD3  ARG  66           HD3      ARG  66  -6.310  -2.865  -2.926
  Start of MODEL   22
15296    HE   ARG  66           HE       ARG  66  -9.072  -2.263  -2.430
  Start of MODEL   22
15297   HH11  ARG  66          HH11      ARG  66  -6.052  -1.044  -3.861
  Start of MODEL   22
15298   HH12  ARG  66          HH12      ARG  66  -6.840   0.137  -4.801
  Start of MODEL   22
15299   HH21  ARG  66          HH21      ARG  66 -10.092  -0.659  -3.731
  Start of MODEL   22
15300   HH22  ARG  66          HH22      ARG  66  -9.151   0.364  -4.737
  Start of MODEL   22
15301    H    ARG  66           HN       ARG  66  -9.576  -3.835   1.971
  Start of MODEL   22
15302    HA   HIS  67           HA       HIS  67  -5.381  -6.454   2.452
  Start of MODEL   22
15303    HB3  HIS  67           HB2      HIS  67  -4.883  -8.867   2.543
  Start of MODEL   22
15304    HB2  HIS  67           HB3      HIS  67  -5.999  -9.152   1.221
  Start of MODEL   22
15305    HD1  HIS  67           HD1      HIS  67  -5.915  -8.525   4.887
  Start of MODEL   22
15306    HD2  HIS  67           HD2      HIS  67  -8.709  -9.135   1.884
  Start of MODEL   22
15307    HE1  HIS  67           HE1      HIS  67  -8.103  -8.951   6.060
  Start of MODEL   22
15308    HE2  HIS  67           HE2      HIS  67  -9.769  -9.365   4.211
  Start of MODEL   22
15309    H    HIS  67           HN       HIS  67  -7.349  -7.162   0.395
  Start of MODEL   22
15310    HA2  GLY  68           HA2      GLY  68  -2.133  -7.437  -0.392
  Start of MODEL   22
15311    H    GLY  68           HN       GLY  68  -3.207  -6.287   1.925
  Start of MODEL   22
15312    HA3  GLY  68           HA1      GLY  68  -2.505  -5.742  -0.676
  Start of MODEL   22
15313    HA   CYS  69           HA       CYS  69   1.231  -5.006   1.372
  Start of MODEL   22
15314    HB3  CYS  69           HB2      CYS  69   2.045  -7.589   0.037
  Start of MODEL   22
15315    HB2  CYS  69           HB3      CYS  69   1.740  -7.290   1.746
  Start of MODEL   22
15316    H    CYS  69           HN       CYS  69  -0.070  -6.072  -0.986
  Start of MODEL   22
15317    HA   LEU  70           HA       LEU  70   3.329  -3.067  -1.974
  Start of MODEL   22
15318    HB3  LEU  70           HB2      LEU  70   4.294  -1.604   0.503
  Start of MODEL   22
15319    HB2  LEU  70           HB3      LEU  70   2.909  -1.115  -0.444
  Start of MODEL   22
15320    HG   LEU  70           HG       LEU  70   5.723  -1.244  -1.527
  Start of MODEL   22
15321   HD11  LEU  70          HD11      LEU  70   3.191  -0.071  -2.597
  Start of MODEL   22
15322   HD13  LEU  70          HD12      LEU  70   4.133  -1.401  -3.285
  Start of MODEL   22
15323   HD12  LEU  70          HD13      LEU  70   4.784   0.246  -3.253
  Start of MODEL   22
15324   HD21  LEU  70          HD21      LEU  70   5.612   0.431   0.249
  Start of MODEL   22
15325   HD23  LEU  70          HD22      LEU  70   4.201   1.154  -0.531
  Start of MODEL   22
15326   HD22  LEU  70          HD23      LEU  70   5.767   1.178  -1.342
  Start of MODEL   22
15327    H    LEU  70           HN       LEU  70   2.689  -3.491   0.836
  Start of MODEL   22
15328    HA   ARG  71           HA       ARG  71   6.837  -5.270  -0.758
  Start of MODEL   22
15329    HB3  ARG  71           HB2      ARG  71   5.832  -6.945  -3.055
  Start of MODEL   22
15330    HB2  ARG  71           HB3      ARG  71   5.265  -7.093  -1.398
  Start of MODEL   22
15331    HG2  ARG  71           HG2      ARG  71   8.068  -7.591  -2.391
  Start of MODEL   22
15332    HG3  ARG  71           HG3      ARG  71   7.583  -7.640  -0.698
  Start of MODEL   22
15333    HD2  ARG  71           HD2      ARG  71   7.611  -9.882  -1.544
  Start of MODEL   22
15334    HD3  ARG  71           HD3      ARG  71   5.939  -9.395  -1.281
  Start of MODEL   22
15335    HE   ARG  71           HE       ARG  71   7.176  -9.239  -3.925
  Start of MODEL   22
15336   HH11  ARG  71          HH11      ARG  71   4.680 -10.577  -1.823
  Start of MODEL   22
15337   HH12  ARG  71          HH12      ARG  71   3.719 -11.188  -3.090
  Start of MODEL   22
15338   HH21  ARG  71          HH21      ARG  71   5.883 -10.133  -5.687
  Start of MODEL   22
15339   HH22  ARG  71          HH22      ARG  71   4.417 -10.913  -5.338
  Start of MODEL   22
15340    H    ARG  71           HN       ARG  71   4.802  -4.483  -2.683
  Start of MODEL   22
15341    HA   LEU  72           HA       LEU  72   9.489  -3.992  -3.881
  Start of MODEL   22
15342    HB3  LEU  72           HB2      LEU  72  11.395  -2.845  -2.777
  Start of MODEL   22
15343    HB2  LEU  72           HB3      LEU  72  10.826  -3.395  -1.220
  Start of MODEL   22
15344    HG   LEU  72           HG       LEU  72   9.160  -1.601  -2.963
  Start of MODEL   22
15345   HD13  LEU  72          HD11      LEU  72   7.956  -2.668  -1.153
  Start of MODEL   22
15346   HD12  LEU  72          HD12      LEU  72   8.104  -0.933  -0.866
  Start of MODEL   22
15347   HD11  LEU  72          HD13      LEU  72   9.136  -2.061   0.010
  Start of MODEL   22
15348   HD23  LEU  72          HD21      LEU  72  11.119  -0.720  -0.865
  Start of MODEL   22
15349   HD22  LEU  72          HD22      LEU  72  10.001   0.305  -1.786
  Start of MODEL   22
15350   HD21  LEU  72          HD23      LEU  72  11.317  -0.526  -2.607
  Start of MODEL   22
15351    H    LEU  72           HN       LEU  72   8.760  -4.872  -1.192
  Start of MODEL   22
15352    HA   ASN  73           HA       ASN  73  11.438  -7.873  -3.614
  Start of MODEL   22
15353    HB3  ASN  73           HB2      ASN  73  10.460  -8.041  -5.911
  Start of MODEL   22
15354    HB2  ASN  73           HB3      ASN  73  12.064  -8.740  -5.809
  Start of MODEL   22
15355   HD21  ASN  73          HD21      ASN  73  12.428  -8.594  -7.977
  Start of MODEL   22
15356   HD22  ASN  73          HD22      ASN  73  12.734  -7.092  -8.767
  Start of MODEL   22
15357    H    ASN  73           HN       ASN  73  10.363  -5.594  -4.917
  Start of MODEL   22
15358    HA   GLN  74           HA       GLN  74  15.210  -5.503  -3.529
  Start of MODEL   22
15359    HB3  GLN  74           HB2      GLN  74  15.278  -4.758  -6.468
  Start of MODEL   22
15360    HB2  GLN  74           HB3      GLN  74  15.880  -6.254  -5.756
  Start of MODEL   22
15361    HG2  GLN  74           HG2      GLN  74  16.936  -3.514  -5.116
  Start of MODEL   22
15362    HG3  GLN  74           HG3      GLN  74  17.572  -5.047  -4.540
  Start of MODEL   22
15363   HE21  GLN  74          HE21      GLN  74  17.171  -6.310  -7.170
  Start of MODEL   22
15364   HE22  GLN  74          HE22      GLN  74  18.454  -5.718  -8.151
  Start of MODEL   22
15365    H    GLN  74           HN       GLN  74  12.903  -5.148  -5.245
  Start of MODEL   22
15366    HA   PRO  75           HA       PRO  75  13.622  -1.375  -2.891
  Start of MODEL   22
15367    HB3  PRO  75           HB2      PRO  75  13.596  -1.874  -0.635
  Start of MODEL   22
15368    HB2  PRO  75           HB3      PRO  75  15.021  -0.828  -0.651
  Start of MODEL   22
15369    HG2  PRO  75           HG2      PRO  75  16.491  -2.613  -0.609
  Start of MODEL   22
15370    HG3  PRO  75           HG3      PRO  75  15.144  -3.329   0.292
  Start of MODEL   22
15371    HD2  PRO  75           HD2      PRO  75  16.204  -4.404  -1.992
  Start of MODEL   22
15372    HD3  PRO  75           HD3      PRO  75  14.526  -4.667  -1.467
  Start of MODEL   22
15373    HA   THR  76           HA       THR  76  17.136   0.744  -4.456
  Start of MODEL   22
15374    HB   THR  76           HB       THR  76  16.331   2.969  -5.379
  Start of MODEL   22
15375    HG1  THR  76           HG1      THR  76  14.035   2.245  -3.948
  Start of MODEL   22
15376   HG22  THR  76          HG21      THR  76  14.906   2.037  -7.151
  Start of MODEL   22
15377   HG21  THR  76          HG22      THR  76  14.651   0.587  -6.182
  Start of MODEL   22
15378   HG23  THR  76          HG23      THR  76  16.260   0.965  -6.796
  Start of MODEL   22
15379    H    THR  76           HN       THR  76  14.361   0.468  -3.670
  Start of MODEL   22
15380    HA   HIS  77           HA       HIS  77  18.431   2.469  -0.818
  Start of MODEL   22
15381    HB3  HIS  77           HB2      HIS  77  20.577   2.624  -2.016
  Start of MODEL   22
15382    HB2  HIS  77           HB3      HIS  77  20.402   3.876  -0.814
  Start of MODEL   22
15383    HD1  HIS  77           HD1      HIS  77  20.395   3.495  -4.565
  Start of MODEL   22
15384    HD2  HIS  77           HD2      HIS  77  20.817   6.431  -1.666
  Start of MODEL   22
15385    HE1  HIS  77           HE1      HIS  77  21.036   5.585  -5.808
  Start of MODEL   22
15386    HE2  HIS  77           HE2      HIS  77  21.130   7.380  -4.065
  Start of MODEL   22
15387    H    HIS  77           HN       HIS  77  18.484   2.417  -3.614
  Start of MODEL   22
15388    HA   VAL  78           HA       VAL  78  16.747   6.810  -1.120
  Start of MODEL   22
15389    HB   VAL  78           HB       VAL  78  15.042   7.742  -2.648
  Start of MODEL   22
15390    H    VAL  78           HN       VAL  78  16.890   4.588  -2.932
  Start of MODEL   22
15391    HA   ASN  79           HA       ASN  79  12.614   4.578  -0.378
  Start of MODEL   22
15392    HB3  ASN  79           HB2      ASN  79  12.362   2.088   0.030
  Start of MODEL   22
15393    HB2  ASN  79           HB3      ASN  79  14.009   1.930  -0.571
  Start of MODEL   22
15394   HD21  ASN  79          HD21      ASN  79  11.549   4.174  -1.727
  Start of MODEL   22
15395   HD22  ASN  79          HD22      ASN  79  11.436   3.491  -3.304
  Start of MODEL   22
15396    H    ASN  79           HN       ASN  79  15.288   3.811  -1.122
  Start of MODEL   22
15397    HA   ASN  80           HA       ASN  80  13.924   4.104   3.846
  Start of MODEL   22
15398    HB3  ASN  80           HB2      ASN  80  15.924   5.183   4.878
  Start of MODEL   22
15399    HB2  ASN  80           HB3      ASN  80  16.353   5.853   3.313
  Start of MODEL   22
15400   HD21  ASN  80          HD21      ASN  80  18.322   4.824   3.282
  Start of MODEL   22
15401   HD22  ASN  80          HD22      ASN  80  18.481   3.131   3.010
  Start of MODEL   22
15402    H    ASN  80           HN       ASN  80  14.768   5.416   1.361
  Start of MODEL   22
15403    HA2  GLY  81           HA2      GLY  81  12.101   7.802   5.169
  Start of MODEL   22
15404    H    GLY  81           HN       GLY  81  11.980   5.224   4.028
  Start of MODEL   22
15405    HA3  GLY  81           HA1      GLY  81  11.585   7.922   3.494
  Start of MODEL   22
15406    HA   ASN  82           HA       ASN  82   7.949   6.867   5.819
  Start of MODEL   22
15407    HB3  ASN  82           HB2      ASN  82   7.421   9.757   5.165
  Start of MODEL   22
15408    HB2  ASN  82           HB3      ASN  82   8.176   9.208   6.652
  Start of MODEL   22
15409   HD21  ASN  82          HD21      ASN  82   6.629  10.119   7.908
  Start of MODEL   22
15410   HD22  ASN  82          HD22      ASN  82   5.019   9.502   8.056
  Start of MODEL   22
15411    H    ASN  82           HN       ASN  82   9.595   8.773   4.383
  Start of MODEL   22
15412    HA   TYR  83           HA       TYR  83   5.637   6.450   2.081
  Start of MODEL   22
15413    HB3  TYR  83           HB2      TYR  83   4.653   4.150   2.087
  Start of MODEL   22
15414    HB2  TYR  83           HB3      TYR  83   5.291   3.917   3.708
  Start of MODEL   22
15415    HD1  TYR  83           HD1      TYR  83   6.005   3.788   0.202
  Start of MODEL   22
15416    HD2  TYR  83           HD2      TYR  83   7.789   3.936   4.058
  Start of MODEL   22
15417    HE1  TYR  83           HE1      TYR  83   8.124   2.986  -0.745
  Start of MODEL   22
15418    HE2  TYR  83           HE2      TYR  83   9.908   3.134   3.111
  Start of MODEL   22
15419    HH   TYR  83           HH       TYR  83  10.747   2.033   1.228
  Start of MODEL   22
15420    H    TYR  83           HN       TYR  83   6.459   5.742   4.789
  Start of MODEL   22
15421    HA   THR  84           HA       THR  84   1.956   7.523   4.213
  Start of MODEL   22
15422    HB   THR  84           HB       THR  84   2.320   9.666   2.107
  Start of MODEL   22
15423    HG1  THR  84           HG1      THR  84   3.752   9.109   4.331
  Start of MODEL   22
15424   HG22  THR  84          HG21      THR  84   0.943  11.014   3.645
  Start of MODEL   22
15425   HG21  THR  84          HG22      THR  84   0.816   9.634   4.738
  Start of MODEL   22
15426   HG23  THR  84          HG23      THR  84   0.075   9.562   3.146
  Start of MODEL   22
15427    H    THR  84           HN       THR  84   3.982   7.800   2.153
  Start of MODEL   22
15428    HA   LEU  85           HA       LEU  85  -0.288   5.874   0.816
  Start of MODEL   22
15429    HB3  LEU  85           HB2      LEU  85  -1.325   4.404   3.247
  Start of MODEL   22
15430    HB2  LEU  85           HB3      LEU  85  -0.041   3.856   2.184
  Start of MODEL   22
15431    HG   LEU  85           HG       LEU  85  -2.946   4.152   1.421
  Start of MODEL   22
15432   HD11  LEU  85          HD11      LEU  85  -0.564   3.157  -0.079
  Start of MODEL   22
15433   HD13  LEU  85          HD12      LEU  85  -1.509   4.617  -0.444
  Start of MODEL   22
15434   HD12  LEU  85          HD13      LEU  85  -2.239   3.011  -0.623
  Start of MODEL   22
15435   HD23  LEU  85          HD21      LEU  85  -1.261   1.687   1.784
  Start of MODEL   22
15436   HD22  LEU  85          HD22      LEU  85  -2.976   1.757   1.341
  Start of MODEL   22
15437   HD21  LEU  85          HD23      LEU  85  -2.446   2.296   2.933
  Start of MODEL   22
15438    H    LEU  85           HN       LEU  85   0.298   6.266   3.645
  Start of MODEL   22
15439    HA   LEU  86           HA       LEU  86  -3.853   8.262   1.613
  Start of MODEL   22
15440    HB3  LEU  86           HB2      LEU  86  -4.238   9.794  -0.309
  Start of MODEL   22
15441    HB2  LEU  86           HB3      LEU  86  -2.913   9.052  -1.160
  Start of MODEL   22
15442    HG   LEU  86           HG       LEU  86  -2.453  11.299  -0.211
  Start of MODEL   22
15443   HD13  LEU  86          HD11      LEU  86  -3.629  11.174   1.849
  Start of MODEL   22
15444   HD12  LEU  86          HD12      LEU  86  -1.928  11.529   2.143
  Start of MODEL   22
15445   HD11  LEU  86          HD13      LEU  86  -2.551   9.906   2.430
  Start of MODEL   22
15446   HD21  LEU  86          HD21      LEU  86  -0.620   9.835  -0.827
  Start of MODEL   22
15447   HD23  LEU  86          HD22      LEU  86  -0.668   9.078   0.767
  Start of MODEL   22
15448   HD22  LEU  86          HD23      LEU  86  -0.205  10.772   0.609
  Start of MODEL   22
15449    H    LEU  86           HN       LEU  86  -1.731   7.113  -0.047
  Start of MODEL   22
15450    HA   ALA  87           HA       ALA  87  -6.390   6.040  -1.168
  Start of MODEL   22
15451    HB2  ALA  87           HB1      ALA  87  -8.053   4.698   0.080
  Start of MODEL   22
15452    HB1  ALA  87           HB2      ALA  87  -7.647   5.584   1.542
  Start of MODEL   22
15453    HB3  ALA  87           HB3      ALA  87  -6.449   4.533   0.797
  Start of MODEL   22
15454    H    ALA  87           HN       ALA  87  -5.821   7.451   1.352
  Start of MODEL   22
15455    HA   ALA  88           HA       ALA  88  -9.450   9.100  -1.098
  Start of MODEL   22
15456    HB3  ALA  88           HB1      ALA  88  -7.982  10.006  -2.780
  Start of MODEL   22
15457    HB2  ALA  88           HB2      ALA  88  -9.654  10.122  -3.320
  Start of MODEL   22
15458    HB1  ALA  88           HB3      ALA  88  -8.593   8.871  -3.986
  Start of MODEL   22
15459    H    ALA  88           HN       ALA  88  -7.700   7.148  -2.374
  Start of MODEL   22
15460    HA   ASN  89           HA       ASN  89 -12.712   6.479  -2.398
  Start of MODEL   22
15461    HB3  ASN  89           HB2      ASN  89 -12.863   7.055   0.577
  Start of MODEL   22
15462    HB2  ASN  89           HB3      ASN  89 -12.011   5.696  -0.111
  Start of MODEL   22
15463   HD21  ASN  89          HD21      ASN  89 -13.171   3.917  -0.863
  Start of MODEL   22
15464   HD22  ASN  89          HD22      ASN  89 -14.813   3.701  -0.465
  Start of MODEL   22
15465    H    ASN  89           HN       ASN  89 -11.350   8.481  -0.721
  Start of MODEL   22
15466    HA   PRO  90           HA       PRO  90 -15.682   9.770  -3.027
  Start of MODEL   22
15467    HB3  PRO  90           HB2      PRO  90 -16.962   8.507  -4.397
  Start of MODEL   22
15468    HB2  PRO  90           HB3      PRO  90 -18.011   8.267  -2.994
  Start of MODEL   22
15469    HG2  PRO  90           HG2      PRO  90 -17.075   6.213  -2.485
  Start of MODEL   22
15470    HG3  PRO  90           HG3      PRO  90 -16.874   6.193  -4.245
  Start of MODEL   22
15471    HD2  PRO  90           HD2      PRO  90 -14.791   5.828  -2.619
  Start of MODEL   22
15472    HD3  PRO  90           HD3      PRO  90 -14.622   6.769  -4.116
  Start of MODEL   22
15473    HA   CYS  91           HA       CYS  91 -17.899   9.323   1.039
  Start of MODEL   22
15474    HB3  CYS  91           HB2      CYS  91 -16.278   7.002   2.112
  Start of MODEL   22
15475    HB2  CYS  91           HB3      CYS  91 -17.877   6.870   1.406
  Start of MODEL   22
15476    H    CYS  91           HN       CYS  91 -15.929   7.654  -0.263
  Start of MODEL   22
15477    HA2  GLY  92           HA2      GLY  92 -13.843  11.429   2.002
  Start of MODEL   22
15478    H    GLY  92           HN       GLY  92 -14.396   8.977   0.948
  Start of MODEL   22
15479    HA3  GLY  92           HA1      GLY  92 -13.870  10.329   3.377
  Start of MODEL   22
15480    HA   GLN  93           HA       GLN  93 -10.022   9.455   1.469
  Start of MODEL   22
15481    HB3  GLN  93           HB2      GLN  93  -9.324  12.257   2.377
  Start of MODEL   22
15482    HB2  GLN  93           HB3      GLN  93  -9.717  11.741   0.758
  Start of MODEL   22
15483    HG2  GLN  93           HG2      GLN  93  -7.295  10.854   2.288
  Start of MODEL   22
15484    HG3  GLN  93           HG3      GLN  93  -7.697  10.439   0.620
  Start of MODEL   22
15485   HE21  GLN  93          HE21      GLN  93  -5.416  11.862   1.744
  Start of MODEL   22
15486   HE22  GLN  93          HE22      GLN  93  -5.341  13.366   0.908
  Start of MODEL   22
15487    H    GLN  93           HN       GLN  93 -11.544  11.316   3.127
  Start of MODEL   22
15488    HA   ALA  94           HA       ALA  94  -8.130   8.582   5.314
  Start of MODEL   22
15489    HB2  ALA  94           HB1      ALA  94  -7.720   6.143   5.330
  Start of MODEL   22
15490    HB1  ALA  94           HB2      ALA  94  -8.118   6.104   3.615
  Start of MODEL   22
15491    HB3  ALA  94           HB3      ALA  94  -9.354   6.551   4.794
  Start of MODEL   22
15492    H    ALA  94           HN       ALA  94  -8.450   8.315   2.401
  Start of MODEL   22
15493    HA   SER  95           HA       SER  95  -3.956   7.658   4.157
  Start of MODEL   22
15494    HB3  SER  95           HB2      SER  95  -4.103  10.056   4.036
  Start of MODEL   22
15495    HB2  SER  95           HB3      SER  95  -2.660   9.645   4.962
  Start of MODEL   22
15496    HG   SER  95           HG       SER  95  -4.799  11.086   5.655
  Start of MODEL   22
15497    H    SER  95           HN       SER  95  -6.019   8.123   6.091
  Start of MODEL   22
15498    HA   ALA  96           HA       ALA  96  -1.795   6.937   7.986
  Start of MODEL   22
15499    HB1  ALA  96           HB1      ALA  96  -1.731   4.440   6.271
  Start of MODEL   22
15500    HB3  ALA  96           HB2      ALA  96  -2.938   4.811   7.502
  Start of MODEL   22
15501    HB2  ALA  96           HB3      ALA  96  -1.264   4.512   7.971
  Start of MODEL   22
15502    H    ALA  96           HN       ALA  96  -2.010   7.075   5.134
  Start of MODEL   22
15503    HA   SER  97           HA       SER  97   2.268   6.601   6.188
  Start of MODEL   22
15504    HB3  SER  97           HB2      SER  97   3.516   8.315   7.416
  Start of MODEL   22
15505    HB2  SER  97           HB3      SER  97   2.373   8.187   8.758
  Start of MODEL   22
15506    HG   SER  97           HG       SER  97   1.150   8.546   6.395
  Start of MODEL   22
15507    H    SER  97           HN       SER  97   0.511   6.135   8.453
  Start of MODEL   22
15508    HA   ILE  98           HA       ILE  98   4.697   4.075   8.794
  Start of MODEL   22
15509    HB   ILE  98           HB       ILE  98   3.310   2.417   7.561
  Start of MODEL   22
15510   HD11  ILE  98          HD11      ILE  98   7.161   2.154   7.568
  Start of MODEL   22
15511   HD13  ILE  98          HD12      ILE  98   6.589   1.009   6.355
  Start of MODEL   22
15512   HD12  ILE  98          HD13      ILE  98   7.096   0.429   7.941
  Start of MODEL   22
15513    H    ILE  98           HN       ILE  98   3.849   5.171   6.222
  Start of MODEL   22
15514    HA   MET  99           HA       MET  99   8.385   5.345   6.904
  Start of MODEL   22
15515    HB3  MET  99           HB2      MET  99   8.827   5.931   9.830
  Start of MODEL   22
15516    HB2  MET  99           HB3      MET  99   7.894   6.968   8.762
  Start of MODEL   22
15517    HG2  MET  99           HG2      MET  99  10.808   6.323   8.629
  Start of MODEL   22
15518    HG3  MET  99           HG3      MET  99   9.950   7.131   7.319
  Start of MODEL   22
15519    HE2  MET  99           HE1      MET  99  11.850  10.147   8.612
  Start of MODEL   22
15520    HE1  MET  99           HE2      MET  99  11.306   9.157   7.239
  Start of MODEL   22
15521    HE3  MET  99           HE3      MET  99  12.431   8.484   8.416
  Start of MODEL   22
15522    H    MET  99           HN       MET  99   6.792   4.394   9.171
  Start of MODEL   22
15523    HA   ALA 100           HA       ALA 100  10.875   1.989   8.030
  Start of MODEL   22
15524    HB3  ALA 100           HB1      ALA 100   9.187   0.965   6.580
  Start of MODEL   22
15525    HB2  ALA 100           HB2      ALA 100  10.795   0.320   6.259
  Start of MODEL   22
15526    HB1  ALA 100           HB3      ALA 100  10.081   1.493   5.156
  Start of MODEL   22
15527    H    ALA 100           HN       ALA 100   9.764   3.965   6.165
  Start of MODEL   22
15528    HA   ALA 101           HA       ALA 101  14.534   2.681   5.620
  Start of MODEL   22
15529    HB2  ALA 101           HB1      ALA 101  16.377   2.670   7.272
  Start of MODEL   22
15530    HB1  ALA 101           HB2      ALA 101  15.276   2.001   8.478
  Start of MODEL   22
15531    HB3  ALA 101           HB3      ALA 101  15.002   3.621   7.832
  Start of MODEL   22
15532    H    ALA 101           HN       ALA 101  12.932   1.205   7.563
  Start of MODEL   22
15533    HA   PHE 102           HA       PHE 102  15.428  -1.532   5.112
  Start of MODEL   22
15534    HB3  PHE 102           HB2      PHE 102  15.528  -2.078   2.740
  Start of MODEL   22
15535    HB2  PHE 102           HB3      PHE 102  15.738  -0.379   2.332
  Start of MODEL   22
15536    HD1  PHE 102           HD1      PHE 102  13.361  -1.942   4.742
  Start of MODEL   22
15537    HD2  PHE 102           HD2      PHE 102  13.863   0.170   1.090
  Start of MODEL   22
15538    HE1  PHE 102           HE1      PHE 102  10.924  -1.694   4.558
  Start of MODEL   22
15539    HE2  PHE 102           HE2      PHE 102  11.422   0.422   0.905
  Start of MODEL   22
15540    HZ   PHE 102           HZ       PHE 102   9.954  -0.506   2.636
  Start of MODEL   22
15541    H    PHE 102           HN       PHE 102  15.492   1.301   4.355
  Start of MODEL   22
15542    HA   MET 103           HA       MET 103  19.833  -0.893   4.414
  Start of MODEL   22
15543    HB3  MET 103           HB2      MET 103  19.539  -2.312   2.403
  Start of MODEL   22
15544    HB2  MET 103           HB3      MET 103  21.067  -1.460   2.385
  Start of MODEL   22
15545    HG2  MET 103           HG2      MET 103  18.627  -0.680   0.802
  Start of MODEL   22
15546    HG3  MET 103           HG3      MET 103  20.186   0.147   0.782
  Start of MODEL   22
15547    HE1  MET 103           HE1      MET 103  20.404  -0.028  -1.815
  Start of MODEL   22
15548    HE3  MET 103           HE2      MET 103  18.811  -0.784  -1.885
  Start of MODEL   22
15549    HE2  MET 103           HE3      MET 103  20.177  -1.514  -2.733
  Start of MODEL   22
15550    H    MET 103           HN       MET 103  17.635   0.158   2.818
  Start of MODEL   22
15551    HA   ASP 104           HA       ASP 104  21.166   3.157   4.751
  Start of MODEL   22
15552    HB3  ASP 104           HB2      ASP 104  23.693   1.520   4.768
  Start of MODEL   22
15553    HB2  ASP 104           HB3      ASP 104  22.715   1.930   6.170
  Start of MODEL   22
15554    H    ASP 104           HN       ASP 104  21.489   0.408   4.681
  Start of MODEL   22
15555    HA   ASN 105           HA       ASN 105  21.675   4.495   0.615
  Start of MODEL   22
15556    HB3  ASN 105           HB2      ASN 105  22.271   7.034   0.748
  Start of MODEL   22
15557    HB2  ASN 105           HB3      ASN 105  21.903   6.857   2.454
  Start of MODEL   22
15558   HD21  ASN 105          HD21      ASN 105  19.776   6.607   3.116
  Start of MODEL   22
15559   HD22  ASN 105          HD22      ASN 105  18.464   6.835   2.002
  Start of MODEL   22
15560    H    ASN 105           HN       ASN 105  21.412   4.735   3.375
  Start of MODEL   22
15561    HA   PRO 106           HA       PRO 106  26.246   4.399   0.377
  Start of MODEL   22
15562    HB3  PRO 106           HB2      PRO 106  26.593   2.596  -0.906
  Start of MODEL   22
15563    HB2  PRO 106           HB3      PRO 106  25.791   3.361  -2.267
  Start of MODEL   22
15564    HG2  PRO 106           HG2      PRO 106  24.209   1.716  -1.885
  Start of MODEL   22
15565    HG3  PRO 106           HG3      PRO 106  24.590   1.616  -0.156
  Start of MODEL   22
15566    HD2  PRO 106           HD2      PRO 106  22.981   3.690  -1.616
  Start of MODEL   22
15567    HD3  PRO 106           HD3      PRO 106  22.619   2.840  -0.090
  Start of MODEL   22
15568    HA   PHE 107           HA       PHE 107  27.667   7.272  -2.487
  Start of MODEL   22
15569    HB3  PHE 107           HB2      PHE 107  25.133   8.792  -1.821
  Start of MODEL   22
15570    HB2  PHE 107           HB3      PHE 107  25.198   7.382  -2.885
  Start of MODEL   22
15571    HD1  PHE 107           HD1      PHE 107  26.332  10.907  -2.483
  Start of MODEL   22
15572    HD2  PHE 107           HD2      PHE 107  26.068   7.579  -5.125
  Start of MODEL   22
15573    HE1  PHE 107           HE1      PHE 107  26.975  12.351  -4.362
  Start of MODEL   22
15574    HE2  PHE 107           HE2      PHE 107  26.718   9.020  -7.007
  Start of MODEL   22
15575    HZ   PHE 107           HZ       PHE 107  27.172  11.408  -6.627
  Start of MODEL   22
15576    H    PHE 107           HN       PHE 107  26.893   6.456  -0.050
  Start of MODEL   23
15577    H1   ASP   1           H        ASP   1 -24.905   0.897  -2.561
  Start of MODEL   23
15578    H2   ASP   1           H2       ASP   1 -26.363   0.698  -1.797
  Start of MODEL   23
15579    H3   ASP   1           H3       ASP   1 -25.524   2.126  -1.591
  Start of MODEL   23
15580    HA   ASP   1           HA       ASP   1 -27.353   2.502  -3.023
  Start of MODEL   23
15581    HB3  ASP   1           HB2      ASP   1 -26.159   3.106  -5.185
  Start of MODEL   23
15582    HB2  ASP   1           HB3      ASP   1 -24.702   2.458  -4.440
  Start of MODEL   23
15583    HA   ASP   2           HA       ASP   2 -27.777  -0.621  -6.131
  Start of MODEL   23
15584    HB3  ASP   2           HB2      ASP   2 -26.401  -1.561  -7.951
  Start of MODEL   23
15585    HB2  ASP   2           HB3      ASP   2 -24.945  -1.114  -7.073
  Start of MODEL   23
15586    H    ASP   2           HN       ASP   2 -25.272   0.112  -4.782
  Start of MODEL   23
15587    HA   ASP   3           HA       ASP   3 -26.432  -4.758  -4.888
  Start of MODEL   23
15588    HB3  ASP   3           HB2      ASP   3 -23.594  -4.621  -5.968
  Start of MODEL   23
15589    HB2  ASP   3           HB3      ASP   3 -25.002  -5.238  -6.822
  Start of MODEL   23
15590    H    ASP   3           HN       ASP   3 -24.854  -2.549  -5.965
  Start of MODEL   23
15591    HA   ASP   4           HA       ASP   4 -23.373  -3.526  -1.551
  Start of MODEL   23
15592    HB3  ASP   4           HB2      ASP   4 -21.920  -2.113  -2.964
  Start of MODEL   23
15593    HB2  ASP   4           HB3      ASP   4 -22.166  -1.388  -1.379
  Start of MODEL   23
15594    H    ASP   4           HN       ASP   4 -24.435  -2.343  -3.982
  Start of MODEL   23
15595    HA   ASP   5           HA       ASP   5 -26.275  -0.887   0.572
  Start of MODEL   23
15596    HB3  ASP   5           HB2      ASP   5 -26.150  -3.322   2.373
  Start of MODEL   23
15597    HB2  ASP   5           HB3      ASP   5 -27.247  -3.164   1.004
  Start of MODEL   23
15598    H    ASP   5           HN       ASP   5 -24.218  -3.031   0.432
  Start of MODEL   23
15599    HA   VAL   6           HA       VAL   6 -23.713  -0.738   4.467
  Start of MODEL   23
15600    HB   VAL   6           HB       VAL   6 -21.654  -2.102   5.189
  Start of MODEL   23
15601    H    VAL   6           HN       VAL   6 -23.909  -2.691   2.444
  Start of MODEL   23
15602    HA   SER   7           HA       SER   7 -20.971   1.415   1.931
  Start of MODEL   23
15603    HB3  SER   7           HB2      SER   7 -22.550   3.643   3.222
  Start of MODEL   23
15604    HB2  SER   7           HB3      SER   7 -23.093   2.737   1.809
  Start of MODEL   23
15605    HG   SER   7           HG       SER   7 -21.184   3.409   0.762
  Start of MODEL   23
15606    H    SER   7           HN       SER   7 -23.014   1.195   3.976
  Start of MODEL   23
15607    HA   PHE   8           HA       PHE   8 -18.298   2.505   5.206
  Start of MODEL   23
15608    HB3  PHE   8           HB2      PHE   8 -16.433   0.882   5.345
  Start of MODEL   23
15609    HB2  PHE   8           HB3      PHE   8 -17.052   0.069   3.912
  Start of MODEL   23
15610    HD1  PHE   8           HD1      PHE   8 -18.080  -1.913   4.333
  Start of MODEL   23
15611    HD2  PHE   8           HD2      PHE   8 -18.490   1.247   7.146
  Start of MODEL   23
15612    HE1  PHE   8           HE1      PHE   8 -19.515  -3.341   5.730
  Start of MODEL   23
15613    HE2  PHE   8           HE2      PHE   8 -19.915  -0.177   8.545
  Start of MODEL   23
15614    HZ   PHE   8           HZ       PHE   8 -20.428  -2.476   7.834
  Start of MODEL   23
15615    H    PHE   8           HN       PHE   8 -19.131   0.962   2.870
  Start of MODEL   23
15616    HA   CYS   9           HA       CYS   9 -16.006   4.797   2.348
  Start of MODEL   23
15617    HB3  CYS   9           HB2      CYS   9 -15.340   6.807   3.486
  Start of MODEL   23
15618    HB2  CYS   9           HB3      CYS   9 -15.357   5.976   5.045
  Start of MODEL   23
15619    H    CYS   9           HN       CYS   9 -16.746   3.951   5.006
  Start of MODEL   23
15620    HA   ALA  10           HA       ALA  10 -11.990   3.369   2.856
  Start of MODEL   23
15621    HB1  ALA  10           HB1      ALA  10 -11.015   6.131   2.146
  Start of MODEL   23
15622    HB3  ALA  10           HB2      ALA  10 -11.603   4.918   1.000
  Start of MODEL   23
15623    HB2  ALA  10           HB3      ALA  10 -10.123   4.630   1.925
  Start of MODEL   23
15624    H    ALA  10           HN       ALA  10 -13.394   5.920   2.960
  Start of MODEL   23
15625    HA   SER  11           HA       SER  11  -9.695   4.581   6.321
  Start of MODEL   23
15626    HB3  SER  11           HB2      SER  11 -10.887   1.894   7.088
  Start of MODEL   23
15627    HB2  SER  11           HB3      SER  11 -11.702   3.438   7.334
  Start of MODEL   23
15628    HG   SER  11           HG       SER  11  -9.828   2.230   8.822
  Start of MODEL   23
15629    H    SER  11           HN       SER  11 -10.927   2.660   4.504
  Start of MODEL   23
15630    HA   VAL  12           HA       VAL  12  -6.403   1.836   5.304
  Start of MODEL   23
15631    HB   VAL  12           HB       VAL  12  -5.276   4.662   5.387
  Start of MODEL   23
15632    H    VAL  12           HN       VAL  12  -7.555   4.202   6.636
  Start of MODEL   23
15633    HA   GLN  13           HA       GLN  13  -3.711   1.930   8.733
  Start of MODEL   23
15634    HB3  GLN  13           HB2      GLN  13  -5.355   0.641   9.883
  Start of MODEL   23
15635    HB2  GLN  13           HB3      GLN  13  -3.860  -0.298   9.936
  Start of MODEL   23
15636    HG2  GLN  13           HG2      GLN  13  -6.137  -0.778   8.067
  Start of MODEL   23
15637    HG3  GLN  13           HG3      GLN  13  -4.611  -1.662   8.120
  Start of MODEL   23
15638   HE21  GLN  13          HE21      GLN  13  -7.407  -2.529   8.553
  Start of MODEL   23
15639   HE22  GLN  13          HE22      GLN  13  -7.409  -3.287  10.101
  Start of MODEL   23
15640    H    GLN  13           HN       GLN  13  -5.083   0.648   6.518
  Start of MODEL   23
15641    HA   LEU  14           HA       LEU  14  -0.538  -0.252   6.763
  Start of MODEL   23
15642    HB3  LEU  14           HB2      LEU  14   1.492   1.244   6.864
  Start of MODEL   23
15643    HB2  LEU  14           HB3      LEU  14   0.450   2.465   7.584
  Start of MODEL   23
15644    HG   LEU  14           HG       LEU  14  -1.012   2.156   5.469
  Start of MODEL   23
15645   HD13  LEU  14          HD11      LEU  14   0.413   4.106   5.839
  Start of MODEL   23
15646   HD12  LEU  14          HD12      LEU  14   0.396   3.602   4.151
  Start of MODEL   23
15647   HD11  LEU  14          HD13      LEU  14   1.792   3.222   5.171
  Start of MODEL   23
15648   HD21  LEU  14          HD21      LEU  14   0.006   0.051   4.807
  Start of MODEL   23
15649   HD23  LEU  14          HD22      LEU  14   1.543   0.889   4.558
  Start of MODEL   23
15650   HD22  LEU  14          HD23      LEU  14   0.147   1.279   3.548
  Start of MODEL   23
15651    H    LEU  14           HN       LEU  14  -1.628   1.762   8.563
  Start of MODEL   23
15652    HA   HIS  15           HA       HIS  15   1.802  -1.431  10.235
  Start of MODEL   23
15653    HB3  HIS  15           HB2      HIS  15   1.876  -3.934  10.090
  Start of MODEL   23
15654    HB2  HIS  15           HB3      HIS  15   1.225  -3.825   8.458
  Start of MODEL   23
15655    HD1  HIS  15           HD1      HIS  15   0.251  -3.516  12.033
  Start of MODEL   23
15656    HD2  HIS  15           HD2      HIS  15  -1.531  -3.214   8.294
  Start of MODEL   23
15657    HE1  HIS  15           HE1      HIS  15  -2.223  -3.442  12.463
  Start of MODEL   23
15658    HE2  HIS  15           HE2      HIS  15  -3.222  -3.691  10.208
  Start of MODEL   23
15659    H    HIS  15           HN       HIS  15   1.337  -1.388   7.366
  Start of MODEL   23
15660    HA   THR  16           HA       THR  16   5.983  -1.285   9.540
  Start of MODEL   23
15661    HB   THR  16           HB       THR  16   5.824  -3.642  11.427
  Start of MODEL   23
15662    HG1  THR  16           HG1      THR  16   4.860  -2.091  12.512
  Start of MODEL   23
15663   HG23  THR  16          HG21      THR  16   8.043  -3.327  10.433
  Start of MODEL   23
15664   HG22  THR  16          HG22      THR  16   8.059  -2.893  12.145
  Start of MODEL   23
15665   HG21  THR  16          HG23      THR  16   8.017  -1.632  10.909
  Start of MODEL   23
15666    H    THR  16           HN       THR  16   3.776  -2.219  10.799
  Start of MODEL   23
15667    HA   ALA  17           HA       ALA  17   6.849  -3.994   6.211
  Start of MODEL   23
15668    HB1  ALA  17           HB1      ALA  17   9.507  -2.766   6.961
  Start of MODEL   23
15669    HB3  ALA  17           HB2      ALA  17   8.367  -2.075   5.815
  Start of MODEL   23
15670    HB2  ALA  17           HB3      ALA  17   9.148  -3.621   5.461
  Start of MODEL   23
15671    H    ALA  17           HN       ALA  17   7.342  -1.966   8.044
  Start of MODEL   23
15672    HA   VAL  18           HA       VAL  18   8.319  -7.137   8.672
  Start of MODEL   23
15673    HB   VAL  18           HB       VAL  18   7.675  -9.372   7.791
  Start of MODEL   23
15674    H    VAL  18           HN       VAL  18   7.499  -6.074   6.112
  Start of MODEL   23
15675    HA   GLU  19           HA       GLU  19  12.343  -7.599   7.356
  Start of MODEL   23
15676    HB3  GLU  19           HB2      GLU  19  13.632  -8.628   9.198
  Start of MODEL   23
15677    HB2  GLU  19           HB3      GLU  19  12.126  -9.048   9.988
  Start of MODEL   23
15678    HG2  GLU  19           HG2      GLU  19  11.575  -6.684  10.221
  Start of MODEL   23
15679    HG3  GLU  19           HG3      GLU  19  13.070  -7.119  11.038
  Start of MODEL   23
15680    H    GLU  19           HN       GLU  19  10.126  -8.052   9.078
  Start of MODEL   23
15681    HA   MET  20           HA       MET  20  12.602 -11.750   6.118
  Start of MODEL   23
15682    HB3  MET  20           HB2      MET  20  11.292 -12.402   4.094
  Start of MODEL   23
15683    HB2  MET  20           HB3      MET  20  10.736 -10.753   3.953
  Start of MODEL   23
15684    HG2  MET  20           HG2      MET  20  10.161 -12.511   6.313
  Start of MODEL   23
15685    HG3  MET  20           HG3      MET  20   9.494 -10.912   5.987
  Start of MODEL   23
15686    HE3  MET  20           HE1      MET  20   7.904 -10.401   3.840
  Start of MODEL   23
15687    HE2  MET  20           HE2      MET  20   7.343 -11.651   2.736
  Start of MODEL   23
15688    HE1  MET  20           HE3      MET  20   9.044 -11.186   2.745
  Start of MODEL   23
15689    H    MET  20           HN       MET  20  12.027  -8.936   5.548
  Start of MODEL   23
15690    HA   HIS  21           HA       HIS  21  15.496 -11.390   2.892
  Start of MODEL   23
15691    HB3  HIS  21           HB2      HIS  21  15.506 -13.027   0.970
  Start of MODEL   23
15692    HB2  HIS  21           HB3      HIS  21  13.956 -13.626   1.550
  Start of MODEL   23
15693    HD1  HIS  21           HD1      HIS  21  14.117 -15.597   3.062
  Start of MODEL   23
15694    HD2  HIS  21           HD2      HIS  21  17.586 -13.309   3.128
  Start of MODEL   23
15695    HE1  HIS  21           HE1      HIS  21  15.695 -16.800   4.574
  Start of MODEL   23
15696    HE2  HIS  21           HE2      HIS  21  17.850 -15.549   4.370
  Start of MODEL   23
15697    H    HIS  21           HN       HIS  21  13.098 -12.703   3.679
  Start of MODEL   23
15698    HA   HIS  22           HA       HIS  22  13.007  -9.158   0.007
  Start of MODEL   23
15699    HB3  HIS  22           HB2      HIS  22  10.643  -9.566  -0.980
  Start of MODEL   23
15700    HB2  HIS  22           HB3      HIS  22  10.739 -11.113  -0.158
  Start of MODEL   23
15701    HD1  HIS  22           HD1      HIS  22  11.882  -9.311  -3.110
  Start of MODEL   23
15702    HD2  HIS  22           HD2      HIS  22  12.853 -12.809  -1.124
  Start of MODEL   23
15703    HE1  HIS  22           HE1      HIS  22  13.273 -10.639  -4.731
  Start of MODEL   23
15704    HE2  HIS  22           HE2      HIS  22  14.118 -12.546  -3.356
  Start of MODEL   23
15705    H    HIS  22           HN       HIS  22  12.217 -11.194   1.911
  Start of MODEL   23
15706    HA   TRP  23           HA       TRP  23  10.826  -6.667   2.629
  Start of MODEL   23
15707    HB3  TRP  23           HB2      TRP  23  10.855  -4.298   1.829
  Start of MODEL   23
15708    HB2  TRP  23           HB3      TRP  23  11.509  -4.888   0.302
  Start of MODEL   23
15709    HD1  TRP  23           HD1      TRP  23  14.079  -4.844   0.204
  Start of MODEL   23
15710    HE1  TRP  23           HE1      TRP  23  15.993  -4.908   1.958
  Start of MODEL   23
15711    HE3  TRP  23           HE3      TRP  23  11.309  -5.365   4.464
  Start of MODEL   23
15712    HZ2  TRP  23           HZ2      TRP  23  16.277  -5.144   4.732
  Start of MODEL   23
15713    HZ3  TRP  23           HZ3      TRP  23  12.466  -5.510   6.612
  Start of MODEL   23
15714    HH2  TRP  23           HH2      TRP  23  14.902  -5.404   6.748
  Start of MODEL   23
15715    H    TRP  23           HN       TRP  23  11.900  -7.256   0.046
  Start of MODEL   23
15716    HA   CYS  24           HA       CYS  24   6.782  -6.099   1.188
  Start of MODEL   23
15717    HB3  CYS  24           HB2      CYS  24   6.901  -8.269   3.305
  Start of MODEL   23
15718    HB2  CYS  24           HB3      CYS  24   6.974  -8.509   1.572
  Start of MODEL   23
15719    H    CYS  24           HN       CYS  24   8.876  -6.505   3.178
  Start of MODEL   23
15720    HA   ILE  25           HA       ILE  25   5.354  -3.772   4.677
  Start of MODEL   23
15721    HB   ILE  25           HB       ILE  25   4.785  -2.016   2.262
  Start of MODEL   23
15722   HD13  ILE  25          HD11      ILE  25   6.621  -0.233   1.752
  Start of MODEL   23
15723   HD12  ILE  25          HD12      ILE  25   8.057  -0.191   2.780
  Start of MODEL   23
15724   HD11  ILE  25          HD13      ILE  25   6.500   0.335   3.416
  Start of MODEL   23
15725    H    ILE  25           HN       ILE  25   5.643  -4.401   1.816
  Start of MODEL   23
15726    HA   PRO  26           HA       PRO  26   1.298  -5.554   3.579
  Start of MODEL   23
15727    HB3  PRO  26           HB2      PRO  26   1.069  -7.124   5.206
  Start of MODEL   23
15728    HB2  PRO  26           HB3      PRO  26   0.881  -5.877   6.436
  Start of MODEL   23
15729    HG2  PRO  26           HG2      PRO  26   2.941  -6.658   7.124
  Start of MODEL   23
15730    HG3  PRO  26           HG3      PRO  26   3.337  -7.278   5.515
  Start of MODEL   23
15731    HD2  PRO  26           HD2      PRO  26   3.567  -4.486   6.567
  Start of MODEL   23
15732    HD3  PRO  26           HD3      PRO  26   4.690  -5.418   5.548
  Start of MODEL   23
15733    HA   PHE  27           HA       PHE  27  -1.181  -2.367   5.235
  Start of MODEL   23
15734    HB3  PHE  27           HB2      PHE  27  -0.242  -1.225   3.277
  Start of MODEL   23
15735    HB2  PHE  27           HB3      PHE  27  -1.942  -0.844   3.477
  Start of MODEL   23
15736    HD1  PHE  27           HD1      PHE  27  -3.623  -1.568   1.819
  Start of MODEL   23
15737    HD2  PHE  27           HD2      PHE  27   0.533  -2.483   1.380
  Start of MODEL   23
15738    HE1  PHE  27           HE1      PHE  27  -3.991  -2.141  -0.515
  Start of MODEL   23
15739    HE2  PHE  27           HE2      PHE  27   0.146  -3.050  -0.971
  Start of MODEL   23
15740    HZ   PHE  27           HZ       PHE  27  -2.111  -2.882  -1.923
  Start of MODEL   23
15741    H    PHE  27           HN       PHE  27  -0.478  -4.396   3.253
  Start of MODEL   23
15742    HA   SER  28           HA       SER  28  -5.165  -3.696   4.035
  Start of MODEL   23
15743    HB3  SER  28           HB2      SER  28  -6.395  -4.145   6.115
  Start of MODEL   23
15744    HB2  SER  28           HB3      SER  28  -5.233  -3.187   7.026
  Start of MODEL   23
15745    HG   SER  28           HG       SER  28  -3.865  -4.955   5.613
  Start of MODEL   23
15746    H    SER  28           HN       SER  28  -3.382  -1.922   5.460
  Start of MODEL   23
15747    HA   VAL  29           HA       VAL  29  -7.509  -0.027   4.296
  Start of MODEL   23
15748    HB   VAL  29           HB       VAL  29  -6.267   0.579   2.321
  Start of MODEL   23
15749    H    VAL  29           HN       VAL  29  -6.792  -2.631   3.217
  Start of MODEL   23
15750    HA   ASP  30           HA       ASP  30 -11.282  -1.995   3.619
  Start of MODEL   23
15751    HB3  ASP  30           HB2      ASP  30 -10.898  -2.381   5.966
  Start of MODEL   23
15752    HB2  ASP  30           HB3      ASP  30 -12.588  -1.990   5.696
  Start of MODEL   23
15753    H    ASP  30           HN       ASP  30  -9.595   0.130   4.711
  Start of MODEL   23
15754    HA2  GLY  31           HA2      GLY  31 -14.986   0.479   3.489
  Start of MODEL   23
15755    H    GLY  31           HN       GLY  31 -13.380  -1.615   3.175
  Start of MODEL   23
15756    HA3  GLY  31           HA1      GLY  31 -13.905   1.049   2.222
  Start of MODEL   23
15757    HA   GLN  32           HA       GLN  32 -16.275  -1.476  -0.242
  Start of MODEL   23
15758    HB3  GLN  32           HB2      GLN  32 -18.773  -0.886  -0.738
  Start of MODEL   23
15759    HB2  GLN  32           HB3      GLN  32 -18.627   0.116   0.706
  Start of MODEL   23
15760    HG2  GLN  32           HG2      GLN  32 -17.868  -1.875   1.956
  Start of MODEL   23
15761    HG3  GLN  32           HG3      GLN  32 -19.514  -2.011   1.329
  Start of MODEL   23
15762   HE21  GLN  32          HE21      GLN  32 -16.200  -3.118   0.957
  Start of MODEL   23
15763   HE22  GLN  32          HE22      GLN  32 -16.580  -4.499  -0.002
  Start of MODEL   23
15764    H    GLN  32           HN       GLN  32 -16.164   1.030   1.204
  Start of MODEL   23
15765    HA   PRO  33           HA       PRO  33 -16.813   1.858  -3.692
  Start of MODEL   23
15766    HB3  PRO  33           HB2      PRO  33 -17.077   4.162  -3.431
  Start of MODEL   23
15767    HB2  PRO  33           HB3      PRO  33 -15.882   4.232  -2.129
  Start of MODEL   23
15768    HG2  PRO  33           HG2      PRO  33 -17.856   4.491  -0.924
  Start of MODEL   23
15769    HG3  PRO  33           HG3      PRO  33 -18.766   3.430  -2.016
  Start of MODEL   23
15770    HD2  PRO  33           HD2      PRO  33 -16.844   2.708   0.154
  Start of MODEL   23
15771    HD3  PRO  33           HD3      PRO  33 -18.372   1.933  -0.310
  Start of MODEL   23
15772    HA   ALA  34           HA       ALA  34 -12.626   0.625  -3.489
  Start of MODEL   23
15773    HB2  ALA  34           HB1      ALA  34 -13.051   1.172  -6.421
  Start of MODEL   23
15774    HB1  ALA  34           HB2      ALA  34 -13.408  -0.349  -5.605
  Start of MODEL   23
15775    HB3  ALA  34           HB3      ALA  34 -11.748   0.230  -5.697
  Start of MODEL   23
15776    H    ALA  34           HN       ALA  34 -15.014   1.300  -4.739
  Start of MODEL   23
15777    HA   PRO  35           HA       PRO  35 -10.940   4.733  -3.412
  Start of MODEL   23
15778    HB3  PRO  35           HB2      PRO  35 -10.741   4.325  -1.137
  Start of MODEL   23
15779    HB2  PRO  35           HB3      PRO  35  -9.043   4.303  -1.631
  Start of MODEL   23
15780    HG2  PRO  35           HG2      PRO  35  -8.915   1.996  -1.567
  Start of MODEL   23
15781    HG3  PRO  35           HG3      PRO  35 -10.148   2.214  -0.325
  Start of MODEL   23
15782    HD2  PRO  35           HD2      PRO  35 -10.483   0.761  -2.677
  Start of MODEL   23
15783    HD3  PRO  35           HD3      PRO  35 -11.806   1.414  -1.687
  Start of MODEL   23
15784    HA   SER  36           HA       SER  36  -7.417   4.074  -5.863
  Start of MODEL   23
15785    HB3  SER  36           HB2      SER  36  -8.052   6.057  -6.930
  Start of MODEL   23
15786    HB2  SER  36           HB3      SER  36  -6.442   6.446  -6.324
  Start of MODEL   23
15787    HG   SER  36           HG       SER  36  -7.288   7.932  -5.179
  Start of MODEL   23
15788    H    SER  36           HN       SER  36  -9.133   5.710  -4.275
  Start of MODEL   23
15789    HA   LEU  37           HA       LEU  37  -4.712   4.039  -2.384
  Start of MODEL   23
15790    HB3  LEU  37           HB2      LEU  37  -3.386   1.994  -2.439
  Start of MODEL   23
15791    HB2  LEU  37           HB3      LEU  37  -4.065   1.573  -3.998
  Start of MODEL   23
15792    HG   LEU  37           HG       LEU  37  -6.316   1.453  -2.910
  Start of MODEL   23
15793   HD11  LEU  37          HD11      LEU  37  -4.203  -0.287  -1.653
  Start of MODEL   23
15794   HD13  LEU  37          HD12      LEU  37  -4.910  -0.534  -3.248
  Start of MODEL   23
15795   HD12  LEU  37          HD13      LEU  37  -5.922  -0.668  -1.813
  Start of MODEL   23
15796   HD23  LEU  37          HD21      LEU  37  -4.678   1.843  -0.416
  Start of MODEL   23
15797   HD22  LEU  37          HD22      LEU  37  -6.377   1.368  -0.460
  Start of MODEL   23
15798   HD21  LEU  37          HD23      LEU  37  -5.893   2.953  -1.058
  Start of MODEL   23
15799    H    LEU  37           HN       LEU  37  -5.885   3.011  -4.802
  Start of MODEL   23
15800    HA   ARG  38           HA       ARG  38  -1.156   5.184  -4.513
  Start of MODEL   23
15801    HB3  ARG  38           HB2      ARG  38  -2.562   7.686  -3.596
  Start of MODEL   23
15802    HB2  ARG  38           HB3      ARG  38  -2.765   6.890  -5.140
  Start of MODEL   23
15803    HG2  ARG  38           HG2      ARG  38  -1.431   8.726  -5.578
  Start of MODEL   23
15804    HG3  ARG  38           HG3      ARG  38  -0.417   8.466  -4.159
  Start of MODEL   23
15805    HD2  ARG  38           HD2      ARG  38   0.578   7.895  -6.400
  Start of MODEL   23
15806    HD3  ARG  38           HD3      ARG  38   0.691   6.653  -5.167
  Start of MODEL   23
15807    HE   ARG  38           HE       ARG  38  -1.637   6.284  -6.742
  Start of MODEL   23
15808   HH11  ARG  38          HH11      ARG  38   1.928   5.910  -7.039
  Start of MODEL   23
15809   HH12  ARG  38          HH12      ARG  38   1.765   4.521  -8.005
  Start of MODEL   23
15810   HH21  ARG  38          HH21      ARG  38  -1.736   4.305  -8.008
  Start of MODEL   23
15811   HH22  ARG  38          HH22      ARG  38  -0.281   3.554  -8.505
  Start of MODEL   23
15812    H    ARG  38           HN       ARG  38  -3.110   5.327  -2.367
  Start of MODEL   23
15813    HA   TRP  39           HA       TRP  39   1.328   5.773  -1.020
  Start of MODEL   23
15814    HB3  TRP  39           HB2      TRP  39   3.550   4.842  -1.524
  Start of MODEL   23
15815    HB2  TRP  39           HB3      TRP  39   3.096   4.723  -3.222
  Start of MODEL   23
15816    HD1  TRP  39           HD1      TRP  39   1.474   2.769  -3.952
  Start of MODEL   23
15817    HE1  TRP  39           HE1      TRP  39   0.784   0.597  -2.799
  Start of MODEL   23
15818    HE3  TRP  39           HE3      TRP  39   3.046   3.865   0.780
  Start of MODEL   23
15819    HZ2  TRP  39           HZ2      TRP  39   0.881  -0.519  -0.193
  Start of MODEL   23
15820    HZ3  TRP  39           HZ3      TRP  39   2.712   2.188   2.547
  Start of MODEL   23
15821    HH2  TRP  39           HH2      TRP  39   1.656   0.044   2.064
  Start of MODEL   23
15822    H    TRP  39           HN       TRP  39   0.835   5.309  -3.836
  Start of MODEL   23
15823    HA   LEU  40           HA       LEU  40   3.582   9.292  -2.287
  Start of MODEL   23
15824    HB3  LEU  40           HB2      LEU  40   2.201  10.156   0.261
  Start of MODEL   23
15825    HB2  LEU  40           HB3      LEU  40   1.410  10.137  -1.310
  Start of MODEL   23
15826    HG   LEU  40           HG       LEU  40   3.856  11.776  -0.797
  Start of MODEL   23
15827   HD13  LEU  40          HD11      LEU  40   3.420  11.266  -3.093
  Start of MODEL   23
15828   HD12  LEU  40          HD12      LEU  40   3.045  12.962  -2.783
  Start of MODEL   23
15829   HD11  LEU  40          HD13      LEU  40   1.743  11.768  -2.930
  Start of MODEL   23
15830   HD22  LEU  40          HD21      LEU  40   2.340  13.668  -0.551
  Start of MODEL   23
15831   HD21  LEU  40          HD22      LEU  40   2.086  12.481   0.731
  Start of MODEL   23
15832   HD23  LEU  40          HD23      LEU  40   0.957  12.579  -0.622
  Start of MODEL   23
15833    H    LEU  40           HN       LEU  40   2.210   7.570  -0.350
  Start of MODEL   23
15834    HA   PHE  41           HA       PHE  41   6.532   8.738   0.851
  Start of MODEL   23
15835    HB3  PHE  41           HB2      PHE  41   7.978   8.684  -1.808
  Start of MODEL   23
15836    HB2  PHE  41           HB3      PHE  41   7.444   7.303  -0.856
  Start of MODEL   23
15837    HD1  PHE  41           HD1      PHE  41  10.164   9.355  -1.626
  Start of MODEL   23
15838    HD2  PHE  41           HD2      PHE  41   8.428   7.165   1.571
  Start of MODEL   23
15839    HE1  PHE  41           HE1      PHE  41  12.341   9.257  -0.520
  Start of MODEL   23
15840    HE2  PHE  41           HE2      PHE  41  10.609   7.059   2.692
  Start of MODEL   23
15841    HZ   PHE  41           HZ       PHE  41  12.543   8.207   1.712
  Start of MODEL   23
15842    H    PHE  41           HN       PHE  41   5.650   9.690  -1.761
  Start of MODEL   23
15843    HA   ASN  42           HA       ASN  42   7.026  12.516   2.844
  Start of MODEL   23
15844    HB3  ASN  42           HB2      ASN  42   9.643  11.995   1.398
  Start of MODEL   23
15845    HB2  ASN  42           HB3      ASN  42   9.184  11.250   2.915
  Start of MODEL   23
15846   HD21  ASN  42          HD21      ASN  42  11.454  12.882   2.333
  Start of MODEL   23
15847   HD22  ASN  42          HD22      ASN  42  11.410  14.220   3.407
  Start of MODEL   23
15848    H    ASN  42           HN       ASN  42   6.433  10.548   1.953
  Start of MODEL   23
15849    HA2  GLY  43           HA2      GLY  43   4.741  14.913  -0.260
  Start of MODEL   23
15850    H    GLY  43           HN       GLY  43   5.450  12.934   0.769
  Start of MODEL   23
15851    HA3  GLY  43           HA1      GLY  43   6.399  15.491  -0.248
  Start of MODEL   23
15852    HA   SER  44           HA       SER  44   6.749  13.626  -4.234
  Start of MODEL   23
15853    HB3  SER  44           HB2      SER  44   8.692  11.600  -3.068
  Start of MODEL   23
15854    HB2  SER  44           HB3      SER  44   9.091  13.290  -3.349
  Start of MODEL   23
15855    HG   SER  44           HG       SER  44   9.474  11.424  -5.015
  Start of MODEL   23
15856    H    SER  44           HN       SER  44   7.137  12.752  -1.452
  Start of MODEL   23
15857    HA   VAL  45           HA       VAL  45   4.009  10.450  -4.855
  Start of MODEL   23
15858    HB   VAL  45           HB       VAL  45   4.810  11.390  -7.628
  Start of MODEL   23
15859    H    VAL  45           HN       VAL  45   5.983  12.309  -5.758
  Start of MODEL   23
15860    HA   LEU  46           HA       LEU  46   6.827   7.225  -5.618
  Start of MODEL   23
15861    HB3  LEU  46           HB2      LEU  46   4.632   5.901  -4.019
  Start of MODEL   23
15862    HB2  LEU  46           HB3      LEU  46   6.039   6.662  -3.301
  Start of MODEL   23
15863    HG   LEU  46           HG       LEU  46   6.230   4.371  -5.242
  Start of MODEL   23
15864   HD13  LEU  46          HD11      LEU  46   8.250   5.656  -5.045
  Start of MODEL   23
15865   HD12  LEU  46          HD12      LEU  46   8.459   4.080  -4.282
  Start of MODEL   23
15866   HD11  LEU  46          HD13      LEU  46   8.202   5.514  -3.289
  Start of MODEL   23
15867   HD22  LEU  46          HD21      LEU  46   4.965   3.554  -3.386
  Start of MODEL   23
15868   HD21  LEU  46          HD22      LEU  46   6.067   4.286  -2.240
  Start of MODEL   23
15869   HD23  LEU  46          HD23      LEU  46   6.609   2.929  -3.243
  Start of MODEL   23
15870    H    LEU  46           HN       LEU  46   4.439   8.372  -4.493
  Start of MODEL   23
15871    HA   ASN  47           HA       ASN  47   4.237   5.527  -8.617
  Start of MODEL   23
15872    HB3  ASN  47           HB2      ASN  47   5.332   7.274  -9.989
  Start of MODEL   23
15873    HB2  ASN  47           HB3      ASN  47   5.162   5.775 -10.885
  Start of MODEL   23
15874   HD21  ASN  47          HD21      ASN  47   7.404   8.003  -9.492
  Start of MODEL   23
15875   HD22  ASN  47          HD22      ASN  47   8.811   7.328 -10.215
  Start of MODEL   23
15876    H    ASN  47           HN       ASN  47   6.818   6.329  -7.551
  Start of MODEL   23
15877    HA   GLU  48           HA       GLU  48   5.718   1.502  -8.333
  Start of MODEL   23
15878    HB3  GLU  48           HB2      GLU  48   4.253  -0.117  -9.386
  Start of MODEL   23
15879    HB2  GLU  48           HB3      GLU  48   3.552   1.114 -10.420
  Start of MODEL   23
15880    HG2  GLU  48           HG2      GLU  48   2.279   0.254  -8.290
  Start of MODEL   23
15881    HG3  GLU  48           HG3      GLU  48   3.313   1.410  -7.462
  Start of MODEL   23
15882    H    GLU  48           HN       GLU  48   4.002   3.463  -9.364
  Start of MODEL   23
15883    HA   THR  49           HA       THR  49   8.157   1.663 -11.966
  Start of MODEL   23
15884    HB   THR  49           HB       THR  49   9.501   3.185 -10.524
  Start of MODEL   23
15885    HG1  THR  49           HG1      THR  49  10.661   2.778 -12.209
  Start of MODEL   23
15886   HG22  THR  49          HG21      THR  49  11.238   2.255  -9.051
  Start of MODEL   23
15887   HG21  THR  49          HG22      THR  49  10.594   0.637  -9.343
  Start of MODEL   23
15888   HG23  THR  49          HG23      THR  49   9.610   1.844  -8.511
  Start of MODEL   23
15889    H    THR  49           HN       THR  49   7.669   1.711  -9.120
  Start of MODEL   23
15890    HA   SER  50           HA       SER  50   9.227  -2.408 -12.744
  Start of MODEL   23
15891    HB3  SER  50           HB2      SER  50  12.119  -1.545 -12.535
  Start of MODEL   23
15892    HB2  SER  50           HB3      SER  50  11.115  -1.515 -13.982
  Start of MODEL   23
15893    HG   SER  50           HG       SER  50  12.481  -3.233 -13.933
  Start of MODEL   23
15894    H    SER  50           HN       SER  50  10.208   0.119 -12.412
  Start of MODEL   23
15895    HA   PHE  51           HA       PHE  51  10.960  -3.972  -8.886
  Start of MODEL   23
15896    HB3  PHE  51           HB2      PHE  51  12.903  -3.400  -7.504
  Start of MODEL   23
15897    HB2  PHE  51           HB3      PHE  51  12.894  -1.772  -8.177
  Start of MODEL   23
15898    HD1  PHE  51           HD1      PHE  51  13.078  -5.346  -9.208
  Start of MODEL   23
15899    HD2  PHE  51           HD2      PHE  51  14.128  -1.317 -10.078
  Start of MODEL   23
15900    HE1  PHE  51           HE1      PHE  51  14.511  -6.115 -11.048
  Start of MODEL   23
15901    HE2  PHE  51           HE2      PHE  51  15.554  -2.083 -11.924
  Start of MODEL   23
15902    HZ   PHE  51           HZ       PHE  51  15.621  -4.489 -12.506
  Start of MODEL   23
15903    H    PHE  51           HN       PHE  51  10.995  -1.236  -9.929
  Start of MODEL   23
15904    HA   ILE  52           HA       ILE  52   8.661  -1.892  -5.722
  Start of MODEL   23
15905    HB   ILE  52           HB       ILE  52   8.291   0.794  -7.148
  Start of MODEL   23
15906   HD11  ILE  52          HD11      ILE  52   9.590   2.286  -4.642
  Start of MODEL   23
15907   HD13  ILE  52          HD12      ILE  52  10.005   2.677  -6.313
  Start of MODEL   23
15908   HD12  ILE  52          HD13      ILE  52  11.259   2.169  -5.179
  Start of MODEL   23
15909    H    ILE  52           HN       ILE  52   9.135  -1.388  -8.581
  Start of MODEL   23
15910    HA   PHE  53           HA       PHE  53   4.837  -2.499  -7.769
  Start of MODEL   23
15911    HB3  PHE  53           HB2      PHE  53   5.783  -5.215  -6.832
  Start of MODEL   23
15912    HB2  PHE  53           HB3      PHE  53   6.275  -4.452  -8.334
  Start of MODEL   23
15913    HD1  PHE  53           HD1      PHE  53   4.671  -4.099 -10.130
  Start of MODEL   23
15914    HD2  PHE  53           HD2      PHE  53   3.720  -6.377  -6.682
  Start of MODEL   23
15915    HE1  PHE  53           HE1      PHE  53   2.779  -5.142 -11.343
  Start of MODEL   23
15916    HE2  PHE  53           HE2      PHE  53   1.833  -7.424  -7.872
  Start of MODEL   23
15917    HZ   PHE  53           HZ       PHE  53   1.367  -6.807 -10.208
  Start of MODEL   23
15918    H    PHE  53           HN       PHE  53   6.879  -3.103  -5.738
  Start of MODEL   23
15919    HA   THR  54           HA       THR  54   2.384  -2.986  -4.151
  Start of MODEL   23
15920    HB   THR  54           HB       THR  54   0.311  -2.036  -6.149
  Start of MODEL   23
15921    HG1  THR  54           HG1      THR  54   2.548  -0.796  -5.451
  Start of MODEL   23
15922   HG23  THR  54          HG21      THR  54  -0.500  -2.773  -3.947
  Start of MODEL   23
15923   HG22  THR  54          HG22      THR  54  -0.714  -1.034  -4.158
  Start of MODEL   23
15924   HG21  THR  54          HG23      THR  54   0.608  -1.647  -3.162
  Start of MODEL   23
15925    H    THR  54           HN       THR  54   2.749  -2.509  -7.011
  Start of MODEL   23
15926    HA   GLU  55           HA       GLU  55   0.649  -6.682  -5.743
  Start of MODEL   23
15927    HB3  GLU  55           HB2      GLU  55   2.248  -7.625  -3.362
  Start of MODEL   23
15928    HB2  GLU  55           HB3      GLU  55   2.951  -7.335  -4.942
  Start of MODEL   23
15929    HG2  GLU  55           HG2      GLU  55   0.889  -9.394  -4.225
  Start of MODEL   23
15930    HG3  GLU  55           HG3      GLU  55   1.388  -9.008  -5.871
  Start of MODEL   23
15931    H    GLU  55           HN       GLU  55   1.940  -5.103  -3.665
  Start of MODEL   23
15932    HA   PHE  56           HA       PHE  56  -2.430  -7.188  -2.674
  Start of MODEL   23
15933    HB3  PHE  56           HB2      PHE  56  -4.606  -7.174  -3.849
  Start of MODEL   23
15934    HB2  PHE  56           HB3      PHE  56  -3.770  -7.349  -5.382
  Start of MODEL   23
15935    HD1  PHE  56           HD1      PHE  56  -4.411  -5.066  -2.590
  Start of MODEL   23
15936    HD2  PHE  56           HD2      PHE  56  -2.759  -5.521  -6.475
  Start of MODEL   23
15937    HE1  PHE  56           HE1      PHE  56  -4.277  -2.627  -2.815
  Start of MODEL   23
15938    HE2  PHE  56           HE2      PHE  56  -2.611  -3.077  -6.710
  Start of MODEL   23
15939    HZ   PHE  56           HZ       PHE  56  -3.375  -1.625  -4.876
  Start of MODEL   23
15940    H    PHE  56           HN       PHE  56  -1.222  -7.755  -5.292
  Start of MODEL   23
15941    HA   LEU  57           HA       LEU  57  -3.499 -11.399  -3.121
  Start of MODEL   23
15942    HB3  LEU  57           HB2      LEU  57  -2.435 -11.330  -0.900
  Start of MODEL   23
15943    HB2  LEU  57           HB3      LEU  57  -3.838 -12.373  -0.873
  Start of MODEL   23
15944    HG   LEU  57           HG       LEU  57  -4.060  -9.585   0.167
  Start of MODEL   23
15945   HD13  LEU  57          HD11      LEU  57  -6.134 -10.769  -0.133
  Start of MODEL   23
15946   HD12  LEU  57          HD12      LEU  57  -5.799 -10.659   1.604
  Start of MODEL   23
15947   HD11  LEU  57          HD13      LEU  57  -5.498 -12.157   0.729
  Start of MODEL   23
15948   HD21  LEU  57          HD21      LEU  57  -2.135 -10.553   1.298
  Start of MODEL   23
15949   HD23  LEU  57          HD22      LEU  57  -3.075 -11.992   1.696
  Start of MODEL   23
15950   HD22  LEU  57          HD23      LEU  57  -3.508 -10.433   2.397
  Start of MODEL   23
15951    H    LEU  57           HN       LEU  57  -3.792  -8.779  -1.862
  Start of MODEL   23
15952    HA   GLU  58           HA       GLU  58  -7.745 -11.282  -3.654
  Start of MODEL   23
15953    HB3  GLU  58           HB2      GLU  58  -7.513 -14.160  -2.839
  Start of MODEL   23
15954    HB2  GLU  58           HB3      GLU  58  -7.166 -13.544  -4.452
  Start of MODEL   23
15955    HG2  GLU  58           HG2      GLU  58  -9.832 -13.399  -3.069
  Start of MODEL   23
15956    HG3  GLU  58           HG3      GLU  58  -9.480 -12.870  -4.713
  Start of MODEL   23
15957    H    GLU  58           HN       GLU  58  -5.517 -12.780  -2.669
  Start of MODEL   23
15958    HA   PRO  59           HA       PRO  59  -9.158 -10.788   0.643
  Start of MODEL   23
15959    HB3  PRO  59           HB2      PRO  59  -9.712  -8.573   0.632
  Start of MODEL   23
15960    HB2  PRO  59           HB3      PRO  59 -11.117  -8.912  -0.380
  Start of MODEL   23
15961    HG2  PRO  59           HG2      PRO  59  -9.932  -7.749  -1.959
  Start of MODEL   23
15962    HG3  PRO  59           HG3      PRO  59  -8.385  -8.076  -1.164
  Start of MODEL   23
15963    HD2  PRO  59           HD2      PRO  59  -9.942  -9.813  -3.045
  Start of MODEL   23
15964    HD3  PRO  59           HD3      PRO  59  -8.190  -9.510  -2.942
  Start of MODEL   23
15965    HA   ALA  60           HA       ALA  60 -12.698 -13.274   0.126
  Start of MODEL   23
15966    HB1  ALA  60           HB1      ALA  60 -12.325 -12.914   3.099
  Start of MODEL   23
15967    HB3  ALA  60           HB2      ALA  60 -11.664 -14.223   2.120
  Start of MODEL   23
15968    HB2  ALA  60           HB3      ALA  60 -13.408 -14.084   2.346
  Start of MODEL   23
15969    H    ALA  60           HN       ALA  60 -10.782 -11.783   1.647
  Start of MODEL   23
15970    HA   ALA  61           HA       ALA  61 -15.809 -10.280   0.294
  Start of MODEL   23
15971    HB2  ALA  61           HB1      ALA  61 -17.994 -11.211  -0.209
  Start of MODEL   23
15972    HB1  ALA  61           HB2      ALA  61 -17.416 -12.820   0.222
  Start of MODEL   23
15973    HB3  ALA  61           HB3      ALA  61 -16.748 -11.994  -1.184
  Start of MODEL   23
15974    H    ALA  61           HN       ALA  61 -14.913 -12.969   0.242
  Start of MODEL   23
15975    HA   ASN  62           HA       ASN  62 -17.368 -11.838   4.546
  Start of MODEL   23
15976    HB3  ASN  62           HB2      ASN  62 -14.683 -13.197   4.856
  Start of MODEL   23
15977    HB2  ASN  62           HB3      ASN  62 -16.252 -13.972   4.705
  Start of MODEL   23
15978   HD21  ASN  62          HD21      ASN  62 -17.691 -13.875   6.415
  Start of MODEL   23
15979   HD22  ASN  62          HD22      ASN  62 -17.181 -13.563   8.034
  Start of MODEL   23
15980    H    ASN  62           HN       ASN  62 -15.453 -12.619   2.631
  Start of MODEL   23
15981    HA   GLU  63           HA       GLU  63 -14.359  -8.725   5.882
  Start of MODEL   23
15982    HB3  GLU  63           HB2      GLU  63 -12.086  -8.065   5.171
  Start of MODEL   23
15983    HB2  GLU  63           HB3      GLU  63 -12.178  -9.232   3.867
  Start of MODEL   23
15984    HG2  GLU  63           HG2      GLU  63 -12.328  -9.952   6.768
  Start of MODEL   23
15985    HG3  GLU  63           HG3      GLU  63 -12.213 -11.056   5.396
  Start of MODEL   23
15986    H    GLU  63           HN       GLU  63 -14.327 -10.473   3.546
  Start of MODEL   23
15987    HA   THR  64           HA       THR  64 -15.031  -5.609   2.887
  Start of MODEL   23
15988    HB   THR  64           HB       THR  64 -15.765  -3.490   4.087
  Start of MODEL   23
15989    HG1  THR  64           HG1      THR  64 -14.950  -3.529   6.085
  Start of MODEL   23
15990   HG21  THR  64          HG21      THR  64 -17.218  -6.038   4.833
  Start of MODEL   23
15991   HG23  THR  64          HG22      THR  64 -17.409  -5.142   3.325
  Start of MODEL   23
15992   HG22  THR  64          HG23      THR  64 -17.914  -4.418   4.848
  Start of MODEL   23
15993    H    THR  64           HN       THR  64 -14.575  -6.553   5.598
  Start of MODEL   23
15994    HA   VAL  65           HA       VAL  65 -10.973  -3.912   4.073
  Start of MODEL   23
15995    HB   VAL  65           HB       VAL  65 -10.084  -6.449   5.428
  Start of MODEL   23
15996    H    VAL  65           HN       VAL  65 -12.515  -6.398   4.239
  Start of MODEL   23
15997    HA   ARG  66           HA       ARG  66  -9.039  -6.169   0.827
  Start of MODEL   23
15998    HB3  ARG  66           HB2      ARG  66  -8.358  -3.246   0.537
  Start of MODEL   23
15999    HB2  ARG  66           HB3      ARG  66  -9.786  -3.999  -0.141
  Start of MODEL   23
16000    HG2  ARG  66           HG2      ARG  66  -6.956  -4.656  -0.914
  Start of MODEL   23
16001    HG3  ARG  66           HG3      ARG  66  -8.421  -5.353  -1.608
  Start of MODEL   23
16002    HD2  ARG  66           HD2      ARG  66  -7.607  -2.451  -1.688
  Start of MODEL   23
16003    HD3  ARG  66           HD3      ARG  66  -7.569  -3.569  -3.047
  Start of MODEL   23
16004    HE   ARG  66           HE       ARG  66 -10.111  -3.029  -1.694
  Start of MODEL   23
16005   HH11  ARG  66          HH11      ARG  66  -8.151  -2.730  -4.622
  Start of MODEL   23
16006   HH12  ARG  66          HH12      ARG  66  -9.425  -2.165  -5.590
  Start of MODEL   23
16007   HH21  ARG  66          HH21      ARG  66 -11.882  -2.317  -3.031
  Start of MODEL   23
16008   HH22  ARG  66          HH22      ARG  66 -11.624  -1.978  -4.673
  Start of MODEL   23
16009    H    ARG  66           HN       ARG  66  -9.560  -3.845   2.514
  Start of MODEL   23
16010    HA   HIS  67           HA       HIS  67  -5.039  -5.831   2.635
  Start of MODEL   23
16011    HB3  HIS  67           HB2      HIS  67  -4.261  -8.118   3.227
  Start of MODEL   23
16012    HB2  HIS  67           HB3      HIS  67  -5.579  -8.785   2.278
  Start of MODEL   23
16013    HD1  HIS  67           HD1      HIS  67  -4.890  -7.130   5.564
  Start of MODEL   23
16014    HD2  HIS  67           HD2      HIS  67  -8.105  -8.728   3.468
  Start of MODEL   23
16015    HE1  HIS  67           HE1      HIS  67  -6.744  -7.327   7.220
  Start of MODEL   23
16016    HE2  HIS  67           HE2      HIS  67  -8.545  -8.600   5.993
  Start of MODEL   23
16017    H    HIS  67           HN       HIS  67  -7.001  -7.081   0.838
  Start of MODEL   23
16018    HA2  GLY  68           HA2      GLY  68  -2.046  -7.382  -0.232
  Start of MODEL   23
16019    H    GLY  68           HN       GLY  68  -2.931  -5.802   1.961
  Start of MODEL   23
16020    HA3  GLY  68           HA1      GLY  68  -2.286  -5.687  -0.655
  Start of MODEL   23
16021    HA   CYS  69           HA       CYS  69   1.475  -5.006   1.301
  Start of MODEL   23
16022    HB3  CYS  69           HB2      CYS  69   2.288  -7.603  -0.007
  Start of MODEL   23
16023    HB2  CYS  69           HB3      CYS  69   1.868  -7.340   1.685
  Start of MODEL   23
16024    H    CYS  69           HN       CYS  69   0.128  -6.115  -1.003
  Start of MODEL   23
16025    HA   LEU  70           HA       LEU  70   3.495  -3.144  -2.122
  Start of MODEL   23
16026    HB3  LEU  70           HB2      LEU  70   4.584  -1.693   0.305
  Start of MODEL   23
16027    HB2  LEU  70           HB3      LEU  70   3.176  -1.180  -0.603
  Start of MODEL   23
16028    HG   LEU  70           HG       LEU  70   5.982  -1.321  -1.719
  Start of MODEL   23
16029   HD13  LEU  70          HD11      LEU  70   4.303  -1.576  -3.440
  Start of MODEL   23
16030   HD12  LEU  70          HD12      LEU  70   5.076   0.014  -3.540
  Start of MODEL   23
16031   HD11  LEU  70          HD13      LEU  70   3.465  -0.137  -2.844
  Start of MODEL   23
16032   HD22  LEU  70          HD21      LEU  70   5.950   1.113  -1.614
  Start of MODEL   23
16033   HD21  LEU  70          HD22      LEU  70   5.835   0.399  -0.004
  Start of MODEL   23
16034   HD23  LEU  70          HD23      LEU  70   4.395   1.060  -0.786
  Start of MODEL   23
16035    H    LEU  70           HN       LEU  70   2.947  -3.533   0.701
  Start of MODEL   23
16036    HA   ARG  71           HA       ARG  71   7.177  -5.253  -1.287
  Start of MODEL   23
16037    HB3  ARG  71           HB2      ARG  71   7.336  -7.242  -2.877
  Start of MODEL   23
16038    HB2  ARG  71           HB3      ARG  71   5.772  -6.721  -3.506
  Start of MODEL   23
16039    HG2  ARG  71           HG2      ARG  71   6.412  -7.445  -0.658
  Start of MODEL   23
16040    HG3  ARG  71           HG3      ARG  71   4.861  -6.853  -1.219
  Start of MODEL   23
16041    HD2  ARG  71           HD2      ARG  71   4.535  -8.834  -2.539
  Start of MODEL   23
16042    HD3  ARG  71           HD3      ARG  71   6.174  -9.390  -2.183
  Start of MODEL   23
16043    HE   ARG  71           HE       ARG  71   4.817  -8.928   0.219
  Start of MODEL   23
16044   HH11  ARG  71          HH11      ARG  71   4.307 -11.090  -2.462
  Start of MODEL   23
16045   HH12  ARG  71          HH12      ARG  71   4.114 -12.500  -1.530
  Start of MODEL   23
16046   HH21  ARG  71          HH21      ARG  71   4.424 -10.844   1.579
  Start of MODEL   23
16047   HH22  ARG  71          HH22      ARG  71   4.167 -12.339   0.825
  Start of MODEL   23
16048    H    ARG  71           HN       ARG  71   5.068  -4.303  -3.042
  Start of MODEL   23
16049    HA   LEU  72           HA       LEU  72   9.651  -3.601  -4.316
  Start of MODEL   23
16050    HB3  LEU  72           HB2      LEU  72  11.373  -2.246  -3.273
  Start of MODEL   23
16051    HB2  LEU  72           HB3      LEU  72  11.101  -2.941  -1.708
  Start of MODEL   23
16052    HG   LEU  72           HG       LEU  72   8.920  -1.473  -3.182
  Start of MODEL   23
16053   HD13  LEU  72          HD11      LEU  72   8.101  -2.615  -1.246
  Start of MODEL   23
16054   HD12  LEU  72          HD12      LEU  72   8.089  -0.869  -0.945
  Start of MODEL   23
16055   HD11  LEU  72          HD13      LEU  72   9.344  -1.869  -0.236
  Start of MODEL   23
16056   HD23  LEU  72          HD21      LEU  72  10.892  -0.149  -1.367
  Start of MODEL   23
16057   HD22  LEU  72          HD22      LEU  72   9.520   0.597  -2.223
  Start of MODEL   23
16058   HD21  LEU  72          HD23      LEU  72  10.891  -0.041  -3.121
  Start of MODEL   23
16059    H    LEU  72           HN       LEU  72   9.101  -4.761  -1.708
  Start of MODEL   23
16060    HA   ASN  73           HA       ASN  73  11.891  -7.325  -4.668
  Start of MODEL   23
16061    HB3  ASN  73           HB2      ASN  73  12.122  -5.904  -7.333
  Start of MODEL   23
16062    HB2  ASN  73           HB3      ASN  73  10.887  -7.074  -6.901
  Start of MODEL   23
16063   HD21  ASN  73          HD21      ASN  73  11.441  -9.311  -6.789
  Start of MODEL   23
16064   HD22  ASN  73          HD22      ASN  73  12.877  -9.892  -7.499
  Start of MODEL   23
16065    H    ASN  73           HN       ASN  73  10.694  -4.882  -5.513
  Start of MODEL   23
16066    HA   GLN  74           HA       GLN  74  15.753  -5.168  -4.395
  Start of MODEL   23
16067    HB3  GLN  74           HB2      GLN  74  16.913  -3.565  -5.897
  Start of MODEL   23
16068    HB2  GLN  74           HB3      GLN  74  15.373  -3.206  -6.659
  Start of MODEL   23
16069    HG2  GLN  74           HG2      GLN  74  16.688  -5.898  -6.627
  Start of MODEL   23
16070    HG3  GLN  74           HG3      GLN  74  15.191  -5.476  -7.461
  Start of MODEL   23
16071   HE21  GLN  74          HE21      GLN  74  17.624  -6.556  -8.568
  Start of MODEL   23
16072   HE22  GLN  74          HE22      GLN  74  18.168  -5.389  -9.725
  Start of MODEL   23
16073    H    GLN  74           HN       GLN  74  13.211  -4.191  -5.412
  Start of MODEL   23
16074    HA   PRO  75           HA       PRO  75  14.803  -1.753  -1.716
  Start of MODEL   23
16075    HB3  PRO  75           HB2      PRO  75  15.522  -3.005   0.097
  Start of MODEL   23
16076    HB2  PRO  75           HB3      PRO  75  16.997  -2.046  -0.090
  Start of MODEL   23
16077    HG2  PRO  75           HG2      PRO  75  18.115  -3.741  -1.174
  Start of MODEL   23
16078    HG3  PRO  75           HG3      PRO  75  17.012  -4.732  -0.203
  Start of MODEL   23
16079    HD2  PRO  75           HD2      PRO  75  17.156  -4.845  -2.929
  Start of MODEL   23
16080    HD3  PRO  75           HD3      PRO  75  15.696  -5.249  -2.007
  Start of MODEL   23
16081    HA   THR  76           HA       THR  76  18.090   0.846  -3.138
  Start of MODEL   23
16082    HB   THR  76           HB       THR  76  16.837   2.744  -4.342
  Start of MODEL   23
16083    HG1  THR  76           HG1      THR  76  14.680   1.218  -3.337
  Start of MODEL   23
16084   HG22  THR  76          HG21      THR  76  16.021   1.285  -6.155
  Start of MODEL   23
16085   HG21  THR  76          HG22      THR  76  16.133  -0.106  -5.075
  Start of MODEL   23
16086   HG23  THR  76          HG23      THR  76  17.593   0.754  -5.557
  Start of MODEL   23
16087    H    THR  76           HN       THR  76  15.492   0.297  -1.903
  Start of MODEL   23
16088    HA   HIS  77           HA       HIS  77  18.515   3.584   0.070
  Start of MODEL   23
16089    HB3  HIS  77           HB2      HIS  77  20.654   4.005  -1.076
  Start of MODEL   23
16090    HB2  HIS  77           HB3      HIS  77  20.127   5.392  -0.148
  Start of MODEL   23
16091    HD1  HIS  77           HD1      HIS  77  20.694   4.299  -3.685
  Start of MODEL   23
16092    HD2  HIS  77           HD2      HIS  77  19.711   7.730  -1.564
  Start of MODEL   23
16093    HE1  HIS  77           HE1      HIS  77  20.876   6.178  -5.327
  Start of MODEL   23
16094    HE2  HIS  77           HE2      HIS  77  19.992   8.177  -4.094
  Start of MODEL   23
16095    H    HIS  77           HN       HIS  77  18.746   3.120  -2.718
  Start of MODEL   23
16096    HA   VAL  78           HA       VAL  78  15.581   6.950  -0.956
  Start of MODEL   23
16097    HB   VAL  78           HB       VAL  78  13.767   7.058  -2.615
  Start of MODEL   23
16098    H    VAL  78           HN       VAL  78  16.432   4.497  -2.261
  Start of MODEL   23
16099    HA   ASN  79           HA       ASN  79  12.427   3.708   0.328
  Start of MODEL   23
16100    HB3  ASN  79           HB2      ASN  79  12.859   1.348   0.969
  Start of MODEL   23
16101    HB2  ASN  79           HB3      ASN  79  14.542   1.570   0.510
  Start of MODEL   23
16102   HD21  ASN  79          HD21      ASN  79  11.799   2.942  -1.221
  Start of MODEL   23
16103   HD22  ASN  79          HD22      ASN  79  12.035   1.989  -2.645
  Start of MODEL   23
16104    H    ASN  79           HN       ASN  79  15.213   3.717  -0.439
  Start of MODEL   23
16105    HA   ASN  80           HA       ASN  80  13.910   4.422   4.447
  Start of MODEL   23
16106    HB3  ASN  80           HB2      ASN  80  15.895   5.728   5.069
  Start of MODEL   23
16107    HB2  ASN  80           HB3      ASN  80  16.081   6.259   3.407
  Start of MODEL   23
16108   HD21  ASN  80          HD21      ASN  80  18.072   5.452   3.164
  Start of MODEL   23
16109   HD22  ASN  80          HD22      ASN  80  18.389   3.750   3.077
  Start of MODEL   23
16110    H    ASN  80           HN       ASN  80  14.163   5.458   1.712
  Start of MODEL   23
16111    HA2  GLY  81           HA2      GLY  81  12.042   8.023   5.863
  Start of MODEL   23
16112    H    GLY  81           HN       GLY  81  12.127   5.458   5.041
  Start of MODEL   23
16113    HA3  GLY  81           HA1      GLY  81  11.561   8.133   4.183
  Start of MODEL   23
16114    HA   ASN  82           HA       ASN  82   7.958   6.751   6.260
  Start of MODEL   23
16115    HB3  ASN  82           HB2      ASN  82   7.301   9.676   5.896
  Start of MODEL   23
16116    HB2  ASN  82           HB3      ASN  82   8.046   8.980   7.331
  Start of MODEL   23
16117   HD21  ASN  82          HD21      ASN  82   6.847   7.730   8.686
  Start of MODEL   23
16118   HD22  ASN  82          HD22      ASN  82   5.129   7.706   8.691
  Start of MODEL   23
16119    H    ASN  82           HN       ASN  82   9.522   8.832   4.953
  Start of MODEL   23
16120    HA   TYR  83           HA       TYR  83   5.816   6.631   2.426
  Start of MODEL   23
16121    HB3  TYR  83           HB2      TYR  83   5.040   4.176   2.101
  Start of MODEL   23
16122    HB2  TYR  83           HB3      TYR  83   5.914   3.829   3.589
  Start of MODEL   23
16123    HD1  TYR  83           HD1      TYR  83   6.229   4.288   0.018
  Start of MODEL   23
16124    HD2  TYR  83           HD2      TYR  83   8.420   4.331   3.677
  Start of MODEL   23
16125    HE1  TYR  83           HE1      TYR  83   8.336   3.938  -1.218
  Start of MODEL   23
16126    HE2  TYR  83           HE2      TYR  83  10.496   3.972   2.436
  Start of MODEL   23
16127    HH   TYR  83           HH       TYR  83  11.076   2.866   0.218
  Start of MODEL   23
16128    H    TYR  83           HN       TYR  83   6.576   5.624   5.063
  Start of MODEL   23
16129    HA   THR  84           HA       THR  84   1.870   6.894   4.287
  Start of MODEL   23
16130    HB   THR  84           HB       THR  84   2.153   9.335   2.507
  Start of MODEL   23
16131    HG1  THR  84           HG1      THR  84   2.450   9.032   5.330
  Start of MODEL   23
16132   HG22  THR  84          HG21      THR  84   0.319  10.298   3.850
  Start of MODEL   23
16133   HG21  THR  84          HG22      THR  84   0.146   8.763   4.705
  Start of MODEL   23
16134   HG23  THR  84          HG23      THR  84  -0.214   8.861   2.979
  Start of MODEL   23
16135    H    THR  84           HN       THR  84   3.894   7.582   2.300
  Start of MODEL   23
16136    HA   LEU  85           HA       LEU  85  -0.338   5.440   0.815
  Start of MODEL   23
16137    HB3  LEU  85           HB2      LEU  85  -1.406   3.919   3.202
  Start of MODEL   23
16138    HB2  LEU  85           HB3      LEU  85  -0.104   3.393   2.148
  Start of MODEL   23
16139    HG   LEU  85           HG       LEU  85  -2.994   3.711   1.329
  Start of MODEL   23
16140   HD13  LEU  85          HD11      LEU  85  -1.483   4.143  -0.494
  Start of MODEL   23
16141   HD12  LEU  85          HD12      LEU  85  -2.277   2.566  -0.696
  Start of MODEL   23
16142   HD11  LEU  85          HD13      LEU  85  -0.604   2.661  -0.108
  Start of MODEL   23
16143   HD23  LEU  85          HD21      LEU  85  -1.355   1.227   1.760
  Start of MODEL   23
16144   HD22  LEU  85          HD22      LEU  85  -3.047   1.314   1.237
  Start of MODEL   23
16145   HD21  LEU  85          HD23      LEU  85  -2.589   1.849   2.853
  Start of MODEL   23
16146    H    LEU  85           HN       LEU  85   0.118   5.861   3.671
  Start of MODEL   23
16147    HA   LEU  86           HA       LEU  86  -3.943   7.795   1.527
  Start of MODEL   23
16148    HB3  LEU  86           HB2      LEU  86  -4.357   9.177  -0.497
  Start of MODEL   23
16149    HB2  LEU  86           HB3      LEU  86  -3.043   8.373  -1.310
  Start of MODEL   23
16150    HG   LEU  86           HG       LEU  86  -2.579  10.674  -0.549
  Start of MODEL   23
16151   HD13  LEU  86          HD11      LEU  86  -3.723  10.712   1.535
  Start of MODEL   23
16152   HD12  LEU  86          HD12      LEU  86  -2.020  11.097   1.768
  Start of MODEL   23
16153   HD11  LEU  86          HD13      LEU  86  -2.627   9.499   2.199
  Start of MODEL   23
16154   HD21  LEU  86          HD21      LEU  86  -0.746   9.191  -1.076
  Start of MODEL   23
16155   HD23  LEU  86          HD22      LEU  86  -0.774   8.531   0.560
  Start of MODEL   23
16156   HD22  LEU  86          HD23      LEU  86  -0.316  10.214   0.294
  Start of MODEL   23
16157    H    LEU  86           HN       LEU  86  -1.830   6.569  -0.079
  Start of MODEL   23
16158    HA   ALA  87           HA       ALA  87  -6.618   5.694  -1.257
  Start of MODEL   23
16159    HB3  ALA  87           HB1      ALA  87  -6.500   4.105   0.605
  Start of MODEL   23
16160    HB2  ALA  87           HB2      ALA  87  -8.181   4.312   0.113
  Start of MODEL   23
16161    HB1  ALA  87           HB3      ALA  87  -7.575   5.124   1.549
  Start of MODEL   23
16162    H    ALA  87           HN       ALA  87  -5.978   7.235   1.149
  Start of MODEL   23
16163    HA   ALA  88           HA       ALA  88  -9.891   8.524  -0.741
  Start of MODEL   23
16164    HB2  ALA  88           HB1      ALA  88  -9.824  10.177  -2.517
  Start of MODEL   23
16165    HB1  ALA  88           HB2      ALA  88  -8.722   9.162  -3.444
  Start of MODEL   23
16166    HB3  ALA  88           HB3      ALA  88  -8.197   9.862  -1.910
  Start of MODEL   23
16167    H    ALA  88           HN       ALA  88  -8.111   6.816  -2.324
  Start of MODEL   23
16168    HA   ASN  89           HA       ASN  89 -12.906   7.390  -3.651
  Start of MODEL   23
16169    HB3  ASN  89           HB2      ASN  89 -12.807   5.287  -2.328
  Start of MODEL   23
16170    HB2  ASN  89           HB3      ASN  89 -14.462   5.712  -2.675
  Start of MODEL   23
16171   HD21  ASN  89          HD21      ASN  89 -13.568   3.925  -0.739
  Start of MODEL   23
16172   HD22  ASN  89          HD22      ASN  89 -14.060   4.488   0.819
  Start of MODEL   23
16173    H    ASN  89           HN       ASN  89 -11.967   8.349  -1.120
  Start of MODEL   23
16174    HA   PRO  90           HA       PRO  90 -15.970  10.488  -3.345
  Start of MODEL   23
16175    HB3  PRO  90           HB2      PRO  90 -18.078   9.904  -4.048
  Start of MODEL   23
16176    HB2  PRO  90           HB3      PRO  90 -18.232   8.611  -2.855
  Start of MODEL   23
16177    HG2  PRO  90           HG2      PRO  90 -17.793   7.396  -4.816
  Start of MODEL   23
16178    HG3  PRO  90           HG3      PRO  90 -16.703   8.649  -5.438
  Start of MODEL   23
16179    HD2  PRO  90           HD2      PRO  90 -16.222   6.590  -3.335
  Start of MODEL   23
16180    HD3  PRO  90           HD3      PRO  90 -15.127   7.160  -4.612
  Start of MODEL   23
16181    HA   CYS  91           HA       CYS  91 -17.699   9.971   0.922
  Start of MODEL   23
16182    HB3  CYS  91           HB2      CYS  91 -16.364   7.370   1.684
  Start of MODEL   23
16183    HB2  CYS  91           HB3      CYS  91 -18.034   7.549   1.159
  Start of MODEL   23
16184    H    CYS  91           HN       CYS  91 -16.171   8.178  -0.731
  Start of MODEL   23
16185    HA2  GLY  92           HA2      GLY  92 -13.412  11.677   1.502
  Start of MODEL   23
16186    H    GLY  92           HN       GLY  92 -14.304   9.442   0.339
  Start of MODEL   23
16187    HA3  GLY  92           HA1      GLY  92 -13.557  10.589   2.876
  Start of MODEL   23
16188    HA   GLN  93           HA       GLN  93  -9.701   9.318   1.212
  Start of MODEL   23
16189    HB3  GLN  93           HB2      GLN  93  -8.864  12.114   1.987
  Start of MODEL   23
16190    HB2  GLN  93           HB3      GLN  93  -9.347  11.604   0.375
  Start of MODEL   23
16191    HG2  GLN  93           HG2      GLN  93  -7.024  10.399   1.850
  Start of MODEL   23
16192    HG3  GLN  93           HG3      GLN  93  -7.422  10.230   0.144
  Start of MODEL   23
16193   HE21  GLN  93          HE21      GLN  93  -6.987  11.964  -1.251
  Start of MODEL   23
16194   HE22  GLN  93          HE22      GLN  93  -5.942  13.253  -0.783
  Start of MODEL   23
16195    H    GLN  93           HN       GLN  93 -11.201  11.283   2.777
  Start of MODEL   23
16196    HA   ALA  94           HA       ALA  94  -8.051   8.669   5.231
  Start of MODEL   23
16197    HB1  ALA  94           HB1      ALA  94  -7.915   6.082   3.710
  Start of MODEL   23
16198    HB3  ALA  94           HB2      ALA  94  -9.178   6.551   4.850
  Start of MODEL   23
16199    HB2  ALA  94           HB3      ALA  94  -7.524   6.245   5.412
  Start of MODEL   23
16200    H    ALA  94           HN       ALA  94  -8.468   8.063   2.385
  Start of MODEL   23
16201    HA   SER  95           HA       SER  95  -3.836   7.986   4.134
  Start of MODEL   23
16202    HB3  SER  95           HB2      SER  95  -4.060  10.352   3.920
  Start of MODEL   23
16203    HB2  SER  95           HB3      SER  95  -2.651  10.079   4.939
  Start of MODEL   23
16204    HG   SER  95           HG       SER  95  -5.255  10.638   5.921
  Start of MODEL   23
16205    H    SER  95           HN       SER  95  -5.926   8.470   6.053
  Start of MODEL   23
16206    HA   ALA  96           HA       ALA  96  -1.979   6.767   7.905
  Start of MODEL   23
16207    HB3  ALA  96           HB1      ALA  96  -3.317   4.773   7.383
  Start of MODEL   23
16208    HB2  ALA  96           HB2      ALA  96  -1.676   4.323   7.867
  Start of MODEL   23
16209    HB1  ALA  96           HB3      ALA  96  -2.125   4.307   6.168
  Start of MODEL   23
16210    H    ALA  96           HN       ALA  96  -2.432   6.666   5.001
  Start of MODEL   23
16211    HA   SER  97           HA       SER  97   2.028   6.258   6.185
  Start of MODEL   23
16212    HB3  SER  97           HB2      SER  97   3.467   7.743   7.494
  Start of MODEL   23
16213    HB2  SER  97           HB3      SER  97   2.282   7.739   8.803
  Start of MODEL   23
16214    HG   SER  97           HG       SER  97   0.879   8.813   7.574
  Start of MODEL   23
16215    H    SER  97           HN       SER  97   0.224   6.087   8.467
  Start of MODEL   23
16216    HA   ILE  98           HA       ILE  98   4.292   3.597   8.800
  Start of MODEL   23
16217    HB   ILE  98           HB       ILE  98   3.125   2.142   7.223
  Start of MODEL   23
16218   HD11  ILE  98          HD11      ILE  98   6.946   1.799   7.679
  Start of MODEL   23
16219   HD13  ILE  98          HD12      ILE  98   6.524   0.825   6.266
  Start of MODEL   23
16220   HD12  ILE  98          HD13      ILE  98   6.808   0.044   7.821
  Start of MODEL   23
16221    H    ILE  98           HN       ILE  98   3.850   5.053   6.330
  Start of MODEL   23
16222    HA   MET  99           HA       MET  99   8.150   5.318   7.886
  Start of MODEL   23
16223    HB3  MET  99           HB2      MET  99   8.595   4.233  10.668
  Start of MODEL   23
16224    HB2  MET  99           HB3      MET  99   7.706   5.721  10.366
  Start of MODEL   23
16225    HG2  MET  99           HG2      MET  99  10.054   6.120  10.973
  Start of MODEL   23
16226    HG3  MET  99           HG3      MET  99  10.559   5.214   9.546
  Start of MODEL   23
16227    HE3  MET  99           HE1      MET  99  11.535   8.196  10.118
  Start of MODEL   23
16228    HE2  MET  99           HE2      MET  99  11.362   8.901   8.507
  Start of MODEL   23
16229    HE1  MET  99           HE3      MET  99  11.999   7.267   8.688
  Start of MODEL   23
16230    H    MET  99           HN       MET  99   6.299   3.761   9.494
  Start of MODEL   23
16231    HA   ALA 100           HA       ALA 100  10.344   1.573   7.326
  Start of MODEL   23
16232    HB1  ALA 100           HB1      ALA 100   9.668   2.517   4.543
  Start of MODEL   23
16233    HB3  ALA 100           HB2      ALA 100   8.668   1.465   5.544
  Start of MODEL   23
16234    HB2  ALA 100           HB3      ALA 100  10.246   0.911   4.985
  Start of MODEL   23
16235    H    ALA 100           HN       ALA 100   9.528   4.276   6.555
  Start of MODEL   23
16236    HA   ALA 101           HA       ALA 101  14.157   2.874   5.618
  Start of MODEL   23
16237    HB1  ALA 101           HB1      ALA 101  14.583   2.339   8.559
  Start of MODEL   23
16238    HB3  ALA 101           HB2      ALA 101  14.200   3.903   7.836
  Start of MODEL   23
16239    HB2  ALA 101           HB3      ALA 101  15.743   3.120   7.484
  Start of MODEL   23
16240    H    ALA 101           HN       ALA 101  12.428   1.230   7.282
  Start of MODEL   23
16241    HA   PHE 102           HA       PHE 102  15.230  -1.357   5.316
  Start of MODEL   23
16242    HB3  PHE 102           HB2      PHE 102  15.693  -1.988   2.964
  Start of MODEL   23
16243    HB2  PHE 102           HB3      PHE 102  15.527  -0.303   2.495
  Start of MODEL   23
16244    HD1  PHE 102           HD1      PHE 102  13.307  -1.623   5.039
  Start of MODEL   23
16245    HD2  PHE 102           HD2      PHE 102  13.751  -0.941   0.855
  Start of MODEL   23
16246    HE1  PHE 102           HE1      PHE 102  10.898  -1.969   4.723
  Start of MODEL   23
16247    HE2  PHE 102           HE2      PHE 102  11.343  -1.287   0.541
  Start of MODEL   23
16248    HZ   PHE 102           HZ       PHE 102   9.912  -1.730   2.391
  Start of MODEL   23
16249    H    PHE 102           HN       PHE 102  14.690   1.312   4.325
  Start of MODEL   23
16250    HA   MET 103           HA       MET 103  19.522   0.174   5.083
  Start of MODEL   23
16251    HB3  MET 103           HB2      MET 103  19.480  -1.625   3.377
  Start of MODEL   23
16252    HB2  MET 103           HB3      MET 103  20.969  -0.692   3.328
  Start of MODEL   23
16253    HG2  MET 103           HG2      MET 103  18.643  -0.496   1.423
  Start of MODEL   23
16254    HG3  MET 103           HG3      MET 103  20.056   0.553   1.388
  Start of MODEL   23
16255    HE1  MET 103           HE1      MET 103  20.655   0.036  -1.056
  Start of MODEL   23
16256    HE3  MET 103           HE2      MET 103  19.202  -0.954  -1.198
  Start of MODEL   23
16257    HE2  MET 103           HE3      MET 103  20.758  -1.586  -1.739
  Start of MODEL   23
16258    H    MET 103           HN       MET 103  17.349   0.812   3.324
  Start of MODEL   23
16259    HA   ASP 104           HA       ASP 104  19.959   4.338   4.019
  Start of MODEL   23
16260    HB3  ASP 104           HB2      ASP 104  22.105   3.780   6.074
  Start of MODEL   23
16261    HB2  ASP 104           HB3      ASP 104  20.491   4.379   6.398
  Start of MODEL   23
16262    H    ASP 104           HN       ASP 104  20.671   1.936   5.349
  Start of MODEL   23
16263    HA   ASN 105           HA       ASN 105  22.459   5.051   0.717
  Start of MODEL   23
16264    HB3  ASN 105           HB2      ASN 105  23.808   7.103   0.584
  Start of MODEL   23
16265    HB2  ASN 105           HB3      ASN 105  23.636   7.310   2.320
  Start of MODEL   23
16266   HD21  ASN 105          HD21      ASN 105  22.747   9.299   2.017
  Start of MODEL   23
16267   HD22  ASN 105          HD22      ASN 105  21.125   9.510   1.484
  Start of MODEL   23
16268    H    ASN 105           HN       ASN 105  21.672   5.852   3.251
  Start of MODEL   23
16269    HA   PRO 106           HA       PRO 106  26.523   3.315   1.599
  Start of MODEL   23
16270    HB3  PRO 106           HB2      PRO 106  26.075   1.391   0.454
  Start of MODEL   23
16271    HB2  PRO 106           HB3      PRO 106  26.749   2.236  -0.931
  Start of MODEL   23
16272    HG2  PRO 106           HG2      PRO 106  24.716   2.272  -1.911
  Start of MODEL   23
16273    HG3  PRO 106           HG3      PRO 106  24.018   1.458  -0.505
  Start of MODEL   23
16274    HD2  PRO 106           HD2      PRO 106  23.974   4.309  -1.235
  Start of MODEL   23
16275    HD3  PRO 106           HD3      PRO 106  22.933   3.388  -0.128
  Start of MODEL   23
16276    HA   PHE 107           HA       PHE 107  28.891   5.977  -0.884
  Start of MODEL   23
16277    HB3  PHE 107           HB2      PHE 107  31.284   5.133  -1.206
  Start of MODEL   23
16278    HB2  PHE 107           HB3      PHE 107  30.734   3.642  -0.430
  Start of MODEL   23
16279    HD1  PHE 107           HD1      PHE 107  31.281   7.254   0.144
  Start of MODEL   23
16280    HD2  PHE 107           HD2      PHE 107  30.487   3.456   1.877
  Start of MODEL   23
16281    HE1  PHE 107           HE1      PHE 107  31.738   8.178   2.370
  Start of MODEL   23
16282    HE2  PHE 107           HE2      PHE 107  30.941   4.376   4.110
  Start of MODEL   23
16283    HZ   PHE 107           HZ       PHE 107  31.521   6.805   4.340
  Start of MODEL   23
16284    H    PHE 107           HN       PHE 107  28.539   3.342   0.207
  Start of MODEL   24
16285    H1   ASP   1           H        ASP   1 -30.391  -4.769  -5.141
  Start of MODEL   24
16286    H2   ASP   1           H2       ASP   1 -32.013  -5.074  -5.497
  Start of MODEL   24
16287    H3   ASP   1           H3       ASP   1 -31.578  -3.698  -4.603
  Start of MODEL   24
16288    HA   ASP   1           HA       ASP   1 -30.784  -4.285  -7.387
  Start of MODEL   24
16289    HB3  ASP   1           HB2      ASP   1 -32.148  -2.172  -7.883
  Start of MODEL   24
16290    HB2  ASP   1           HB3      ASP   1 -32.876  -2.418  -6.298
  Start of MODEL   24
16291    HA   ASP   2           HA       ASP   2 -28.565  -0.525  -6.214
  Start of MODEL   24
16292    HB3  ASP   2           HB2      ASP   2 -30.066   0.475  -3.767
  Start of MODEL   24
16293    HB2  ASP   2           HB3      ASP   2 -30.518   0.949  -5.398
  Start of MODEL   24
16294    H    ASP   2           HN       ASP   2 -31.006  -1.580  -5.057
  Start of MODEL   24
16295    HA   ASP   3           HA       ASP   3 -27.299  -3.205  -2.909
  Start of MODEL   24
16296    HB3  ASP   3           HB2      ASP   3 -25.866  -5.166  -3.808
  Start of MODEL   24
16297    HB2  ASP   3           HB3      ASP   3 -26.497  -4.679  -5.382
  Start of MODEL   24
16298    H    ASP   3           HN       ASP   3 -27.560  -2.571  -5.669
  Start of MODEL   24
16299    HA   ASP   4           HA       ASP   4 -23.543  -1.335  -2.404
  Start of MODEL   24
16300    HB3  ASP   4           HB2      ASP   4 -24.838   1.130  -3.601
  Start of MODEL   24
16301    HB2  ASP   4           HB3      ASP   4 -24.020  -0.078  -4.581
  Start of MODEL   24
16302    H    ASP   4           HN       ASP   4 -26.395  -1.046  -2.960
  Start of MODEL   24
16303    HA   ASP   5           HA       ASP   5 -26.592   0.566   0.584
  Start of MODEL   24
16304    HB3  ASP   5           HB2      ASP   5 -26.723  -2.323   1.474
  Start of MODEL   24
16305    HB2  ASP   5           HB3      ASP   5 -27.977  -1.473   0.577
  Start of MODEL   24
16306    H    ASP   5           HN       ASP   5 -25.733  -1.781  -0.794
  Start of MODEL   24
16307    HA   VAL   6           HA       VAL   6 -23.465  -0.532   3.628
  Start of MODEL   24
16308    HB   VAL   6           HB       VAL   6 -21.748  -2.373   3.921
  Start of MODEL   24
16309    H    VAL   6           HN       VAL   6 -24.357  -2.069   1.410
  Start of MODEL   24
16310    HA   SER   7           HA       SER   7 -20.334   1.131   1.225
  Start of MODEL   24
16311    HB3  SER   7           HB2      SER   7 -21.976   3.516   2.140
  Start of MODEL   24
16312    HB2  SER   7           HB3      SER   7 -22.163   2.678   0.599
  Start of MODEL   24
16313    HG   SER   7           HG       SER   7 -20.910   4.611   0.565
  Start of MODEL   24
16314    H    SER   7           HN       SER   7 -22.554   1.230   3.110
  Start of MODEL   24
16315    HA   PHE   8           HA       PHE   8 -18.301   1.970   5.031
  Start of MODEL   24
16316    HB3  PHE   8           HB2      PHE   8 -16.284   0.484   5.185
  Start of MODEL   24
16317    HB2  PHE   8           HB3      PHE   8 -16.713  -0.209   3.630
  Start of MODEL   24
16318    HD1  PHE   8           HD1      PHE   8 -18.569  -1.749   3.393
  Start of MODEL   24
16319    HD2  PHE   8           HD2      PHE   8 -17.540  -0.098   7.173
  Start of MODEL   24
16320    HE1  PHE   8           HE1      PHE   8 -19.933  -3.461   4.500
  Start of MODEL   24
16321    HE2  PHE   8           HE2      PHE   8 -18.915  -1.810   8.289
  Start of MODEL   24
16322    HZ   PHE   8           HZ       PHE   8 -20.107  -3.494   6.953
  Start of MODEL   24
16323    H    PHE   8           HN       PHE   8 -18.746   0.560   2.531
  Start of MODEL   24
16324    HA   CYS   9           HA       CYS   9 -15.837   4.703   2.736
  Start of MODEL   24
16325    HB3  CYS   9           HB2      CYS   9 -15.237   6.603   4.161
  Start of MODEL   24
16326    HB2  CYS   9           HB3      CYS   9 -15.599   5.654   5.607
  Start of MODEL   24
16327    H    CYS   9           HN       CYS   9 -16.837   3.587   5.200
  Start of MODEL   24
16328    HA   ALA  10           HA       ALA  10 -11.987   3.151   3.328
  Start of MODEL   24
16329    HB3  ALA  10           HB1      ALA  10 -11.689   4.508   1.312
  Start of MODEL   24
16330    HB2  ALA  10           HB2      ALA  10 -10.168   4.277   2.185
  Start of MODEL   24
16331    HB1  ALA  10           HB3      ALA  10 -11.021   5.811   2.300
  Start of MODEL   24
16332    H    ALA  10           HN       ALA  10 -13.359   5.713   3.243
  Start of MODEL   24
16333    HA   SER  11           HA       SER  11  -9.551   4.616   6.545
  Start of MODEL   24
16334    HB3  SER  11           HB2      SER  11  -9.881   3.163   8.482
  Start of MODEL   24
16335    HB2  SER  11           HB3      SER  11 -10.654   1.946   7.456
  Start of MODEL   24
16336    HG   SER  11           HG       SER  11 -11.966   4.007   6.909
  Start of MODEL   24
16337    H    SER  11           HN       SER  11 -10.901   2.594   4.945
  Start of MODEL   24
16338    HA   VAL  12           HA       VAL  12  -6.359   1.890   5.347
  Start of MODEL   24
16339    HB   VAL  12           HB       VAL  12  -5.201   4.697   5.493
  Start of MODEL   24
16340    H    VAL  12           HN       VAL  12  -7.383   4.246   6.754
  Start of MODEL   24
16341    HA   GLN  13           HA       GLN  13  -3.973   1.610   8.927
  Start of MODEL   24
16342    HB3  GLN  13           HB2      GLN  13  -4.357  -0.570  10.050
  Start of MODEL   24
16343    HB2  GLN  13           HB3      GLN  13  -5.342  -1.078   8.684
  Start of MODEL   24
16344    HG2  GLN  13           HG2      GLN  13  -5.931   1.288  10.446
  Start of MODEL   24
16345    HG3  GLN  13           HG3      GLN  13  -6.949   0.675   9.148
  Start of MODEL   24
16346   HE21  GLN  13          HE21      GLN  13  -8.135  -1.206   9.502
  Start of MODEL   24
16347   HE22  GLN  13          HE22      GLN  13  -8.377  -1.851  11.072
  Start of MODEL   24
16348    H    GLN  13           HN       GLN  13  -5.446   0.513   6.676
  Start of MODEL   24
16349    HA   LEU  14           HA       LEU  14  -0.854  -0.444   6.768
  Start of MODEL   24
16350    HB3  LEU  14           HB2      LEU  14   1.286   0.994   7.059
  Start of MODEL   24
16351    HB2  LEU  14           HB3      LEU  14   0.210   2.176   7.786
  Start of MODEL   24
16352    HG   LEU  14           HG       LEU  14  -1.150   2.073   5.626
  Start of MODEL   24
16353   HD12  LEU  14          HD11      LEU  14   0.411   3.446   4.358
  Start of MODEL   24
16354   HD11  LEU  14          HD12      LEU  14   1.726   2.951   5.432
  Start of MODEL   24
16355   HD13  LEU  14          HD13      LEU  14   0.386   3.921   6.057
  Start of MODEL   24
16356   HD23  LEU  14          HD21      LEU  14   1.309   0.628   4.713
  Start of MODEL   24
16357   HD22  LEU  14          HD22      LEU  14   0.007   1.220   3.682
  Start of MODEL   24
16358   HD21  LEU  14          HD23      LEU  14  -0.310  -0.063   4.854
  Start of MODEL   24
16359    H    LEU  14           HN       LEU  14  -1.904   1.498   8.634
  Start of MODEL   24
16360    HA   HIS  15           HA       HIS  15   1.325  -2.200  10.106
  Start of MODEL   24
16361    HB3  HIS  15           HB2      HIS  15   1.786  -4.556   9.231
  Start of MODEL   24
16362    HB2  HIS  15           HB3      HIS  15   1.172  -4.003   7.688
  Start of MODEL   24
16363    HD1  HIS  15           HD1      HIS  15   0.081  -5.569  10.745
  Start of MODEL   24
16364    HD2  HIS  15           HD2      HIS  15  -1.661  -3.137   7.851
  Start of MODEL   24
16365    HE1  HIS  15           HE1      HIS  15  -2.393  -5.829  11.040
  Start of MODEL   24
16366    HE2  HIS  15           HE2      HIS  15  -3.416  -4.219   9.424
  Start of MODEL   24
16367    H    HIS  15           HN       HIS  15   1.177  -1.482   7.270
  Start of MODEL   24
16368    HA   THR  16           HA       THR  16   5.467  -1.379   9.716
  Start of MODEL   24
16369    HB   THR  16           HB       THR  16   5.566  -3.776  11.544
  Start of MODEL   24
16370    HG1  THR  16           HG1      THR  16   4.479  -1.193  11.846
  Start of MODEL   24
16371   HG22  THR  16          HG21      THR  16   7.406  -2.513  12.589
  Start of MODEL   24
16372   HG21  THR  16          HG22      THR  16   7.157  -1.195  11.446
  Start of MODEL   24
16373   HG23  THR  16          HG23      THR  16   7.735  -2.757  10.871
  Start of MODEL   24
16374    H    THR  16           HN       THR  16   3.328  -2.750  10.760
  Start of MODEL   24
16375    HA   ALA  17           HA       ALA  17   6.674  -4.014   6.528
  Start of MODEL   24
16376    HB1  ALA  17           HB1      ALA  17   7.579  -1.730   6.050
  Start of MODEL   24
16377    HB3  ALA  17           HB2      ALA  17   8.447  -3.066   5.338
  Start of MODEL   24
16378    HB2  ALA  17           HB3      ALA  17   9.101  -2.251   6.782
  Start of MODEL   24
16379    H    ALA  17           HN       ALA  17   7.070  -1.905   8.374
  Start of MODEL   24
16380    HA   VAL  18           HA       VAL  18   9.261  -6.658   8.651
  Start of MODEL   24
16381    HB   VAL  18           HB       VAL  18   9.154  -8.998   7.738
  Start of MODEL   24
16382    H    VAL  18           HN       VAL  18   7.862  -5.843   6.253
  Start of MODEL   24
16383    HA   GLU  19           HA       GLU  19  13.086  -6.533   6.666
  Start of MODEL   24
16384    HB3  GLU  19           HB2      GLU  19  13.447  -6.838   9.654
  Start of MODEL   24
16385    HB2  GLU  19           HB3      GLU  19  13.683  -5.397   8.692
  Start of MODEL   24
16386    HG2  GLU  19           HG2      GLU  19  15.816  -6.272   9.466
  Start of MODEL   24
16387    HG3  GLU  19           HG3      GLU  19  15.474  -7.822   8.718
  Start of MODEL   24
16388    H    GLU  19           HN       GLU  19  11.271  -6.949   8.875
  Start of MODEL   24
16389    HA   MET  20           HA       MET  20  14.273 -10.517   6.231
  Start of MODEL   24
16390    HB3  MET  20           HB2      MET  20  12.143 -11.350   7.033
  Start of MODEL   24
16391    HB2  MET  20           HB3      MET  20  12.598 -12.266   5.626
  Start of MODEL   24
16392    HG2  MET  20           HG2      MET  20  10.156 -11.662   5.897
  Start of MODEL   24
16393    HG3  MET  20           HG3      MET  20  10.626 -10.027   5.456
  Start of MODEL   24
16394    HE2  MET  20           HE1      MET  20   8.700 -11.556   2.371
  Start of MODEL   24
16395    HE1  MET  20           HE2      MET  20   8.673 -10.332   3.643
  Start of MODEL   24
16396    HE3  MET  20           HE3      MET  20   8.453 -12.032   4.053
  Start of MODEL   24
16397    H    MET  20           HN       MET  20  12.705  -8.298   5.477
  Start of MODEL   24
16398    HA   HIS  21           HA       HIS  21  15.613 -10.986   2.305
  Start of MODEL   24
16399    HB3  HIS  21           HB2      HIS  21  14.896 -12.583   0.487
  Start of MODEL   24
16400    HB2  HIS  21           HB3      HIS  21  13.546 -13.024   1.525
  Start of MODEL   24
16401    HD1  HIS  21           HD1      HIS  21  14.763 -15.430   1.305
  Start of MODEL   24
16402    HD2  HIS  21           HD2      HIS  21  16.691 -12.589   3.623
  Start of MODEL   24
16403    HE1  HIS  21           HE1      HIS  21  16.372 -16.713   2.737
  Start of MODEL   24
16404    HE2  HIS  21           HE2      HIS  21  17.146 -14.993   4.389
  Start of MODEL   24
16405    H    HIS  21           HN       HIS  21  13.661 -12.110   3.903
  Start of MODEL   24
16406    HA   HIS  22           HA       HIS  22  12.862  -8.281   0.205
  Start of MODEL   24
16407    HB3  HIS  22           HB2      HIS  22  12.066  -9.956  -1.383
  Start of MODEL   24
16408    HB2  HIS  22           HB3      HIS  22  10.881  -8.669  -1.257
  Start of MODEL   24
16409    HD1  HIS  22           HD1      HIS  22  11.332 -12.306  -0.654
  Start of MODEL   24
16410    HD2  HIS  22           HD2      HIS  22   8.384  -9.418  -0.158
  Start of MODEL   24
16411    HE1  HIS  22           HE1      HIS  22   9.249 -13.560  -0.216
  Start of MODEL   24
16412    HE2  HIS  22           HE2      HIS  22   7.475 -11.855   0.133
  Start of MODEL   24
16413    H    HIS  22           HN       HIS  22  12.177 -10.510   1.931
  Start of MODEL   24
16414    HA   TRP  23           HA       TRP  23  10.470  -6.487   3.167
  Start of MODEL   24
16415    HB3  TRP  23           HB2      TRP  23  10.216  -4.016   2.720
  Start of MODEL   24
16416    HB2  TRP  23           HB3      TRP  23  10.987  -4.347   1.166
  Start of MODEL   24
16417    HD1  TRP  23           HD1      TRP  23  13.542  -5.163   1.223
  Start of MODEL   24
16418    HE1  TRP  23           HE1      TRP  23  15.420  -4.704   2.957
  Start of MODEL   24
16419    HE3  TRP  23           HE3      TRP  23  10.690  -3.578   5.083
  Start of MODEL   24
16420    HZ2  TRP  23           HZ2      TRP  23  15.627  -3.734   5.584
  Start of MODEL   24
16421    HZ3  TRP  23           HZ3      TRP  23  11.775  -2.872   7.185
  Start of MODEL   24
16422    HH2  TRP  23           HH2      TRP  23  14.197  -2.956   7.424
  Start of MODEL   24
16423    H    TRP  23           HN       TRP  23  11.625  -6.469   0.542
  Start of MODEL   24
16424    HA   CYS  24           HA       CYS  24   6.510  -6.087   1.525
  Start of MODEL   24
16425    HB3  CYS  24           HB2      CYS  24   6.363  -8.079   3.807
  Start of MODEL   24
16426    HB2  CYS  24           HB3      CYS  24   6.693  -8.494   2.132
  Start of MODEL   24
16427    H    CYS  24           HN       CYS  24   8.484  -6.570   3.617
  Start of MODEL   24
16428    HA   ILE  25           HA       ILE  25   4.971  -3.596   4.786
  Start of MODEL   24
16429    HB   ILE  25           HB       ILE  25   4.506  -1.967   2.270
  Start of MODEL   24
16430   HD11  ILE  25          HD11      ILE  25   6.321   0.373   3.322
  Start of MODEL   24
16431   HD13  ILE  25          HD12      ILE  25   6.421  -0.275   1.683
  Start of MODEL   24
16432   HD12  ILE  25          HD13      ILE  25   7.854  -0.248   2.706
  Start of MODEL   24
16433    H    ILE  25           HN       ILE  25   5.365  -4.381   1.985
  Start of MODEL   24
16434    HA   PRO  26           HA       PRO  26   0.998  -5.439   3.502
  Start of MODEL   24
16435    HB3  PRO  26           HB2      PRO  26   0.663  -6.981   5.134
  Start of MODEL   24
16436    HB2  PRO  26           HB3      PRO  26   0.463  -5.717   6.348
  Start of MODEL   24
16437    HG2  PRO  26           HG2      PRO  26   2.472  -6.528   7.108
  Start of MODEL   24
16438    HG3  PRO  26           HG3      PRO  26   2.909  -7.184   5.520
  Start of MODEL   24
16439    HD2  PRO  26           HD2      PRO  26   3.193  -4.395   6.561
  Start of MODEL   24
16440    HD3  PRO  26           HD3      PRO  26   4.302  -5.358   5.555
  Start of MODEL   24
16441    HA   PHE  27           HA       PHE  27  -1.417  -2.187   5.006
  Start of MODEL   24
16442    HB3  PHE  27           HB2      PHE  27  -0.535  -1.107   3.003
  Start of MODEL   24
16443    HB2  PHE  27           HB3      PHE  27  -2.243  -0.768   3.186
  Start of MODEL   24
16444    HD1  PHE  27           HD1      PHE  27  -3.892  -1.787   1.680
  Start of MODEL   24
16445    HD2  PHE  27           HD2      PHE  27   0.288  -2.244   1.084
  Start of MODEL   24
16446    HE1  PHE  27           HE1      PHE  27  -4.305  -2.466  -0.648
  Start of MODEL   24
16447    HE2  PHE  27           HE2      PHE  27  -0.112  -2.923  -1.242
  Start of MODEL   24
16448    HZ   PHE  27           HZ       PHE  27  -2.414  -3.036  -2.112
  Start of MODEL   24
16449    H    PHE  27           HN       PHE  27  -0.711  -4.258   3.085
  Start of MODEL   24
16450    HA   SER  28           HA       SER  28  -5.393  -3.699   4.137
  Start of MODEL   24
16451    HB3  SER  28           HB2      SER  28  -6.404  -4.165   6.313
  Start of MODEL   24
16452    HB2  SER  28           HB3      SER  28  -5.217  -3.113   7.101
  Start of MODEL   24
16453    HG   SER  28           HG       SER  28  -3.979  -4.859   5.517
  Start of MODEL   24
16454    H    SER  28           HN       SER  28  -3.552  -1.874   5.423
  Start of MODEL   24
16455    HA   VAL  29           HA       VAL  29  -7.505   0.058   4.310
  Start of MODEL   24
16456    HB   VAL  29           HB       VAL  29  -6.259   0.749   2.323
  Start of MODEL   24
16457    H    VAL  29           HN       VAL  29  -6.593  -2.391   3.040
  Start of MODEL   24
16458    HA   ASP  30           HA       ASP  30 -11.200  -2.001   3.790
  Start of MODEL   24
16459    HB3  ASP  30           HB2      ASP  30 -10.859  -2.557   6.117
  Start of MODEL   24
16460    HB2  ASP  30           HB3      ASP  30 -12.511  -2.012   5.898
  Start of MODEL   24
16461    H    ASP  30           HN       ASP  30  -9.393  -0.114   5.059
  Start of MODEL   24
16462    HA2  GLY  31           HA2      GLY  31 -14.703   0.604   3.383
  Start of MODEL   24
16463    H    GLY  31           HN       GLY  31 -13.103  -1.513   3.102
  Start of MODEL   24
16464    HA3  GLY  31           HA1      GLY  31 -13.450   1.201   2.293
  Start of MODEL   24
16465    HA   GLN  32           HA       GLN  32 -15.980  -1.751   0.076
  Start of MODEL   24
16466    HB3  GLN  32           HB2      GLN  32 -18.505  -0.219   0.771
  Start of MODEL   24
16467    HB2  GLN  32           HB3      GLN  32 -17.944  -1.703   1.515
  Start of MODEL   24
16468    HG2  GLN  32           HG2      GLN  32 -18.215  -2.824  -0.720
  Start of MODEL   24
16469    HG3  GLN  32           HG3      GLN  32 -19.680  -2.372   0.138
  Start of MODEL   24
16470   HE21  GLN  32          HE21      GLN  32 -20.773  -0.576  -0.587
  Start of MODEL   24
16471   HE22  GLN  32          HE22      GLN  32 -20.746  -0.067  -2.248
  Start of MODEL   24
16472    H    GLN  32           HN       GLN  32 -16.265   0.602   1.743
  Start of MODEL   24
16473    HA   PRO  33           HA       PRO  33 -16.944   1.592  -3.319
  Start of MODEL   24
16474    HB3  PRO  33           HB2      PRO  33 -17.832   3.646  -2.746
  Start of MODEL   24
16475    HB2  PRO  33           HB3      PRO  33 -16.187   4.130  -2.334
  Start of MODEL   24
16476    HG2  PRO  33           HG2      PRO  33 -16.492   3.742  -0.092
  Start of MODEL   24
16477    HG3  PRO  33           HG3      PRO  33 -18.186   4.050  -0.513
  Start of MODEL   24
16478    HD2  PRO  33           HD2      PRO  33 -17.441   1.778   0.680
  Start of MODEL   24
16479    HD3  PRO  33           HD3      PRO  33 -18.711   1.791  -0.560
  Start of MODEL   24
16480    HA   ALA  34           HA       ALA  34 -12.805   0.569  -3.149
  Start of MODEL   24
16481    HB3  ALA  34           HB1      ALA  34 -12.073  -0.008  -5.378
  Start of MODEL   24
16482    HB2  ALA  34           HB2      ALA  34 -13.439   0.910  -6.054
  Start of MODEL   24
16483    HB1  ALA  34           HB3      ALA  34 -13.742  -0.520  -5.076
  Start of MODEL   24
16484    H    ALA  34           HN       ALA  34 -15.222   1.233  -4.376
  Start of MODEL   24
16485    HA   PRO  35           HA       PRO  35 -11.025   4.659  -3.396
  Start of MODEL   24
16486    HB3  PRO  35           HB2      PRO  35 -10.773   4.425  -1.098
  Start of MODEL   24
16487    HB2  PRO  35           HB3      PRO  35  -9.092   4.300  -1.624
  Start of MODEL   24
16488    HG2  PRO  35           HG2      PRO  35  -9.059   2.004  -1.416
  Start of MODEL   24
16489    HG3  PRO  35           HG3      PRO  35 -10.217   2.381  -0.137
  Start of MODEL   24
16490    HD2  PRO  35           HD2      PRO  35 -10.750   0.740  -2.306
  Start of MODEL   24
16491    HD3  PRO  35           HD3      PRO  35 -11.993   1.587  -1.360
  Start of MODEL   24
16492    HA   SER  36           HA       SER  36  -7.544   3.713  -5.868
  Start of MODEL   24
16493    HB3  SER  36           HB2      SER  36  -6.731   5.815  -6.906
  Start of MODEL   24
16494    HB2  SER  36           HB3      SER  36  -7.695   6.745  -5.760
  Start of MODEL   24
16495    HG   SER  36           HG       SER  36  -9.520   5.395  -6.690
  Start of MODEL   24
16496    H    SER  36           HN       SER  36  -9.282   5.503  -4.421
  Start of MODEL   24
16497    HA   LEU  37           HA       LEU  37  -4.654   4.345  -2.631
  Start of MODEL   24
16498    HB3  LEU  37           HB2      LEU  37  -3.131   2.367  -2.574
  Start of MODEL   24
16499    HB2  LEU  37           HB3      LEU  37  -3.911   1.799  -4.030
  Start of MODEL   24
16500    HG   LEU  37           HG       LEU  37  -6.045   1.610  -2.807
  Start of MODEL   24
16501   HD12  LEU  37          HD11      LEU  37  -3.744   0.221  -1.455
  Start of MODEL   24
16502   HD11  LEU  37          HD12      LEU  37  -4.387  -0.192  -3.033
  Start of MODEL   24
16503   HD13  LEU  37          HD13      LEU  37  -5.411  -0.360  -1.599
  Start of MODEL   24
16504   HD22  LEU  37          HD21      LEU  37  -5.694   3.309  -1.116
  Start of MODEL   24
16505   HD21  LEU  37          HD22      LEU  37  -4.322   2.417  -0.480
  Start of MODEL   24
16506   HD23  LEU  37          HD23      LEU  37  -5.946   1.754  -0.315
  Start of MODEL   24
16507    H    LEU  37           HN       LEU  37  -5.536   3.195  -5.178
  Start of MODEL   24
16508    HA   ARG  38           HA       ARG  38  -1.017   5.472  -4.642
  Start of MODEL   24
16509    HB3  ARG  38           HB2      ARG  38  -2.317   8.024  -3.669
  Start of MODEL   24
16510    HB2  ARG  38           HB3      ARG  38  -2.436   7.322  -5.267
  Start of MODEL   24
16511    HG2  ARG  38           HG2      ARG  38  -0.907   9.155  -5.384
  Start of MODEL   24
16512    HG3  ARG  38           HG3      ARG  38   0.005   8.552  -4.001
  Start of MODEL   24
16513    HD2  ARG  38           HD2      ARG  38   1.095   8.102  -6.181
  Start of MODEL   24
16514    HD3  ARG  38           HD3      ARG  38   0.773   6.660  -5.246
  Start of MODEL   24
16515    HE   ARG  38           HE       ARG  38  -1.289   7.345  -7.106
  Start of MODEL   24
16516   HH11  ARG  38          HH11      ARG  38   1.835   5.616  -6.801
  Start of MODEL   24
16517   HH12  ARG  38          HH12      ARG  38   1.399   4.411  -7.922
  Start of MODEL   24
16518   HH21  ARG  38          HH21      ARG  38  -1.798   5.659  -8.701
  Start of MODEL   24
16519   HH22  ARG  38          HH22      ARG  38  -0.673   4.421  -8.997
  Start of MODEL   24
16520    H    ARG  38           HN       ARG  38  -3.089   5.688  -2.602
  Start of MODEL   24
16521    HA   TRP  39           HA       TRP  39   1.386   5.818  -1.038
  Start of MODEL   24
16522    HB3  TRP  39           HB2      TRP  39   3.622   4.859  -1.517
  Start of MODEL   24
16523    HB2  TRP  39           HB3      TRP  39   3.154   4.705  -3.205
  Start of MODEL   24
16524    HD1  TRP  39           HD1      TRP  39   1.664   2.692  -3.902
  Start of MODEL   24
16525    HE1  TRP  39           HE1      TRP  39   0.926   0.577  -2.708
  Start of MODEL   24
16526    HE3  TRP  39           HE3      TRP  39   2.926   4.021   0.858
  Start of MODEL   24
16527    HZ2  TRP  39           HZ2      TRP  39   0.859  -0.426  -0.045
  Start of MODEL   24
16528    HZ3  TRP  39           HZ3      TRP  39   2.493   2.425   2.679
  Start of MODEL   24
16529    HH2  TRP  39           HH2      TRP  39   1.484   0.247   2.234
  Start of MODEL   24
16530    H    TRP  39           HN       TRP  39   0.928   5.306  -3.841
  Start of MODEL   24
16531    HA   LEU  40           HA       LEU  40   3.872   9.217  -2.279
  Start of MODEL   24
16532    HB3  LEU  40           HB2      LEU  40   2.599   9.975   0.345
  Start of MODEL   24
16533    HB2  LEU  40           HB3      LEU  40   1.703   9.949  -1.162
  Start of MODEL   24
16534    HG   LEU  40           HG       LEU  40   4.104  11.695  -0.745
  Start of MODEL   24
16535   HD12  LEU  40          HD11      LEU  40   3.151  12.866  -2.666
  Start of MODEL   24
16536   HD11  LEU  40          HD12      LEU  40   1.910  11.603  -2.788
  Start of MODEL   24
16537   HD13  LEU  40          HD13      LEU  40   3.612  11.206  -3.035
  Start of MODEL   24
16538   HD22  LEU  40          HD21      LEU  40   2.503  13.499  -0.402
  Start of MODEL   24
16539   HD21  LEU  40          HD22      LEU  40   2.352  12.274   0.860
  Start of MODEL   24
16540   HD23  LEU  40          HD23      LEU  40   1.176  12.339  -0.454
  Start of MODEL   24
16541    H    LEU  40           HN       LEU  40   2.676   7.379  -0.327
  Start of MODEL   24
16542    HA   PHE  41           HA       PHE  41   7.025   8.454   0.695
  Start of MODEL   24
16543    HB3  PHE  41           HB2      PHE  41   8.363   8.828  -2.008
  Start of MODEL   24
16544    HB2  PHE  41           HB3      PHE  41   8.007   7.319  -1.192
  Start of MODEL   24
16545    HD1  PHE  41           HD1      PHE  41  10.490   9.759  -1.800
  Start of MODEL   24
16546    HD2  PHE  41           HD2      PHE  41   9.177   6.934   1.100
  Start of MODEL   24
16547    HE1  PHE  41           HE1      PHE  41  12.722   9.774  -0.783
  Start of MODEL   24
16548    HE2  PHE  41           HE2      PHE  41  11.410   6.938   2.114
  Start of MODEL   24
16549    HZ   PHE  41           HZ       PHE  41  13.189   8.359   1.179
  Start of MODEL   24
16550    H    PHE  41           HN       PHE  41   5.993   9.493  -1.847
  Start of MODEL   24
16551    HA   ASN  42           HA       ASN  42   7.151  12.114   3.006
  Start of MODEL   24
16552    HB3  ASN  42           HB2      ASN  42   9.468  13.180   2.624
  Start of MODEL   24
16553    HB2  ASN  42           HB3      ASN  42   9.779  11.799   1.575
  Start of MODEL   24
16554   HD21  ASN  42          HD21      ASN  42   9.186  12.823   4.823
  Start of MODEL   24
16555   HD22  ASN  42          HD22      ASN  42   9.705  11.369   5.592
  Start of MODEL   24
16556    H    ASN  42           HN       ASN  42   6.850  10.118   2.020
  Start of MODEL   24
16557    HA2  GLY  43           HA2      GLY  43   4.637  14.287  -0.117
  Start of MODEL   24
16558    H    GLY  43           HN       GLY  43   5.719  12.228   0.570
  Start of MODEL   24
16559    HA3  GLY  43           HA1      GLY  43   6.214  15.061  -0.079
  Start of MODEL   24
16560    HA   SER  44           HA       SER  44   6.793  13.485  -4.190
  Start of MODEL   24
16561    HB3  SER  44           HB2      SER  44   8.709  12.109  -4.758
  Start of MODEL   24
16562    HB2  SER  44           HB3      SER  44   8.704  11.381  -3.149
  Start of MODEL   24
16563    HG   SER  44           HG       SER  44   9.055  14.131  -3.707
  Start of MODEL   24
16564    H    SER  44           HN       SER  44   7.267  12.512  -1.461
  Start of MODEL   24
16565    HA   VAL  45           HA       VAL  45   3.894  10.532  -5.142
  Start of MODEL   24
16566    HB   VAL  45           HB       VAL  45   4.951  11.666  -7.736
  Start of MODEL   24
16567    H    VAL  45           HN       VAL  45   5.875  12.436  -5.740
  Start of MODEL   24
16568    HA   LEU  46           HA       LEU  46   6.606   7.214  -5.867
  Start of MODEL   24
16569    HB3  LEU  46           HB2      LEU  46   4.641   6.097  -3.864
  Start of MODEL   24
16570    HB2  LEU  46           HB3      LEU  46   6.137   6.901  -3.428
  Start of MODEL   24
16571    HG   LEU  46           HG       LEU  46   6.025   4.427  -5.144
  Start of MODEL   24
16572   HD11  LEU  46          HD11      LEU  46   8.275   5.761  -3.673
  Start of MODEL   24
16573   HD13  LEU  46          HD12      LEU  46   8.048   5.667  -5.421
  Start of MODEL   24
16574   HD12  LEU  46          HD13      LEU  46   8.384   4.204  -4.496
  Start of MODEL   24
16575   HD23  LEU  46          HD21      LEU  46   6.396   4.626  -2.158
  Start of MODEL   24
16576   HD22  LEU  46          HD22      LEU  46   6.716   3.182  -3.115
  Start of MODEL   24
16577   HD21  LEU  46          HD23      LEU  46   5.081   3.821  -3.010
  Start of MODEL   24
16578    H    LEU  46           HN       LEU  46   4.361   8.525  -4.618
  Start of MODEL   24
16579    HA   ASN  47           HA       ASN  47   3.686   5.340  -8.369
  Start of MODEL   24
16580    HB3  ASN  47           HB2      ASN  47   4.502   7.084  -9.919
  Start of MODEL   24
16581    HB2  ASN  47           HB3      ASN  47   4.314   5.550 -10.752
  Start of MODEL   24
16582   HD21  ASN  47          HD21      ASN  47   6.602   7.885  -9.585
  Start of MODEL   24
16583   HD22  ASN  47          HD22      ASN  47   7.950   7.278 -10.472
  Start of MODEL   24
16584    H    ASN  47           HN       ASN  47   6.326   6.309  -7.708
  Start of MODEL   24
16585    HA   GLU  48           HA       GLU  48   5.352   1.386  -7.993
  Start of MODEL   24
16586    HB3  GLU  48           HB2      GLU  48   3.888  -0.324  -8.938
  Start of MODEL   24
16587    HB2  GLU  48           HB3      GLU  48   3.099   0.871  -9.951
  Start of MODEL   24
16588    HG2  GLU  48           HG2      GLU  48   1.960   0.044  -7.754
  Start of MODEL   24
16589    HG3  GLU  48           HG3      GLU  48   3.050   1.182  -6.977
  Start of MODEL   24
16590    H    GLU  48           HN       GLU  48   3.526   3.205  -9.054
  Start of MODEL   24
16591    HA   THR  49           HA       THR  49   7.677   1.125 -11.708
  Start of MODEL   24
16592    HB   THR  49           HB       THR  49  10.121   1.193 -11.134
  Start of MODEL   24
16593    HG1  THR  49           HG1      THR  49  10.555   1.713  -8.866
  Start of MODEL   24
16594   HG21  THR  49          HG21      THR  49   8.457   3.301  -9.744
  Start of MODEL   24
16595   HG23  THR  49          HG22      THR  49   8.891   3.293 -11.453
  Start of MODEL   24
16596   HG22  THR  49          HG23      THR  49  10.145   3.478 -10.227
  Start of MODEL   24
16597    H    THR  49           HN       THR  49   7.283   1.022  -8.823
  Start of MODEL   24
16598    HA   SER  50           HA       SER  50   8.794  -3.127 -11.664
  Start of MODEL   24
16599    HB3  SER  50           HB2      SER  50  11.499  -2.183 -12.661
  Start of MODEL   24
16600    HB2  SER  50           HB3      SER  50  10.062  -2.364 -13.660
  Start of MODEL   24
16601    HG   SER  50           HG       SER  50  10.580  -4.659 -12.325
  Start of MODEL   24
16602    H    SER  50           HN       SER  50   9.895  -0.492 -11.948
  Start of MODEL   24
16603    HA   PHE  51           HA       PHE  51  11.998  -3.169  -8.329
  Start of MODEL   24
16604    HB3  PHE  51           HB2      PHE  51  13.348  -1.388  -7.321
  Start of MODEL   24
16605    HB2  PHE  51           HB3      PHE  51  12.361  -0.168  -8.122
  Start of MODEL   24
16606    HD1  PHE  51           HD1      PHE  51  14.862  -2.824  -8.656
  Start of MODEL   24
16607    HD2  PHE  51           HD2      PHE  51  12.709   0.394 -10.415
  Start of MODEL   24
16608    HE1  PHE  51           HE1      PHE  51  16.371  -2.870 -10.606
  Start of MODEL   24
16609    HE2  PHE  51           HE2      PHE  51  14.205   0.344 -12.356
  Start of MODEL   24
16610    HZ   PHE  51           HZ       PHE  51  16.012  -1.338 -12.470
  Start of MODEL   24
16611    H    PHE  51           HN       PHE  51  10.580  -1.025  -9.740
  Start of MODEL   24
16612    HA   ILE  52           HA       ILE  52   9.067  -1.528  -5.183
  Start of MODEL   24
16613    HB   ILE  52           HB       ILE  52   8.661   1.255  -6.343
  Start of MODEL   24
16614   HD13  ILE  52          HD11      ILE  52  10.363   3.046  -5.629
  Start of MODEL   24
16615   HD12  ILE  52          HD12      ILE  52  11.666   2.589  -4.535
  Start of MODEL   24
16616   HD11  ILE  52          HD13      ILE  52  10.009   2.690  -3.939
  Start of MODEL   24
16617    H    ILE  52           HN       ILE  52   9.717  -0.524  -7.881
  Start of MODEL   24
16618    HA   PHE  53           HA       PHE  53   5.169  -1.573  -7.242
  Start of MODEL   24
16619    HB3  PHE  53           HB2      PHE  53   5.987  -4.480  -7.341
  Start of MODEL   24
16620    HB2  PHE  53           HB3      PHE  53   6.479  -3.255  -8.505
  Start of MODEL   24
16621    HD1  PHE  53           HD1      PHE  53   4.586  -2.003  -9.725
  Start of MODEL   24
16622    HD2  PHE  53           HD2      PHE  53   4.086  -5.706  -7.722
  Start of MODEL   24
16623    HE1  PHE  53           HE1      PHE  53   2.598  -2.446 -11.059
  Start of MODEL   24
16624    HE2  PHE  53           HE2      PHE  53   2.089  -6.176  -9.063
  Start of MODEL   24
16625    HZ   PHE  53           HZ       PHE  53   1.300  -4.479 -10.714
  Start of MODEL   24
16626    H    PHE  53           HN       PHE  53   7.155  -2.766  -5.464
  Start of MODEL   24
16627    HA   THR  54           HA       THR  54   2.521  -2.749  -3.974
  Start of MODEL   24
16628    HB   THR  54           HB       THR  54   0.637  -1.571  -6.046
  Start of MODEL   24
16629    HG1  THR  54           HG1      THR  54   1.126   0.400  -5.180
  Start of MODEL   24
16630   HG23  THR  54          HG21      THR  54  -0.470  -2.731  -4.176
  Start of MODEL   24
16631   HG22  THR  54          HG22      THR  54  -0.734  -0.991  -4.092
  Start of MODEL   24
16632   HG21  THR  54          HG23      THR  54   0.449  -1.754  -3.029
  Start of MODEL   24
16633    H    THR  54           HN       THR  54   3.100  -1.737  -6.590
  Start of MODEL   24
16634    HA   GLU  55           HA       GLU  55   0.917  -6.417  -5.854
  Start of MODEL   24
16635    HB3  GLU  55           HB2      GLU  55   1.790  -8.373  -4.482
  Start of MODEL   24
16636    HB2  GLU  55           HB3      GLU  55   2.671  -7.187  -3.531
  Start of MODEL   24
16637    HG2  GLU  55           HG2      GLU  55   3.687  -6.405  -5.714
  Start of MODEL   24
16638    HG3  GLU  55           HG3      GLU  55   4.201  -7.979  -5.104
  Start of MODEL   24
16639    H    GLU  55           HN       GLU  55   2.161  -4.877  -3.708
  Start of MODEL   24
16640    HA   PHE  56           HA       PHE  56  -2.460  -6.458  -3.056
  Start of MODEL   24
16641    HB3  PHE  56           HB2      PHE  56  -4.557  -6.677  -4.407
  Start of MODEL   24
16642    HB2  PHE  56           HB3      PHE  56  -3.564  -6.834  -5.849
  Start of MODEL   24
16643    HD1  PHE  56           HD1      PHE  56  -4.755  -4.522  -3.264
  Start of MODEL   24
16644    HD2  PHE  56           HD2      PHE  56  -2.416  -4.970  -6.780
  Start of MODEL   24
16645    HE1  PHE  56           HE1      PHE  56  -4.701  -2.073  -3.535
  Start of MODEL   24
16646    HE2  PHE  56           HE2      PHE  56  -2.347  -2.550  -7.056
  Start of MODEL   24
16647    HZ   PHE  56           HZ       PHE  56  -3.533  -1.066  -5.341
  Start of MODEL   24
16648    H    PHE  56           HN       PHE  56  -1.161  -6.634  -5.632
  Start of MODEL   24
16649    HA   LEU  57           HA       LEU  57  -3.057 -10.771  -3.244
  Start of MODEL   24
16650    HB3  LEU  57           HB2      LEU  57  -1.566 -10.345  -1.306
  Start of MODEL   24
16651    HB2  LEU  57           HB3      LEU  57  -2.636 -11.695  -1.034
  Start of MODEL   24
16652    HG   LEU  57           HG       LEU  57  -3.378  -9.042   0.087
  Start of MODEL   24
16653   HD13  LEU  57          HD11      LEU  57  -4.984 -10.855   0.165
  Start of MODEL   24
16654   HD12  LEU  57          HD12      LEU  57  -4.423 -10.440   1.788
  Start of MODEL   24
16655   HD11  LEU  57          HD13      LEU  57  -3.805 -11.881   0.971
  Start of MODEL   24
16656   HD23  LEU  57          HD21      LEU  57  -1.440 -10.987   1.310
  Start of MODEL   24
16657   HD22  LEU  57          HD22      LEU  57  -2.160  -9.596   2.125
  Start of MODEL   24
16658   HD21  LEU  57          HD23      LEU  57  -1.064  -9.350   0.764
  Start of MODEL   24
16659    H    LEU  57           HN       LEU  57  -3.574  -8.162  -2.047
  Start of MODEL   24
16660    HA   GLU  58           HA       GLU  58  -7.228 -11.346  -2.914
  Start of MODEL   24
16661    HB3  GLU  58           HB2      GLU  58  -7.872 -13.803  -2.765
  Start of MODEL   24
16662    HB2  GLU  58           HB3      GLU  58  -6.141 -14.087  -2.601
  Start of MODEL   24
16663    HG2  GLU  58           HG2      GLU  58  -5.779 -12.947  -4.754
  Start of MODEL   24
16664    HG3  GLU  58           HG3      GLU  58  -6.812 -14.370  -4.911
  Start of MODEL   24
16665    H    GLU  58           HN       GLU  58  -4.629 -12.415  -2.496
  Start of MODEL   24
16666    HA   PRO  59           HA       PRO  59  -8.393 -11.380   1.425
  Start of MODEL   24
16667    HB3  PRO  59           HB2      PRO  59  -8.893  -9.128   0.954
  Start of MODEL   24
16668    HB2  PRO  59           HB3      PRO  59 -10.519  -9.795   1.145
  Start of MODEL   24
16669    HG2  PRO  59           HG2      PRO  59 -10.874  -9.894  -1.142
  Start of MODEL   24
16670    HG3  PRO  59           HG3      PRO  59  -9.819  -8.473  -1.069
  Start of MODEL   24
16671    HD2  PRO  59           HD2      PRO  59  -9.286 -10.778  -2.513
  Start of MODEL   24
16672    HD3  PRO  59           HD3      PRO  59  -8.063  -9.597  -1.988
  Start of MODEL   24
16673    HA   ALA  60           HA       ALA  60 -11.642 -14.246   1.027
  Start of MODEL   24
16674    HB2  ALA  60           HB1      ALA  60 -12.897 -14.620   3.127
  Start of MODEL   24
16675    HB1  ALA  60           HB2      ALA  60 -12.247 -13.108   3.768
  Start of MODEL   24
16676    HB3  ALA  60           HB3      ALA  60 -11.168 -14.456   3.422
  Start of MODEL   24
16677    H    ALA  60           HN       ALA  60 -10.519 -12.025   2.468
  Start of MODEL   24
16678    HA   ALA  61           HA       ALA  61 -14.636 -12.188  -1.050
  Start of MODEL   24
16679    HB1  ALA  61           HB1      ALA  61 -15.101 -14.514  -1.623
  Start of MODEL   24
16680    HB3  ALA  61           HB2      ALA  61 -16.531 -13.484  -1.715
  Start of MODEL   24
16681    HB2  ALA  61           HB3      ALA  61 -16.312 -14.574  -0.343
  Start of MODEL   24
16682    H    ALA  61           HN       ALA  61 -13.776 -14.366   0.389
  Start of MODEL   24
16683    HA   ASN  62           HA       ASN  62 -17.787 -11.004   1.947
  Start of MODEL   24
16684    HB3  ASN  62           HB2      ASN  62 -16.960 -12.533   4.446
  Start of MODEL   24
16685    HB2  ASN  62           HB3      ASN  62 -18.163 -13.080   3.291
  Start of MODEL   24
16686   HD21  ASN  62          HD21      ASN  62 -20.167 -12.061   3.201
  Start of MODEL   24
16687   HD22  ASN  62          HD22      ASN  62 -20.736 -11.080   4.492
  Start of MODEL   24
16688    H    ASN  62           HN       ASN  62 -15.534 -12.843   2.242
  Start of MODEL   24
16689    HA   GLU  63           HA       GLU  63 -14.627  -8.676   4.513
  Start of MODEL   24
16690    HB3  GLU  63           HB2      GLU  63 -12.240  -8.301   3.911
  Start of MODEL   24
16691    HB2  GLU  63           HB3      GLU  63 -12.376  -9.565   2.707
  Start of MODEL   24
16692    HG2  GLU  63           HG2      GLU  63 -12.700  -9.967   5.655
  Start of MODEL   24
16693    HG3  GLU  63           HG3      GLU  63 -12.759 -11.218   4.408
  Start of MODEL   24
16694    H    GLU  63           HN       GLU  63 -14.518 -10.803   2.598
  Start of MODEL   24
16695    HA   THR  64           HA       THR  64 -14.860  -5.665   1.357
  Start of MODEL   24
16696    HB   THR  64           HB       THR  64 -15.874  -3.560   2.609
  Start of MODEL   24
16697    HG1  THR  64           HG1      THR  64 -17.165  -5.339   4.261
  Start of MODEL   24
16698   HG23  THR  64          HG21      THR  64 -17.071  -4.849   0.899
  Start of MODEL   24
16699   HG22  THR  64          HG22      THR  64 -18.152  -4.467   2.241
  Start of MODEL   24
16700   HG21  THR  64          HG23      THR  64 -17.465  -6.084   2.090
  Start of MODEL   24
16701    H    THR  64           HN       THR  64 -15.104  -6.633   4.072
  Start of MODEL   24
16702    HA   VAL  65           HA       VAL  65 -11.227  -3.868   3.280
  Start of MODEL   24
16703    HB   VAL  65           HB       VAL  65 -10.462  -6.567   4.428
  Start of MODEL   24
16704    H    VAL  65           HN       VAL  65 -12.647  -6.400   2.896
  Start of MODEL   24
16705    HA   ARG  66           HA       ARG  66  -8.857  -5.752   0.121
  Start of MODEL   24
16706    HB3  ARG  66           HB2      ARG  66  -8.047  -2.861   0.183
  Start of MODEL   24
16707    HB2  ARG  66           HB3      ARG  66  -9.403  -3.481  -0.746
  Start of MODEL   24
16708    HG2  ARG  66           HG2      ARG  66  -6.552  -4.342  -1.147
  Start of MODEL   24
16709    HG3  ARG  66           HG3      ARG  66  -7.940  -4.715  -2.170
  Start of MODEL   24
16710    HD2  ARG  66           HD2      ARG  66  -6.795  -1.977  -1.657
  Start of MODEL   24
16711    HD3  ARG  66           HD3      ARG  66  -6.572  -2.909  -3.127
  Start of MODEL   24
16712    HE   ARG  66           HE       ARG  66  -9.316  -2.550  -2.596
  Start of MODEL   24
16713   HH11  ARG  66          HH11      ARG  66  -6.486  -0.807  -3.786
  Start of MODEL   24
16714   HH12  ARG  66          HH12      ARG  66  -7.394   0.339  -4.668
  Start of MODEL   24
16715   HH21  ARG  66          HH21      ARG  66 -10.536  -0.983  -3.789
  Start of MODEL   24
16716   HH22  ARG  66          HH22      ARG  66  -9.727   0.262  -4.655
  Start of MODEL   24
16717    H    ARG  66           HN       ARG  66  -9.493  -3.611   2.003
  Start of MODEL   24
16718    HA   HIS  67           HA       HIS  67  -5.145  -5.829   2.452
  Start of MODEL   24
16719    HB3  HIS  67           HB2      HIS  67  -4.479  -8.190   2.829
  Start of MODEL   24
16720    HB2  HIS  67           HB3      HIS  67  -5.722  -8.720   1.723
  Start of MODEL   24
16721    HD1  HIS  67           HD1      HIS  67  -5.146  -7.903   5.247
  Start of MODEL   24
16722    HD2  HIS  67           HD2      HIS  67  -8.426  -8.359   2.747
  Start of MODEL   24
16723    HE1  HIS  67           HE1      HIS  67  -7.114  -8.206   6.759
  Start of MODEL   24
16724    HE2  HIS  67           HE2      HIS  67  -8.949  -8.901   5.199
  Start of MODEL   24
16725    H    HIS  67           HN       HIS  67  -7.073  -6.896   0.513
  Start of MODEL   24
16726    HA2  GLY  68           HA2      GLY  68  -2.053  -7.161  -0.437
  Start of MODEL   24
16727    H    GLY  68           HN       GLY  68  -2.984  -5.801   1.864
  Start of MODEL   24
16728    HA3  GLY  68           HA1      GLY  68  -2.325  -5.449  -0.750
  Start of MODEL   24
16729    HA   CYS  69           HA       CYS  69   1.455  -4.979   1.294
  Start of MODEL   24
16730    HB3  CYS  69           HB2      CYS  69   2.131  -7.468  -0.262
  Start of MODEL   24
16731    HB2  CYS  69           HB3      CYS  69   1.811  -7.329   1.463
  Start of MODEL   24
16732    H    CYS  69           HN       CYS  69   0.113  -5.923  -1.102
  Start of MODEL   24
16733    HA   LEU  70           HA       LEU  70   3.504  -2.953  -2.036
  Start of MODEL   24
16734    HB3  LEU  70           HB2      LEU  70   4.512  -1.473   0.424
  Start of MODEL   24
16735    HB2  LEU  70           HB3      LEU  70   3.146  -0.957  -0.544
  Start of MODEL   24
16736    HG   LEU  70           HG       LEU  70   6.008  -1.135  -1.515
  Start of MODEL   24
16737   HD12  LEU  70          HD11      LEU  70   5.193   0.135  -3.433
  Start of MODEL   24
16738   HD11  LEU  70          HD12      LEU  70   3.545  -0.039  -2.835
  Start of MODEL   24
16739   HD13  LEU  70          HD13      LEU  70   4.466  -1.466  -3.327
  Start of MODEL   24
16740   HD21  LEU  70          HD21      LEU  70   5.732   0.672   0.118
  Start of MODEL   24
16741   HD23  LEU  70          HD22      LEU  70   4.349   1.272  -0.799
  Start of MODEL   24
16742   HD22  LEU  70          HD23      LEU  70   5.958   1.301  -1.515
  Start of MODEL   24
16743    H    LEU  70           HN       LEU  70   2.817  -3.348   0.754
  Start of MODEL   24
16744    HA   ARG  71           HA       ARG  71   6.887  -5.399  -0.993
  Start of MODEL   24
16745    HB3  ARG  71           HB2      ARG  71   5.930  -6.293  -3.705
  Start of MODEL   24
16746    HB2  ARG  71           HB3      ARG  71   5.376  -6.924  -2.166
  Start of MODEL   24
16747    HG2  ARG  71           HG2      ARG  71   8.201  -7.123  -3.185
  Start of MODEL   24
16748    HG3  ARG  71           HG3      ARG  71   7.560  -7.836  -1.703
  Start of MODEL   24
16749    HD2  ARG  71           HD2      ARG  71   6.578  -8.451  -4.472
  Start of MODEL   24
16750    HD3  ARG  71           HD3      ARG  71   7.735  -9.451  -3.586
  Start of MODEL   24
16751    HE   ARG  71           HE       ARG  71   5.663  -9.376  -1.898
  Start of MODEL   24
16752   HH11  ARG  71          HH11      ARG  71   5.650  -9.914  -5.399
  Start of MODEL   24
16753   HH12  ARG  71          HH12      ARG  71   4.347 -10.999  -5.380
  Start of MODEL   24
16754   HH21  ARG  71          HH21      ARG  71   3.872 -10.901  -1.861
  Start of MODEL   24
16755   HH22  ARG  71          HH22      ARG  71   3.339 -11.599  -3.310
  Start of MODEL   24
16756    H    ARG  71           HN       ARG  71   5.057  -4.125  -2.864
  Start of MODEL   24
16757    HA   LEU  72           HA       LEU  72   9.801  -3.216  -3.389
  Start of MODEL   24
16758    HB3  LEU  72           HB2      LEU  72  11.844  -2.971  -2.061
  Start of MODEL   24
16759    HB2  LEU  72           HB3      LEU  72  11.224  -4.094  -0.870
  Start of MODEL   24
16760    HG   LEU  72           HG       LEU  72   9.377  -2.464  -0.390
  Start of MODEL   24
16761   HD11  LEU  72          HD11      LEU  72  12.174  -1.405  -0.082
  Start of MODEL   24
16762   HD13  LEU  72          HD12      LEU  72  11.301  -2.484   1.018
  Start of MODEL   24
16763   HD12  LEU  72          HD13      LEU  72  10.740  -0.834   0.784
  Start of MODEL   24
16764   HD23  LEU  72          HD21      LEU  72  10.976  -0.702  -2.198
  Start of MODEL   24
16765   HD22  LEU  72          HD22      LEU  72   9.613  -0.186  -1.197
  Start of MODEL   24
16766   HD21  LEU  72          HD23      LEU  72   9.359  -1.333  -2.526
  Start of MODEL   24
16767    H    LEU  72           HN       LEU  72   8.851  -4.568  -1.047
  Start of MODEL   24
16768    HA   ASN  73           HA       ASN  73  10.823  -7.204  -4.917
  Start of MODEL   24
16769    HB3  ASN  73           HB2      ASN  73  11.066  -5.324  -7.290
  Start of MODEL   24
16770    HB2  ASN  73           HB3      ASN  73   9.594  -6.177  -6.841
  Start of MODEL   24
16771   HD21  ASN  73          HD21      ASN  73  12.665  -6.424  -8.382
  Start of MODEL   24
16772   HD22  ASN  73          HD22      ASN  73  12.505  -8.058  -8.895
  Start of MODEL   24
16773    H    ASN  73           HN       ASN  73  10.178  -4.432  -5.042
  Start of MODEL   24
16774    HA   GLN  74           HA       GLN  74  15.023  -5.706  -4.781
  Start of MODEL   24
16775    HB3  GLN  74           HB2      GLN  74  14.956  -3.571  -6.896
  Start of MODEL   24
16776    HB2  GLN  74           HB3      GLN  74  15.024  -5.290  -7.284
  Start of MODEL   24
16777    HG2  GLN  74           HG2      GLN  74  17.070  -3.786  -5.658
  Start of MODEL   24
16778    HG3  GLN  74           HG3      GLN  74  17.161  -5.474  -6.157
  Start of MODEL   24
16779   HE21  GLN  74          HE21      GLN  74  17.463  -2.189  -7.133
  Start of MODEL   24
16780   HE22  GLN  74          HE22      GLN  74  18.199  -2.493  -8.657
  Start of MODEL   24
16781    H    GLN  74           HN       GLN  74  12.650  -4.282  -5.689
  Start of MODEL   24
16782    HA   PRO  75           HA       PRO  75  14.268  -2.134  -2.083
  Start of MODEL   24
16783    HB3  PRO  75           HB2      PRO  75  14.541  -3.046  -0.005
  Start of MODEL   24
16784    HB2  PRO  75           HB3      PRO  75  16.200  -3.534  -0.358
  Start of MODEL   24
16785    HG2  PRO  75           HG2      PRO  75  15.164  -5.620  -0.344
  Start of MODEL   24
16786    HG3  PRO  75           HG3      PRO  75  13.631  -4.959  -0.939
  Start of MODEL   24
16787    HD2  PRO  75           HD2      PRO  75  16.151  -5.525  -2.462
  Start of MODEL   24
16788    HD3  PRO  75           HD3      PRO  75  14.460  -5.903  -2.873
  Start of MODEL   24
16789    HA   THR  76           HA       THR  76  18.236  -0.333  -2.642
  Start of MODEL   24
16790    HB   THR  76           HB       THR  76  17.694   1.718  -4.085
  Start of MODEL   24
16791    HG1  THR  76           HG1      THR  76  15.145   0.553  -4.316
  Start of MODEL   24
16792   HG22  THR  76          HG21      THR  76  17.123   0.368  -6.069
  Start of MODEL   24
16793   HG21  THR  76          HG22      THR  76  16.663  -0.975  -5.023
  Start of MODEL   24
16794   HG23  THR  76          HG23      THR  76  18.343  -0.447  -5.089
  Start of MODEL   24
16795    H    THR  76           HN       THR  76  15.344  -0.328  -2.149
  Start of MODEL   24
16796    HA   HIS  77           HA       HIS  77  18.338   2.567   0.497
  Start of MODEL   24
16797    HB3  HIS  77           HB2      HIS  77  20.710   2.653  -0.186
  Start of MODEL   24
16798    HB2  HIS  77           HB3      HIS  77  20.188   4.089   0.661
  Start of MODEL   24
16799    HD1  HIS  77           HD1      HIS  77  21.835   3.003  -2.379
  Start of MODEL   24
16800    HD2  HIS  77           HD2      HIS  77  20.004   6.432  -0.978
  Start of MODEL   24
16801    HE1  HIS  77           HE1      HIS  77  22.623   4.829  -3.889
  Start of MODEL   24
16802    HE2  HIS  77           HE2      HIS  77  21.753   6.915  -2.794
  Start of MODEL   24
16803    H    HIS  77           HN       HIS  77  19.083   1.958  -2.186
  Start of MODEL   24
16804    HA   VAL  78           HA       VAL  78  16.082   6.165  -1.122
  Start of MODEL   24
16805    HB   VAL  78           HB       VAL  78  14.490   6.310  -2.980
  Start of MODEL   24
16806    H    VAL  78           HN       VAL  78  16.812   3.553  -2.154
  Start of MODEL   24
16807    HA   ASN  79           HA       ASN  79  12.500   3.317   0.077
  Start of MODEL   24
16808    HB3  ASN  79           HB2      ASN  79  12.671   0.922   0.822
  Start of MODEL   24
16809    HB2  ASN  79           HB3      ASN  79  14.377   0.982   0.403
  Start of MODEL   24
16810   HD21  ASN  79          HD21      ASN  79  11.768   2.534  -1.391
  Start of MODEL   24
16811   HD22  ASN  79          HD22      ASN  79  11.963   1.559  -2.805
  Start of MODEL   24
16812    H    ASN  79           HN       ASN  79  15.328   3.024  -0.439
  Start of MODEL   24
16813    HA   ASN  80           HA       ASN  80  13.436   3.890   4.247
  Start of MODEL   24
16814    HB3  ASN  80           HB2      ASN  80  15.830   3.429   4.140
  Start of MODEL   24
16815    HB2  ASN  80           HB3      ASN  80  15.501   4.634   5.367
  Start of MODEL   24
16816   HD21  ASN  80          HD21      ASN  80  17.693   5.128   5.252
  Start of MODEL   24
16817   HD22  ASN  80          HD22      ASN  80  18.337   6.135   4.013
  Start of MODEL   24
16818    H    ASN  80           HN       ASN  80  14.337   4.917   1.688
  Start of MODEL   24
16819    HA2  GLY  81           HA2      GLY  81  11.969   7.640   5.677
  Start of MODEL   24
16820    H    GLY  81           HN       GLY  81  11.791   5.100   4.659
  Start of MODEL   24
16821    HA3  GLY  81           HA1      GLY  81  11.593   7.861   3.969
  Start of MODEL   24
16822    HA   ASN  82           HA       ASN  82   7.720   7.039   6.028
  Start of MODEL   24
16823    HB3  ASN  82           HB2      ASN  82   6.308   9.056   6.170
  Start of MODEL   24
16824    HB2  ASN  82           HB3      ASN  82   7.475   9.944   5.202
  Start of MODEL   24
16825   HD21  ASN  82          HD21      ASN  82   6.760   8.696   8.343
  Start of MODEL   24
16826   HD22  ASN  82          HD22      ASN  82   8.048   9.499   9.157
  Start of MODEL   24
16827    H    ASN  82           HN       ASN  82   9.592   8.748   4.554
  Start of MODEL   24
16828    HA   TYR  83           HA       TYR  83   5.843   6.627   2.087
  Start of MODEL   24
16829    HB3  TYR  83           HB2      TYR  83   5.112   4.170   1.803
  Start of MODEL   24
16830    HB2  TYR  83           HB3      TYR  83   6.002   3.847   3.280
  Start of MODEL   24
16831    HD1  TYR  83           HD1      TYR  83   6.573   5.429  -0.105
  Start of MODEL   24
16832    HD2  TYR  83           HD2      TYR  83   8.179   3.186   3.141
  Start of MODEL   24
16833    HE1  TYR  83           HE1      TYR  83   8.686   5.127  -1.350
  Start of MODEL   24
16834    HE2  TYR  83           HE2      TYR  83  10.291   2.894   1.886
  Start of MODEL   24
16835    HH   TYR  83           HH       TYR  83  11.005   2.875  -0.486
  Start of MODEL   24
16836    H    TYR  83           HN       TYR  83   6.785   5.647   4.645
  Start of MODEL   24
16837    HA   THR  84           HA       THR  84   2.004   7.052   4.183
  Start of MODEL   24
16838    HB   THR  84           HB       THR  84   2.166   9.321   2.179
  Start of MODEL   24
16839    HG1  THR  84           HG1      THR  84   2.779   9.233   4.938
  Start of MODEL   24
16840   HG22  THR  84          HG21      THR  84   0.509  10.409   3.631
  Start of MODEL   24
16841   HG21  THR  84          HG22      THR  84   0.475   8.985   4.672
  Start of MODEL   24
16842   HG23  THR  84          HG23      THR  84  -0.117   8.876   3.017
  Start of MODEL   24
16843    H    THR  84           HN       THR  84   4.048   7.701   2.220
  Start of MODEL   24
16844    HA   LEU  85           HA       LEU  85  -0.308   5.493   0.807
  Start of MODEL   24
16845    HB3  LEU  85           HB2      LEU  85  -1.406   4.086   3.259
  Start of MODEL   24
16846    HB2  LEU  85           HB3      LEU  85  -0.092   3.509   2.255
  Start of MODEL   24
16847    HG   LEU  85           HG       LEU  85  -2.962   3.813   1.363
  Start of MODEL   24
16848   HD12  LEU  85          HD11      LEU  85  -2.170   2.600  -0.614
  Start of MODEL   24
16849   HD11  LEU  85          HD12      LEU  85  -0.520   2.753   0.034
  Start of MODEL   24
16850   HD13  LEU  85          HD13      LEU  85  -1.425   4.199  -0.434
  Start of MODEL   24
16851   HD22  LEU  85          HD21      LEU  85  -3.019   1.428   1.341
  Start of MODEL   24
16852   HD21  LEU  85          HD22      LEU  85  -2.543   1.982   2.952
  Start of MODEL   24
16853   HD23  LEU  85          HD23      LEU  85  -1.331   1.335   1.845
  Start of MODEL   24
16854    H    LEU  85           HN       LEU  85   0.179   6.038   3.642
  Start of MODEL   24
16855    HA   LEU  86           HA       LEU  86  -3.880   7.926   1.518
  Start of MODEL   24
16856    HB3  LEU  86           HB2      LEU  86  -4.250   9.419  -0.437
  Start of MODEL   24
16857    HB2  LEU  86           HB3      LEU  86  -2.931   8.640  -1.274
  Start of MODEL   24
16858    HG   LEU  86           HG       LEU  86  -2.462  10.909  -0.361
  Start of MODEL   24
16859   HD11  LEU  86          HD11      LEU  86  -2.537   9.552   2.302
  Start of MODEL   24
16860   HD13  LEU  86          HD12      LEU  86  -3.627  10.806   1.713
  Start of MODEL   24
16861   HD12  LEU  86          HD13      LEU  86  -1.924  11.174   1.988
  Start of MODEL   24
16862   HD22  LEU  86          HD21      LEU  86  -0.200  10.368   0.454
  Start of MODEL   24
16863   HD21  LEU  86          HD22      LEU  86  -0.637   9.443  -0.983
  Start of MODEL   24
16864   HD23  LEU  86          HD23      LEU  86  -0.677   8.676   0.604
  Start of MODEL   24
16865    H    LEU  86           HN       LEU  86  -1.749   6.733  -0.101
  Start of MODEL   24
16866    HA   ALA  87           HA       ALA  87  -6.495   5.689  -1.216
  Start of MODEL   24
16867    HB3  ALA  87           HB1      ALA  87  -6.369   4.169   0.721
  Start of MODEL   24
16868    HB2  ALA  87           HB2      ALA  87  -8.016   4.291   0.111
  Start of MODEL   24
16869    HB1  ALA  87           HB3      ALA  87  -7.547   5.169   1.566
  Start of MODEL   24
16870    H    ALA  87           HN       ALA  87  -5.865   7.198   1.241
  Start of MODEL   24
16871    HA   ALA  88           HA       ALA  88  -9.847   8.434  -0.836
  Start of MODEL   24
16872    HB3  ALA  88           HB1      ALA  88  -8.189   9.760  -2.047
  Start of MODEL   24
16873    HB2  ALA  88           HB2      ALA  88  -9.818  10.006  -2.677
  Start of MODEL   24
16874    HB1  ALA  88           HB3      ALA  88  -8.677   8.987  -3.557
  Start of MODEL   24
16875    H    ALA  88           HN       ALA  88  -7.984   6.717  -2.331
  Start of MODEL   24
16876    HA   ASN  89           HA       ASN  89 -12.860   6.859  -3.568
  Start of MODEL   24
16877    HB3  ASN  89           HB2      ASN  89 -12.682   4.930  -1.977
  Start of MODEL   24
16878    HB2  ASN  89           HB3      ASN  89 -14.346   5.221  -2.380
  Start of MODEL   24
16879   HD21  ASN  89          HD21      ASN  89 -13.603   3.714  -0.282
  Start of MODEL   24
16880   HD22  ASN  89          HD22      ASN  89 -14.048   4.472   1.204
  Start of MODEL   24
16881    H    ASN  89           HN       ASN  89 -11.883   8.000  -1.073
  Start of MODEL   24
16882    HA   PRO  90           HA       PRO  90 -16.237   9.798  -3.510
  Start of MODEL   24
16883    HB3  PRO  90           HB2      PRO  90 -18.045   8.686  -4.249
  Start of MODEL   24
16884    HB2  PRO  90           HB3      PRO  90 -18.405   8.158  -2.605
  Start of MODEL   24
16885    HG2  PRO  90           HG2      PRO  90 -17.352   6.141  -2.885
  Start of MODEL   24
16886    HG3  PRO  90           HG3      PRO  90 -17.680   6.444  -4.599
  Start of MODEL   24
16887    HD2  PRO  90           HD2      PRO  90 -15.205   5.984  -3.826
  Start of MODEL   24
16888    HD3  PRO  90           HD3      PRO  90 -15.526   7.276  -4.979
  Start of MODEL   24
16889    HA   CYS  91           HA       CYS  91 -17.653   9.560   0.923
  Start of MODEL   24
16890    HB3  CYS  91           HB2      CYS  91 -15.983   7.242   1.922
  Start of MODEL   24
16891    HB2  CYS  91           HB3      CYS  91 -17.657   7.115   1.392
  Start of MODEL   24
16892    H    CYS  91           HN       CYS  91 -16.053   7.749  -0.620
  Start of MODEL   24
16893    HA2  GLY  92           HA2      GLY  92 -13.406  11.536   1.139
  Start of MODEL   24
16894    H    GLY  92           HN       GLY  92 -14.175   9.014   0.485
  Start of MODEL   24
16895    HA3  GLY  92           HA1      GLY  92 -13.442  10.680   2.676
  Start of MODEL   24
16896    HA   GLN  93           HA       GLN  93  -9.631   9.175   1.167
  Start of MODEL   24
16897    HB3  GLN  93           HB2      GLN  93  -8.744  12.020   1.702
  Start of MODEL   24
16898    HB2  GLN  93           HB3      GLN  93  -9.184  11.365   0.134
  Start of MODEL   24
16899    HG2  GLN  93           HG2      GLN  93  -6.860  10.424   1.812
  Start of MODEL   24
16900    HG3  GLN  93           HG3      GLN  93  -7.287   9.848   0.203
  Start of MODEL   24
16901   HE21  GLN  93          HE21      GLN  93  -5.964  12.430   2.051
  Start of MODEL   24
16902   HE22  GLN  93          HE22      GLN  93  -5.296  13.334   0.744
  Start of MODEL   24
16903    H    GLN  93           HN       GLN  93 -11.135  11.251   2.585
  Start of MODEL   24
16904    HA   ALA  94           HA       ALA  94  -7.993   8.672   5.205
  Start of MODEL   24
16905    HB1  ALA  94           HB1      ALA  94  -7.888   6.058   3.741
  Start of MODEL   24
16906    HB3  ALA  94           HB2      ALA  94  -9.153   6.573   4.865
  Start of MODEL   24
16907    HB2  ALA  94           HB3      ALA  94  -7.510   6.249   5.441
  Start of MODEL   24
16908    H    ALA  94           HN       ALA  94  -8.344   8.018   2.353
  Start of MODEL   24
16909    HA   SER  95           HA       SER  95  -3.731   7.954   4.237
  Start of MODEL   24
16910    HB3  SER  95           HB2      SER  95  -3.908  10.300   4.226
  Start of MODEL   24
16911    HB2  SER  95           HB3      SER  95  -2.619   9.936   5.378
  Start of MODEL   24
16912    HG   SER  95           HG       SER  95  -4.929  11.205   5.735
  Start of MODEL   24
16913    H    SER  95           HN       SER  95  -5.903   8.348   6.113
  Start of MODEL   24
16914    HA   ALA  96           HA       ALA  96  -1.479   7.051   7.996
  Start of MODEL   24
16915    HB1  ALA  96           HB1      ALA  96  -1.865   4.484   6.424
  Start of MODEL   24
16916    HB3  ALA  96           HB2      ALA  96  -2.917   5.067   7.709
  Start of MODEL   24
16917    HB2  ALA  96           HB3      ALA  96  -1.263   4.579   8.079
  Start of MODEL   24
16918    H    ALA  96           HN       ALA  96  -1.884   7.149   5.171
  Start of MODEL   24
16919    HA   SER  97           HA       SER  97   2.373   6.416   5.964
  Start of MODEL   24
16920    HB3  SER  97           HB2      SER  97   4.011   7.950   6.960
  Start of MODEL   24
16921    HB2  SER  97           HB3      SER  97   2.938   8.199   8.336
  Start of MODEL   24
16922    HG   SER  97           HG       SER  97   2.088   9.695   7.207
  Start of MODEL   24
16923    H    SER  97           HN       SER  97   0.751   6.749   8.380
  Start of MODEL   24
16924    HA   ILE  98           HA       ILE  98   4.626   3.854   8.621
  Start of MODEL   24
16925    HB   ILE  98           HB       ILE  98   3.127   2.376   7.334
  Start of MODEL   24
16926   HD12  ILE  98          HD11      ILE  98   6.634  -0.039   7.759
  Start of MODEL   24
16927   HD11  ILE  98          HD12      ILE  98   6.931   1.675   7.460
  Start of MODEL   24
16928   HD13  ILE  98          HD13      ILE  98   6.263   0.656   6.182
  Start of MODEL   24
16929    H    ILE  98           HN       ILE  98   3.975   5.018   6.036
  Start of MODEL   24
16930    HA   MET  99           HA       MET  99   8.447   4.922   6.921
  Start of MODEL   24
16931    HB3  MET  99           HB2      MET  99   8.960   4.756   9.898
  Start of MODEL   24
16932    HB2  MET  99           HB3      MET  99   8.613   6.206   8.962
  Start of MODEL   24
16933    HG2  MET  99           HG2      MET  99  11.068   4.461   8.695
  Start of MODEL   24
16934    HG3  MET  99           HG3      MET  99  10.724   5.884   7.721
  Start of MODEL   24
16935    HE3  MET  99           HE1      MET  99  10.901   8.322   8.551
  Start of MODEL   24
16936    HE2  MET  99           HE2      MET  99  11.119   8.802  10.232
  Start of MODEL   24
16937    HE1  MET  99           HE3      MET  99   9.619   8.021   9.725
  Start of MODEL   24
16938    H    MET  99           HN       MET  99   6.742   3.942   9.050
  Start of MODEL   24
16939    HA   ALA 100           HA       ALA 100  10.215   0.960   6.936
  Start of MODEL   24
16940    HB3  ALA 100           HB1      ALA 100   8.776   0.641   4.978
  Start of MODEL   24
16941    HB2  ALA 100           HB2      ALA 100  10.436   0.186   4.585
  Start of MODEL   24
16942    HB1  ALA 100           HB3      ALA 100   9.790   1.734   4.042
  Start of MODEL   24
16943    H    ALA 100           HN       ALA 100   9.140   3.382   5.719
  Start of MODEL   24
16944    HA   ALA 101           HA       ALA 101  14.079   2.649   5.700
  Start of MODEL   24
16945    HB1  ALA 101           HB1      ALA 101  14.339   1.719   8.556
  Start of MODEL   24
16946    HB3  ALA 101           HB2      ALA 101  13.807   3.322   8.038
  Start of MODEL   24
16947    HB2  ALA 101           HB3      ALA 101  15.458   2.792   7.716
  Start of MODEL   24
16948    H    ALA 101           HN       ALA 101  12.382   0.670   7.030
  Start of MODEL   24
16949    HA   PHE 102           HA       PHE 102  15.559  -1.359   4.599
  Start of MODEL   24
16950    HB3  PHE 102           HB2      PHE 102  16.321   0.628   2.448
  Start of MODEL   24
16951    HB2  PHE 102           HB3      PHE 102  15.050  -0.581   2.382
  Start of MODEL   24
16952    HD1  PHE 102           HD1      PHE 102  16.098  -3.070   2.976
  Start of MODEL   24
16953    HD2  PHE 102           HD2      PHE 102  18.080   0.158   1.063
  Start of MODEL   24
16954    HE1  PHE 102           HE1      PHE 102  17.622  -4.662   1.893
  Start of MODEL   24
16955    HE2  PHE 102           HE2      PHE 102  19.617  -1.419  -0.025
  Start of MODEL   24
16956    HZ   PHE 102           HZ       PHE 102  19.431  -3.824   0.423
  Start of MODEL   24
16957    H    PHE 102           HN       PHE 102  14.897   1.363   4.226
  Start of MODEL   24
16958    HA   MET 103           HA       MET 103  19.655   0.426   5.906
  Start of MODEL   24
16959    HB3  MET 103           HB2      MET 103  21.562   0.452   4.202
  Start of MODEL   24
16960    HB2  MET 103           HB3      MET 103  20.344   0.339   2.950
  Start of MODEL   24
16961    HG2  MET 103           HG2      MET 103  20.816  -1.715   5.089
  Start of MODEL   24
16962    HG3  MET 103           HG3      MET 103  19.626  -1.819   3.792
  Start of MODEL   24
16963    HE1  MET 103           HE1      MET 103  20.617  -4.212   3.157
  Start of MODEL   24
16964    HE3  MET 103           HE2      MET 103  21.826  -4.073   4.436
  Start of MODEL   24
16965    HE2  MET 103           HE3      MET 103  22.319  -4.505   2.798
  Start of MODEL   24
16966    H    MET 103           HN       MET 103  17.840   1.270   3.835
  Start of MODEL   24
16967    HA   ASP 104           HA       ASP 104  20.188   4.695   5.721
  Start of MODEL   24
16968    HB3  ASP 104           HB2      ASP 104  22.557   3.680   7.304
  Start of MODEL   24
16969    HB2  ASP 104           HB3      ASP 104  21.049   4.319   7.940
  Start of MODEL   24
16970    H    ASP 104           HN       ASP 104  21.067   2.076   6.388
  Start of MODEL   24
16971    HA   ASN 105           HA       ASN 105  22.549   4.852   2.196
  Start of MODEL   24
16972    HB3  ASN 105           HB2      ASN 105  20.526   5.926   1.479
  Start of MODEL   24
16973    HB2  ASN 105           HB3      ASN 105  21.889   6.831   0.848
  Start of MODEL   24
16974   HD21  ASN 105          HD21      ASN 105  22.162   8.934   1.429
  Start of MODEL   24
16975   HD22  ASN 105          HD22      ASN 105  21.045   9.808   2.406
  Start of MODEL   24
16976    H    ASN 105           HN       ASN 105  20.893   5.989   4.228
  Start of MODEL   24
16977    HA   PRO 106           HA       PRO 106  26.307   6.971   3.529
  Start of MODEL   24
16978    HB3  PRO 106           HB2      PRO 106  27.887   5.617   2.757
  Start of MODEL   24
16979    HB2  PRO 106           HB3      PRO 106  27.303   5.712   1.103
  Start of MODEL   24
16980    HG2  PRO 106           HG2      PRO 106  26.655   3.537   1.538
  Start of MODEL   24
16981    HG3  PRO 106           HG3      PRO 106  26.407   3.856   3.271
  Start of MODEL   24
16982    HD2  PRO 106           HD2      PRO 106  24.654   4.502   0.939
  Start of MODEL   24
16983    HD3  PRO 106           HD3      PRO 106  24.238   3.898   2.561
  Start of MODEL   24
16984    HA   PHE 107           HA       PHE 107  27.268   9.805   0.401
  Start of MODEL   24
16985    HB3  PHE 107           HB2      PHE 107  24.327  10.346   0.859
  Start of MODEL   24
16986    HB2  PHE 107           HB3      PHE 107  25.068   9.148  -0.196
  Start of MODEL   24
16987    HD1  PHE 107           HD1      PHE 107  24.354  12.724   0.300
  Start of MODEL   24
16988    HD2  PHE 107           HD2      PHE 107  26.196   9.888  -2.268
  Start of MODEL   24
16989    HE1  PHE 107           HE1      PHE 107  24.528  14.435  -1.451
  Start of MODEL   24
16990    HE2  PHE 107           HE2      PHE 107  26.377  11.594  -4.020
  Start of MODEL   24
16991    HZ   PHE 107           HZ       PHE 107  25.545  13.871  -3.613
  Start of MODEL   24
16992    H    PHE 107           HN       PHE 107  26.302   9.097   2.911
  Start of MODEL   25
16993    H1   ASP   1           H        ASP   1 -28.016  -8.186  -1.527
  Start of MODEL   25
16994    H2   ASP   1           H2       ASP   1 -26.470  -8.811  -1.759
  Start of MODEL   25
16995    H3   ASP   1           H3       ASP   1 -27.774  -9.863  -1.549
  Start of MODEL   25
16996    HA   ASP   1           HA       ASP   1 -27.074  -9.729  -3.817
  Start of MODEL   25
16997    HB3  ASP   1           HB2      ASP   1 -29.433 -10.205  -3.460
  Start of MODEL   25
16998    HB2  ASP   1           HB3      ASP   1 -29.281  -9.162  -4.858
  Start of MODEL   25
16999    HA   ASP   2           HA       ASP   2 -26.603  -5.398  -4.991
  Start of MODEL   25
17000    HB3  ASP   2           HB2      ASP   2 -27.876  -3.264  -4.702
  Start of MODEL   25
17001    HB2  ASP   2           HB3      ASP   2 -28.904  -4.054  -3.520
  Start of MODEL   25
17002    H    ASP   2           HN       ASP   2 -28.440  -6.516  -2.982
  Start of MODEL   25
17003    HA   ASP   3           HA       ASP   3 -24.563  -3.874  -1.485
  Start of MODEL   25
17004    HB3  ASP   3           HB2      ASP   3 -23.026  -5.588  -2.360
  Start of MODEL   25
17005    HB2  ASP   3           HB3      ASP   3 -22.134  -4.210  -1.748
  Start of MODEL   25
17006    H    ASP   3           HN       ASP   3 -24.896  -4.157  -4.381
  Start of MODEL   25
17007    HA   ASP   4           HA       ASP   4 -23.752   0.186  -3.154
  Start of MODEL   25
17008    HB3  ASP   4           HB2      ASP   4 -25.482   1.560  -4.254
  Start of MODEL   25
17009    HB2  ASP   4           HB3      ASP   4 -26.617   0.233  -4.091
  Start of MODEL   25
17010    H    ASP   4           HN       ASP   4 -25.826  -1.897  -2.857
  Start of MODEL   25
17011    HA   ASP   5           HA       ASP   5 -26.998   1.822  -0.171
  Start of MODEL   25
17012    HB3  ASP   5           HB2      ASP   5 -27.831  -0.830   1.018
  Start of MODEL   25
17013    HB2  ASP   5           HB3      ASP   5 -28.688  -0.102  -0.334
  Start of MODEL   25
17014    H    ASP   5           HN       ASP   5 -26.519  -0.753  -1.314
  Start of MODEL   25
17015    HA   VAL   6           HA       VAL   6 -24.337   0.087   3.202
  Start of MODEL   25
17016    HB   VAL   6           HB       VAL   6 -22.664  -1.824   3.233
  Start of MODEL   25
17017    H    VAL   6           HN       VAL   6 -25.249  -1.073   0.790
  Start of MODEL   25
17018    HA   SER   7           HA       SER   7 -21.085   2.133   1.189
  Start of MODEL   25
17019    HB3  SER   7           HB2      SER   7 -22.465   4.198   2.924
  Start of MODEL   25
17020    HB2  SER   7           HB3      SER   7 -22.872   3.857   1.245
  Start of MODEL   25
17021    HG   SER   7           HG       SER   7 -21.091   4.821   0.576
  Start of MODEL   25
17022    H    SER   7           HN       SER   7 -23.170   1.792   3.204
  Start of MODEL   25
17023    HA   PHE   8           HA       PHE   8 -18.680   2.105   4.809
  Start of MODEL   25
17024    HB3  PHE   8           HB2      PHE   8 -17.037   0.267   4.879
  Start of MODEL   25
17025    HB2  PHE   8           HB3      PHE   8 -17.479  -0.211   3.251
  Start of MODEL   25
17026    HD1  PHE   8           HD1      PHE   8 -18.857  -2.027   3.101
  Start of MODEL   25
17027    HD2  PHE   8           HD2      PHE   8 -19.209   0.501   6.483
  Start of MODEL   25
17028    HE1  PHE   8           HE1      PHE   8 -20.634  -3.475   3.986
  Start of MODEL   25
17029    HE2  PHE   8           HE2      PHE   8 -20.975  -0.935   7.383
  Start of MODEL   25
17030    HZ   PHE   8           HZ       PHE   8 -21.696  -2.934   6.135
  Start of MODEL   25
17031    H    PHE   8           HN       PHE   8 -19.400   1.143   2.151
  Start of MODEL   25
17032    HA   CYS   9           HA       CYS   9 -16.051   4.571   2.540
  Start of MODEL   25
17033    HB3  CYS   9           HB2      CYS   9 -15.455   6.486   3.986
  Start of MODEL   25
17034    HB2  CYS   9           HB3      CYS   9 -16.106   5.614   5.376
  Start of MODEL   25
17035    H    CYS   9           HN       CYS   9 -17.234   3.580   4.949
  Start of MODEL   25
17036    HA   ALA  10           HA       ALA  10 -12.262   3.048   3.282
  Start of MODEL   25
17037    HB3  ALA  10           HB1      ALA  10 -11.891   4.550   1.393
  Start of MODEL   25
17038    HB2  ALA  10           HB2      ALA  10 -10.405   4.210   2.298
  Start of MODEL   25
17039    HB1  ALA  10           HB3      ALA  10 -11.226   5.752   2.508
  Start of MODEL   25
17040    H    ALA  10           HN       ALA  10 -13.611   5.615   3.305
  Start of MODEL   25
17041    HA   SER  11           HA       SER  11  -9.967   4.223   6.748
  Start of MODEL   25
17042    HB3  SER  11           HB2      SER  11 -10.244   2.491   8.422
  Start of MODEL   25
17043    HB2  SER  11           HB3      SER  11 -10.720   1.317   7.199
  Start of MODEL   25
17044    HG   SER  11           HG       SER  11 -12.558   2.696   6.797
  Start of MODEL   25
17045    H    SER  11           HN       SER  11 -11.104   2.375   4.778
  Start of MODEL   25
17046    HA   VAL  12           HA       VAL  12  -6.493   1.968   5.241
  Start of MODEL   25
17047    HB   VAL  12           HB       VAL  12  -5.573   4.838   5.646
  Start of MODEL   25
17048    H    VAL  12           HN       VAL  12  -7.727   4.103   6.833
  Start of MODEL   25
17049    HA   GLN  13           HA       GLN  13  -4.033   1.603   8.798
  Start of MODEL   25
17050    HB3  GLN  13           HB2      GLN  13  -4.151  -0.726   9.657
  Start of MODEL   25
17051    HB2  GLN  13           HB3      GLN  13  -5.141  -1.148   8.269
  Start of MODEL   25
17052    HG2  GLN  13           HG2      GLN  13  -5.874   0.872  10.369
  Start of MODEL   25
17053    HG3  GLN  13           HG3      GLN  13  -6.864   0.379   8.997
  Start of MODEL   25
17054   HE21  GLN  13          HE21      GLN  13  -7.795  -1.634   8.988
  Start of MODEL   25
17055   HE22  GLN  13          HE22      GLN  13  -7.925  -2.605  10.393
  Start of MODEL   25
17056    H    GLN  13           HN       GLN  13  -5.375   0.591   6.420
  Start of MODEL   25
17057    HA   LEU  14           HA       LEU  14  -0.680  -0.432   6.887
  Start of MODEL   25
17058    HB3  LEU  14           HB2      LEU  14   1.307   1.207   7.175
  Start of MODEL   25
17059    HB2  LEU  14           HB3      LEU  14   0.120   2.300   7.848
  Start of MODEL   25
17060    HG   LEU  14           HG       LEU  14  -1.175   2.006   5.653
  Start of MODEL   25
17061   HD13  LEU  14          HD11      LEU  14   0.129   4.011   6.136
  Start of MODEL   25
17062   HD12  LEU  14          HD12      LEU  14   0.249   3.544   4.440
  Start of MODEL   25
17063   HD11  LEU  14          HD13      LEU  14   1.590   3.209   5.544
  Start of MODEL   25
17064   HD21  LEU  14          HD21      LEU  14  -0.038  -0.037   4.969
  Start of MODEL   25
17065   HD23  LEU  14          HD22      LEU  14   1.472   0.872   4.813
  Start of MODEL   25
17066   HD22  LEU  14          HD23      LEU  14   0.104   1.240   3.761
  Start of MODEL   25
17067    H    LEU  14           HN       LEU  14  -1.927   1.184   8.975
  Start of MODEL   25
17068    HA   HIS  15           HA       HIS  15   1.774  -1.753  10.253
  Start of MODEL   25
17069    HB3  HIS  15           HB2      HIS  15   2.113  -4.256   9.687
  Start of MODEL   25
17070    HB2  HIS  15           HB3      HIS  15   1.208  -3.924   8.221
  Start of MODEL   25
17071    HD1  HIS  15           HD1      HIS  15   0.788  -4.365  11.879
  Start of MODEL   25
17072    HD2  HIS  15           HD2      HIS  15  -1.564  -3.470   8.577
  Start of MODEL   25
17073    HE1  HIS  15           HE1      HIS  15  -1.591  -4.595  12.660
  Start of MODEL   25
17074    HE2  HIS  15           HE2      HIS  15  -2.976  -3.819  10.727
  Start of MODEL   25
17075    H    HIS  15           HN       HIS  15   1.209  -1.486   7.407
  Start of MODEL   25
17076    HA   THR  16           HA       THR  16   5.735  -1.058   9.006
  Start of MODEL   25
17077    HB   THR  16           HB       THR  16   6.255  -2.880  11.364
  Start of MODEL   25
17078    HG1  THR  16           HG1      THR  16   5.784  -0.070  11.409
  Start of MODEL   25
17079   HG23  THR  16          HG21      THR  16   8.252  -2.108  10.101
  Start of MODEL   25
17080   HG22  THR  16          HG22      THR  16   8.180  -1.369  11.702
  Start of MODEL   25
17081   HG21  THR  16          HG23      THR  16   7.702  -0.442  10.282
  Start of MODEL   25
17082    H    THR  16           HN       THR  16   3.871  -2.269  10.677
  Start of MODEL   25
17083    HA   ALA  17           HA       ALA  17   6.859  -4.107   6.153
  Start of MODEL   25
17084    HB1  ALA  17           HB1      ALA  17   8.240  -2.133   5.560
  Start of MODEL   25
17085    HB3  ALA  17           HB2      ALA  17   9.018  -3.671   5.214
  Start of MODEL   25
17086    HB2  ALA  17           HB3      ALA  17   9.499  -2.742   6.636
  Start of MODEL   25
17087    H    ALA  17           HN       ALA  17   7.261  -1.875   7.707
  Start of MODEL   25
17088    HA   VAL  18           HA       VAL  18   8.724  -7.139   8.602
  Start of MODEL   25
17089    HB   VAL  18           HB       VAL  18   8.116  -9.384   7.761
  Start of MODEL   25
17090    H    VAL  18           HN       VAL  18   7.590  -6.124   6.121
  Start of MODEL   25
17091    HA   GLU  19           HA       GLU  19  12.542  -7.474   6.752
  Start of MODEL   25
17092    HB3  GLU  19           HB2      GLU  19  14.229  -8.288   8.314
  Start of MODEL   25
17093    HB2  GLU  19           HB3      GLU  19  12.968  -8.958   9.333
  Start of MODEL   25
17094    HG2  GLU  19           HG2      GLU  19  13.274  -6.047   8.682
  Start of MODEL   25
17095    HG3  GLU  19           HG3      GLU  19  12.112  -6.765   9.799
  Start of MODEL   25
17096    H    GLU  19           HN       GLU  19  10.610  -8.376   8.699
  Start of MODEL   25
17097    HA   MET  20           HA       MET  20  13.946 -11.178   5.229
  Start of MODEL   25
17098    HB3  MET  20           HB2      MET  20  11.679 -12.007   5.244
  Start of MODEL   25
17099    HB2  MET  20           HB3      MET  20  12.352 -12.318   3.661
  Start of MODEL   25
17100    HG2  MET  20           HG2      MET  20  10.424 -10.137   4.378
  Start of MODEL   25
17101    HG3  MET  20           HG3      MET  20  11.166 -10.346   2.793
  Start of MODEL   25
17102    HE1  MET  20           HE1      MET  20   8.785 -10.412   1.672
  Start of MODEL   25
17103    HE3  MET  20           HE2      MET  20   8.004 -10.220   3.244
  Start of MODEL   25
17104    HE2  MET  20           HE3      MET  20   7.495 -11.512   2.151
  Start of MODEL   25
17105    H    MET  20           HN       MET  20  12.858  -8.617   5.043
  Start of MODEL   25
17106    HA   HIS  21           HA       HIS  21  15.855 -10.003   1.699
  Start of MODEL   25
17107    HB3  HIS  21           HB2      HIS  21  16.005 -11.381  -0.409
  Start of MODEL   25
17108    HB2  HIS  21           HB3      HIS  21  14.706 -12.382   0.234
  Start of MODEL   25
17109    HD1  HIS  21           HD1      HIS  21  18.354 -11.703   0.603
  Start of MODEL   25
17110    HD2  HIS  21           HD2      HIS  21  15.432 -14.004   2.455
  Start of MODEL   25
17111    HE1  HIS  21           HE1      HIS  21  19.572 -13.262   2.112
  Start of MODEL   25
17112    HE2  HIS  21           HE2      HIS  21  17.772 -14.343   3.446
  Start of MODEL   25
17113    H    HIS  21           HN       HIS  21  13.883 -11.885   2.533
  Start of MODEL   25
17114    HA   HIS  22           HA       HIS  22  12.773  -8.122  -0.923
  Start of MODEL   25
17115    HB3  HIS  22           HB2      HIS  22  10.743  -8.857  -2.058
  Start of MODEL   25
17116    HB2  HIS  22           HB3      HIS  22  10.525 -10.170  -0.908
  Start of MODEL   25
17117    HD1  HIS  22           HD1      HIS  22  13.171  -9.172  -3.534
  Start of MODEL   25
17118    HD2  HIS  22           HD2      HIS  22  11.405 -12.544  -1.836
  Start of MODEL   25
17119    HE1  HIS  22           HE1      HIS  22  14.175 -11.125  -4.694
  Start of MODEL   25
17120    HE2  HIS  22           HE2      HIS  22  13.331 -13.111  -3.445
  Start of MODEL   25
17121    H    HIS  22           HN       HIS  22  12.545 -10.507   0.764
  Start of MODEL   25
17122    HA   TRP  23           HA       TRP  23  10.731  -6.739   2.559
  Start of MODEL   25
17123    HB3  TRP  23           HB2      TRP  23  10.719  -4.224   2.626
  Start of MODEL   25
17124    HB2  TRP  23           HB3      TRP  23  11.433  -4.258   1.015
  Start of MODEL   25
17125    HD1  TRP  23           HD1      TRP  23  13.940  -5.274   0.824
  Start of MODEL   25
17126    HE1  TRP  23           HE1      TRP  23  15.844  -5.403   2.559
  Start of MODEL   25
17127    HE3  TRP  23           HE3      TRP  23  11.203  -4.538   5.066
  Start of MODEL   25
17128    HZ2  TRP  23           HZ2      TRP  23  16.129  -5.235   5.360
  Start of MODEL   25
17129    HZ3  TRP  23           HZ3      TRP  23  12.357  -4.538   7.234
  Start of MODEL   25
17130    HH2  TRP  23           HH2      TRP  23  14.774  -4.876   7.376
  Start of MODEL   25
17131    H    TRP  23           HN       TRP  23  11.774  -6.370  -0.096
  Start of MODEL   25
17132    HA   CYS  24           HA       CYS  24   6.711  -5.863   1.251
  Start of MODEL   25
17133    HB3  CYS  24           HB2      CYS  24   6.772  -8.077   3.316
  Start of MODEL   25
17134    HB2  CYS  24           HB3      CYS  24   6.874  -8.271   1.579
  Start of MODEL   25
17135    H    CYS  24           HN       CYS  24   8.776  -6.453   3.242
  Start of MODEL   25
17136    HA   ILE  25           HA       ILE  25   5.274  -3.535   4.727
  Start of MODEL   25
17137    HB   ILE  25           HB       ILE  25   4.593  -1.842   2.292
  Start of MODEL   25
17138   HD11  ILE  25          HD11      ILE  25   6.202   0.605   3.403
  Start of MODEL   25
17139   HD13  ILE  25          HD12      ILE  25   6.309   0.010   1.750
  Start of MODEL   25
17140   HD12  ILE  25          HD13      ILE  25   7.770   0.139   2.734
  Start of MODEL   25
17141    H    ILE  25           HN       ILE  25   5.591  -4.153   1.872
  Start of MODEL   25
17142    HA   PRO  26           HA       PRO  26   1.267  -5.493   3.796
  Start of MODEL   25
17143    HB3  PRO  26           HB2      PRO  26   1.115  -6.971   5.511
  Start of MODEL   25
17144    HB2  PRO  26           HB3      PRO  26   0.932  -5.662   6.681
  Start of MODEL   25
17145    HG2  PRO  26           HG2      PRO  26   3.019  -6.352   7.354
  Start of MODEL   25
17146    HG3  PRO  26           HG3      PRO  26   3.388  -7.063   5.774
  Start of MODEL   25
17147    HD2  PRO  26           HD2      PRO  26   3.597  -4.214   6.666
  Start of MODEL   25
17148    HD3  PRO  26           HD3      PRO  26   4.695  -5.177   5.650
  Start of MODEL   25
17149    HA   PHE  27           HA       PHE  27  -1.346  -2.386   5.434
  Start of MODEL   25
17150    HB3  PHE  27           HB2      PHE  27  -0.451  -1.227   3.435
  Start of MODEL   25
17151    HB2  PHE  27           HB3      PHE  27  -2.148  -0.872   3.698
  Start of MODEL   25
17152    HD1  PHE  27           HD1      PHE  27  -3.884  -1.736   2.157
  Start of MODEL   25
17153    HD2  PHE  27           HD2      PHE  27   0.283  -2.341   1.460
  Start of MODEL   25
17154    HE1  PHE  27           HE1      PHE  27  -4.355  -2.306  -0.165
  Start of MODEL   25
17155    HE2  PHE  27           HE2      PHE  27  -0.202  -2.916  -0.875
  Start of MODEL   25
17156    HZ   PHE  27           HZ       PHE  27  -2.522  -2.899  -1.690
  Start of MODEL   25
17157    H    PHE  27           HN       PHE  27  -0.611  -4.443   3.502
  Start of MODEL   25
17158    HA   SER  28           HA       SER  28  -5.354  -3.806   4.184
  Start of MODEL   25
17159    HB3  SER  28           HB2      SER  28  -6.514  -4.271   6.316
  Start of MODEL   25
17160    HB2  SER  28           HB3      SER  28  -5.319  -3.295   7.175
  Start of MODEL   25
17161    HG   SER  28           HG       SER  28  -4.045  -5.065   5.652
  Start of MODEL   25
17162    H    SER  28           HN       SER  28  -3.608  -1.882   5.446
  Start of MODEL   25
17163    HA   VAL  29           HA       VAL  29  -7.597  -0.095   4.388
  Start of MODEL   25
17164    HB   VAL  29           HB       VAL  29  -6.304   0.618   2.432
  Start of MODEL   25
17165    H    VAL  29           HN       VAL  29  -6.666  -2.548   3.113
  Start of MODEL   25
17166    HA   ASP  30           HA       ASP  30 -11.444  -2.075   3.813
  Start of MODEL   25
17167    HB3  ASP  30           HB2      ASP  30 -11.654  -0.309   6.262
  Start of MODEL   25
17168    HB2  ASP  30           HB3      ASP  30 -11.203  -2.007   6.254
  Start of MODEL   25
17169    H    ASP  30           HN       ASP  30  -9.626   0.021   4.824
  Start of MODEL   25
17170    HA2  GLY  31           HA2      GLY  31 -14.754   0.745   2.905
  Start of MODEL   25
17171    H    GLY  31           HN       GLY  31 -13.306  -1.577   2.799
  Start of MODEL   25
17172    HA3  GLY  31           HA1      GLY  31 -13.579   0.975   1.613
  Start of MODEL   25
17173    HA   GLN  32           HA       GLN  32 -16.773  -1.915   0.167
  Start of MODEL   25
17174    HB3  GLN  32           HB2      GLN  32 -19.041  -0.040  -0.098
  Start of MODEL   25
17175    HB2  GLN  32           HB3      GLN  32 -18.603  -0.377   1.566
  Start of MODEL   25
17176    HG2  GLN  32           HG2      GLN  32 -18.986  -2.722   1.266
  Start of MODEL   25
17177    HG3  GLN  32           HG3      GLN  32 -20.400  -1.814   0.742
  Start of MODEL   25
17178   HE21  GLN  32          HE21      GLN  32 -20.798  -1.693  -1.506
  Start of MODEL   25
17179   HE22  GLN  32          HE22      GLN  32 -20.214  -2.896  -2.557
  Start of MODEL   25
17180    H    GLN  32           HN       GLN  32 -16.494   0.660   1.500
  Start of MODEL   25
17181    HA   PRO  33           HA       PRO  33 -16.772   0.950  -3.637
  Start of MODEL   25
17182    HB3  PRO  33           HB2      PRO  33 -17.904   2.988  -3.446
  Start of MODEL   25
17183    HB2  PRO  33           HB3      PRO  33 -16.268   3.629  -3.278
  Start of MODEL   25
17184    HG2  PRO  33           HG2      PRO  33 -16.436   3.800  -0.988
  Start of MODEL   25
17185    HG3  PRO  33           HG3      PRO  33 -18.147   3.998  -1.392
  Start of MODEL   25
17186    HD2  PRO  33           HD2      PRO  33 -17.223   2.056   0.274
  Start of MODEL   25
17187    HD3  PRO  33           HD3      PRO  33 -18.684   1.891  -0.715
  Start of MODEL   25
17188    HA   ALA  34           HA       ALA  34 -12.630   0.242  -2.594
  Start of MODEL   25
17189    HB1  ALA  34           HB1      ALA  34 -13.100  -1.370  -4.358
  Start of MODEL   25
17190    HB3  ALA  34           HB2      ALA  34 -11.455  -0.740  -4.481
  Start of MODEL   25
17191    HB2  ALA  34           HB3      ALA  34 -12.713  -0.159  -5.578
  Start of MODEL   25
17192    H    ALA  34           HN       ALA  34 -14.828   0.437  -4.332
  Start of MODEL   25
17193    HA   PRO  35           HA       PRO  35 -11.069   4.421  -3.331
  Start of MODEL   25
17194    HB3  PRO  35           HB2      PRO  35 -10.637   4.591  -1.045
  Start of MODEL   25
17195    HB2  PRO  35           HB3      PRO  35  -9.017   4.205  -1.604
  Start of MODEL   25
17196    HG2  PRO  35           HG2      PRO  35  -9.180   1.988  -1.052
  Start of MODEL   25
17197    HG3  PRO  35           HG3      PRO  35 -10.235   2.645   0.205
  Start of MODEL   25
17198    HD2  PRO  35           HD2      PRO  35 -11.044   0.746  -1.490
  Start of MODEL   25
17199    HD3  PRO  35           HD3      PRO  35 -12.162   2.004  -0.921
  Start of MODEL   25
17200    HA   SER  36           HA       SER  36  -7.668   3.342  -5.870
  Start of MODEL   25
17201    HB3  SER  36           HB2      SER  36  -7.942   6.366  -6.106
  Start of MODEL   25
17202    HB2  SER  36           HB3      SER  36  -8.762   5.202  -7.141
  Start of MODEL   25
17203    HG   SER  36           HG       SER  36  -6.708   6.228  -7.848
  Start of MODEL   25
17204    H    SER  36           HN       SER  36  -9.540   5.146  -4.668
  Start of MODEL   25
17205    HA   LEU  37           HA       LEU  37  -4.933   4.267  -2.534
  Start of MODEL   25
17206    HB3  LEU  37           HB2      LEU  37  -3.333   2.385  -2.321
  Start of MODEL   25
17207    HB2  LEU  37           HB3      LEU  37  -3.927   1.739  -3.828
  Start of MODEL   25
17208    HG   LEU  37           HG       LEU  37  -6.142   1.391  -2.783
  Start of MODEL   25
17209   HD11  LEU  37          HD11      LEU  37  -3.850   0.195  -1.244
  Start of MODEL   25
17210   HD13  LEU  37          HD12      LEU  37  -4.394  -0.336  -2.826
  Start of MODEL   25
17211   HD12  LEU  37          HD13      LEU  37  -5.467  -0.489  -1.437
  Start of MODEL   25
17212   HD22  LEU  37          HD21      LEU  37  -6.302   1.565  -0.329
  Start of MODEL   25
17213   HD21  LEU  37          HD22      LEU  37  -6.068   3.128  -1.105
  Start of MODEL   25
17214   HD23  LEU  37          HD23      LEU  37  -4.707   2.321  -0.313
  Start of MODEL   25
17215    H    LEU  37           HN       LEU  37  -5.898   2.779  -4.804
  Start of MODEL   25
17216    HA   ARG  38           HA       ARG  38  -1.329   5.614  -4.691
  Start of MODEL   25
17217    HB3  ARG  38           HB2      ARG  38  -2.601   8.021  -3.362
  Start of MODEL   25
17218    HB2  ARG  38           HB3      ARG  38  -2.902   7.481  -5.005
  Start of MODEL   25
17219    HG2  ARG  38           HG2      ARG  38  -0.255   8.458  -3.955
  Start of MODEL   25
17220    HG3  ARG  38           HG3      ARG  38  -0.580   7.991  -5.617
  Start of MODEL   25
17221    HD2  ARG  38           HD2      ARG  38  -0.661  10.380  -5.476
  Start of MODEL   25
17222    HD3  ARG  38           HD3      ARG  38  -2.304   9.787  -5.710
  Start of MODEL   25
17223    HE   ARG  38           HE       ARG  38  -1.828  10.042  -2.973
  Start of MODEL   25
17224   HH11  ARG  38          HH11      ARG  38  -2.314  12.084  -5.824
  Start of MODEL   25
17225   HH12  ARG  38          HH12      ARG  38  -2.857  13.429  -4.957
  Start of MODEL   25
17226   HH21  ARG  38          HH21      ARG  38  -2.557  11.969  -1.742
  Start of MODEL   25
17227   HH22  ARG  38          HH22      ARG  38  -3.036  13.337  -2.602
  Start of MODEL   25
17228    H    ARG  38           HN       ARG  38  -3.262   5.595  -2.479
  Start of MODEL   25
17229    HA   TRP  39           HA       TRP  39   1.194   5.917  -1.104
  Start of MODEL   25
17230    HB3  TRP  39           HB2      TRP  39   3.418   4.966  -1.578
  Start of MODEL   25
17231    HB2  TRP  39           HB3      TRP  39   3.005   4.862  -3.282
  Start of MODEL   25
17232    HD1  TRP  39           HD1      TRP  39   1.431   2.909  -4.052
  Start of MODEL   25
17233    HE1  TRP  39           HE1      TRP  39   0.695   0.748  -2.950
  Start of MODEL   25
17234    HE3  TRP  39           HE3      TRP  39   2.781   4.015   0.747
  Start of MODEL   25
17235    HZ2  TRP  39           HZ2      TRP  39   0.667  -0.378  -0.313
  Start of MODEL   25
17236    HZ3  TRP  39           HZ3      TRP  39   2.373   2.341   2.502
  Start of MODEL   25
17237    HH2  TRP  39           HH2      TRP  39   1.345   0.196   1.986
  Start of MODEL   25
17238    H    TRP  39           HN       TRP  39   0.725   5.608  -3.968
  Start of MODEL   25
17239    HA   LEU  40           HA       LEU  40   3.620   9.411  -2.171
  Start of MODEL   25
17240    HB3  LEU  40           HB2      LEU  40   2.629  10.021   0.615
  Start of MODEL   25
17241    HB2  LEU  40           HB3      LEU  40   1.572  10.155  -0.781
  Start of MODEL   25
17242    HG   LEU  40           HG       LEU  40   4.111  11.734  -0.530
  Start of MODEL   25
17243   HD13  LEU  40          HD11      LEU  40   3.319  11.458  -2.767
  Start of MODEL   25
17244   HD12  LEU  40          HD12      LEU  40   3.009  13.116  -2.230
  Start of MODEL   25
17245   HD11  LEU  40          HD13      LEU  40   1.692  11.935  -2.286
  Start of MODEL   25
17246   HD21  LEU  40          HD21      LEU  40   2.620  12.309   1.331
  Start of MODEL   25
17247   HD23  LEU  40          HD22      LEU  40   1.288  12.526   0.197
  Start of MODEL   25
17248   HD22  LEU  40          HD23      LEU  40   2.681  13.607   0.139
  Start of MODEL   25
17249    H    LEU  40           HN       LEU  40   2.314   7.529  -0.317
  Start of MODEL   25
17250    HA   PHE  41           HA       PHE  41   6.897   8.411   0.623
  Start of MODEL   25
17251    HB3  PHE  41           HB2      PHE  41   7.997   8.554  -2.199
  Start of MODEL   25
17252    HB2  PHE  41           HB3      PHE  41   7.450   7.116  -1.350
  Start of MODEL   25
17253    HD1  PHE  41           HD1      PHE  41  10.234   9.217  -2.068
  Start of MODEL   25
17254    HD2  PHE  41           HD2      PHE  41   8.733   6.370   0.711
  Start of MODEL   25
17255    HE1  PHE  41           HE1      PHE  41  12.515   8.803  -1.258
  Start of MODEL   25
17256    HE2  PHE  41           HE2      PHE  41  11.015   5.950   1.525
  Start of MODEL   25
17257    HZ   PHE  41           HZ       PHE  41  12.915   7.184   0.529
  Start of MODEL   25
17258    H    PHE  41           HN       PHE  41   5.780   9.770  -1.727
  Start of MODEL   25
17259    HA   ASN  42           HA       ASN  42   8.500  11.761   2.883
  Start of MODEL   25
17260    HB3  ASN  42           HB2      ASN  42  10.504  12.766   1.672
  Start of MODEL   25
17261    HB2  ASN  42           HB3      ASN  42  10.242  11.578   0.412
  Start of MODEL   25
17262   HD21  ASN  42          HD21      ASN  42  12.536  11.965   2.080
  Start of MODEL   25
17263   HD22  ASN  42          HD22      ASN  42  12.824  10.463   2.872
  Start of MODEL   25
17264    H    ASN  42           HN       ASN  42   7.598   9.874   1.954
  Start of MODEL   25
17265    HA2  GLY  43           HA2      GLY  43   4.946  14.071   0.664
  Start of MODEL   25
17266    H    GLY  43           HN       GLY  43   6.218  12.120   1.060
  Start of MODEL   25
17267    HA3  GLY  43           HA1      GLY  43   6.413  15.024   0.819
  Start of MODEL   25
17268    HA   SER  44           HA       SER  44   6.432  14.020  -3.673
  Start of MODEL   25
17269    HB3  SER  44           HB2      SER  44   8.405  12.945  -4.606
  Start of MODEL   25
17270    HB2  SER  44           HB3      SER  44   8.651  12.032  -3.114
  Start of MODEL   25
17271    HG   SER  44           HG       SER  44   8.485  14.688  -2.640
  Start of MODEL   25
17272    H    SER  44           HN       SER  44   7.085  12.497  -1.211
  Start of MODEL   25
17273    HA   VAL  45           HA       VAL  45   3.997  10.764  -4.749
  Start of MODEL   25
17274    HB   VAL  45           HB       VAL  45   4.740  11.923  -7.460
  Start of MODEL   25
17275    H    VAL  45           HN       VAL  45   5.791  12.861  -5.435
  Start of MODEL   25
17276    HA   LEU  46           HA       LEU  46   7.086   7.799  -5.543
  Start of MODEL   25
17277    HB3  LEU  46           HB2      LEU  46   4.845   6.409  -4.081
  Start of MODEL   25
17278    HB2  LEU  46           HB3      LEU  46   6.262   7.121  -3.342
  Start of MODEL   25
17279    HG   LEU  46           HG       LEU  46   6.343   4.795  -5.259
  Start of MODEL   25
17280   HD11  LEU  46          HD11      LEU  46   8.453   5.963  -3.462
  Start of MODEL   25
17281   HD13  LEU  46          HD12      LEU  46   8.405   6.039  -5.223
  Start of MODEL   25
17282   HD12  LEU  46          HD13      LEU  46   8.611   4.486  -4.414
  Start of MODEL   25
17283   HD23  LEU  46          HD21      LEU  46   6.472   4.805  -2.251
  Start of MODEL   25
17284   HD22  LEU  46          HD22      LEU  46   6.723   3.402  -3.299
  Start of MODEL   25
17285   HD21  LEU  46          HD23      LEU  46   5.146   4.184  -3.235
  Start of MODEL   25
17286    H    LEU  46           HN       LEU  46   4.559   8.743  -4.555
  Start of MODEL   25
17287    HA   ASN  47           HA       ASN  47   4.877   6.300  -9.005
  Start of MODEL   25
17288    HB3  ASN  47           HB2      ASN  47   7.724   6.698  -9.960
  Start of MODEL   25
17289    HB2  ASN  47           HB3      ASN  47   6.394   7.823 -10.203
  Start of MODEL   25
17290   HD21  ASN  47          HD21      ASN  47   4.829   7.351 -11.751
  Start of MODEL   25
17291   HD22  ASN  47          HD22      ASN  47   5.073   6.166 -12.972
  Start of MODEL   25
17292    H    ASN  47           HN       ASN  47   7.198   7.290  -7.643
  Start of MODEL   25
17293    HA   GLU  48           HA       GLU  48   6.056   2.257  -7.714
  Start of MODEL   25
17294    HB3  GLU  48           HB2      GLU  48   4.331   0.652  -8.496
  Start of MODEL   25
17295    HB2  GLU  48           HB3      GLU  48   3.590   1.960  -9.407
  Start of MODEL   25
17296    HG2  GLU  48           HG2      GLU  48   3.808   1.755  -6.429
  Start of MODEL   25
17297    HG3  GLU  48           HG3      GLU  48   3.215   3.175  -7.298
  Start of MODEL   25
17298    H    GLU  48           HN       GLU  48   4.401   4.195  -8.957
  Start of MODEL   25
17299    HA   THR  49           HA       THR  49   7.987   1.136 -11.493
  Start of MODEL   25
17300    HB   THR  49           HB       THR  49  10.359   0.598 -10.954
  Start of MODEL   25
17301    HG1  THR  49           HG1      THR  49  10.782   1.135  -8.561
  Start of MODEL   25
17302   HG23  THR  49          HG21      THR  49   9.681   2.949 -11.274
  Start of MODEL   25
17303   HG22  THR  49          HG22      THR  49  10.967   2.819 -10.074
  Start of MODEL   25
17304   HG21  THR  49          HG23      THR  49   9.301   3.069  -9.556
  Start of MODEL   25
17305    H    THR  49           HN       THR  49   7.639   1.109  -8.581
  Start of MODEL   25
17306    HA   SER  50           HA       SER  50   8.038  -3.271 -11.481
  Start of MODEL   25
17307    HB3  SER  50           HB2      SER  50   9.907  -4.442 -12.536
  Start of MODEL   25
17308    HB2  SER  50           HB3      SER  50  10.948  -3.038 -12.285
  Start of MODEL   25
17309    HG   SER  50           HG       SER  50   8.607  -3.167 -13.855
  Start of MODEL   25
17310    H    SER  50           HN       SER  50   9.584  -0.970 -11.934
  Start of MODEL   25
17311    HA   PHE  51           HA       PHE  51  11.105  -3.974  -8.051
  Start of MODEL   25
17312    HB3  PHE  51           HB2      PHE  51  12.693  -2.546  -6.919
  Start of MODEL   25
17313    HB2  PHE  51           HB3      PHE  51  11.987  -1.115  -7.658
  Start of MODEL   25
17314    HD1  PHE  51           HD1      PHE  51  13.684  -4.299  -8.505
  Start of MODEL   25
17315    HD2  PHE  51           HD2      PHE  51  12.840  -0.289  -9.646
  Start of MODEL   25
17316    HE1  PHE  51           HE1      PHE  51  15.264  -4.504 -10.363
  Start of MODEL   25
17317    HE2  PHE  51           HE2      PHE  51  14.420  -0.489 -11.516
  Start of MODEL   25
17318    HZ   PHE  51           HZ       PHE  51  15.561  -2.574 -11.938
  Start of MODEL   25
17319    H    PHE  51           HN       PHE  51  10.366  -1.611  -9.583
  Start of MODEL   25
17320    HA   ILE  52           HA       ILE  52   8.496  -1.724  -5.016
  Start of MODEL   25
17321    HB   ILE  52           HB       ILE  52   8.201   1.021  -6.266
  Start of MODEL   25
17322   HD11  ILE  52          HD11      ILE  52   9.920   2.386  -4.090
  Start of MODEL   25
17323   HD13  ILE  52          HD12      ILE  52  10.038   2.767  -5.809
  Start of MODEL   25
17324   HD12  ILE  52          HD13      ILE  52  11.477   2.266  -4.911
  Start of MODEL   25
17325    H    ILE  52           HN       ILE  52   9.384  -0.913  -7.707
  Start of MODEL   25
17326    HA   PHE  53           HA       PHE  53   4.588  -1.473  -7.000
  Start of MODEL   25
17327    HB3  PHE  53           HB2      PHE  53   5.494  -3.112  -8.486
  Start of MODEL   25
17328    HB2  PHE  53           HB3      PHE  53   3.911  -3.676  -7.962
  Start of MODEL   25
17329    HD1  PHE  53           HD1      PHE  53   7.487  -4.308  -7.861
  Start of MODEL   25
17330    HD2  PHE  53           HD2      PHE  53   3.675  -5.603  -6.495
  Start of MODEL   25
17331    HE1  PHE  53           HE1      PHE  53   8.465  -6.447  -7.188
  Start of MODEL   25
17332    HE2  PHE  53           HE2      PHE  53   4.642  -7.754  -5.813
  Start of MODEL   25
17333    HZ   PHE  53           HZ       PHE  53   7.047  -8.182  -6.157
  Start of MODEL   25
17334    H    PHE  53           HN       PHE  53   6.547  -2.805  -5.306
  Start of MODEL   25
17335    HA   THR  54           HA       THR  54   1.978  -2.683  -3.750
  Start of MODEL   25
17336    HB   THR  54           HB       THR  54   0.012  -1.595  -5.789
  Start of MODEL   25
17337    HG1  THR  54           HG1      THR  54   1.408   0.024  -5.539
  Start of MODEL   25
17338   HG21  THR  54          HG21      THR  54  -0.055  -1.677  -2.766
  Start of MODEL   25
17339   HG23  THR  54          HG22      THR  54  -0.994  -2.714  -3.840
  Start of MODEL   25
17340   HG22  THR  54          HG23      THR  54  -1.294  -0.978  -3.806
  Start of MODEL   25
17341    H    THR  54           HN       THR  54   2.484  -1.715  -6.417
  Start of MODEL   25
17342    HA   GLU  55           HA       GLU  55   0.315  -6.300  -5.624
  Start of MODEL   25
17343    HB3  GLU  55           HB2      GLU  55   2.082  -7.249  -3.363
  Start of MODEL   25
17344    HB2  GLU  55           HB3      GLU  55   2.627  -6.968  -5.002
  Start of MODEL   25
17345    HG2  GLU  55           HG2      GLU  55   0.706  -9.077  -4.052
  Start of MODEL   25
17346    HG3  GLU  55           HG3      GLU  55   1.013  -8.707  -5.750
  Start of MODEL   25
17347    H    GLU  55           HN       GLU  55   1.594  -4.795  -3.463
  Start of MODEL   25
17348    HA   PHE  56           HA       PHE  56  -2.689  -6.753  -2.470
  Start of MODEL   25
17349    HB3  PHE  56           HB2      PHE  56  -4.930  -6.973  -3.530
  Start of MODEL   25
17350    HB2  PHE  56           HB3      PHE  56  -4.156  -7.114  -5.099
  Start of MODEL   25
17351    HD1  PHE  56           HD1      PHE  56  -5.122  -4.870  -2.422
  Start of MODEL   25
17352    HD2  PHE  56           HD2      PHE  56  -3.053  -5.162  -6.130
  Start of MODEL   25
17353    HE1  PHE  56           HE1      PHE  56  -5.161  -2.430  -2.636
  Start of MODEL   25
17354    HE2  PHE  56           HE2      PHE  56  -3.085  -2.717  -6.348
  Start of MODEL   25
17355    HZ   PHE  56           HZ       PHE  56  -4.136  -1.342  -4.596
  Start of MODEL   25
17356    H    PHE  56           HN       PHE  56  -1.680  -7.081  -5.191
  Start of MODEL   25
17357    HA   LEU  57           HA       LEU  57  -3.384 -11.042  -2.724
  Start of MODEL   25
17358    HB3  LEU  57           HB2      LEU  57  -1.876 -10.694  -0.783
  Start of MODEL   25
17359    HB2  LEU  57           HB3      LEU  57  -2.974 -12.025  -0.538
  Start of MODEL   25
17360    HG   LEU  57           HG       LEU  57  -3.640  -9.392   0.665
  Start of MODEL   25
17361   HD11  LEU  57          HD11      LEU  57  -4.155 -12.252   1.446
  Start of MODEL   25
17362   HD13  LEU  57          HD12      LEU  57  -5.318 -11.126   0.751
  Start of MODEL   25
17363   HD12  LEU  57          HD13      LEU  57  -4.674 -10.839   2.368
  Start of MODEL   25
17364   HD22  LEU  57          HD21      LEU  57  -2.391 -10.043   2.675
  Start of MODEL   25
17365   HD21  LEU  57          HD22      LEU  57  -1.331  -9.764   1.293
  Start of MODEL   25
17366   HD23  LEU  57          HD23      LEU  57  -1.717 -11.414   1.794
  Start of MODEL   25
17367    H    LEU  57           HN       LEU  57  -3.896  -8.455  -1.498
  Start of MODEL   25
17368    HA   GLU  58           HA       GLU  58  -7.415 -11.818  -3.149
  Start of MODEL   25
17369    HB3  GLU  58           HB2      GLU  58  -8.130 -14.154  -2.613
  Start of MODEL   25
17370    HB2  GLU  58           HB3      GLU  58  -6.567 -14.403  -1.863
  Start of MODEL   25
17371    HG2  GLU  58           HG2      GLU  58  -6.691 -15.317  -4.139
  Start of MODEL   25
17372    HG3  GLU  58           HG3      GLU  58  -6.994 -13.707  -4.766
  Start of MODEL   25
17373    H    GLU  58           HN       GLU  58  -4.913 -12.548  -2.422
  Start of MODEL   25
17374    HA   PRO  59           HA       PRO  59  -9.368 -10.854   0.814
  Start of MODEL   25
17375    HB3  PRO  59           HB2      PRO  59  -9.730  -8.637   0.422
  Start of MODEL   25
17376    HB2  PRO  59           HB3      PRO  59 -11.128  -9.084  -0.551
  Start of MODEL   25
17377    HG2  PRO  59           HG2      PRO  59  -9.962  -8.281  -2.340
  Start of MODEL   25
17378    HG3  PRO  59           HG3      PRO  59  -8.451  -8.242  -1.416
  Start of MODEL   25
17379    HD2  PRO  59           HD2      PRO  59  -9.623 -10.455  -3.048
  Start of MODEL   25
17380    HD3  PRO  59           HD3      PRO  59  -7.928  -9.973  -2.807
  Start of MODEL   25
17381    HA   ALA  60           HA       ALA  60 -12.592 -13.602  -0.148
  Start of MODEL   25
17382    HB3  ALA  60           HB1      ALA  60 -11.849 -14.288   2.093
  Start of MODEL   25
17383    HB2  ALA  60           HB2      ALA  60 -13.594 -14.412   1.930
  Start of MODEL   25
17384    HB1  ALA  60           HB3      ALA  60 -12.887 -13.059   2.815
  Start of MODEL   25
17385    H    ALA  60           HN       ALA  60 -11.163 -11.840   1.599
  Start of MODEL   25
17386    HA   ALA  61           HA       ALA  61 -15.972 -11.144  -0.864
  Start of MODEL   25
17387    HB2  ALA  61           HB1      ALA  61 -17.472 -13.741  -0.581
  Start of MODEL   25
17388    HB1  ALA  61           HB2      ALA  61 -16.592 -13.226  -2.019
  Start of MODEL   25
17389    HB3  ALA  61           HB3      ALA  61 -18.009 -12.322  -1.478
  Start of MODEL   25
17390    H    ALA  61           HN       ALA  61 -14.956 -13.677  -0.099
  Start of MODEL   25
17391    HA   ASN  62           HA       ASN  62 -18.026 -11.031   3.194
  Start of MODEL   25
17392    HB3  ASN  62           HB2      ASN  62 -17.331 -12.133   5.395
  Start of MODEL   25
17393    HB2  ASN  62           HB3      ASN  62 -16.195 -13.085   4.455
  Start of MODEL   25
17394   HD21  ASN  62          HD21      ASN  62 -19.518 -12.607   5.249
  Start of MODEL   25
17395   HD22  ASN  62          HD22      ASN  62 -20.092 -14.060   4.524
  Start of MODEL   25
17396    H    ASN  62           HN       ASN  62 -15.703 -12.470   2.089
  Start of MODEL   25
17397    HA   GLU  63           HA       GLU  63 -14.594  -8.571   4.648
  Start of MODEL   25
17398    HB3  GLU  63           HB2      GLU  63 -12.284  -8.397   3.864
  Start of MODEL   25
17399    HB2  GLU  63           HB3      GLU  63 -12.665  -9.427   2.497
  Start of MODEL   25
17400    HG2  GLU  63           HG2      GLU  63 -12.804 -10.256   5.374
  Start of MODEL   25
17401    HG3  GLU  63           HG3      GLU  63 -13.122 -11.277   3.972
  Start of MODEL   25
17402    H    GLU  63           HN       GLU  63 -15.127 -10.166   2.246
  Start of MODEL   25
17403    HA   THR  64           HA       THR  64 -14.909  -5.267   1.782
  Start of MODEL   25
17404    HB   THR  64           HB       THR  64 -15.435  -3.191   3.232
  Start of MODEL   25
17405    HG1  THR  64           HG1      THR  64 -14.883  -3.736   5.221
  Start of MODEL   25
17406   HG22  THR  64          HG21      THR  64 -17.786  -3.892   3.550
  Start of MODEL   25
17407   HG21  THR  64          HG22      THR  64 -17.306  -5.570   3.277
  Start of MODEL   25
17408   HG23  THR  64          HG23      THR  64 -17.163  -4.387   1.976
  Start of MODEL   25
17409    H    THR  64           HN       THR  64 -14.828  -6.430   4.435
  Start of MODEL   25
17410    HA   VAL  65           HA       VAL  65 -10.930  -3.971   3.786
  Start of MODEL   25
17411    HB   VAL  65           HB       VAL  65 -10.365  -6.693   4.959
  Start of MODEL   25
17412    H    VAL  65           HN       VAL  65 -12.724  -6.254   3.849
  Start of MODEL   25
17413    HA   ARG  66           HA       ARG  66  -8.918  -6.039   0.513
  Start of MODEL   25
17414    HB3  ARG  66           HB2      ARG  66  -7.936  -4.303  -0.895
  Start of MODEL   25
17415    HB2  ARG  66           HB3      ARG  66  -8.125  -3.126   0.395
  Start of MODEL   25
17416    HG2  ARG  66           HG2      ARG  66 -10.263  -4.428  -1.272
  Start of MODEL   25
17417    HG3  ARG  66           HG3      ARG  66 -10.624  -3.586   0.236
  Start of MODEL   25
17418    HD2  ARG  66           HD2      ARG  66 -10.932  -2.113  -1.678
  Start of MODEL   25
17419    HD3  ARG  66           HD3      ARG  66  -9.615  -1.551  -0.654
  Start of MODEL   25
17420    HE   ARG  66           HE       ARG  66  -8.890  -3.198  -2.928
  Start of MODEL   25
17421   HH11  ARG  66          HH11      ARG  66  -9.029   0.025  -1.561
  Start of MODEL   25
17422   HH12  ARG  66          HH12      ARG  66  -8.203   0.770  -2.869
  Start of MODEL   25
17423   HH21  ARG  66          HH21      ARG  66  -7.717  -2.236  -4.644
  Start of MODEL   25
17424   HH22  ARG  66          HH22      ARG  66  -7.378  -0.574  -4.637
  Start of MODEL   25
17425    H    ARG  66           HN       ARG  66  -9.428  -3.833   2.370
  Start of MODEL   25
17426    HA   HIS  67           HA       HIS  67  -5.158  -6.078   2.763
  Start of MODEL   25
17427    HB3  HIS  67           HB2      HIS  67  -4.443  -8.419   3.032
  Start of MODEL   25
17428    HB2  HIS  67           HB3      HIS  67  -5.611  -8.910   1.821
  Start of MODEL   25
17429    HD1  HIS  67           HD1      HIS  67  -5.275  -8.417   5.422
  Start of MODEL   25
17430    HD2  HIS  67           HD2      HIS  67  -8.356  -8.646   2.653
  Start of MODEL   25
17431    HE1  HIS  67           HE1      HIS  67  -7.347  -8.919   6.741
  Start of MODEL   25
17432    HE2  HIS  67           HE2      HIS  67  -9.034  -9.461   4.978
  Start of MODEL   25
17433    H    HIS  67           HN       HIS  67  -7.089  -7.129   0.811
  Start of MODEL   25
17434    HA2  GLY  68           HA2      GLY  68  -2.063  -7.176  -0.210
  Start of MODEL   25
17435    H    GLY  68           HN       GLY  68  -3.001  -5.932   2.164
  Start of MODEL   25
17436    HA3  GLY  68           HA1      GLY  68  -2.353  -5.454  -0.431
  Start of MODEL   25
17437    HA   CYS  69           HA       CYS  69   1.461  -4.875   1.438
  Start of MODEL   25
17438    HB3  CYS  69           HB2      CYS  69   2.126  -7.373  -0.109
  Start of MODEL   25
17439    HB2  CYS  69           HB3      CYS  69   1.914  -7.195   1.631
  Start of MODEL   25
17440    H    CYS  69           HN       CYS  69   0.019  -5.808  -0.881
  Start of MODEL   25
17441    HA   LEU  70           HA       LEU  70   3.342  -2.882  -2.027
  Start of MODEL   25
17442    HB3  LEU  70           HB2      LEU  70   4.448  -1.400   0.382
  Start of MODEL   25
17443    HB2  LEU  70           HB3      LEU  70   3.006  -0.908  -0.482
  Start of MODEL   25
17444    HG   LEU  70           HG       LEU  70   5.789  -1.010  -1.668
  Start of MODEL   25
17445   HD11  LEU  70          HD11      LEU  70   3.206   0.080  -2.743
  Start of MODEL   25
17446   HD13  LEU  70          HD12      LEU  70   4.111  -1.307  -3.370
  Start of MODEL   25
17447   HD12  LEU  70          HD13      LEU  70   4.790   0.322  -3.466
  Start of MODEL   25
17448   HD21  LEU  70          HD21      LEU  70   5.627   0.721   0.031
  Start of MODEL   25
17449   HD23  LEU  70          HD22      LEU  70   4.159   1.334  -0.734
  Start of MODEL   25
17450   HD22  LEU  70          HD23      LEU  70   5.698   1.428  -1.584
  Start of MODEL   25
17451    H    LEU  70           HN       LEU  70   2.806  -3.269   0.807
  Start of MODEL   25
17452    HA   ARG  71           HA       ARG  71   6.792  -5.223  -0.943
  Start of MODEL   25
17453    HB3  ARG  71           HB2      ARG  71   5.568  -6.714  -3.269
  Start of MODEL   25
17454    HB2  ARG  71           HB3      ARG  71   5.162  -6.952  -1.577
  Start of MODEL   25
17455    HG2  ARG  71           HG2      ARG  71   7.763  -7.571  -2.945
  Start of MODEL   25
17456    HG3  ARG  71           HG3      ARG  71   7.571  -7.564  -1.196
  Start of MODEL   25
17457    HD2  ARG  71           HD2      ARG  71   7.367  -9.819  -2.034
  Start of MODEL   25
17458    HD3  ARG  71           HD3      ARG  71   5.824  -9.282  -1.396
  Start of MODEL   25
17459    HE   ARG  71           HE       ARG  71   4.956  -9.204  -3.584
  Start of MODEL   25
17460   HH11  ARG  71          HH11      ARG  71   8.281 -10.486  -3.507
  Start of MODEL   25
17461   HH12  ARG  71          HH12      ARG  71   8.164 -11.213  -5.030
  Start of MODEL   25
17462   HH21  ARG  71          HH21      ARG  71   4.803 -10.286  -5.653
  Start of MODEL   25
17463   HH22  ARG  71          HH22      ARG  71   6.167 -11.116  -6.268
  Start of MODEL   25
17464    H    ARG  71           HN       ARG  71   4.765  -4.270  -2.804
  Start of MODEL   25
17465    HA   LEU  72           HA       LEU  72   9.468  -3.943  -4.027
  Start of MODEL   25
17466    HB3  LEU  72           HB2      LEU  72  11.596  -3.122  -2.922
  Start of MODEL   25
17467    HB2  LEU  72           HB3      LEU  72  10.872  -3.530  -1.384
  Start of MODEL   25
17468    HG   LEU  72           HG       LEU  72   9.537  -1.614  -3.256
  Start of MODEL   25
17469   HD12  LEU  72          HD11      LEU  72   8.577  -0.680  -1.236
  Start of MODEL   25
17470   HD11  LEU  72          HD12      LEU  72   9.398  -1.910  -0.277
  Start of MODEL   25
17471   HD13  LEU  72          HD13      LEU  72   8.155  -2.384  -1.445
  Start of MODEL   25
17472   HD23  LEU  72          HD21      LEU  72  11.576  -0.858  -1.179
  Start of MODEL   25
17473   HD22  LEU  72          HD22      LEU  72  10.580   0.229  -2.170
  Start of MODEL   25
17474   HD21  LEU  72          HD23      LEU  72  11.797  -0.794  -2.933
  Start of MODEL   25
17475    H    LEU  72           HN       LEU  72   8.761  -4.880  -1.364
  Start of MODEL   25
17476    HA   ASN  73           HA       ASN  73  11.143  -7.928  -4.449
  Start of MODEL   25
17477    HB3  ASN  73           HB2      ASN  73  11.447  -6.505  -7.119
  Start of MODEL   25
17478    HB2  ASN  73           HB3      ASN  73  10.106  -7.547  -6.659
  Start of MODEL   25
17479   HD21  ASN  73          HD21      ASN  73  11.899  -7.800  -8.894
  Start of MODEL   25
17480   HD22  ASN  73          HD22      ASN  73  12.651  -9.332  -8.771
  Start of MODEL   25
17481    H    ASN  73           HN       ASN  73  10.162  -5.380  -5.225
  Start of MODEL   25
17482    HA   GLN  74           HA       GLN  74  15.169  -5.919  -4.279
  Start of MODEL   25
17483    HB3  GLN  74           HB2      GLN  74  16.442  -4.596  -6.010
  Start of MODEL   25
17484    HB2  GLN  74           HB3      GLN  74  14.936  -4.387  -6.883
  Start of MODEL   25
17485    HG2  GLN  74           HG2      GLN  74  14.747  -6.821  -7.117
  Start of MODEL   25
17486    HG3  GLN  74           HG3      GLN  74  16.221  -6.192  -7.855
  Start of MODEL   25
17487   HE21  GLN  74          HE21      GLN  74  17.650  -5.863  -5.337
  Start of MODEL   25
17488   HE22  GLN  74          HE22      GLN  74  18.043  -7.447  -4.807
  Start of MODEL   25
17489    H    GLN  74           HN       GLN  74  12.716  -4.967  -5.513
  Start of MODEL   25
17490    HA   PRO  75           HA       PRO  75  14.193  -2.109  -2.193
  Start of MODEL   25
17491    HB3  PRO  75           HB2      PRO  75  14.302  -3.380  -0.264
  Start of MODEL   25
17492    HB2  PRO  75           HB3      PRO  75  15.804  -2.463  -0.084
  Start of MODEL   25
17493    HG2  PRO  75           HG2      PRO  75  17.119  -4.221  -0.817
  Start of MODEL   25
17494    HG3  PRO  75           HG3      PRO  75  15.819  -5.150  -0.060
  Start of MODEL   25
17495    HD2  PRO  75           HD2      PRO  75  16.565  -5.395  -2.690
  Start of MODEL   25
17496    HD3  PRO  75           HD3      PRO  75  14.948  -5.793  -2.074
  Start of MODEL   25
17497    HA   THR  76           HA       THR  76  17.923  -0.051  -3.124
  Start of MODEL   25
17498    HB   THR  76           HB       THR  76  17.259   2.119  -4.292
  Start of MODEL   25
17499    HG1  THR  76           HG1      THR  76  14.926   1.963  -4.939
  Start of MODEL   25
17500   HG21  THR  76          HG21      THR  76  16.058  -0.456  -5.337
  Start of MODEL   25
17501   HG23  THR  76          HG22      THR  76  17.719   0.083  -5.582
  Start of MODEL   25
17502   HG22  THR  76          HG23      THR  76  16.384   0.979  -6.302
  Start of MODEL   25
17503    H    THR  76           HN       THR  76  15.067  -0.179  -2.660
  Start of MODEL   25
17504    HA   HIS  77           HA       HIS  77  18.158   2.050   0.631
  Start of MODEL   25
17505    HB3  HIS  77           HB2      HIS  77  20.584   1.546   0.144
  Start of MODEL   25
17506    HB2  HIS  77           HB3      HIS  77  20.347   2.955   1.157
  Start of MODEL   25
17507    HD1  HIS  77           HD1      HIS  77  21.803   1.934  -2.125
  Start of MODEL   25
17508    HD2  HIS  77           HD2      HIS  77  21.098   5.418   0.027
  Start of MODEL   25
17509    HE1  HIS  77           HE1      HIS  77  23.063   3.712  -3.316
  Start of MODEL   25
17510    HE2  HIS  77           HE2      HIS  77  22.528   5.841  -2.119
  Start of MODEL   25
17511    H    HIS  77           HN       HIS  77  19.111   1.482  -1.997
  Start of MODEL   25
17512    HA   VAL  78           HA       VAL  78  17.717   6.348  -1.216
  Start of MODEL   25
17513    HB   VAL  78           HB       VAL  78  16.722   6.965  -3.382
  Start of MODEL   25
17514    H    VAL  78           HN       VAL  78  17.918   3.707  -2.261
  Start of MODEL   25
17515    HA   ASN  79           HA       ASN  79  13.366   5.406  -0.740
  Start of MODEL   25
17516    HB3  ASN  79           HB2      ASN  79  11.977   3.234  -0.734
  Start of MODEL   25
17517    HB2  ASN  79           HB3      ASN  79  13.426   2.508  -1.428
  Start of MODEL   25
17518   HD21  ASN  79          HD21      ASN  79  13.996   3.011  -3.391
  Start of MODEL   25
17519   HD22  ASN  79          HD22      ASN  79  13.035   3.892  -4.532
  Start of MODEL   25
17520    H    ASN  79           HN       ASN  79  15.621   3.641  -1.099
  Start of MODEL   25
17521    HA   ASN  80           HA       ASN  80  14.074   3.576   3.405
  Start of MODEL   25
17522    HB3  ASN  80           HB2      ASN  80  16.636   5.222   3.420
  Start of MODEL   25
17523    HB2  ASN  80           HB3      ASN  80  16.600   3.498   3.097
  Start of MODEL   25
17524   HD21  ASN  80          HD21      ASN  80  17.940   3.034   4.801
  Start of MODEL   25
17525   HD22  ASN  80          HD22      ASN  80  17.432   3.104   6.448
  Start of MODEL   25
17526    H    ASN  80           HN       ASN  80  15.435   4.937   1.212
  Start of MODEL   25
17527    HA2  GLY  81           HA2      GLY  81  12.555   7.411   4.842
  Start of MODEL   25
17528    H    GLY  81           HN       GLY  81  12.189   4.922   3.437
  Start of MODEL   25
17529    HA3  GLY  81           HA1      GLY  81  11.962   7.593   3.203
  Start of MODEL   25
17530    HA   ASN  82           HA       ASN  82   8.378   6.823   5.628
  Start of MODEL   25
17531    HB3  ASN  82           HB2      ASN  82   8.170   9.759   4.996
  Start of MODEL   25
17532    HB2  ASN  82           HB3      ASN  82   8.854   9.068   6.463
  Start of MODEL   25
17533   HD21  ASN  82          HD21      ASN  82   7.500   8.233   8.004
  Start of MODEL   25
17534   HD22  ASN  82          HD22      ASN  82   5.810   8.530   8.022
  Start of MODEL   25
17535    H    ASN  82           HN       ASN  82  10.049   8.464   3.872
  Start of MODEL   25
17536    HA   TYR  83           HA       TYR  83   5.788   6.589   2.120
  Start of MODEL   25
17537    HB3  TYR  83           HB2      TYR  83   4.767   4.289   2.176
  Start of MODEL   25
17538    HB2  TYR  83           HB3      TYR  83   5.630   4.001   3.678
  Start of MODEL   25
17539    HD1  TYR  83           HD1      TYR  83   5.738   3.575   0.225
  Start of MODEL   25
17540    HD2  TYR  83           HD2      TYR  83   8.268   4.411   3.537
  Start of MODEL   25
17541    HE1  TYR  83           HE1      TYR  83   7.674   2.754  -1.042
  Start of MODEL   25
17542    HE2  TYR  83           HE2      TYR  83  10.209   3.602   2.250
  Start of MODEL   25
17543    HH   TYR  83           HH       TYR  83  10.689   2.224   0.436
  Start of MODEL   25
17544    H    TYR  83           HN       TYR  83   6.805   5.785   4.728
  Start of MODEL   25
17545    HA   THR  84           HA       THR  84   2.009   7.003   4.292
  Start of MODEL   25
17546    HB   THR  84           HB       THR  84   2.090   9.301   2.313
  Start of MODEL   25
17547    HG1  THR  84           HG1      THR  84   3.590   8.771   4.502
  Start of MODEL   25
17548   HG23  THR  84          HG21      THR  84  -0.108   8.950   3.345
  Start of MODEL   25
17549   HG22  THR  84          HG22      THR  84   0.630  10.430   3.954
  Start of MODEL   25
17550   HG21  THR  84          HG23      THR  84   0.625   8.971   4.948
  Start of MODEL   25
17551    H    THR  84           HN       THR  84   3.787   7.305   1.980
  Start of MODEL   25
17552    HA   LEU  85           HA       LEU  85  -0.376   5.456   0.972
  Start of MODEL   25
17553    HB3  LEU  85           HB2      LEU  85  -1.471   4.069   3.432
  Start of MODEL   25
17554    HB2  LEU  85           HB3      LEU  85  -0.180   3.469   2.407
  Start of MODEL   25
17555    HG   LEU  85           HG       LEU  85  -3.071   3.800   1.589
  Start of MODEL   25
17556   HD13  LEU  85          HD11      LEU  85  -1.594   4.180  -0.274
  Start of MODEL   25
17557   HD12  LEU  85          HD12      LEU  85  -2.358   2.581  -0.420
  Start of MODEL   25
17558   HD11  LEU  85          HD13      LEU  85  -0.687   2.731   0.153
  Start of MODEL   25
17559   HD22  LEU  85          HD21      LEU  85  -3.139   1.412   1.555
  Start of MODEL   25
17560   HD21  LEU  85          HD22      LEU  85  -2.630   1.968   3.159
  Start of MODEL   25
17561   HD23  LEU  85          HD23      LEU  85  -1.440   1.314   2.032
  Start of MODEL   25
17562    H    LEU  85           HN       LEU  85   0.132   5.996   3.798
  Start of MODEL   25
17563    HA   LEU  86           HA       LEU  86  -3.939   7.846   1.622
  Start of MODEL   25
17564    HB3  LEU  86           HB2      LEU  86  -4.190   9.367  -0.310
  Start of MODEL   25
17565    HB2  LEU  86           HB3      LEU  86  -2.876   8.557  -1.124
  Start of MODEL   25
17566    HG   LEU  86           HG       LEU  86  -2.361  10.787  -0.171
  Start of MODEL   25
17567   HD12  LEU  86          HD11      LEU  86  -1.872  10.998   2.200
  Start of MODEL   25
17568   HD11  LEU  86          HD12      LEU  86  -2.539   9.388   2.465
  Start of MODEL   25
17569   HD13  LEU  86          HD13      LEU  86  -3.578  10.688   1.875
  Start of MODEL   25
17570   HD23  LEU  86          HD21      LEU  86  -0.673   8.504   0.839
  Start of MODEL   25
17571   HD22  LEU  86          HD22      LEU  86  -0.151  10.181   0.709
  Start of MODEL   25
17572   HD21  LEU  86          HD23      LEU  86  -0.561   9.271  -0.748
  Start of MODEL   25
17573    H    LEU  86           HN       LEU  86  -1.856   6.557   0.027
  Start of MODEL   25
17574    HA   ALA  87           HA       ALA  87  -6.466   5.698  -1.244
  Start of MODEL   25
17575    HB2  ALA  87           HB1      ALA  87  -8.113   4.433   0.093
  Start of MODEL   25
17576    HB1  ALA  87           HB2      ALA  87  -7.657   5.375   1.505
  Start of MODEL   25
17577    HB3  ALA  87           HB3      ALA  87  -6.486   4.296   0.756
  Start of MODEL   25
17578    H    ALA  87           HN       ALA  87  -5.969   7.356   1.133
  Start of MODEL   25
17579    HA   ALA  88           HA       ALA  88  -9.704   8.629  -1.252
  Start of MODEL   25
17580    HB3  ALA  88           HB1      ALA  88  -8.055   9.713  -2.703
  Start of MODEL   25
17581    HB2  ALA  88           HB2      ALA  88  -9.688   9.878  -3.347
  Start of MODEL   25
17582    HB1  ALA  88           HB3      ALA  88  -8.579   8.703  -4.051
  Start of MODEL   25
17583    H    ALA  88           HN       ALA  88  -7.854   6.728  -2.518
  Start of MODEL   25
17584    HA   ASN  89           HA       ASN  89 -12.781   6.671  -3.635
  Start of MODEL   25
17585    HB3  ASN  89           HB2      ASN  89 -12.342   4.984  -1.734
  Start of MODEL   25
17586    HB2  ASN  89           HB3      ASN  89 -13.963   5.005  -2.356
  Start of MODEL   25
17587   HD21  ASN  89          HD21      ASN  89 -14.613   3.952  -0.522
  Start of MODEL   25
17588   HD22  ASN  89          HD22      ASN  89 -14.895   4.775   0.966
  Start of MODEL   25
17589    H    ASN  89           HN       ASN  89 -11.746   8.093  -1.320
  Start of MODEL   25
17590    HA   PRO  90           HA       PRO  90 -16.219   9.470  -3.560
  Start of MODEL   25
17591    HB3  PRO  90           HB2      PRO  90 -18.331   8.542  -3.716
  Start of MODEL   25
17592    HB2  PRO  90           HB3      PRO  90 -18.081   7.488  -2.316
  Start of MODEL   25
17593    HG2  PRO  90           HG2      PRO  90 -17.800   6.009  -4.115
  Start of MODEL   25
17594    HG3  PRO  90           HG3      PRO  90 -16.968   7.232  -5.094
  Start of MODEL   25
17595    HD2  PRO  90           HD2      PRO  90 -15.957   5.672  -2.754
  Start of MODEL   25
17596    HD3  PRO  90           HD3      PRO  90 -15.124   6.086  -4.269
  Start of MODEL   25
17597    HA   CYS  91           HA       CYS  91 -17.283   9.723   1.032
  Start of MODEL   25
17598    HB3  CYS  91           HB2      CYS  91 -16.271   8.565   2.999
  Start of MODEL   25
17599    HB2  CYS  91           HB3      CYS  91 -15.406   7.535   1.870
  Start of MODEL   25
17600    H    CYS  91           HN       CYS  91 -15.833   7.768  -0.508
  Start of MODEL   25
17601    HA2  GLY  92           HA2      GLY  92 -13.070  11.832  -0.032
  Start of MODEL   25
17602    H    GLY  92           HN       GLY  92 -14.091   9.554  -0.228
  Start of MODEL   25
17603    HA3  GLY  92           HA1      GLY  92 -13.220  11.573   1.702
  Start of MODEL   25
17604    HA   GLN  93           HA       GLN  93  -9.375   9.649   0.690
  Start of MODEL   25
17605    HB3  GLN  93           HB2      GLN  93  -8.404  12.257   1.842
  Start of MODEL   25
17606    HB2  GLN  93           HB3      GLN  93  -8.798  12.041   0.144
  Start of MODEL   25
17607    HG2  GLN  93           HG2      GLN  93  -6.747  10.396   1.592
  Start of MODEL   25
17608    HG3  GLN  93           HG3      GLN  93  -7.054  10.450  -0.140
  Start of MODEL   25
17609   HE21  GLN  93          HE21      GLN  93  -5.064  11.108  -0.724
  Start of MODEL   25
17610   HE22  GLN  93          HE22      GLN  93  -4.406  12.653  -0.313
  Start of MODEL   25
17611    H    GLN  93           HN       GLN  93 -10.957  11.833   1.833
  Start of MODEL   25
17612    HA   ALA  94           HA       ALA  94  -8.315   8.852   4.915
  Start of MODEL   25
17613    HB2  ALA  94           HB1      ALA  94  -8.178   6.388   5.158
  Start of MODEL   25
17614    HB1  ALA  94           HB2      ALA  94  -8.334   6.231   3.424
  Start of MODEL   25
17615    HB3  ALA  94           HB3      ALA  94  -9.681   6.883   4.371
  Start of MODEL   25
17616    H    ALA  94           HN       ALA  94  -8.338   8.326   2.010
  Start of MODEL   25
17617    HA   SER  95           HA       SER  95  -4.100   7.506   4.212
  Start of MODEL   25
17618    HB3  SER  95           HB2      SER  95  -4.160   9.880   4.045
  Start of MODEL   25
17619    HB2  SER  95           HB3      SER  95  -2.802   9.455   5.084
  Start of MODEL   25
17620    HG   SER  95           HG       SER  95  -5.229   9.891   6.365
  Start of MODEL   25
17621    H    SER  95           HN       SER  95  -6.302   8.006   5.986
  Start of MODEL   25
17622    HA   ALA  96           HA       ALA  96  -1.958   6.869   8.133
  Start of MODEL   25
17623    HB2  ALA  96           HB1      ALA  96  -1.535   4.419   8.212
  Start of MODEL   25
17624    HB1  ALA  96           HB2      ALA  96  -2.032   4.297   6.524
  Start of MODEL   25
17625    HB3  ALA  96           HB3      ALA  96  -3.202   4.777   7.756
  Start of MODEL   25
17626    H    ALA  96           HN       ALA  96  -2.167   6.945   5.287
  Start of MODEL   25
17627    HA   SER  97           HA       SER  97   2.067   6.561   6.334
  Start of MODEL   25
17628    HB3  SER  97           HB2      SER  97   2.020   8.740   7.343
  Start of MODEL   25
17629    HB2  SER  97           HB3      SER  97   3.559   7.994   7.774
  Start of MODEL   25
17630    HG   SER  97           HG       SER  97   1.716   8.959   9.390
  Start of MODEL   25
17631    H    SER  97           HN       SER  97   0.320   6.399   8.681
  Start of MODEL   25
17632    HA   ILE  98           HA       ILE  98   4.745   4.071   8.890
  Start of MODEL   25
17633    HB   ILE  98           HB       ILE  98   3.267   2.534   7.608
  Start of MODEL   25
17634   HD11  ILE  98          HD11      ILE  98   7.087   2.120   7.444
  Start of MODEL   25
17635   HD13  ILE  98          HD12      ILE  98   6.424   1.054   6.204
  Start of MODEL   25
17636   HD12  ILE  98          HD13      ILE  98   6.985   0.385   7.734
  Start of MODEL   25
17637    H    ILE  98           HN       ILE  98   4.110   5.554   6.509
  Start of MODEL   25
17638    HA   MET  99           HA       MET  99   8.503   5.383   7.071
  Start of MODEL   25
17639    HB3  MET  99           HB2      MET  99   9.379   4.908   9.919
  Start of MODEL   25
17640    HB2  MET  99           HB3      MET  99   8.311   6.243   9.534
  Start of MODEL   25
17641    HG2  MET  99           HG2      MET  99  10.003   7.139   7.996
  Start of MODEL   25
17642    HG3  MET  99           HG3      MET  99  10.546   7.054   9.663
  Start of MODEL   25
17643    HE2  MET  99           HE1      MET  99  13.742   6.584   7.430
  Start of MODEL   25
17644    HE1  MET  99           HE2      MET  99  12.981   7.535   8.713
  Start of MODEL   25
17645    HE3  MET  99           HE3      MET  99  12.295   7.543   7.090
  Start of MODEL   25
17646    H    MET  99           HN       MET  99   6.922   4.149   9.200
  Start of MODEL   25
17647    HA   ALA 100           HA       ALA 100  10.126   1.355   7.106
  Start of MODEL   25
17648    HB2  ALA 100           HB1      ALA 100   9.748   1.911   4.173
  Start of MODEL   25
17649    HB1  ALA 100           HB2      ALA 100   8.535   1.233   5.254
  Start of MODEL   25
17650    HB3  ALA 100           HB3      ALA 100  10.016   0.334   4.914
  Start of MODEL   25
17651    H    ALA 100           HN       ALA 100   9.594   3.938   5.844
  Start of MODEL   25
17652    HA   ALA 101           HA       ALA 101  14.237   2.284   6.068
  Start of MODEL   25
17653    HB2  ALA 101           HB1      ALA 101  15.611   1.920   8.057
  Start of MODEL   25
17654    HB1  ALA 101           HB2      ALA 101  14.231   1.200   8.883
  Start of MODEL   25
17655    HB3  ALA 101           HB3      ALA 101  14.199   2.908   8.442
  Start of MODEL   25
17656    H    ALA 101           HN       ALA 101  12.083   1.172   7.691
  Start of MODEL   25
17657    HA   PHE 102           HA       PHE 102  14.428  -2.018   5.040
  Start of MODEL   25
17658    HB3  PHE 102           HB2      PHE 102  15.147  -2.308   2.746
  Start of MODEL   25
17659    HB2  PHE 102           HB3      PHE 102  15.686  -0.636   2.655
  Start of MODEL   25
17660    HD1  PHE 102           HD1      PHE 102  12.519  -2.277   3.773
  Start of MODEL   25
17661    HD2  PHE 102           HD2      PHE 102  14.380   0.584   1.240
  Start of MODEL   25
17662    HE1  PHE 102           HE1      PHE 102  10.315  -1.618   2.910
  Start of MODEL   25
17663    HE2  PHE 102           HE2      PHE 102  12.191   1.249   0.377
  Start of MODEL   25
17664    HZ   PHE 102           HZ       PHE 102  10.144   0.149   1.211
  Start of MODEL   25
17665    H    PHE 102           HN       PHE 102  14.538   0.807   4.555
  Start of MODEL   25
17666    HA   MET 103           HA       MET 103  18.868  -1.344   5.803
  Start of MODEL   25
17667    HB3  MET 103           HB2      MET 103  18.989  -2.814   3.879
  Start of MODEL   25
17668    HB2  MET 103           HB3      MET 103  20.536  -2.010   4.111
  Start of MODEL   25
17669    HG2  MET 103           HG2      MET 103  18.459  -1.247   2.068
  Start of MODEL   25
17670    HG3  MET 103           HG3      MET 103  20.053  -0.514   2.262
  Start of MODEL   25
17671    HE1  MET 103           HE1      MET 103  20.528  -0.945  -0.341
  Start of MODEL   25
17672    HE3  MET 103           HE2      MET 103  18.932  -1.675  -0.499
  Start of MODEL   25
17673    HE2  MET 103           HE3      MET 103  20.350  -2.520  -1.117
  Start of MODEL   25
17674    H    MET 103           HN       MET 103  17.204  -0.117   3.817
  Start of MODEL   25
17675    HA   ASP 104           HA       ASP 104  20.273   2.687   5.925
  Start of MODEL   25
17676    HB3  ASP 104           HB2      ASP 104  22.328   1.012   7.369
  Start of MODEL   25
17677    HB2  ASP 104           HB3      ASP 104  20.949   1.845   8.066
  Start of MODEL   25
17678    H    ASP 104           HN       ASP 104  20.646  -0.136   6.240
  Start of MODEL   25
17679    HA   ASN 105           HA       ASN 105  22.683   3.391   2.394
  Start of MODEL   25
17680    HB3  ASN 105           HB2      ASN 105  22.585   5.973   3.949
  Start of MODEL   25
17681    HB2  ASN 105           HB3      ASN 105  21.677   5.530   2.513
  Start of MODEL   25
17682   HD21  ASN 105          HD21      ASN 105  24.723   6.706   3.716
  Start of MODEL   25
17683   HD22  ASN 105          HD22      ASN 105  25.395   7.150   2.210
  Start of MODEL   25
17684    H    ASN 105           HN       ASN 105  21.353   4.065   4.720
  Start of MODEL   25
17685    HA   PRO 106           HA       PRO 106  26.807   2.713   4.080
  Start of MODEL   25
17686    HB3  PRO 106           HB2      PRO 106  27.384   0.838   2.920
  Start of MODEL   25
17687    HB2  PRO 106           HB3      PRO 106  27.493   1.776   1.432
  Start of MODEL   25
17688    HG2  PRO 106           HG2      PRO 106  25.669   0.560   0.814
  Start of MODEL   25
17689    HG3  PRO 106           HG3      PRO 106  25.250   0.183   2.493
  Start of MODEL   25
17690    HD2  PRO 106           HD2      PRO 106  24.580   2.595   0.863
  Start of MODEL   25
17691    HD3  PRO 106           HD3      PRO 106  23.601   1.708   2.059
  Start of MODEL   25
17692    HA   PHE 107           HA       PHE 107  30.016   5.515   3.190
  Start of MODEL   25
17693    HB3  PHE 107           HB2      PHE 107  30.206   6.192   0.756
  Start of MODEL   25
17694    HB2  PHE 107           HB3      PHE 107  28.912   5.043   0.416
  Start of MODEL   25
17695    HD1  PHE 107           HD1      PHE 107  32.394   5.391   1.548
  Start of MODEL   25
17696    HD2  PHE 107           HD2      PHE 107  29.321   2.684   0.393
  Start of MODEL   25
17697    HE1  PHE 107           HE1      PHE 107  34.052   3.583   1.396
  Start of MODEL   25
17698    HE2  PHE 107           HE2      PHE 107  30.981   0.869   0.244
  Start of MODEL   25
17699    HZ   PHE 107           HZ       PHE 107  33.342   1.319   0.746
  Start of MODEL   25
17700    H    PHE 107           HN       PHE 107  28.688   3.829   3.731

  No H/Q in entry =       17700