NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
611533 |
2nan   |
25802 | cing | 1-original | 6 | XPLOR/CNS | distance | NOE | ambi |
assign (resid 23 and name HB2) (resid 23 and name HB1) 2.048 0.524 0.524 weight 1.000 ! spec=HCH, no=5, id=3109, vol=1.740000e+08
assign (resid 23 and name HB2) (resid 31 and name HE22) 3.329 1.386 1.386 weight 1.000 ! spec=HCH, no=6, id=3110, vol=9.410000e+06
assign (resid 23 and name HB2) (resid 23 and name HA) 2.992 1.119 1.119 weight 1.000 ! spec=HCH, no=11, id=3115, vol=1.790000e+07
assign (resid 23 and name HB1) (resid 23 and name HA) 2.620 0.858 0.858 weight 1.000 ! spec=HCH, no=12, id=3116, vol=3.960000e+07
assign (resid 23 and name HB2) (resid 24 and name HN) 3.654 1.669 1.669 weight 1.000 ! spec=HCH, no=14, id=3118, vol=5.390000e+06
assign (resid 23 and name HB2) (resid 157 and name HD12) 3.043 1.158 1.158 weight 1.000 ! spec=HCH, no=16, id=3120, vol=1.610000e+07
or (resid 23 and name HB2) (resid 157 and name HD11)
or (resid 23 and name HB2) (resid 157 and name HD13)
assign (resid 23 and name HB1) (resid 157 and name HD12) 2.683 0.900 0.900 weight 1.000 ! spec=HCH, no=17, id=3121, vol=3.440000e+07
or (resid 23 and name HB1) (resid 157 and name HD11)
or (resid 23 and name HB1) (resid 157 and name HD13)
assign (resid 24 and name HA) (resid 24 and name HB1) 2.718 0.923 0.923 weight 1.000 ! spec=HCH, no=23, id=3125, vol=3.180000e+07
assign (resid 24 and name HA) (resid 25 and name HD2) 2.820 0.994 0.994 weight 1.000 ! spec=HCH, no=24, id=3126, vol=2.550000e+07
assign (resid 24 and name HA) (resid 25 and name HD1) 2.581 0.833 0.833 weight 1.000 ! spec=HCH, no=25, id=3127, vol=4.340000e+07
assign (resid 24 and name HA) (resid 157 and name HG22) 3.202 1.281 1.281 weight 1.000 ! spec=HCH, no=26, id=3128, vol=1.190000e+07
or (resid 24 and name HA) (resid 157 and name HG21)
or (resid 24 and name HA) (resid 157 and name HG23)
assign (resid 26 and name HN) (resid 24 and name HB2) 3.525 1.553 1.553 weight 1.000 ! spec=HCH, no=27, id=3129, vol=6.690000e+06
assign (resid 24 and name HB2) (resid 24 and name HN) 3.122 1.219 1.219 weight 1.000 ! spec=HCH, no=28, id=3130, vol=1.380000e+07
assign (resid 24 and name HB2) (resid 25 and name HD2) 3.170 1.256 1.256 weight 1.000 ! spec=HCH, no=31, id=3133, vol=1.260000e+07
assign (resid 24 and name HB1) (resid 25 and name HB2) 3.700 1.711 1.711 weight 1.000 ! spec=HCH, no=39, id=3140, vol=5.000000e+06
assign (resid 24 and name HB1) (resid 29 and name HE3) 3.681 1.694 1.694 weight 1.000 ! spec=HCH, no=41, id=3142, vol=5.150000e+06
assign (resid 24 and name HB2) (resid 29 and name HB2) 2.777 0.964 0.964 weight 1.000 ! spec=HCH, no=42, id=3143, vol=2.800000e+07
assign (resid 25 and name HA) (resid 25 and name HD2) 3.510 1.540 1.540 weight 1.000 ! spec=HCH, no=46, id=3147, vol=6.860000e+06
assign (resid 25 and name HA) (resid 25 and name HB1) 2.588 0.837 0.837 weight 1.000 ! spec=HCH, no=47, id=3148, vol=4.270000e+07
assign (resid 25 and name HA) (resid 25 and name HG2) 3.159 1.247 1.247 weight 1.000 ! spec=HCH, no=49, id=3150, vol=1.290000e+07
assign (resid 25 and name HB2) (resid 25 and name HD2) 3.444 1.482 1.482 weight 1.000 ! spec=HCH, no=51, id=3152, vol=7.690000e+06
assign (resid 25 and name HB2) (resid 25 and name HA) 3.217 1.293 1.293 weight 1.000 ! spec=HCH, no=53, id=3154, vol=1.160000e+07
assign (resid 25 and name HB1) (resid 25 and name HB2) 2.336 0.682 0.682 weight 1.000 ! spec=HCH, no=56, id=3156, vol=7.890000e+07
assign (resid 25 and name HB2) (resid 25 and name HD1) 3.686 1.698 1.698 weight 1.000 ! spec=HCH, no=58, id=3158, vol=5.120000e+06
assign (resid 25 and name HB1) (resid 25 and name HD1) 3.501 1.532 1.532 weight 1.000 ! spec=HCH, no=59, id=3159, vol=6.970000e+06
assign (resid 25 and name HB2) (resid 25 and name HG2) 2.983 1.112 1.112 weight 1.000 ! spec=HCH, no=60, id=3160, vol=1.820000e+07
assign (resid 25 and name HB1) (resid 25 and name HG2) 2.654 0.881 0.881 weight 1.000 ! spec=HCH, no=61, id=3161, vol=3.670000e+07
assign (resid 25 and name HD2) (resid 25 and name HB1) 3.518 1.547 1.547 weight 1.000 ! spec=HCH, no=68, id=3168, vol=6.760000e+06
assign (resid 25 and name HD2) (resid 24 and name HB1) 3.051 1.163 1.163 weight 1.000 ! spec=HCH, no=75, id=3175, vol=1.590000e+07
assign (resid 25 and name HD1) (resid 24 and name HB1) 2.977 1.108 1.108 weight 1.000 ! spec=HCH, no=76, id=3176, vol=1.840000e+07
assign (resid 25 and name HD1) (resid 25 and name HA) 3.678 1.691 1.691 weight 1.000 ! spec=HCH, no=77, id=3177, vol=5.180000e+06
assign (resid 25 and name HD1) (resid 25 and name HD2) 2.606 0.849 0.849 weight 1.000 ! spec=HCH, no=79, id=3178, vol=4.090000e+07
assign (resid 25 and name HD2) (resid 25 and name HG2) 3.113 1.211 1.211 weight 1.000 ! spec=HCH, no=82, id=3180, vol=1.410000e+07
assign (resid 25 and name HD1) (resid 25 and name HG2) 2.900 1.051 1.051 weight 1.000 ! spec=HCH, no=83, id=3181, vol=2.160000e+07
assign (resid 25 and name HD1) (resid 25 and name HG1) 2.884 1.040 1.040 weight 1.000 ! spec=HCH, no=84, id=3182, vol=2.230000e+07
assign (resid 25 and name HG2) (resid 24 and name HA) 3.701 1.712 1.712 weight 1.000 ! spec=HCH, no=89, id=3186, vol=4.990000e+06
assign (resid 25 and name HG2) (resid 24 and name HB1) 3.515 1.544 1.544 weight 1.000 ! spec=HCH, no=90, id=3187, vol=6.800000e+06
assign (resid 25 and name HG1) (resid 25 and name HA) 3.449 1.487 1.487 weight 1.000 ! spec=HCH, no=92, id=3189, vol=7.620000e+06
assign (resid 25 and name HG1) (resid 25 and name HB1) 2.956 1.092 1.092 weight 1.000 ! spec=HCH, no=94, id=3191, vol=1.920000e+07
assign (resid 25 and name HG1) (resid 25 and name HG2) 2.405 0.723 0.723 weight 1.000 ! spec=HCH, no=98, id=3194, vol=6.620000e+07
assign (resid 26 and name HB2) (resid 26 and name HA) 2.725 0.928 0.928 weight 1.000 ! spec=HCH, no=106, id=3201, vol=3.130000e+07
assign (resid 26 and name HB1) (resid 26 and name HA) 2.659 0.884 0.884 weight 1.000 ! spec=HCH, no=107, id=3202, vol=3.630000e+07
assign (resid 26 and name HB1) (resid 26 and name HB2) 2.301 0.662 0.662 weight 1.000 ! spec=HCH, no=109, id=3203, vol=8.630000e+07
assign (resid 27 and name HA) (resid 27 and name HB2) 2.279 0.649 0.649 weight 1.000 ! spec=HCH, no=113, id=3205, vol=9.150000e+07
assign (resid 27 and name HA) (resid 27 and name HB1) 2.342 0.686 0.686 weight 1.000 ! spec=HCH, no=114, id=3206, vol=7.770000e+07
assign (resid 27 and name HA) (resid 29 and name HB2) 3.771 1.778 1.778 weight 1.000 ! spec=HCH, no=115, id=3207, vol=4.460000e+06
assign (resid 27 and name HB1) (resid 27 and name HB2) 1.985 0.492 0.492 weight 1.000 ! spec=HCH, no=118, id=3210, vol=2.100000e+08
assign (resid 29 and name HN) (resid 28 and name HA) 3.063 1.173 1.173 weight 1.000 ! spec=HCH, no=126, id=3216, vol=1.550000e+07
assign (resid 28 and name HB) (resid 28 and name HA) 2.439 0.744 0.744 weight 1.000 ! spec=HCH, no=130, id=3220, vol=6.090000e+07
assign (resid 29 and name HN) (resid 28 and name HB) 3.238 1.311 1.311 weight 1.000 ! spec=HCH, no=133, id=3222, vol=1.110000e+07
assign (resid 28 and name HB) (resid 29 and name HA) 4.060 2.060 2.060 weight 1.000 ! spec=HCH, no=134, id=3223, vol=2.860000e+06
assign (resid 28 and name HB) (resid 38 and name HG11) 3.639 1.655 1.655 weight 1.000 ! spec=HCH, no=136, id=3225, vol=5.520000e+06
assign (resid 28 and name HB) (resid 38 and name HD12) 2.708 0.916 0.916 weight 1.000 ! spec=HCH, no=137, id=3226, vol=3.250000e+07
or (resid 28 and name HB) (resid 38 and name HD11)
or (resid 28 and name HB) (resid 38 and name HD13)
assign (resid 28 and name HG21) (resid 82 and name HG2) 3.310 1.369 1.369 weight 1.000 ! spec=HCH, no=141, id=3230, vol=9.760000e+06
or (resid 28 and name HG22) (resid 82 and name HG2)
or (resid 28 and name HG23) (resid 82 and name HG2)
assign (resid 28 and name HG21) (resid 39 and name HN) 3.604 1.624 1.624 weight 1.000 ! spec=HCH, no=144, id=3233, vol=5.850000e+06
or (resid 28 and name HG22) (resid 39 and name HN)
or (resid 28 and name HG23) (resid 39 and name HN)
assign (resid 29 and name HN) (resid 28 and name HG21) 3.181 1.265 1.265 weight 1.000 ! spec=HCH, no=147, id=3236, vol=1.240000e+07
or (resid 29 and name HN) (resid 28 and name HG22)
or (resid 29 and name HN) (resid 28 and name HG23)
assign (resid 28 and name HG21) (resid 29 and name HA) 3.374 1.423 1.423 weight 1.000 ! spec=HCH, no=150, id=3238, vol=8.690000e+06
or (resid 28 and name HG22) (resid 29 and name HA)
or (resid 28 and name HG23) (resid 29 and name HA)
assign (resid 28 and name HA) (resid 28 and name HG21) 2.310 0.667 0.667 weight 1.000 ! spec=HCH, no=152, id=3240, vol=8.450000e+07
or (resid 28 and name HA) (resid 28 and name HG22)
or (resid 28 and name HA) (resid 28 and name HG23)
assign (resid 28 and name HB) (resid 28 and name HG21) 2.187 0.598 0.598 weight 1.000 ! spec=HCH, no=153, id=3241, vol=1.170000e+08
or (resid 28 and name HB) (resid 28 and name HG22)
or (resid 28 and name HB) (resid 28 and name HG23)
assign (resid 28 and name HG21) (resid 28 and name HG22) 1.084 0.147 0.147 weight 1.000 ! spec=HCH, no=154, id=3242, vol=7.910000e+09
or (resid 28 and name HG21) (resid 28 and name HG23)
or (resid 28 and name HG21) (resid 28 and name HG22)
or (resid 28 and name HG22) (resid 28 and name HG23)
or (resid 28 and name HG21) (resid 28 and name HG23)
or (resid 28 and name HG22) (resid 28 and name HG23)
assign (resid 28 and name HG21) (resid 29 and name HE1) 3.914 1.915 1.915 weight 1.000 ! spec=HCH, no=157, id=3245, vol=3.570000e+06
or (resid 28 and name HG22) (resid 29 and name HE1)
or (resid 28 and name HG23) (resid 29 and name HE1)
assign (resid 28 and name HG21) (resid 38 and name HB) 3.128 1.223 1.223 weight 1.000 ! spec=HCH, no=158, id=3246, vol=1.370000e+07
or (resid 28 and name HG22) (resid 38 and name HB)
or (resid 28 and name HG23) (resid 38 and name HB)
assign (resid 28 and name HG21) (resid 38 and name HG12) 2.864 1.025 1.025 weight 1.000 ! spec=HCH, no=159, id=3247, vol=2.320000e+07
or (resid 28 and name HG22) (resid 38 and name HG12)
or (resid 28 and name HG23) (resid 38 and name HG12)
assign (resid 28 and name HG21) (resid 38 and name HG11) 2.576 0.829 0.829 weight 1.000 ! spec=HCH, no=160, id=3248, vol=4.390000e+07
or (resid 28 and name HG22) (resid 38 and name HG11)
or (resid 28 and name HG23) (resid 38 and name HG11)
assign (resid 28 and name HG21) (resid 38 and name HD12) 2.278 0.649 0.649 weight 1.000 ! spec=HCH, no=161, id=3249, vol=9.170000e+07
or (resid 28 and name HG21) (resid 38 and name HD11)
or (resid 28 and name HG21) (resid 38 and name HD13)
or (resid 28 and name HG22) (resid 38 and name HD12)
or (resid 28 and name HG22) (resid 38 and name HD11)
or (resid 28 and name HG22) (resid 38 and name HD13)
or (resid 28 and name HG23) (resid 38 and name HD12)
or (resid 28 and name HG23) (resid 38 and name HD11)
or (resid 28 and name HG23) (resid 38 and name HD13)
assign (resid 28 and name HG21) (resid 38 and name HG22) 3.262 1.330 1.330 weight 1.000 ! spec=HCH, no=162, id=3250, vol=1.070000e+07
or (resid 28 and name HG21) (resid 38 and name HG21)
or (resid 28 and name HG21) (resid 38 and name HG23)
or (resid 28 and name HG22) (resid 38 and name HG22)
or (resid 28 and name HG22) (resid 38 and name HG21)
or (resid 28 and name HG22) (resid 38 and name HG23)
or (resid 28 and name HG23) (resid 38 and name HG22)
or (resid 28 and name HG23) (resid 38 and name HG21)
or (resid 28 and name HG23) (resid 38 and name HG23)
assign (resid 29 and name HA) (resid 29 and name HB2) 2.685 0.901 0.901 weight 1.000 ! spec=HCH, no=163, id=3251, vol=3.420000e+07
assign (resid 30 and name HN) (resid 29 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=HCH, no=164, id=3252, vol=4.230000e+07
assign (resid 30 and name HN) (resid 29 and name HB2) 3.665 1.679 1.679 weight 1.000 ! spec=HCH, no=168, id=3256, vol=5.290000e+06
assign (resid 29 and name HB2) (resid 37 and name HN) 3.935 1.936 1.936 weight 1.000 ! spec=HCH, no=169, id=3257, vol=3.450000e+06
assign (resid 30 and name HB) (resid 29 and name HA) 3.603 1.622 1.622 weight 1.000 ! spec=HCH, no=175, id=3263, vol=5.860000e+06
assign (resid 30 and name HB) (resid 74 and name HE1) 3.396 1.442 1.442 weight 1.000 ! spec=HCH, no=183, id=3269, vol=8.350000e+06
assign (resid 30 and name HB) (resid 30 and name HA) 3.072 1.180 1.180 weight 1.000 ! spec=HCH, no=187, id=3273, vol=1.530000e+07
assign (resid 30 and name HB) (resid 31 and name HN) 3.602 1.622 1.622 weight 1.000 ! spec=HCH, no=191, id=3276, vol=5.870000e+06
assign (resid 30 and name HB) (resid 31 and name HA) 3.612 1.631 1.631 weight 1.000 ! spec=HCH, no=192, id=3277, vol=5.780000e+06
assign (resid 30 and name HB) (resid 37 and name HA) 3.983 1.983 1.983 weight 1.000 ! spec=HCH, no=193, id=3278, vol=3.210000e+06
assign (resid 30 and name HB) (resid 83 and name HZ2) 3.216 1.293 1.293 weight 1.000 ! spec=HCH, no=195, id=3280, vol=1.160000e+07
assign (resid 30 and name HD12) (resid 37 and name HA) 4.027 2.027 2.027 weight 1.000 ! spec=HCH, no=196, id=3281, vol=3.010000e+06
or (resid 30 and name HD11) (resid 37 and name HA)
or (resid 30 and name HD13) (resid 37 and name HA)
assign (resid 30 and name HD12) (resid 78 and name HG21) 2.258 0.637 0.637 weight 1.000 ! spec=HCH, no=198, id=3283, vol=9.680000e+07
or (resid 30 and name HD12) (resid 78 and name HG22)
or (resid 30 and name HD12) (resid 78 and name HG23)
or (resid 30 and name HD11) (resid 78 and name HG21)
or (resid 30 and name HD11) (resid 78 and name HG22)
or (resid 30 and name HD11) (resid 78 and name HG23)
or (resid 30 and name HD13) (resid 78 and name HG21)
or (resid 30 and name HD13) (resid 78 and name HG22)
or (resid 30 and name HD13) (resid 78 and name HG23)
assign (resid 30 and name HD12) (resid 78 and name HA) 3.462 1.498 1.498 weight 1.000 ! spec=HCH, no=200, id=3285, vol=7.450000e+06
or (resid 30 and name HD11) (resid 78 and name HA)
or (resid 30 and name HD13) (resid 78 and name HA)
assign (resid 30 and name HD12) (resid 29 and name HA) 3.412 1.455 1.455 weight 1.000 ! spec=HCH, no=201, id=3286, vol=8.130000e+06
or (resid 30 and name HD11) (resid 29 and name HA)
or (resid 30 and name HD13) (resid 29 and name HA)
assign (resid 30 and name HN) (resid 30 and name HD12) 3.249 1.320 1.320 weight 1.000 ! spec=HCH, no=203, id=3288, vol=1.090000e+07
or (resid 30 and name HN) (resid 30 and name HD11)
or (resid 30 and name HN) (resid 30 and name HD13)
assign (resid 30 and name HD12) (resid 30 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=HCH, no=204, id=3289, vol=2.320000e+07
or (resid 30 and name HD11) (resid 30 and name HA)
or (resid 30 and name HD13) (resid 30 and name HA)
assign (resid 30 and name HB) (resid 30 and name HD12) 2.367 0.700 0.700 weight 1.000 ! spec=HCH, no=205, id=3290, vol=7.290000e+07
or (resid 30 and name HB) (resid 30 and name HD11)
or (resid 30 and name HB) (resid 30 and name HD13)
assign (resid 30 and name HD12) (resid 30 and name HG12) 2.128 0.566 0.566 weight 1.000 ! spec=HCH, no=206, id=3291, vol=1.380000e+08
or (resid 30 and name HD11) (resid 30 and name HG12)
or (resid 30 and name HD13) (resid 30 and name HG12)
assign (resid 30 and name HD12) (resid 82 and name HB1) 2.171 0.589 0.589 weight 1.000 ! spec=HCH, no=209, id=3294, vol=1.220000e+08
or (resid 30 and name HD11) (resid 82 and name HB1)
or (resid 30 and name HD13) (resid 82 and name HB1)
assign (resid 82 and name HE22) (resid 30 and name HD12) 2.862 1.024 1.024 weight 1.000 ! spec=HCH, no=210, id=3295, vol=2.330000e+07
or (resid 82 and name HE22) (resid 30 and name HD11)
or (resid 82 and name HE22) (resid 30 and name HD13)
assign (resid 30 and name HD12) (resid 82 and name HG2) 2.367 0.700 0.700 weight 1.000 ! spec=HCH, no=211, id=3296, vol=7.290000e+07
or (resid 30 and name HD11) (resid 82 and name HG2)
or (resid 30 and name HD13) (resid 82 and name HG2)
assign (resid 30 and name HG12) (resid 30 and name HA) 2.821 0.995 0.995 weight 1.000 ! spec=HCH, no=214, id=3299, vol=2.540000e+07
assign (resid 30 and name HG12) (resid 30 and name HG11) 2.106 0.554 0.554 weight 1.000 ! spec=HCH, no=215, id=3300, vol=1.470000e+08
assign (resid 30 and name HN) (resid 30 and name HG11) 3.145 1.236 1.236 weight 1.000 ! spec=HCH, no=223, id=3308, vol=1.330000e+07
assign (resid 30 and name HG11) (resid 30 and name HA) 3.136 1.229 1.229 weight 1.000 ! spec=HCH, no=224, id=3309, vol=1.350000e+07
assign (resid 30 and name HG12) (resid 30 and name HB) 3.034 1.151 1.151 weight 1.000 ! spec=HCH, no=225, id=3310, vol=1.640000e+07
assign (resid 30 and name HB) (resid 30 and name HG11) 2.658 0.883 0.883 weight 1.000 ! spec=HCH, no=226, id=3311, vol=3.640000e+07
assign (resid 30 and name HG11) (resid 30 and name HD12) 2.510 0.788 0.788 weight 1.000 ! spec=HCH, no=229, id=3313, vol=5.130000e+07
or (resid 30 and name HG11) (resid 30 and name HD11)
or (resid 30 and name HG11) (resid 30 and name HD13)
assign (resid 30 and name HG11) (resid 78 and name HG21) 3.456 1.493 1.493 weight 1.000 ! spec=HCH, no=234, id=3318, vol=7.520000e+06
or (resid 30 and name HG11) (resid 78 and name HG22)
or (resid 30 and name HG11) (resid 78 and name HG23)
assign (resid 82 and name HE22) (resid 30 and name HG12) 3.796 1.801 1.801 weight 1.000 ! spec=HCH, no=235, id=3319, vol=4.290000e+06
assign (resid 32 and name HN) (resid 30 and name HG22) 3.424 1.466 1.466 weight 1.000 ! spec=HCH, no=242, id=3324, vol=7.950000e+06
or (resid 32 and name HN) (resid 30 and name HG21)
or (resid 32 and name HN) (resid 30 and name HG23)
assign (resid 30 and name HG22) (resid 78 and name HN) 3.854 1.857 1.857 weight 1.000 ! spec=HCH, no=248, id=3330, vol=3.910000e+06
or (resid 30 and name HG21) (resid 78 and name HN)
or (resid 30 and name HG23) (resid 78 and name HN)
assign (resid 30 and name HN) (resid 30 and name HG22) 3.016 1.137 1.137 weight 1.000 ! spec=HCH, no=251, id=3333, vol=1.710000e+07
or (resid 30 and name HN) (resid 30 and name HG21)
or (resid 30 and name HN) (resid 30 and name HG23)
assign (resid 30 and name HG22) (resid 30 and name HA) 2.310 0.667 0.667 weight 1.000 ! spec=HCH, no=252, id=3334, vol=8.450000e+07
or (resid 30 and name HG21) (resid 30 and name HA)
or (resid 30 and name HG23) (resid 30 and name HA)
assign (resid 30 and name HB) (resid 30 and name HG22) 2.152 0.579 0.579 weight 1.000 ! spec=HCH, no=253, id=3335, vol=1.290000e+08
or (resid 30 and name HB) (resid 30 and name HG21)
or (resid 30 and name HB) (resid 30 and name HG23)
assign (resid 30 and name HG11) (resid 30 and name HG22) 2.494 0.778 0.778 weight 1.000 ! spec=HCH, no=254, id=3336, vol=5.320000e+07
or (resid 30 and name HG11) (resid 30 and name HG21)
or (resid 30 and name HG11) (resid 30 and name HG23)
assign (resid 30 and name HG22) (resid 30 and name HD12) 2.147 0.576 0.576 weight 1.000 ! spec=HCH, no=255, id=3337, vol=1.310000e+08
or (resid 30 and name HG22) (resid 30 and name HD11)
or (resid 30 and name HG22) (resid 30 and name HD13)
or (resid 30 and name HG21) (resid 30 and name HD12)
or (resid 30 and name HG21) (resid 30 and name HD11)
or (resid 30 and name HG21) (resid 30 and name HD13)
or (resid 30 and name HG23) (resid 30 and name HD12)
or (resid 30 and name HG23) (resid 30 and name HD11)
or (resid 30 and name HG23) (resid 30 and name HD13)
assign (resid 30 and name HG22) (resid 30 and name HG21) 1.215 0.185 0.185 weight 1.000 ! spec=HCH, no=256, id=3338, vol=3.980000e+09
or (resid 30 and name HG22) (resid 30 and name HG23)
or (resid 30 and name HG22) (resid 30 and name HG21)
or (resid 30 and name HG21) (resid 30 and name HG23)
or (resid 30 and name HG22) (resid 30 and name HG23)
or (resid 30 and name HG21) (resid 30 and name HG23)
assign (resid 31 and name HN) (resid 30 and name HG22) 2.370 0.702 0.702 weight 1.000 ! spec=HCH, no=257, id=3339, vol=7.230000e+07
or (resid 31 and name HN) (resid 30 and name HG21)
or (resid 31 and name HN) (resid 30 and name HG23)
assign (resid 30 and name HG22) (resid 31 and name HA) 3.433 1.474 1.474 weight 1.000 ! spec=HCH, no=258, id=3340, vol=7.830000e+06
or (resid 30 and name HG21) (resid 31 and name HA)
or (resid 30 and name HG23) (resid 31 and name HA)
assign (resid 30 and name HG22) (resid 36 and name HA) 3.607 1.626 1.626 weight 1.000 ! spec=HCH, no=259, id=3341, vol=5.820000e+06
or (resid 30 and name HG21) (resid 36 and name HA)
or (resid 30 and name HG23) (resid 36 and name HA)
assign (resid 37 and name HN) (resid 30 and name HG22) 3.489 1.521 1.521 weight 1.000 ! spec=HCH, no=260, id=3342, vol=7.110000e+06
or (resid 37 and name HN) (resid 30 and name HG21)
or (resid 37 and name HN) (resid 30 and name HG23)
assign (resid 30 and name HG22) (resid 37 and name HB2) 3.409 1.452 1.452 weight 1.000 ! spec=HCH, no=261, id=3343, vol=8.180000e+06
or (resid 30 and name HG21) (resid 37 and name HB2)
or (resid 30 and name HG23) (resid 37 and name HB2)
assign (resid 30 and name HG22) (resid 37 and name HB1) 2.998 1.124 1.124 weight 1.000 ! spec=HCH, no=262, id=3344, vol=1.770000e+07
or (resid 30 and name HG21) (resid 37 and name HB1)
or (resid 30 and name HG23) (resid 37 and name HB1)
assign (resid 30 and name HG22) (resid 37 and name HD1) 2.935 1.077 1.077 weight 1.000 ! spec=HCH, no=263, id=3345, vol=2.000000e+07
or (resid 30 and name HG21) (resid 37 and name HD1)
or (resid 30 and name HG23) (resid 37 and name HD1)
assign (resid 30 and name HG22) (resid 78 and name HA) 3.826 1.830 1.830 weight 1.000 ! spec=HCH, no=266, id=3348, vol=4.090000e+06
or (resid 30 and name HG21) (resid 78 and name HA)
or (resid 30 and name HG23) (resid 78 and name HA)
assign (resid 30 and name HG22) (resid 78 and name HG21) 2.697 0.909 0.909 weight 1.000 ! spec=HCH, no=267, id=3349, vol=3.330000e+07
or (resid 30 and name HG22) (resid 78 and name HG22)
or (resid 30 and name HG22) (resid 78 and name HG23)
or (resid 30 and name HG21) (resid 78 and name HG21)
or (resid 30 and name HG21) (resid 78 and name HG22)
or (resid 30 and name HG21) (resid 78 and name HG23)
or (resid 30 and name HG23) (resid 78 and name HG21)
or (resid 30 and name HG23) (resid 78 and name HG22)
or (resid 30 and name HG23) (resid 78 and name HG23)
assign (resid 30 and name HG22) (resid 81 and name HE2) 3.614 1.632 1.632 weight 1.000 ! spec=HCH, no=268, id=3350, vol=5.760000e+06
or (resid 30 and name HG21) (resid 81 and name HE2)
or (resid 30 and name HG23) (resid 81 and name HE2)
assign (resid 30 and name HG22) (resid 82 and name HN) 3.950 1.950 1.950 weight 1.000 ! spec=HCH, no=269, id=3351, vol=3.380000e+06
or (resid 30 and name HG21) (resid 82 and name HN)
or (resid 30 and name HG23) (resid 82 and name HN)
assign (resid 31 and name HA) (resid 31 and name HB2) 2.598 0.844 0.844 weight 1.000 ! spec=HCH, no=278, id=3360, vol=4.170000e+07
or (resid 31 and name HA) (resid 31 and name HB1)
assign (resid 31 and name HA) (resid 32 and name HA) 4.009 2.009 2.009 weight 1.000 ! spec=HCH, no=282, id=3364, vol=3.090000e+06
assign (resid 31 and name HA) (resid 36 and name HA) 2.840 1.008 1.008 weight 1.000 ! spec=HCH, no=283, id=3365, vol=2.450000e+07
assign (resid 31 and name HA) (resid 36 and name HB2) 3.666 1.680 1.680 weight 1.000 ! spec=HCH, no=284, id=3366, vol=5.280000e+06
assign (resid 31 and name HB2) (resid 24 and name HA) 3.942 1.942 1.942 weight 1.000 ! spec=HCH, no=288, id=3370, vol=3.420000e+06
assign (resid 31 and name HA) (resid 31 and name HB2) 2.914 1.061 1.061 weight 1.000 ! spec=HCH, no=290, id=3372, vol=2.100000e+07
assign (resid 31 and name HB2) (resid 157 and name HD12) 3.264 1.332 1.332 weight 1.000 ! spec=HCH, no=291, id=3373, vol=1.060000e+07
or (resid 31 and name HB2) (resid 157 and name HD11)
or (resid 31 and name HB2) (resid 157 and name HD13)
assign (resid 31 and name HG2) (resid 34 and name HA) 3.191 1.273 1.273 weight 1.000 ! spec=HCH, no=293, id=3375, vol=1.210000e+07
assign (resid 31 and name HG2) (resid 31 and name HN) 3.357 1.409 1.409 weight 1.000 ! spec=HCH, no=302, id=3384, vol=8.960000e+06
assign (resid 31 and name HG1) (resid 31 and name HN) 3.284 1.348 1.348 weight 1.000 ! spec=HCH, no=303, id=3385, vol=1.020000e+07
assign (resid 31 and name HG2) (resid 31 and name HA) 3.027 1.145 1.145 weight 1.000 ! spec=HCH, no=304, id=3386, vol=1.670000e+07
assign (resid 31 and name HG1) (resid 31 and name HA) 2.931 1.074 1.074 weight 1.000 ! spec=HCH, no=305, id=3387, vol=2.020000e+07
assign (resid 31 and name HG2) (resid 32 and name HN) 3.053 1.165 1.165 weight 1.000 ! spec=HCH, no=308, id=3390, vol=1.580000e+07
assign (resid 31 and name HG2) (resid 157 and name HD12) 2.883 1.039 1.039 weight 1.000 ! spec=HCH, no=310, id=3392, vol=2.230000e+07
or (resid 31 and name HG2) (resid 157 and name HD11)
or (resid 31 and name HG2) (resid 157 and name HD13)
assign (resid 32 and name HN) (resid 32 and name HA) 2.981 1.111 1.111 weight 1.000 ! spec=HCH, no=317, id=3399, vol=1.830000e+07
assign (resid 32 and name HA) (resid 32 and name HB2) 2.644 0.874 0.874 weight 1.000 ! spec=HCH, no=318, id=3400, vol=3.750000e+07
assign (resid 32 and name HA) (resid 32 and name HB1) 2.652 0.879 0.879 weight 1.000 ! spec=HCH, no=319, id=3401, vol=3.690000e+07
assign (resid 32 and name HA) (resid 33 and name HA) 3.183 1.266 1.266 weight 1.000 ! spec=HCH, no=322, id=3404, vol=1.230000e+07
assign (resid 32 and name HA) (resid 33 and name HG1) 2.984 1.113 1.113 weight 1.000 ! spec=HCH, no=323, id=3405, vol=1.820000e+07
assign (resid 32 and name HB2) (resid 32 and name HB1) 2.507 0.786 0.786 weight 1.000 ! spec=HCH, no=325, id=3407, vol=5.170000e+07
assign (resid 32 and name HB2) (resid 32 and name HD1) 2.838 1.006 1.006 weight 1.000 ! spec=HCH, no=333, id=3415, vol=2.460000e+07
assign (resid 32 and name HB2) (resid 37 and name HD1) 3.404 1.448 1.448 weight 1.000 ! spec=HCH, no=337, id=3419, vol=8.250000e+06
assign (resid 32 and name HB1) (resid 74 and name HE1) 3.757 1.764 1.764 weight 1.000 ! spec=HCH, no=342, id=3424, vol=4.560000e+06
assign (resid 32 and name HB1) (resid 74 and name HE2) 3.774 1.780 1.780 weight 1.000 ! spec=HCH, no=343, id=3425, vol=4.440000e+06
assign (resid 33 and name HA) (resid 33 and name HB2) 2.405 0.723 0.723 weight 1.000 ! spec=HCH, no=345, id=3427, vol=6.620000e+07
or (resid 33 and name HA) (resid 33 and name HB1)
assign (resid 33 and name HE21) (resid 33 and name HA) 3.826 1.830 1.830 weight 1.000 ! spec=HCH, no=351, id=3432, vol=4.090000e+06
assign (resid 33 and name HA) (resid 33 and name HG2) 2.830 1.001 1.001 weight 1.000 ! spec=HCH, no=352, id=3433, vol=2.500000e+07
assign (resid 33 and name HA) (resid 33 and name HG1) 2.572 0.827 0.827 weight 1.000 ! spec=HCH, no=353, id=3434, vol=4.430000e+07
assign (resid 33 and name HA) (resid 34 and name HA) 3.841 1.844 1.844 weight 1.000 ! spec=HCH, no=354, id=3435, vol=3.990000e+06
assign (resid 33 and name HN) (resid 33 and name HB2) 3.543 1.569 1.569 weight 1.000 ! spec=HCH, no=358, id=3439, vol=6.480000e+06
assign (resid 33 and name HA) (resid 33 and name HB2) 2.771 0.960 0.960 weight 1.000 ! spec=HCH, no=359, id=3440, vol=2.830000e+07
assign (resid 33 and name HE21) (resid 33 and name HB2) 3.447 1.486 1.486 weight 1.000 ! spec=HCH, no=360, id=3441, vol=7.640000e+06
assign (resid 33 and name HB2) (resid 34 and name HB2) 3.812 1.817 1.817 weight 1.000 ! spec=HCH, no=363, id=3443, vol=4.180000e+06
assign (resid 33 and name HG1) (resid 33 and name HG2) 2.220 0.616 0.616 weight 1.000 ! spec=HCH, no=377, id=3456, vol=1.070000e+08
assign (resid 33 and name HB2) (resid 33 and name HG2) 2.578 0.831 0.831 weight 1.000 ! spec=HCH, no=380, id=3458, vol=4.370000e+07
assign (resid 33 and name HB2) (resid 33 and name HG1) 2.358 0.695 0.695 weight 1.000 ! spec=HCH, no=381, id=3459, vol=7.460000e+07
assign (resid 34 and name HB2) (resid 34 and name HA) 2.464 0.759 0.759 weight 1.000 ! spec=HCH, no=397, id=3474, vol=5.730000e+07
assign (resid 35 and name HA) (resid 35 and name HB1) 3.110 1.209 1.209 weight 1.000 ! spec=HCH, no=405, id=3480, vol=1.420000e+07
assign (resid 35 and name HA) (resid 156 and name HA) 2.675 0.894 0.894 weight 1.000 ! spec=HCH, no=407, id=3482, vol=3.500000e+07
assign (resid 35 and name HA) (resid 156 and name HB2) 2.941 1.081 1.081 weight 1.000 ! spec=HCH, no=408, id=3483, vol=1.980000e+07
or (resid 35 and name HA) (resid 156 and name HB1)
or (resid 35 and name HA) (resid 156 and name HB3)
assign (resid 35 and name HA) (resid 157 and name HG11) 2.941 1.081 1.081 weight 1.000 ! spec=HCH, no=409, id=3484, vol=1.980000e+07
assign (resid 35 and name HA) (resid 157 and name HD12) 3.191 1.273 1.273 weight 1.000 ! spec=HCH, no=410, id=3485, vol=1.220000e+07
or (resid 35 and name HA) (resid 157 and name HD11)
or (resid 35 and name HA) (resid 157 and name HD13)
assign (resid 35 and name HB1) (resid 37 and name HE1) 3.119 1.216 1.216 weight 1.000 ! spec=HCH, no=413, id=3488, vol=1.390000e+07
or (resid 35 and name HB1) (resid 37 and name HE2)
assign (resid 35 and name HN) (resid 35 and name HB2) 3.049 1.162 1.162 weight 1.000 ! spec=HCH, no=414, id=3489, vol=1.600000e+07
assign (resid 35 and name HA) (resid 35 and name HB2) 2.820 0.994 0.994 weight 1.000 ! spec=HCH, no=416, id=3491, vol=2.550000e+07
assign (resid 35 and name HB1) (resid 35 and name HB2) 2.399 0.719 0.719 weight 1.000 ! spec=HCH, no=420, id=3494, vol=6.730000e+07
assign (resid 36 and name HN) (resid 35 and name HB2) 2.781 0.967 0.967 weight 1.000 ! spec=HCH, no=422, id=3495, vol=2.770000e+07
assign (resid 35 and name HB2) (resid 154 and name HG2) 3.102 1.203 1.203 weight 1.000 ! spec=HCH, no=426, id=3499, vol=1.440000e+07
assign (resid 35 and name HB1) (resid 154 and name HG2) 3.626 1.644 1.644 weight 1.000 ! spec=HCH, no=427, id=3500, vol=5.640000e+06
assign (resid 35 and name HB2) (resid 154 and name HG1) 3.350 1.403 1.403 weight 1.000 ! spec=HCH, no=428, id=3501, vol=9.080000e+06
assign (resid 35 and name HB1) (resid 154 and name HG1) 3.669 1.683 1.683 weight 1.000 ! spec=HCH, no=429, id=3502, vol=5.260000e+06
assign (resid 35 and name HB1) (resid 154 and name HD2) 3.746 1.754 1.754 weight 1.000 ! spec=HCH, no=431, id=3504, vol=4.640000e+06
assign (resid 35 and name HB2) (resid 154 and name HE2) 3.239 1.311 1.311 weight 1.000 ! spec=HCH, no=432, id=3505, vol=1.110000e+07
assign (resid 35 and name HB1) (resid 154 and name HE2) 3.540 1.567 1.567 weight 1.000 ! spec=HCH, no=433, id=3506, vol=6.510000e+06
assign (resid 35 and name HB2) (resid 156 and name HA) 3.270 1.337 1.337 weight 1.000 ! spec=HCH, no=435, id=3508, vol=1.050000e+07
assign (resid 35 and name HB1) (resid 156 and name HA) 3.476 1.511 1.511 weight 1.000 ! spec=HCH, no=436, id=3509, vol=7.270000e+06
assign (resid 36 and name HA) (resid 74 and name HE1) 4.222 2.229 2.229 weight 1.000 ! spec=HCH, no=448, id=3521, vol=2.260000e+06
assign (resid 36 and name HA) (resid 154 and name HG1) 3.698 1.710 1.710 weight 1.000 ! spec=HCH, no=457, id=3530, vol=5.010000e+06
assign (resid 36 and name HN) (resid 36 and name HA) 3.020 1.140 1.140 weight 1.000 ! spec=HCH, no=463, id=3536, vol=1.690000e+07
assign (resid 36 and name HA) (resid 36 and name HB2) 3.037 1.153 1.153 weight 1.000 ! spec=HCH, no=465, id=3537, vol=1.630000e+07
assign (resid 36 and name HA) (resid 36 and name HB1) 3.027 1.145 1.145 weight 1.000 ! spec=HCH, no=466, id=3538, vol=1.670000e+07
assign (resid 36 and name HA) (resid 37 and name HB1) 3.396 1.442 1.442 weight 1.000 ! spec=HCH, no=468, id=3540, vol=8.360000e+06
assign (resid 36 and name HA) (resid 37 and name HE1) 3.206 1.285 1.285 weight 1.000 ! spec=HCH, no=470, id=3542, vol=1.180000e+07
assign (resid 36 and name HA) (resid 155 and name HG21) 3.601 1.621 1.621 weight 1.000 ! spec=HCH, no=471, id=3543, vol=5.880000e+06
or (resid 36 and name HA) (resid 155 and name HG22)
or (resid 36 and name HA) (resid 155 and name HG23)
assign (resid 36 and name HA) (resid 157 and name HG22) 3.752 1.760 1.760 weight 1.000 ! spec=HCH, no=472, id=3544, vol=4.590000e+06
or (resid 36 and name HA) (resid 157 and name HG21)
or (resid 36 and name HA) (resid 157 and name HG23)
assign (resid 36 and name HB2) (resid 24 and name HA) 4.032 2.032 2.032 weight 1.000 ! spec=HCH, no=478, id=3550, vol=2.990000e+06
assign (resid 36 and name HB1) (resid 24 and name HA) 3.750 1.757 1.757 weight 1.000 ! spec=HCH, no=479, id=3551, vol=4.610000e+06
assign (resid 36 and name HB2) (resid 25 and name HD2) 4.113 2.114 2.114 weight 1.000 ! spec=HCH, no=480, id=3552, vol=2.650000e+06
assign (resid 36 and name HB1) (resid 25 and name HD2) 3.934 1.935 1.935 weight 1.000 ! spec=HCH, no=481, id=3553, vol=3.460000e+06
assign (resid 36 and name HB1) (resid 31 and name HA) 4.181 2.185 2.185 weight 1.000 ! spec=HCH, no=485, id=3557, vol=2.400000e+06
assign (resid 36 and name HB2) (resid 35 and name HA) 4.009 2.009 2.009 weight 1.000 ! spec=HCH, no=486, id=3558, vol=3.090000e+06
assign (resid 36 and name HB1) (resid 36 and name HB2) 2.470 0.763 0.763 weight 1.000 ! spec=HCH, no=490, id=3561, vol=5.650000e+07
assign (resid 36 and name HB1) (resid 37 and name HN) 3.502 1.533 1.533 weight 1.000 ! spec=HCH, no=494, id=3564, vol=6.950000e+06
assign (resid 36 and name HB1) (resid 156 and name HA) 4.102 2.103 2.103 weight 1.000 ! spec=HCH, no=502, id=3572, vol=2.690000e+06
assign (resid 37 and name HA) (resid 83 and name HH2) 3.505 1.536 1.536 weight 1.000 ! spec=HCH, no=505, id=3575, vol=6.910000e+06
assign (resid 37 and name HA) (resid 37 and name HE1) 3.697 1.708 1.708 weight 1.000 ! spec=HCH, no=507, id=3577, vol=5.020000e+06
or (resid 37 and name HA) (resid 37 and name HE2)
assign (resid 37 and name HA) (resid 38 and name HA) 3.924 1.925 1.925 weight 1.000 ! spec=HCH, no=508, id=3578, vol=3.510000e+06
assign (resid 153 and name HN) (resid 37 and name HA) 3.738 1.747 1.747 weight 1.000 ! spec=HCH, no=510, id=3580, vol=4.700000e+06
assign (resid 37 and name HA) (resid 29 and name HZ3) 3.993 1.993 1.993 weight 1.000 ! spec=HCH, no=513, id=3582, vol=3.160000e+06
assign (resid 37 and name HA) (resid 37 and name HN) 3.288 1.352 1.352 weight 1.000 ! spec=HCH, no=514, id=3583, vol=1.010000e+07
assign (resid 37 and name HA) (resid 37 and name HB2) 2.883 1.039 1.039 weight 1.000 ! spec=HCH, no=516, id=3584, vol=2.230000e+07
assign (resid 37 and name HA) (resid 37 and name HB1) 3.045 1.159 1.159 weight 1.000 ! spec=HCH, no=517, id=3585, vol=1.610000e+07
assign (resid 37 and name HA) (resid 37 and name HD1) 3.156 1.245 1.245 weight 1.000 ! spec=HCH, no=518, id=3586, vol=1.300000e+07
assign (resid 37 and name HA) (resid 152 and name HD12) 3.286 1.350 1.350 weight 1.000 ! spec=HCH, no=520, id=3588, vol=1.020000e+07
or (resid 37 and name HA) (resid 152 and name HD11)
or (resid 37 and name HA) (resid 152 and name HD13)
assign (resid 37 and name HA) (resid 152 and name HD22) 3.286 1.350 1.350 weight 1.000 ! spec=HCH, no=521, id=3589, vol=1.020000e+07
or (resid 37 and name HA) (resid 152 and name HD21)
or (resid 37 and name HA) (resid 152 and name HD23)
assign (resid 37 and name HA) (resid 153 and name HB2) 4.161 2.164 2.164 weight 1.000 ! spec=HCH, no=522, id=3590, vol=2.470000e+06
assign (resid 37 and name HA) (resid 153 and name HB1) 3.706 1.717 1.717 weight 1.000 ! spec=HCH, no=523, id=3591, vol=4.950000e+06
assign (resid 37 and name HA) (resid 154 and name HA) 2.716 0.922 0.922 weight 1.000 ! spec=HCH, no=524, id=3592, vol=3.200000e+07
assign (resid 37 and name HA) (resid 154 and name HB2) 3.545 1.571 1.571 weight 1.000 ! spec=HCH, no=525, id=3593, vol=6.460000e+06
assign (resid 37 and name HA) (resid 154 and name HG1) 3.761 1.768 1.768 weight 1.000 ! spec=HCH, no=526, id=3594, vol=4.530000e+06
assign (resid 37 and name HA) (resid 155 and name HB) 4.046 2.047 2.047 weight 1.000 ! spec=HCH, no=527, id=3595, vol=2.920000e+06
assign (resid 37 and name HB1) (resid 74 and name HE1) 3.742 1.751 1.751 weight 1.000 ! spec=HCH, no=532, id=3599, vol=4.670000e+06
assign (resid 37 and name HB2) (resid 37 and name HB1) 2.542 0.808 0.808 weight 1.000 ! spec=HCH, no=537, id=3604, vol=4.750000e+07
assign (resid 37 and name HB2) (resid 37 and name HD1) 2.807 0.985 0.985 weight 1.000 ! spec=HCH, no=539, id=3605, vol=2.620000e+07
assign (resid 37 and name HB2) (resid 152 and name HD22) 3.065 1.174 1.174 weight 1.000 ! spec=HCH, no=547, id=3613, vol=1.550000e+07
or (resid 37 and name HB2) (resid 152 and name HD21)
or (resid 37 and name HB2) (resid 152 and name HD23)
assign (resid 37 and name HB1) (resid 152 and name HD22) 3.162 1.250 1.250 weight 1.000 ! spec=HCH, no=548, id=3614, vol=1.280000e+07
or (resid 37 and name HB1) (resid 152 and name HD21)
or (resid 37 and name HB1) (resid 152 and name HD23)
assign (resid 38 and name HN) (resid 38 and name HA) 3.040 1.155 1.155 weight 1.000 ! spec=HCH, no=549, id=3615, vol=1.620000e+07
assign (resid 38 and name HA) (resid 38 and name HB) 2.699 0.911 0.911 weight 1.000 ! spec=HCH, no=550, id=3616, vol=3.320000e+07
assign (resid 38 and name HA) (resid 38 and name HG12) 2.886 1.041 1.041 weight 1.000 ! spec=HCH, no=551, id=3617, vol=2.220000e+07
assign (resid 38 and name HA) (resid 38 and name HG11) 2.690 0.904 0.904 weight 1.000 ! spec=HCH, no=552, id=3618, vol=3.390000e+07
assign (resid 39 and name HN) (resid 38 and name HA) 2.610 0.851 0.851 weight 1.000 ! spec=HCH, no=555, id=3621, vol=4.060000e+07
assign (resid 38 and name HA) (resid 83 and name HH2) 2.674 0.894 0.894 weight 1.000 ! spec=HCH, no=557, id=3623, vol=3.510000e+07
assign (resid 38 and name HB) (resid 29 and name HA) 3.714 1.724 1.724 weight 1.000 ! spec=HCH, no=559, id=3625, vol=4.890000e+06
assign (resid 38 and name HG22) (resid 29 and name HE3) 3.307 1.367 1.367 weight 1.000 ! spec=HCH, no=561, id=3627, vol=9.800000e+06
or (resid 38 and name HG21) (resid 29 and name HE3)
or (resid 38 and name HG23) (resid 29 and name HE3)
assign (resid 39 and name HN) (resid 38 and name HG22) 3.255 1.325 1.325 weight 1.000 ! spec=HCH, no=568, id=3633, vol=1.080000e+07
or (resid 39 and name HN) (resid 38 and name HG21)
or (resid 39 and name HN) (resid 38 and name HG23)
assign (resid 38 and name HD12) (resid 26 and name HN) 3.678 1.691 1.691 weight 1.000 ! spec=HCH, no=570, id=3635, vol=5.180000e+06
or (resid 38 and name HD11) (resid 26 and name HN)
or (resid 38 and name HD13) (resid 26 and name HN)
assign (resid 38 and name HD12) (resid 30 and name HG11) 4.098 2.100 2.100 weight 1.000 ! spec=HCH, no=579, id=3644, vol=2.710000e+06
or (resid 38 and name HD11) (resid 30 and name HG11)
or (resid 38 and name HD13) (resid 30 and name HG11)
assign (resid 38 and name HD12) (resid 25 and name HD2) 4.027 2.027 2.027 weight 1.000 ! spec=HCH, no=580, id=3645, vol=3.010000e+06
or (resid 38 and name HD11) (resid 25 and name HD2)
or (resid 38 and name HD13) (resid 25 and name HD2)
assign (resid 28 and name HA) (resid 38 and name HD12) 3.626 1.644 1.644 weight 1.000 ! spec=HCH, no=581, id=3646, vol=5.640000e+06
or (resid 28 and name HA) (resid 38 and name HD11)
or (resid 28 and name HA) (resid 38 and name HD13)
assign (resid 38 and name HD12) (resid 29 and name HA) 3.170 1.256 1.256 weight 1.000 ! spec=HCH, no=583, id=3648, vol=1.260000e+07
or (resid 38 and name HD11) (resid 29 and name HA)
or (resid 38 and name HD13) (resid 29 and name HA)
assign (resid 38 and name HD12) (resid 29 and name HZ2) 3.044 1.158 1.158 weight 1.000 ! spec=HCH, no=586, id=3651, vol=1.610000e+07
or (resid 38 and name HD11) (resid 29 and name HZ2)
or (resid 38 and name HD13) (resid 29 and name HZ2)
assign (resid 38 and name HD12) (resid 29 and name HB2) 3.645 1.661 1.661 weight 1.000 ! spec=HCH, no=588, id=3653, vol=5.470000e+06
or (resid 38 and name HD11) (resid 29 and name HB2)
or (resid 38 and name HD13) (resid 29 and name HB2)
assign (resid 30 and name HN) (resid 38 and name HD12) 4.081 2.082 2.082 weight 1.000 ! spec=HCH, no=589, id=3654, vol=2.780000e+06
or (resid 30 and name HN) (resid 38 and name HD11)
or (resid 30 and name HN) (resid 38 and name HD13)
assign (resid 38 and name HN) (resid 38 and name HD12) 3.641 1.658 1.658 weight 1.000 ! spec=HCH, no=590, id=3655, vol=5.500000e+06
or (resid 38 and name HN) (resid 38 and name HD11)
or (resid 38 and name HN) (resid 38 and name HD13)
assign (resid 38 and name HA) (resid 38 and name HD12) 2.919 1.065 1.065 weight 1.000 ! spec=HCH, no=591, id=3656, vol=2.070000e+07
or (resid 38 and name HA) (resid 38 and name HD11)
or (resid 38 and name HA) (resid 38 and name HD13)
assign (resid 38 and name HB) (resid 38 and name HD12) 2.346 0.688 0.688 weight 1.000 ! spec=HCH, no=592, id=3657, vol=7.700000e+07
or (resid 38 and name HB) (resid 38 and name HD11)
or (resid 38 and name HB) (resid 38 and name HD13)
assign (resid 38 and name HD12) (resid 38 and name HG12) 2.176 0.592 0.592 weight 1.000 ! spec=HCH, no=593, id=3658, vol=1.210000e+08
or (resid 38 and name HD11) (resid 38 and name HG12)
or (resid 38 and name HD13) (resid 38 and name HG12)
assign (resid 38 and name HD12) (resid 38 and name HG11) 2.332 0.680 0.680 weight 1.000 ! spec=HCH, no=594, id=3659, vol=7.970000e+07
or (resid 38 and name HD11) (resid 38 and name HG11)
or (resid 38 and name HD13) (resid 38 and name HG11)
assign (resid 38 and name HD12) (resid 38 and name HD11) 1.361 0.232 0.232 weight 1.000 ! spec=HCH, no=595, id=3660, vol=2.020000e+09
or (resid 38 and name HD12) (resid 38 and name HD13)
or (resid 38 and name HD12) (resid 38 and name HD11)
or (resid 38 and name HD11) (resid 38 and name HD13)
or (resid 38 and name HD12) (resid 38 and name HD13)
or (resid 38 and name HD11) (resid 38 and name HD13)
assign (resid 38 and name HD12) (resid 38 and name HG22) 2.196 0.603 0.603 weight 1.000 ! spec=HCH, no=596, id=3661, vol=1.140000e+08
or (resid 38 and name HD12) (resid 38 and name HG21)
or (resid 38 and name HD12) (resid 38 and name HG23)
or (resid 38 and name HD11) (resid 38 and name HG22)
or (resid 38 and name HD11) (resid 38 and name HG21)
or (resid 38 and name HD11) (resid 38 and name HG23)
or (resid 38 and name HD13) (resid 38 and name HG22)
or (resid 38 and name HD13) (resid 38 and name HG21)
or (resid 38 and name HD13) (resid 38 and name HG23)
assign (resid 39 and name HN) (resid 38 and name HD12) 3.265 1.333 1.333 weight 1.000 ! spec=HCH, no=597, id=3662, vol=1.060000e+07
or (resid 39 and name HN) (resid 38 and name HD11)
or (resid 39 and name HN) (resid 38 and name HD13)
assign (resid 40 and name HN) (resid 38 and name HD12) 3.837 1.841 1.841 weight 1.000 ! spec=HCH, no=598, id=3663, vol=4.020000e+06
or (resid 40 and name HN) (resid 38 and name HD11)
or (resid 40 and name HN) (resid 38 and name HD13)
assign (resid 38 and name HD12) (resid 40 and name HD12) 2.213 0.612 0.612 weight 1.000 ! spec=HCH, no=599, id=3664, vol=1.090000e+08
or (resid 38 and name HD12) (resid 40 and name HD11)
or (resid 38 and name HD12) (resid 40 and name HD13)
or (resid 38 and name HD11) (resid 40 and name HD12)
or (resid 38 and name HD11) (resid 40 and name HD11)
or (resid 38 and name HD11) (resid 40 and name HD13)
or (resid 38 and name HD13) (resid 40 and name HD12)
or (resid 38 and name HD13) (resid 40 and name HD11)
or (resid 38 and name HD13) (resid 40 and name HD13)
assign (resid 38 and name HD12) (resid 59 and name HB1) 3.787 1.793 1.793 weight 1.000 ! spec=HCH, no=600, id=3665, vol=4.350000e+06
or (resid 38 and name HD11) (resid 59 and name HB1)
or (resid 38 and name HD13) (resid 59 and name HB1)
assign (resid 38 and name HD12) (resid 153 and name HB2) 3.480 1.514 1.514 weight 1.000 ! spec=HCH, no=603, id=3668, vol=7.220000e+06
or (resid 38 and name HD11) (resid 153 and name HB2)
or (resid 38 and name HD13) (resid 153 and name HB2)
assign (resid 38 and name HG11) (resid 83 and name HD1) 3.650 1.665 1.665 weight 1.000 ! spec=HCH, no=604, id=3669, vol=5.420000e+06
assign (resid 38 and name HG11) (resid 38 and name HN) 3.868 1.870 1.870 weight 1.000 ! spec=HCH, no=605, id=3670, vol=3.830000e+06
assign (resid 39 and name HN) (resid 38 and name HG11) 3.204 1.283 1.283 weight 1.000 ! spec=HCH, no=610, id=3675, vol=1.190000e+07
assign (resid 38 and name HG12) (resid 29 and name HA) 4.154 2.157 2.157 weight 1.000 ! spec=HCH, no=612, id=3676, vol=2.500000e+06
assign (resid 38 and name HG11) (resid 29 and name HA) 3.625 1.643 1.643 weight 1.000 ! spec=HCH, no=613, id=3677, vol=5.650000e+06
assign (resid 38 and name HG12) (resid 38 and name HN) 4.188 2.192 2.192 weight 1.000 ! spec=HCH, no=614, id=3678, vol=2.380000e+06
assign (resid 38 and name HG12) (resid 38 and name HB) 2.702 0.912 0.912 weight 1.000 ! spec=HCH, no=617, id=3681, vol=3.300000e+07
assign (resid 38 and name HB) (resid 38 and name HG11) 2.653 0.880 0.880 weight 1.000 ! spec=HCH, no=618, id=3682, vol=3.680000e+07
assign (resid 38 and name HG11) (resid 38 and name HG12) 2.367 0.700 0.700 weight 1.000 ! spec=HCH, no=620, id=3683, vol=7.290000e+07
assign (resid 38 and name HG12) (resid 38 and name HG22) 3.033 1.150 1.150 weight 1.000 ! spec=HCH, no=625, id=3687, vol=1.650000e+07
or (resid 38 and name HG12) (resid 38 and name HG21)
or (resid 38 and name HG12) (resid 38 and name HG23)
assign (resid 39 and name HN) (resid 38 and name HG12) 3.448 1.486 1.486 weight 1.000 ! spec=HCH, no=627, id=3689, vol=7.630000e+06
assign (resid 38 and name HG22) (resid 40 and name HD12) 2.487 0.773 0.773 weight 1.000 ! spec=HCH, no=631, id=3693, vol=5.420000e+07
or (resid 38 and name HG22) (resid 40 and name HD11)
or (resid 38 and name HG22) (resid 40 and name HD13)
or (resid 38 and name HG21) (resid 40 and name HD12)
or (resid 38 and name HG21) (resid 40 and name HD11)
or (resid 38 and name HG21) (resid 40 and name HD13)
or (resid 38 and name HG23) (resid 40 and name HD12)
or (resid 38 and name HG23) (resid 40 and name HD11)
or (resid 38 and name HG23) (resid 40 and name HD13)
assign (resid 38 and name HG22) (resid 29 and name HA) 3.523 1.551 1.551 weight 1.000 ! spec=HCH, no=632, id=3694, vol=6.710000e+06
or (resid 38 and name HG21) (resid 29 and name HA)
or (resid 38 and name HG23) (resid 29 and name HA)
assign (resid 37 and name HA) (resid 38 and name HG22) 3.389 1.436 1.436 weight 1.000 ! spec=HCH, no=635, id=3697, vol=8.460000e+06
or (resid 37 and name HA) (resid 38 and name HG21)
or (resid 37 and name HA) (resid 38 and name HG23)
assign (resid 38 and name HA) (resid 38 and name HG22) 3.044 1.158 1.158 weight 1.000 ! spec=HCH, no=638, id=3700, vol=1.610000e+07
or (resid 38 and name HA) (resid 38 and name HG21)
or (resid 38 and name HA) (resid 38 and name HG23)
assign (resid 38 and name HB) (resid 38 and name HG22) 2.437 0.742 0.742 weight 1.000 ! spec=HCH, no=639, id=3701, vol=6.130000e+07
or (resid 38 and name HB) (resid 38 and name HG21)
or (resid 38 and name HB) (resid 38 and name HG23)
assign (resid 38 and name HG11) (resid 38 and name HG22) 2.894 1.047 1.047 weight 1.000 ! spec=HCH, no=640, id=3702, vol=2.190000e+07
or (resid 38 and name HG11) (resid 38 and name HG21)
or (resid 38 and name HG11) (resid 38 and name HG23)
assign (resid 38 and name HG22) (resid 38 and name HG21) 1.527 0.291 0.291 weight 1.000 ! spec=HCH, no=642, id=3704, vol=1.010000e+09
or (resid 38 and name HG22) (resid 38 and name HG23)
or (resid 38 and name HG22) (resid 38 and name HG21)
or (resid 38 and name HG21) (resid 38 and name HG23)
or (resid 38 and name HG22) (resid 38 and name HG23)
or (resid 38 and name HG21) (resid 38 and name HG23)
assign (resid 38 and name HG22) (resid 40 and name HA) 3.783 1.789 1.789 weight 1.000 ! spec=HCH, no=643, id=3705, vol=4.370000e+06
or (resid 38 and name HG21) (resid 40 and name HA)
or (resid 38 and name HG23) (resid 40 and name HA)
assign (resid 38 and name HG22) (resid 40 and name HG) 2.889 1.043 1.043 weight 1.000 ! spec=HCH, no=645, id=3707, vol=2.210000e+07
or (resid 38 and name HG21) (resid 40 and name HG)
or (resid 38 and name HG23) (resid 40 and name HG)
assign (resid 38 and name HG22) (resid 40 and name HD22) 2.969 1.102 1.102 weight 1.000 ! spec=HCH, no=647, id=3709, vol=1.870000e+07
or (resid 38 and name HG22) (resid 40 and name HD21)
or (resid 38 and name HG22) (resid 40 and name HD23)
or (resid 38 and name HG21) (resid 40 and name HD22)
or (resid 38 and name HG21) (resid 40 and name HD21)
or (resid 38 and name HG21) (resid 40 and name HD23)
or (resid 38 and name HG23) (resid 40 and name HD22)
or (resid 38 and name HG23) (resid 40 and name HD21)
or (resid 38 and name HG23) (resid 40 and name HD23)
assign (resid 38 and name HG22) (resid 59 and name HB1) 3.776 1.782 1.782 weight 1.000 ! spec=HCH, no=648, id=3710, vol=4.420000e+06
or (resid 38 and name HG21) (resid 59 and name HB1)
or (resid 38 and name HG23) (resid 59 and name HB1)
assign (resid 38 and name HG22) (resid 152 and name HA) 3.602 1.622 1.622 weight 1.000 ! spec=HCH, no=651, id=3713, vol=5.870000e+06
or (resid 38 and name HG21) (resid 152 and name HA)
or (resid 38 and name HG23) (resid 152 and name HA)
assign (resid 38 and name HG22) (resid 152 and name HD12) 3.416 1.458 1.458 weight 1.000 ! spec=HCH, no=652, id=3714, vol=8.070000e+06
or (resid 38 and name HG22) (resid 152 and name HD11)
or (resid 38 and name HG22) (resid 152 and name HD13)
or (resid 38 and name HG21) (resid 152 and name HD12)
or (resid 38 and name HG21) (resid 152 and name HD11)
or (resid 38 and name HG21) (resid 152 and name HD13)
or (resid 38 and name HG23) (resid 152 and name HD12)
or (resid 38 and name HG23) (resid 152 and name HD11)
or (resid 38 and name HG23) (resid 152 and name HD13)
assign (resid 38 and name HG22) (resid 153 and name HB2) 2.525 0.797 0.797 weight 1.000 ! spec=HCH, no=655, id=3717, vol=4.940000e+07
or (resid 38 and name HG21) (resid 153 and name HB2)
or (resid 38 and name HG23) (resid 153 and name HB2)
assign (resid 38 and name HG22) (resid 153 and name HB1) 2.766 0.956 0.956 weight 1.000 ! spec=HCH, no=656, id=3718, vol=2.860000e+07
or (resid 38 and name HG21) (resid 153 and name HB1)
or (resid 38 and name HG23) (resid 153 and name HB1)
assign (resid 38 and name HG22) (resid 154 and name HA) 3.983 1.983 1.983 weight 1.000 ! spec=HCH, no=658, id=3720, vol=3.210000e+06
or (resid 38 and name HG21) (resid 154 and name HA)
or (resid 38 and name HG23) (resid 154 and name HA)
assign (resid 38 and name HG22) (resid 155 and name HB) 4.013 2.013 2.013 weight 1.000 ! spec=HCH, no=659, id=3721, vol=3.070000e+06
or (resid 38 and name HG21) (resid 155 and name HB)
or (resid 38 and name HG23) (resid 155 and name HB)
assign (resid 39 and name HA) (resid 39 and name HB1) 2.863 1.024 1.024 weight 1.000 ! spec=HCH, no=665, id=3727, vol=2.330000e+07
assign (resid 39 and name HB1) (resid 39 and name HB2) 2.405 0.723 0.723 weight 1.000 ! spec=HCH, no=672, id=3733, vol=6.620000e+07
assign (resid 39 and name HB2) (resid 40 and name HA) 3.435 1.475 1.475 weight 1.000 ! spec=HCH, no=673, id=3734, vol=7.810000e+06
assign (resid 40 and name HA) (resid 38 and name HD12) 3.710 1.721 1.721 weight 1.000 ! spec=HCH, no=678, id=3739, vol=4.910000e+06
or (resid 40 and name HA) (resid 38 and name HD11)
or (resid 40 and name HA) (resid 38 and name HD13)
assign (resid 40 and name HA) (resid 40 and name HB2) 2.613 0.853 0.853 weight 1.000 ! spec=HCH, no=680, id=3741, vol=4.030000e+07
assign (resid 40 and name HA) (resid 40 and name HB1) 3.005 1.129 1.129 weight 1.000 ! spec=HCH, no=681, id=3742, vol=1.740000e+07
assign (resid 40 and name HA) (resid 40 and name HD12) 2.479 0.768 0.768 weight 1.000 ! spec=HCH, no=682, id=3743, vol=5.520000e+07
or (resid 40 and name HA) (resid 40 and name HD11)
or (resid 40 and name HA) (resid 40 and name HD13)
assign (resid 40 and name HA) (resid 42 and name HN) 3.624 1.641 1.641 weight 1.000 ! spec=HCH, no=685, id=3746, vol=5.670000e+06
assign (resid 40 and name HB2) (resid 38 and name HD12) 3.646 1.662 1.662 weight 1.000 ! spec=HCH, no=690, id=3751, vol=5.460000e+06
or (resid 40 and name HB2) (resid 38 and name HD11)
or (resid 40 and name HB2) (resid 38 and name HD13)
assign (resid 38 and name HG22) (resid 40 and name HB2) 3.762 1.769 1.769 weight 1.000 ! spec=HCH, no=691, id=3752, vol=4.520000e+06
or (resid 38 and name HG21) (resid 40 and name HB2)
or (resid 38 and name HG23) (resid 40 and name HB2)
assign (resid 40 and name HN) (resid 40 and name HB2) 3.155 1.244 1.244 weight 1.000 ! spec=HCH, no=692, id=3753, vol=1.300000e+07
assign (resid 40 and name HB1) (resid 40 and name HN) 3.070 1.178 1.178 weight 1.000 ! spec=HCH, no=693, id=3754, vol=1.530000e+07
assign (resid 40 and name HB1) (resid 40 and name HB2) 2.323 0.674 0.674 weight 1.000 ! spec=HCH, no=696, id=3756, vol=8.170000e+07
assign (resid 40 and name HB2) (resid 40 and name HD12) 2.651 0.879 0.879 weight 1.000 ! spec=HCH, no=698, id=3758, vol=3.690000e+07
or (resid 40 and name HB2) (resid 40 and name HD11)
or (resid 40 and name HB2) (resid 40 and name HD13)
assign (resid 40 and name HB2) (resid 40 and name HD22) 2.670 0.891 0.891 weight 1.000 ! spec=HCH, no=700, id=3760, vol=3.540000e+07
or (resid 40 and name HB2) (resid 40 and name HD21)
or (resid 40 and name HB2) (resid 40 and name HD23)
assign (resid 41 and name HN) (resid 40 and name HB2) 3.717 1.727 1.727 weight 1.000 ! spec=HCH, no=702, id=3762, vol=4.860000e+06
assign (resid 40 and name HD12) (resid 64 and name HN) 4.339 2.353 2.353 weight 1.000 ! spec=HCH, no=709, id=3769, vol=1.920000e+06
or (resid 40 and name HD11) (resid 64 and name HN)
or (resid 40 and name HD13) (resid 64 and name HN)
assign (resid 40 and name HD12) (resid 39 and name HB1) 4.127 2.129 2.129 weight 1.000 ! spec=HCH, no=717, id=3777, vol=2.600000e+06
or (resid 40 and name HD11) (resid 39 and name HB1)
or (resid 40 and name HD13) (resid 39 and name HB1)
assign (resid 151 and name HN) (resid 40 and name HD12) 3.924 1.925 1.925 weight 1.000 ! spec=HCH, no=719, id=3779, vol=3.510000e+06
or (resid 151 and name HN) (resid 40 and name HD11)
or (resid 151 and name HN) (resid 40 and name HD13)
assign (resid 40 and name HD12) (resid 38 and name HA) 3.509 1.539 1.539 weight 1.000 ! spec=HCH, no=721, id=3781, vol=6.870000e+06
or (resid 40 and name HD11) (resid 38 and name HA)
or (resid 40 and name HD13) (resid 38 and name HA)
assign (resid 42 and name HN) (resid 40 and name HD12) 3.745 1.753 1.753 weight 1.000 ! spec=HCH, no=723, id=3783, vol=4.650000e+06
or (resid 42 and name HN) (resid 40 and name HD11)
or (resid 42 and name HN) (resid 40 and name HD13)
assign (resid 40 and name HD12) (resid 39 and name HN) 3.718 1.728 1.728 weight 1.000 ! spec=HCH, no=725, id=3785, vol=4.850000e+06
or (resid 40 and name HD11) (resid 39 and name HN)
or (resid 40 and name HD13) (resid 39 and name HN)
assign (resid 40 and name HD12) (resid 38 and name HG11) 2.893 1.046 1.046 weight 1.000 ! spec=HCH, no=728, id=3788, vol=2.190000e+07
or (resid 40 and name HD11) (resid 38 and name HG11)
or (resid 40 and name HD13) (resid 38 and name HG11)
assign (resid 40 and name HD12) (resid 39 and name HD1) 3.891 1.893 1.893 weight 1.000 ! spec=HCH, no=731, id=3791, vol=3.690000e+06
or (resid 40 and name HD11) (resid 39 and name HD1)
or (resid 40 and name HD13) (resid 39 and name HD1)
assign (resid 40 and name HN) (resid 40 and name HD12) 2.920 1.066 1.066 weight 1.000 ! spec=HCH, no=732, id=3792, vol=2.070000e+07
or (resid 40 and name HN) (resid 40 and name HD11)
or (resid 40 and name HN) (resid 40 and name HD13)
assign (resid 40 and name HB1) (resid 40 and name HD12) 2.584 0.835 0.835 weight 1.000 ! spec=HCH, no=734, id=3794, vol=4.300000e+07
or (resid 40 and name HB1) (resid 40 and name HD11)
or (resid 40 and name HB1) (resid 40 and name HD13)
assign (resid 40 and name HD12) (resid 40 and name HG) 2.057 0.529 0.529 weight 1.000 ! spec=HCH, no=735, id=3795, vol=1.690000e+08
or (resid 40 and name HD11) (resid 40 and name HG)
or (resid 40 and name HD13) (resid 40 and name HG)
assign (resid 40 and name HD12) (resid 40 and name HD11) 1.291 0.208 0.208 weight 1.000 ! spec=HCH, no=736, id=3796, vol=2.770000e+09
or (resid 40 and name HD12) (resid 40 and name HD13)
or (resid 40 and name HD12) (resid 40 and name HD11)
or (resid 40 and name HD11) (resid 40 and name HD13)
or (resid 40 and name HD12) (resid 40 and name HD13)
or (resid 40 and name HD11) (resid 40 and name HD13)
assign (resid 40 and name HD12) (resid 40 and name HD22) 2.007 0.504 0.504 weight 1.000 ! spec=HCH, no=737, id=3797, vol=1.960000e+08
or (resid 40 and name HD12) (resid 40 and name HD21)
or (resid 40 and name HD12) (resid 40 and name HD23)
or (resid 40 and name HD11) (resid 40 and name HD22)
or (resid 40 and name HD11) (resid 40 and name HD21)
or (resid 40 and name HD11) (resid 40 and name HD23)
or (resid 40 and name HD13) (resid 40 and name HD22)
or (resid 40 and name HD13) (resid 40 and name HD21)
or (resid 40 and name HD13) (resid 40 and name HD23)
assign (resid 40 and name HD12) (resid 56 and name HA) 3.474 1.509 1.509 weight 1.000 ! spec=HCH, no=738, id=3798, vol=7.300000e+06
or (resid 40 and name HD11) (resid 56 and name HA)
or (resid 40 and name HD13) (resid 56 and name HA)
assign (resid 40 and name HD12) (resid 152 and name HD12) 3.151 1.241 1.241 weight 1.000 ! spec=HCH, no=742, id=3802, vol=1.310000e+07
or (resid 40 and name HD12) (resid 152 and name HD11)
or (resid 40 and name HD12) (resid 152 and name HD13)
or (resid 40 and name HD11) (resid 152 and name HD12)
or (resid 40 and name HD11) (resid 152 and name HD11)
or (resid 40 and name HD11) (resid 152 and name HD13)
or (resid 40 and name HD13) (resid 152 and name HD12)
or (resid 40 and name HD13) (resid 152 and name HD11)
or (resid 40 and name HD13) (resid 152 and name HD13)
assign (resid 40 and name HD22) (resid 150 and name HA2) 3.513 1.542 1.542 weight 1.000 ! spec=HCH, no=744, id=3804, vol=6.820000e+06
or (resid 40 and name HD21) (resid 150 and name HA2)
or (resid 40 and name HD23) (resid 150 and name HA2)
assign (resid 40 and name HD22) (resid 56 and name HB1) 3.509 1.539 1.539 weight 1.000 ! spec=HCH, no=747, id=3807, vol=6.870000e+06
or (resid 40 and name HD21) (resid 56 and name HB1)
or (resid 40 and name HD23) (resid 56 and name HB1)
assign (resid 38 and name HD12) (resid 40 and name HD22) 3.329 1.386 1.386 weight 1.000 ! spec=HCH, no=753, id=3813, vol=9.420000e+06
or (resid 38 and name HD12) (resid 40 and name HD21)
or (resid 38 and name HD12) (resid 40 and name HD23)
or (resid 38 and name HD11) (resid 40 and name HD22)
or (resid 38 and name HD11) (resid 40 and name HD21)
or (resid 38 and name HD11) (resid 40 and name HD23)
or (resid 38 and name HD13) (resid 40 and name HD22)
or (resid 38 and name HD13) (resid 40 and name HD21)
or (resid 38 and name HD13) (resid 40 and name HD23)
assign (resid 40 and name HD22) (resid 39 and name HD1) 4.016 2.016 2.016 weight 1.000 ! spec=HCH, no=755, id=3815, vol=3.050000e+06
or (resid 40 and name HD21) (resid 39 and name HD1)
or (resid 40 and name HD23) (resid 39 and name HD1)
assign (resid 40 and name HA) (resid 40 and name HD22) 2.994 1.120 1.120 weight 1.000 ! spec=HCH, no=757, id=3817, vol=1.780000e+07
or (resid 40 and name HA) (resid 40 and name HD21)
or (resid 40 and name HA) (resid 40 and name HD23)
assign (resid 40 and name HB1) (resid 40 and name HD22) 2.550 0.813 0.813 weight 1.000 ! spec=HCH, no=759, id=3819, vol=4.660000e+07
or (resid 40 and name HB1) (resid 40 and name HD21)
or (resid 40 and name HB1) (resid 40 and name HD23)
assign (resid 40 and name HD22) (resid 40 and name HD21) 1.422 0.253 0.253 weight 1.000 ! spec=HCH, no=761, id=3821, vol=1.550000e+09
or (resid 40 and name HD22) (resid 40 and name HD23)
or (resid 40 and name HD22) (resid 40 and name HD21)
or (resid 40 and name HD21) (resid 40 and name HD23)
or (resid 40 and name HD22) (resid 40 and name HD23)
or (resid 40 and name HD21) (resid 40 and name HD23)
assign (resid 40 and name HD22) (resid 55 and name HB2) 2.615 0.855 0.855 weight 1.000 ! spec=HCH, no=762, id=3822, vol=4.010000e+07
or (resid 40 and name HD21) (resid 55 and name HB2)
or (resid 40 and name HD23) (resid 55 and name HB2)
assign (resid 40 and name HD22) (resid 55 and name HG1) 3.115 1.213 1.213 weight 1.000 ! spec=HCH, no=763, id=3823, vol=1.400000e+07
or (resid 40 and name HD21) (resid 55 and name HG1)
or (resid 40 and name HD23) (resid 55 and name HG1)
assign (resid 40 and name HD22) (resid 56 and name HA) 3.198 1.278 1.278 weight 1.000 ! spec=HCH, no=764, id=3824, vol=1.200000e+07
or (resid 40 and name HD21) (resid 56 and name HA)
or (resid 40 and name HD23) (resid 56 and name HA)
assign (resid 40 and name HD22) (resid 151 and name HA) 3.762 1.769 1.769 weight 1.000 ! spec=HCH, no=766, id=3826, vol=4.530000e+06
or (resid 40 and name HD21) (resid 151 and name HA)
or (resid 40 and name HD23) (resid 151 and name HA)
assign (resid 40 and name HN) (resid 40 and name HG) 3.200 1.280 1.280 weight 1.000 ! spec=HCH, no=769, id=3829, vol=1.200000e+07
assign (resid 40 and name HG) (resid 40 and name HA) 3.325 1.382 1.382 weight 1.000 ! spec=HCH, no=770, id=3830, vol=9.490000e+06
assign (resid 40 and name HG) (resid 40 and name HB1) 2.764 0.955 0.955 weight 1.000 ! spec=HCH, no=771, id=3831, vol=2.880000e+07
assign (resid 40 and name HG) (resid 40 and name HD22) 2.674 0.894 0.894 weight 1.000 ! spec=HCH, no=774, id=3833, vol=3.510000e+07
or (resid 40 and name HG) (resid 40 and name HD21)
or (resid 40 and name HG) (resid 40 and name HD23)
assign (resid 41 and name HA) (resid 39 and name HZ) 3.592 1.613 1.613 weight 1.000 ! spec=HCH, no=775, id=3834, vol=5.970000e+06
assign (resid 41 and name HA) (resid 41 and name HN) 2.955 1.092 1.092 weight 1.000 ! spec=HCH, no=776, id=3835, vol=1.930000e+07
assign (resid 41 and name HA) (resid 41 and name HB1) 2.350 0.691 0.691 weight 1.000 ! spec=HCH, no=777, id=3836, vol=7.600000e+07
assign (resid 41 and name HA) (resid 150 and name HA2) 2.949 1.087 1.087 weight 1.000 ! spec=HCH, no=780, id=3839, vol=1.950000e+07
assign (resid 41 and name HB1) (resid 41 and name HB2) 1.939 0.470 0.470 weight 1.000 ! spec=HCH, no=785, id=3844, vol=2.410000e+08
assign (resid 41 and name HB2) (resid 41 and name HG1) 1.939 0.470 0.470 weight 1.000 ! spec=HCH, no=787, id=3845, vol=2.410000e+08
assign (resid 41 and name HB2) (resid 42 and name HN) 3.587 1.609 1.609 weight 1.000 ! spec=HCH, no=788, id=3846, vol=6.020000e+06
assign (resid 41 and name HB1) (resid 42 and name HN) 3.511 1.541 1.541 weight 1.000 ! spec=HCH, no=789, id=3847, vol=6.840000e+06
assign (resid 41 and name HA) (resid 150 and name HA1) 2.886 1.041 1.041 weight 1.000 ! spec=HCH, no=791, id=3849, vol=2.220000e+07
assign (resid 41 and name HG2) (resid 39 and name HD1) 3.657 1.672 1.672 weight 1.000 ! spec=HCH, no=794, id=3852, vol=5.360000e+06
or (resid 41 and name HG2) (resid 39 and name HD2)
assign (resid 41 and name HG1) (resid 39 and name HD1) 3.437 1.477 1.477 weight 1.000 ! spec=HCH, no=797, id=3855, vol=7.770000e+06
or (resid 41 and name HG1) (resid 39 and name HD2)
assign (resid 41 and name HG1) (resid 40 and name HN) 3.992 1.992 1.992 weight 1.000 ! spec=HCH, no=798, id=3856, vol=3.170000e+06
assign (resid 41 and name HG2) (resid 41 and name HA) 2.843 1.010 1.010 weight 1.000 ! spec=HCH, no=801, id=3859, vol=2.430000e+07
assign (resid 41 and name HG1) (resid 41 and name HA) 2.787 0.971 0.971 weight 1.000 ! spec=HCH, no=802, id=3860, vol=2.740000e+07
assign (resid 41 and name HG2) (resid 41 and name HB2) 2.332 0.680 0.680 weight 1.000 ! spec=HCH, no=803, id=3861, vol=7.970000e+07
assign (resid 41 and name HG1) (resid 41 and name HE21) 3.171 1.257 1.257 weight 1.000 ! spec=HCH, no=806, id=3864, vol=1.260000e+07
assign (resid 41 and name HG1) (resid 41 and name HE22) 3.284 1.348 1.348 weight 1.000 ! spec=HCH, no=808, id=3866, vol=1.020000e+07
assign (resid 41 and name HG1) (resid 42 and name HN) 3.668 1.682 1.682 weight 1.000 ! spec=HCH, no=810, id=3867, vol=5.260000e+06
assign (resid 41 and name HG2) (resid 150 and name HA2) 3.517 1.546 1.546 weight 1.000 ! spec=HCH, no=813, id=3870, vol=6.780000e+06
assign (resid 41 and name HG1) (resid 150 and name HA2) 3.342 1.396 1.396 weight 1.000 ! spec=HCH, no=814, id=3871, vol=9.200000e+06
assign (resid 41 and name HG2) (resid 150 and name HA1) 3.520 1.549 1.549 weight 1.000 ! spec=HCH, no=815, id=3872, vol=6.740000e+06
assign (resid 41 and name HG1) (resid 150 and name HA1) 3.340 1.394 1.394 weight 1.000 ! spec=HCH, no=816, id=3873, vol=9.240000e+06
assign (resid 41 and name HG2) (resid 151 and name HN) 3.873 1.875 1.875 weight 1.000 ! spec=HCH, no=817, id=3874, vol=3.800000e+06
assign (resid 42 and name HA) (resid 42 and name HB2) 2.390 0.714 0.714 weight 1.000 ! spec=HCH, no=820, id=3877, vol=6.890000e+07
assign (resid 42 and name HA) (resid 42 and name HN) 2.617 0.856 0.856 weight 1.000 ! spec=HCH, no=821, id=3878, vol=3.990000e+07
assign (resid 42 and name HA) (resid 42 and name HB1) 2.539 0.806 0.806 weight 1.000 ! spec=HCH, no=822, id=3879, vol=4.790000e+07
assign (resid 42 and name HB2) (resid 42 and name HG2) 2.133 0.569 0.569 weight 1.000 ! spec=HCH, no=837, id=3893, vol=1.360000e+08
assign (resid 42 and name HB1) (resid 44 and name HN) 3.940 1.941 1.941 weight 1.000 ! spec=HCH, no=841, id=3897, vol=3.430000e+06
assign (resid 42 and name HB1) (resid 44 and name HG12) 3.614 1.633 1.633 weight 1.000 ! spec=HCH, no=842, id=3898, vol=5.750000e+06
assign (resid 42 and name HG2) (resid 42 and name HA) 2.480 0.769 0.769 weight 1.000 ! spec=HCH, no=848, id=3904, vol=5.520000e+07
assign (resid 42 and name HG2) (resid 40 and name HN) 4.141 2.144 2.144 weight 1.000 ! spec=HCH, no=858, id=3914, vol=2.540000e+06
assign (resid 42 and name HG2) (resid 40 and name HA) 3.054 1.166 1.166 weight 1.000 ! spec=HCH, no=859, id=3915, vol=1.580000e+07
assign (resid 42 and name HG2) (resid 40 and name HB2) 3.121 1.218 1.218 weight 1.000 ! spec=HCH, no=860, id=3916, vol=1.390000e+07
assign (resid 42 and name HG2) (resid 40 and name HB1) 3.755 1.762 1.762 weight 1.000 ! spec=HCH, no=861, id=3917, vol=4.580000e+06
assign (resid 42 and name HG2) (resid 40 and name HG) 3.121 1.218 1.218 weight 1.000 ! spec=HCH, no=862, id=3918, vol=1.390000e+07
assign (resid 40 and name HD12) (resid 42 and name HG2) 3.392 1.438 1.438 weight 1.000 ! spec=HCH, no=863, id=3919, vol=8.420000e+06
or (resid 40 and name HD11) (resid 42 and name HG2)
or (resid 40 and name HD13) (resid 42 and name HG2)
assign (resid 42 and name HG2) (resid 40 and name HD22) 3.430 1.470 1.470 weight 1.000 ! spec=HCH, no=864, id=3920, vol=7.880000e+06
or (resid 42 and name HG2) (resid 40 and name HD21)
or (resid 42 and name HG2) (resid 40 and name HD23)
assign (resid 42 and name HG2) (resid 42 and name HN) 2.791 0.973 0.973 weight 1.000 ! spec=HCH, no=865, id=3921, vol=2.720000e+07
assign (resid 44 and name HN) (resid 43 and name HA) 2.251 0.634 0.634 weight 1.000 ! spec=HCH, no=876, id=3930, vol=9.850000e+07
assign (resid 43 and name HA) (resid 44 and name HG22) 3.141 1.233 1.233 weight 1.000 ! spec=HCH, no=877, id=3931, vol=1.340000e+07
or (resid 43 and name HA) (resid 44 and name HG21)
or (resid 43 and name HA) (resid 44 and name HG23)
assign (resid 43 and name HN) (resid 43 and name HB2) 2.209 0.610 0.610 weight 1.000 ! spec=HCH, no=885, id=3939, vol=1.100000e+08
or (resid 43 and name HN) (resid 43 and name HB1)
or (resid 43 and name HN) (resid 43 and name HB3)
assign (resid 43 and name HB2) (resid 43 and name HA) 2.125 0.564 0.564 weight 1.000 ! spec=HCH, no=886, id=3940, vol=1.390000e+08
or (resid 43 and name HB1) (resid 43 and name HA)
or (resid 43 and name HB3) (resid 43 and name HA)
assign (resid 43 and name HB2) (resid 43 and name HB1) 1.126 0.158 0.158 weight 1.000 ! spec=HCH, no=887, id=3941, vol=6.310000e+09
or (resid 43 and name HB2) (resid 43 and name HB3)
or (resid 43 and name HB2) (resid 43 and name HB1)
or (resid 43 and name HB1) (resid 43 and name HB3)
or (resid 43 and name HB2) (resid 43 and name HB3)
or (resid 43 and name HB1) (resid 43 and name HB3)
assign (resid 44 and name HA) (resid 44 and name HB) 2.342 0.685 0.685 weight 1.000 ! spec=HCH, no=893, id=3946, vol=7.780000e+07
assign (resid 44 and name HA) (resid 44 and name HG12) 2.845 1.012 1.012 weight 1.000 ! spec=HCH, no=894, id=3947, vol=2.420000e+07
assign (resid 44 and name HA) (resid 44 and name HG11) 2.861 1.023 1.023 weight 1.000 ! spec=HCH, no=895, id=3948, vol=2.340000e+07
assign (resid 44 and name HN) (resid 44 and name HB) 2.975 1.106 1.106 weight 1.000 ! spec=HCH, no=900, id=3953, vol=1.850000e+07
assign (resid 44 and name HB) (resid 44 and name HG11) 2.669 0.890 0.890 weight 1.000 ! spec=HCH, no=903, id=3955, vol=3.550000e+07
assign (resid 44 and name HD12) (resid 52 and name HA) 2.757 0.950 0.950 weight 1.000 ! spec=HCH, no=909, id=3961, vol=2.920000e+07
or (resid 44 and name HD11) (resid 52 and name HA)
or (resid 44 and name HD13) (resid 52 and name HA)
assign (resid 44 and name HD12) (resid 55 and name HG2) 2.562 0.820 0.820 weight 1.000 ! spec=HCH, no=912, id=3964, vol=4.540000e+07
or (resid 44 and name HD11) (resid 55 and name HG2)
or (resid 44 and name HD13) (resid 55 and name HG2)
assign (resid 45 and name HN) (resid 44 and name HD12) 2.926 1.070 1.070 weight 1.000 ! spec=HCH, no=913, id=3965, vol=2.040000e+07
or (resid 45 and name HN) (resid 44 and name HD11)
or (resid 45 and name HN) (resid 44 and name HD13)
assign (resid 44 and name HD12) (resid 55 and name HG1) 2.660 0.884 0.884 weight 1.000 ! spec=HCH, no=914, id=3966, vol=3.620000e+07
or (resid 44 and name HD11) (resid 55 and name HG1)
or (resid 44 and name HD13) (resid 55 and name HG1)
assign (resid 44 and name HD12) (resid 44 and name HB) 2.211 0.611 0.611 weight 1.000 ! spec=HCH, no=918, id=3969, vol=1.100000e+08
or (resid 44 and name HD11) (resid 44 and name HB)
or (resid 44 and name HD13) (resid 44 and name HB)
assign (resid 44 and name HD12) (resid 44 and name HG12) 1.789 0.400 0.400 weight 1.000 ! spec=HCH, no=919, id=3970, vol=3.910000e+08
or (resid 44 and name HD11) (resid 44 and name HG12)
or (resid 44 and name HD13) (resid 44 and name HG12)
assign (resid 44 and name HD12) (resid 44 and name HG11) 1.939 0.470 0.470 weight 1.000 ! spec=HCH, no=920, id=3971, vol=2.410000e+08
or (resid 44 and name HD11) (resid 44 and name HG11)
or (resid 44 and name HD13) (resid 44 and name HG11)
assign (resid 44 and name HG11) (resid 46 and name HB) 3.537 1.563 1.563 weight 1.000 ! spec=HCH, no=923, id=3974, vol=6.550000e+06
assign (resid 44 and name HG11) (resid 44 and name HG12) 2.078 0.540 0.540 weight 1.000 ! spec=HCH, no=925, id=3976, vol=1.590000e+08
assign (resid 44 and name HG11) (resid 46 and name HG22) 2.197 0.603 0.603 weight 1.000 ! spec=HCH, no=928, id=3979, vol=1.140000e+08
or (resid 44 and name HG11) (resid 46 and name HG21)
or (resid 44 and name HG11) (resid 46 and name HG23)
assign (resid 44 and name HG11) (resid 148 and name HB) 3.510 1.540 1.540 weight 1.000 ! spec=HCH, no=929, id=3980, vol=6.850000e+06
assign (resid 44 and name HG22) (resid 55 and name HG1) 2.963 1.097 1.097 weight 1.000 ! spec=HCH, no=933, id=3984, vol=1.900000e+07
or (resid 44 and name HG21) (resid 55 and name HG1)
or (resid 44 and name HG23) (resid 55 and name HG1)
assign (resid 44 and name HG22) (resid 42 and name HB1) 2.599 0.844 0.844 weight 1.000 ! spec=HCH, no=939, id=3989, vol=4.170000e+07
or (resid 44 and name HG21) (resid 42 and name HB1)
or (resid 44 and name HG23) (resid 42 and name HB1)
assign (resid 44 and name HN) (resid 44 and name HG22) 2.565 0.823 0.823 weight 1.000 ! spec=HCH, no=941, id=3991, vol=4.500000e+07
or (resid 44 and name HN) (resid 44 and name HG21)
or (resid 44 and name HN) (resid 44 and name HG23)
assign (resid 44 and name HA) (resid 44 and name HG22) 2.141 0.573 0.573 weight 1.000 ! spec=HCH, no=942, id=3992, vol=1.330000e+08
or (resid 44 and name HA) (resid 44 and name HG21)
or (resid 44 and name HA) (resid 44 and name HG23)
assign (resid 44 and name HB) (resid 44 and name HG22) 1.943 0.472 0.472 weight 1.000 ! spec=HCH, no=943, id=3993, vol=2.390000e+08
or (resid 44 and name HB) (resid 44 and name HG21)
or (resid 44 and name HB) (resid 44 and name HG23)
assign (resid 44 and name HG22) (resid 44 and name HG21) 1.065 0.142 0.142 weight 1.000 ! spec=HCH, no=945, id=3995, vol=8.800000e+09
or (resid 44 and name HG22) (resid 44 and name HG23)
or (resid 44 and name HG22) (resid 44 and name HG21)
or (resid 44 and name HG21) (resid 44 and name HG23)
or (resid 44 and name HG22) (resid 44 and name HG23)
or (resid 44 and name HG21) (resid 44 and name HG23)
assign (resid 55 and name HE22) (resid 44 and name HG22) 3.002 1.127 1.127 weight 1.000 ! spec=HCH, no=949, id=3999, vol=1.750000e+07
or (resid 55 and name HE22) (resid 44 and name HG21)
or (resid 55 and name HE22) (resid 44 and name HG23)
assign (resid 45 and name HA) (resid 45 and name HB2) 2.455 0.753 0.753 weight 1.000 ! spec=HCH, no=953, id=4003, vol=5.860000e+07
assign (resid 45 and name HA) (resid 45 and name HB1) 2.368 0.701 0.701 weight 1.000 ! spec=HCH, no=954, id=4004, vol=7.270000e+07
assign (resid 45 and name HA) (resid 46 and name HN) 2.102 0.552 0.552 weight 1.000 ! spec=HCH, no=955, id=4005, vol=1.490000e+08
assign (resid 45 and name HB1) (resid 45 and name HG2) 2.557 0.817 0.817 weight 1.000 ! spec=HCH, no=959, id=4009, vol=4.590000e+07
assign (resid 45 and name HB1) (resid 45 and name HG1) 2.452 0.751 0.751 weight 1.000 ! spec=HCH, no=960, id=4010, vol=5.910000e+07
assign (resid 45 and name HB2) (resid 46 and name HN) 3.139 1.232 1.232 weight 1.000 ! spec=HCH, no=961, id=4011, vol=1.340000e+07
assign (resid 46 and name HN) (resid 45 and name HB1) 3.147 1.238 1.238 weight 1.000 ! spec=HCH, no=962, id=4012, vol=1.320000e+07
assign (resid 45 and name HD2) (resid 45 and name HN) 3.167 1.254 1.254 weight 1.000 ! spec=HCH, no=969, id=4019, vol=1.270000e+07
assign (resid 45 and name HD2) (resid 45 and name HE2) 2.232 0.623 0.623 weight 1.000 ! spec=HCH, no=972, id=4021, vol=1.040000e+08
assign (resid 45 and name HN) (resid 45 and name HG2) 3.385 1.432 1.432 weight 1.000 ! spec=HCH, no=982, id=4030, vol=8.520000e+06
assign (resid 45 and name HN) (resid 45 and name HG1) 3.338 1.393 1.393 weight 1.000 ! spec=HCH, no=983, id=4031, vol=9.270000e+06
assign (resid 45 and name HD2) (resid 45 and name HG1) 2.023 0.511 0.511 weight 1.000 ! spec=HCH, no=984, id=4032, vol=1.870000e+08
assign (resid 45 and name HG2) (resid 45 and name HE2) 3.178 1.262 1.262 weight 1.000 ! spec=HCH, no=985, id=4033, vol=1.250000e+07
assign (resid 45 and name HG1) (resid 45 and name HE2) 3.420 1.462 1.462 weight 1.000 ! spec=HCH, no=986, id=4034, vol=8.020000e+06
assign (resid 45 and name HG1) (resid 46 and name HA) 3.011 1.133 1.133 weight 1.000 ! spec=HCH, no=990, id=4038, vol=1.720000e+07
assign (resid 45 and name HG1) (resid 46 and name HG22) 3.627 1.644 1.644 weight 1.000 ! spec=HCH, no=992, id=4040, vol=5.630000e+06
or (resid 45 and name HG1) (resid 46 and name HG21)
or (resid 45 and name HG1) (resid 46 and name HG23)
assign (resid 46 and name HA) (resid 46 and name HB) 2.526 0.798 0.798 weight 1.000 ! spec=HCH, no=993, id=4041, vol=4.940000e+07
assign (resid 47 and name HN) (resid 46 and name HA) 2.202 0.606 0.606 weight 1.000 ! spec=HCH, no=995, id=4043, vol=1.120000e+08
assign (resid 46 and name HA) (resid 47 and name HG2) 2.916 1.063 1.063 weight 1.000 ! spec=HCH, no=996, id=4044, vol=2.090000e+07
assign (resid 46 and name HB) (resid 148 and name HB) 2.859 1.022 1.022 weight 1.000 ! spec=HCH, no=1000, id=4048, vol=2.350000e+07
assign (resid 46 and name HB) (resid 47 and name HN) 3.011 1.134 1.134 weight 1.000 ! spec=HCH, no=1006, id=4054, vol=1.720000e+07
assign (resid 46 and name HB) (resid 47 and name HA) 3.591 1.612 1.612 weight 1.000 ! spec=HCH, no=1007, id=4055, vol=5.980000e+06
assign (resid 46 and name HG12) (resid 48 and name HB1) 3.324 1.381 1.381 weight 1.000 ! spec=HCH, no=1013, id=4061, vol=9.510000e+06
or (resid 46 and name HG11) (resid 48 and name HB1)
or (resid 46 and name HG13) (resid 48 and name HB1)
assign (resid 46 and name HG12) (resid 52 and name HA) 2.816 0.991 0.991 weight 1.000 ! spec=HCH, no=1016, id=4064, vol=2.570000e+07
or (resid 46 and name HG11) (resid 52 and name HA)
or (resid 46 and name HG13) (resid 52 and name HA)
assign (resid 48 and name HN) (resid 46 and name HG12) 2.420 0.732 0.732 weight 1.000 ! spec=HCH, no=1018, id=4066, vol=6.380000e+07
or (resid 48 and name HN) (resid 46 and name HG11)
or (resid 48 and name HN) (resid 46 and name HG13)
assign (resid 46 and name HG12) (resid 146 and name HN) 3.771 1.778 1.778 weight 1.000 ! spec=HCH, no=1020, id=4068, vol=4.460000e+06
or (resid 46 and name HG11) (resid 146 and name HN)
or (resid 46 and name HG13) (resid 146 and name HN)
assign (resid 46 and name HG12) (resid 47 and name HA) 3.058 1.169 1.169 weight 1.000 ! spec=HCH, no=1021, id=4069, vol=1.570000e+07
or (resid 46 and name HG11) (resid 47 and name HA)
or (resid 46 and name HG13) (resid 47 and name HA)
assign (resid 46 and name HA) (resid 46 and name HG12) 2.140 0.572 0.572 weight 1.000 ! spec=HCH, no=1027, id=4075, vol=1.340000e+08
or (resid 46 and name HA) (resid 46 and name HG11)
or (resid 46 and name HA) (resid 46 and name HG13)
assign (resid 46 and name HB) (resid 46 and name HG12) 2.049 0.525 0.525 weight 1.000 ! spec=HCH, no=1028, id=4076, vol=1.730000e+08
or (resid 46 and name HB) (resid 46 and name HG11)
or (resid 46 and name HB) (resid 46 and name HG13)
assign (resid 46 and name HG12) (resid 46 and name HG11) 1.219 0.186 0.186 weight 1.000 ! spec=HCH, no=1029, id=4077, vol=3.910000e+09
or (resid 46 and name HG12) (resid 46 and name HG13)
or (resid 46 and name HG12) (resid 46 and name HG11)
or (resid 46 and name HG11) (resid 46 and name HG13)
or (resid 46 and name HG12) (resid 46 and name HG13)
or (resid 46 and name HG11) (resid 46 and name HG13)
assign (resid 47 and name HN) (resid 46 and name HG12) 2.622 0.860 0.860 weight 1.000 ! spec=HCH, no=1030, id=4078, vol=3.940000e+07
or (resid 47 and name HN) (resid 46 and name HG11)
or (resid 47 and name HN) (resid 46 and name HG13)
assign (resid 46 and name HG12) (resid 51 and name HN) 3.196 1.277 1.277 weight 1.000 ! spec=HCH, no=1033, id=4081, vol=1.200000e+07
or (resid 46 and name HG11) (resid 51 and name HN)
or (resid 46 and name HG13) (resid 51 and name HN)
assign (resid 46 and name HG12) (resid 51 and name HB2) 2.473 0.765 0.765 weight 1.000 ! spec=HCH, no=1034, id=4082, vol=5.600000e+07
or (resid 46 and name HG11) (resid 51 and name HB2)
or (resid 46 and name HG13) (resid 51 and name HB2)
assign (resid 46 and name HG12) (resid 51 and name HB1) 2.508 0.786 0.786 weight 1.000 ! spec=HCH, no=1035, id=4083, vol=5.160000e+07
or (resid 46 and name HG11) (resid 51 and name HB1)
or (resid 46 and name HG13) (resid 51 and name HB1)
assign (resid 46 and name HG12) (resid 148 and name HG22) 2.148 0.577 0.577 weight 1.000 ! spec=HCH, no=1039, id=4087, vol=1.310000e+08
or (resid 46 and name HG12) (resid 148 and name HG21)
or (resid 46 and name HG12) (resid 148 and name HG23)
or (resid 46 and name HG11) (resid 148 and name HG22)
or (resid 46 and name HG11) (resid 148 and name HG21)
or (resid 46 and name HG11) (resid 148 and name HG23)
or (resid 46 and name HG13) (resid 148 and name HG22)
or (resid 46 and name HG13) (resid 148 and name HG21)
or (resid 46 and name HG13) (resid 148 and name HG23)
assign (resid 51 and name HN) (resid 46 and name HG22) 3.539 1.566 1.566 weight 1.000 ! spec=HCH, no=1051, id=4099, vol=6.530000e+06
or (resid 51 and name HN) (resid 46 and name HG21)
or (resid 51 and name HN) (resid 46 and name HG23)
assign (resid 46 and name HG22) (resid 44 and name HN) 3.565 1.588 1.588 weight 1.000 ! spec=HCH, no=1052, id=4100, vol=6.250000e+06
or (resid 46 and name HG21) (resid 44 and name HN)
or (resid 46 and name HG23) (resid 44 and name HN)
assign (resid 46 and name HG22) (resid 46 and name HN) 2.229 0.621 0.621 weight 1.000 ! spec=HCH, no=1053, id=4101, vol=1.050000e+08
or (resid 46 and name HG21) (resid 46 and name HN)
or (resid 46 and name HG23) (resid 46 and name HN)
assign (resid 46 and name HG22) (resid 46 and name HA) 2.245 0.630 0.630 weight 1.000 ! spec=HCH, no=1054, id=4102, vol=1.000000e+08
or (resid 46 and name HG21) (resid 46 and name HA)
or (resid 46 and name HG23) (resid 46 and name HA)
assign (resid 46 and name HG22) (resid 46 and name HB) 2.113 0.558 0.558 weight 1.000 ! spec=HCH, no=1055, id=4103, vol=1.440000e+08
or (resid 46 and name HG21) (resid 46 and name HB)
or (resid 46 and name HG23) (resid 46 and name HB)
assign (resid 46 and name HG22) (resid 46 and name HG21) 1.220 0.186 0.186 weight 1.000 ! spec=HCH, no=1056, id=4104, vol=3.880000e+09
or (resid 46 and name HG22) (resid 46 and name HG23)
or (resid 46 and name HG22) (resid 46 and name HG21)
or (resid 46 and name HG21) (resid 46 and name HG23)
or (resid 46 and name HG22) (resid 46 and name HG23)
or (resid 46 and name HG21) (resid 46 and name HG23)
assign (resid 46 and name HG22) (resid 47 and name HN) 2.886 1.041 1.041 weight 1.000 ! spec=HCH, no=1057, id=4105, vol=2.220000e+07
or (resid 46 and name HG21) (resid 47 and name HN)
or (resid 46 and name HG23) (resid 47 and name HN)
assign (resid 46 and name HG22) (resid 51 and name HB2) 2.896 1.048 1.048 weight 1.000 ! spec=HCH, no=1058, id=4106, vol=2.170000e+07
or (resid 46 and name HG21) (resid 51 and name HB2)
or (resid 46 and name HG23) (resid 51 and name HB2)
assign (resid 46 and name HG22) (resid 51 and name HB1) 2.850 1.015 1.015 weight 1.000 ! spec=HCH, no=1059, id=4107, vol=2.400000e+07
or (resid 46 and name HG21) (resid 51 and name HB1)
or (resid 46 and name HG23) (resid 51 and name HB1)
assign (resid 46 and name HG22) (resid 55 and name HE21) 3.656 1.670 1.670 weight 1.000 ! spec=HCH, no=1064, id=4112, vol=5.370000e+06
or (resid 46 and name HG21) (resid 55 and name HE21)
or (resid 46 and name HG23) (resid 55 and name HE21)
assign (resid 46 and name HG22) (resid 55 and name HE22) 3.737 1.746 1.746 weight 1.000 ! spec=HCH, no=1065, id=4113, vol=4.710000e+06
or (resid 46 and name HG21) (resid 55 and name HE22)
or (resid 46 and name HG23) (resid 55 and name HE22)
assign (resid 46 and name HG22) (resid 146 and name HB1) 3.055 1.166 1.166 weight 1.000 ! spec=HCH, no=1068, id=4116, vol=1.580000e+07
or (resid 46 and name HG21) (resid 146 and name HB1)
or (resid 46 and name HG23) (resid 146 and name HB1)
assign (resid 47 and name HA) (resid 47 and name HB1) 2.826 0.998 0.998 weight 1.000 ! spec=HCH, no=1076, id=4123, vol=2.520000e+07
assign (resid 47 and name HA) (resid 47 and name HG2) 2.326 0.676 0.676 weight 1.000 ! spec=HCH, no=1077, id=4124, vol=8.100000e+07
assign (resid 47 and name HN) (resid 47 and name HB2) 3.051 1.163 1.163 weight 1.000 ! spec=HCH, no=1080, id=4127, vol=1.590000e+07
assign (resid 47 and name HB2) (resid 47 and name HA) 2.768 0.958 0.958 weight 1.000 ! spec=HCH, no=1082, id=4129, vol=2.850000e+07
assign (resid 47 and name HB1) (resid 47 and name HB2) 1.888 0.446 0.446 weight 1.000 ! spec=HCH, no=1084, id=4131, vol=2.830000e+08
assign (resid 48 and name HN) (resid 47 and name HB2) 3.323 1.380 1.380 weight 1.000 ! spec=HCH, no=1086, id=4133, vol=9.520000e+06
assign (resid 47 and name HG2) (resid 48 and name HN) 3.152 1.242 1.242 weight 1.000 ! spec=HCH, no=1090, id=4137, vol=1.310000e+07
assign (resid 46 and name HG12) (resid 47 and name HG2) 3.361 1.412 1.412 weight 1.000 ! spec=HCH, no=1092, id=4139, vol=8.900000e+06
or (resid 46 and name HG11) (resid 47 and name HG2)
or (resid 46 and name HG13) (resid 47 and name HG2)
assign (resid 47 and name HG2) (resid 47 and name HN) 2.828 0.999 0.999 weight 1.000 ! spec=HCH, no=1093, id=4140, vol=2.510000e+07
assign (resid 47 and name HG2) (resid 47 and name HB1) 1.896 0.450 0.450 weight 1.000 ! spec=HCH, no=1095, id=4142, vol=2.760000e+08
assign (resid 48 and name HA) (resid 46 and name HG12) 2.739 0.938 0.938 weight 1.000 ! spec=HCH, no=1099, id=4146, vol=3.040000e+07
or (resid 48 and name HA) (resid 46 and name HG11)
or (resid 48 and name HA) (resid 46 and name HG13)
assign (resid 48 and name HN) (resid 48 and name HA) 2.624 0.861 0.861 weight 1.000 ! spec=HCH, no=1100, id=4147, vol=3.930000e+07
assign (resid 48 and name HA) (resid 48 and name HB2) 2.399 0.719 0.719 weight 1.000 ! spec=HCH, no=1102, id=4148, vol=6.730000e+07
assign (resid 48 and name HA) (resid 48 and name HB1) 2.285 0.653 0.653 weight 1.000 ! spec=HCH, no=1103, id=4149, vol=9.010000e+07
assign (resid 48 and name HA) (resid 49 and name HG22) 2.987 1.116 1.116 weight 1.000 ! spec=HCH, no=1106, id=4152, vol=1.800000e+07
or (resid 48 and name HA) (resid 49 and name HG21)
or (resid 48 and name HA) (resid 49 and name HG23)
assign (resid 48 and name HB2) (resid 50 and name HG2) 2.993 1.120 1.120 weight 1.000 ! spec=HCH, no=1108, id=4154, vol=1.780000e+07
assign (resid 48 and name HB2) (resid 46 and name HG12) 3.466 1.501 1.501 weight 1.000 ! spec=HCH, no=1113, id=4159, vol=7.400000e+06
or (resid 48 and name HB2) (resid 46 and name HG11)
or (resid 48 and name HB2) (resid 46 and name HG13)
assign (resid 48 and name HB1) (resid 48 and name HB2) 2.077 0.539 0.539 weight 1.000 ! spec=HCH, no=1121, id=4166, vol=1.600000e+08
assign (resid 48 and name HB1) (resid 49 and name HN) 2.622 0.859 0.859 weight 1.000 ! spec=HCH, no=1124, id=4168, vol=3.950000e+07
assign (resid 48 and name HB1) (resid 49 and name HB) 3.396 1.442 1.442 weight 1.000 ! spec=HCH, no=1125, id=4169, vol=8.360000e+06
assign (resid 48 and name HB2) (resid 50 and name HB2) 3.372 1.421 1.421 weight 1.000 ! spec=HCH, no=1130, id=4174, vol=8.720000e+06
assign (resid 48 and name HB1) (resid 50 and name HB2) 3.226 1.301 1.301 weight 1.000 ! spec=HCH, no=1131, id=4175, vol=1.140000e+07
assign (resid 48 and name HB2) (resid 51 and name HN) 3.674 1.688 1.688 weight 1.000 ! spec=HCH, no=1132, id=4176, vol=5.210000e+06
assign (resid 48 and name HB2) (resid 52 and name HN) 3.992 1.992 1.992 weight 1.000 ! spec=HCH, no=1134, id=4178, vol=3.170000e+06
assign (resid 52 and name HN) (resid 48 and name HB1) 4.083 2.084 2.084 weight 1.000 ! spec=HCH, no=1135, id=4179, vol=2.770000e+06
assign (resid 46 and name HG12) (resid 49 and name HA) 2.752 0.946 0.946 weight 1.000 ! spec=HCH, no=1138, id=4182, vol=2.950000e+07
or (resid 46 and name HG11) (resid 49 and name HA)
or (resid 46 and name HG13) (resid 49 and name HA)
assign (resid 49 and name HA) (resid 48 and name HA) 3.168 1.255 1.255 weight 1.000 ! spec=HCH, no=1139, id=4183, vol=1.270000e+07
assign (resid 49 and name HA) (resid 49 and name HB) 2.338 0.684 0.684 weight 1.000 ! spec=HCH, no=1141, id=4185, vol=7.840000e+07
assign (resid 49 and name HA) (resid 49 and name HG12) 2.515 0.791 0.791 weight 1.000 ! spec=HCH, no=1142, id=4186, vol=5.060000e+07
assign (resid 49 and name HA) (resid 49 and name HG22) 2.378 0.707 0.707 weight 1.000 ! spec=HCH, no=1143, id=4187, vol=7.090000e+07
or (resid 49 and name HA) (resid 49 and name HG21)
or (resid 49 and name HA) (resid 49 and name HG23)
assign (resid 49 and name HA) (resid 51 and name HN) 3.293 1.355 1.355 weight 1.000 ! spec=HCH, no=1145, id=4189, vol=1.010000e+07
assign (resid 52 and name HN) (resid 49 and name HA) 2.859 1.022 1.022 weight 1.000 ! spec=HCH, no=1146, id=4190, vol=2.350000e+07
assign (resid 49 and name HB) (resid 143 and name HB1) 3.725 1.734 1.734 weight 1.000 ! spec=HCH, no=1150, id=4194, vol=4.800000e+06
assign (resid 49 and name HB) (resid 90 and name HD22) 3.508 1.538 1.538 weight 1.000 ! spec=HCH, no=1151, id=4195, vol=6.880000e+06
or (resid 49 and name HB) (resid 90 and name HD21)
or (resid 49 and name HB) (resid 90 and name HD23)
assign (resid 48 and name HA) (resid 49 and name HB) 3.470 1.505 1.505 weight 1.000 ! spec=HCH, no=1154, id=4198, vol=7.340000e+06
assign (resid 49 and name HB) (resid 50 and name HN) 3.281 1.346 1.346 weight 1.000 ! spec=HCH, no=1161, id=4204, vol=1.030000e+07
assign (resid 49 and name HB) (resid 52 and name HG12) 3.190 1.272 1.272 weight 1.000 ! spec=HCH, no=1163, id=4206, vol=1.220000e+07
or (resid 49 and name HB) (resid 52 and name HG11)
or (resid 49 and name HB) (resid 52 and name HG13)
assign (resid 49 and name HD12) (resid 94 and name HN) 3.711 1.722 1.722 weight 1.000 ! spec=HCH, no=1164, id=4207, vol=4.910000e+06
or (resid 49 and name HD11) (resid 94 and name HN)
or (resid 49 and name HD13) (resid 94 and name HN)
assign (resid 49 and name HD12) (resid 143 and name HB1) 3.260 1.329 1.329 weight 1.000 ! spec=HCH, no=1168, id=4210, vol=1.070000e+07
or (resid 49 and name HD11) (resid 143 and name HB1)
or (resid 49 and name HD13) (resid 143 and name HB1)
assign (resid 49 and name HD12) (resid 143 and name HA) 3.250 1.320 1.320 weight 1.000 ! spec=HCH, no=1171, id=4213, vol=1.090000e+07
or (resid 49 and name HD11) (resid 143 and name HA)
or (resid 49 and name HD13) (resid 143 and name HA)
assign (resid 49 and name HD12) (resid 94 and name HA) 3.671 1.685 1.685 weight 1.000 ! spec=HCH, no=1175, id=4217, vol=5.240000e+06
or (resid 49 and name HD11) (resid 94 and name HA)
or (resid 49 and name HD13) (resid 94 and name HA)
assign (resid 49 and name HN) (resid 49 and name HD12) 3.030 1.148 1.148 weight 1.000 ! spec=HCH, no=1181, id=4223, vol=1.660000e+07
or (resid 49 and name HN) (resid 49 and name HD11)
or (resid 49 and name HN) (resid 49 and name HD13)
assign (resid 49 and name HD12) (resid 49 and name HB) 2.184 0.596 0.596 weight 1.000 ! spec=HCH, no=1183, id=4225, vol=1.180000e+08
or (resid 49 and name HD11) (resid 49 and name HB)
or (resid 49 and name HD13) (resid 49 and name HB)
assign (resid 49 and name HD12) (resid 49 and name HG12) 2.150 0.578 0.578 weight 1.000 ! spec=HCH, no=1184, id=4226, vol=1.300000e+08
or (resid 49 and name HD11) (resid 49 and name HG12)
or (resid 49 and name HD13) (resid 49 and name HG12)
assign (resid 49 and name HD12) (resid 49 and name HD11) 1.212 0.184 0.184 weight 1.000 ! spec=HCH, no=1185, id=4227, vol=4.050000e+09
or (resid 49 and name HD12) (resid 49 and name HD13)
or (resid 49 and name HD12) (resid 49 and name HD11)
or (resid 49 and name HD11) (resid 49 and name HD13)
or (resid 49 and name HD12) (resid 49 and name HD13)
or (resid 49 and name HD11) (resid 49 and name HD13)
assign (resid 49 and name HD12) (resid 91 and name HN) 3.964 1.964 1.964 weight 1.000 ! spec=HCH, no=1189, id=4231, vol=3.310000e+06
or (resid 49 and name HD11) (resid 91 and name HN)
or (resid 49 and name HD13) (resid 91 and name HN)
assign (resid 49 and name HD12) (resid 128 and name HB2) 3.265 1.333 1.333 weight 1.000 ! spec=HCH, no=1190, id=4232, vol=1.060000e+07
or (resid 49 and name HD11) (resid 128 and name HB2)
or (resid 49 and name HD13) (resid 128 and name HB2)
assign (resid 49 and name HD12) (resid 143 and name HB2) 3.444 1.483 1.483 weight 1.000 ! spec=HCH, no=1191, id=4233, vol=7.690000e+06
or (resid 49 and name HD11) (resid 143 and name HB2)
or (resid 49 and name HD13) (resid 143 and name HB2)
assign (resid 49 and name HB) (resid 49 and name HG12) 2.505 0.784 0.784 weight 1.000 ! spec=HCH, no=1194, id=4236, vol=5.200000e+07
assign (resid 49 and name HG12) (resid 90 and name HD22) 3.355 1.407 1.407 weight 1.000 ! spec=HCH, no=1195, id=4237, vol=8.990000e+06
or (resid 49 and name HG12) (resid 90 and name HD21)
or (resid 49 and name HG12) (resid 90 and name HD23)
assign (resid 49 and name HG12) (resid 90 and name HD12) 3.119 1.216 1.216 weight 1.000 ! spec=HCH, no=1196, id=4238, vol=1.390000e+07
or (resid 49 and name HG12) (resid 90 and name HD11)
or (resid 49 and name HG12) (resid 90 and name HD13)
assign (resid 49 and name HN) (resid 49 and name HG12) 3.286 1.350 1.350 weight 1.000 ! spec=HCH, no=1200, id=4242, vol=1.020000e+07
assign (resid 49 and name HN) (resid 49 and name HG11) 3.214 1.291 1.291 weight 1.000 ! spec=HCH, no=1201, id=4243, vol=1.160000e+07
assign (resid 49 and name HG11) (resid 49 and name HA) 2.829 1.001 1.001 weight 1.000 ! spec=HCH, no=1203, id=4245, vol=2.500000e+07
assign (resid 49 and name HG12) (resid 105 and name HZ) 3.084 1.189 1.189 weight 1.000 ! spec=HCH, no=1206, id=4248, vol=1.490000e+07
assign (resid 49 and name HG11) (resid 105 and name HZ) 3.092 1.195 1.195 weight 1.000 ! spec=HCH, no=1207, id=4249, vol=1.470000e+07
assign (resid 49 and name HG22) (resid 53 and name HD1) 3.765 1.772 1.772 weight 1.000 ! spec=HCH, no=1216, id=4253, vol=4.500000e+06
or (resid 49 and name HG21) (resid 53 and name HD1)
or (resid 49 and name HG23) (resid 53 and name HD1)
assign (resid 49 and name HG11) (resid 49 and name HG22) 2.189 0.599 0.599 weight 1.000 ! spec=HCH, no=1218, id=4254, vol=1.170000e+08
or (resid 49 and name HG11) (resid 49 and name HG21)
or (resid 49 and name HG11) (resid 49 and name HG23)
assign (resid 49 and name HG22) (resid 105 and name HD1) 3.316 1.374 1.374 weight 1.000 ! spec=HCH, no=1221, id=4257, vol=9.650000e+06
or (resid 49 and name HG22) (resid 105 and name HD2)
or (resid 49 and name HG21) (resid 105 and name HD1)
or (resid 49 and name HG21) (resid 105 and name HD2)
or (resid 49 and name HG23) (resid 105 and name HD1)
or (resid 49 and name HG23) (resid 105 and name HD2)
assign (resid 49 and name HG22) (resid 143 and name HN) 4.103 2.104 2.104 weight 1.000 ! spec=HCH, no=1224, id=4260, vol=2.690000e+06
or (resid 49 and name HG21) (resid 143 and name HN)
or (resid 49 and name HG23) (resid 143 and name HN)
assign (resid 48 and name HB1) (resid 49 and name HG22) 2.930 1.073 1.073 weight 1.000 ! spec=HCH, no=1226, id=4262, vol=2.030000e+07
or (resid 48 and name HB1) (resid 49 and name HG21)
or (resid 48 and name HB1) (resid 49 and name HG23)
assign (resid 49 and name HG22) (resid 144 and name HG2) 2.681 0.898 0.898 weight 1.000 ! spec=HCH, no=1234, id=4270, vol=3.450000e+07
or (resid 49 and name HG22) (resid 144 and name HG1)
or (resid 49 and name HG21) (resid 144 and name HG2)
or (resid 49 and name HG21) (resid 144 and name HG1)
or (resid 49 and name HG23) (resid 144 and name HG2)
or (resid 49 and name HG23) (resid 144 and name HG1)
assign (resid 49 and name HG22) (resid 142 and name HA) 4.009 2.009 2.009 weight 1.000 ! spec=HCH, no=1236, id=4272, vol=3.090000e+06
or (resid 49 and name HG21) (resid 142 and name HA)
or (resid 49 and name HG23) (resid 142 and name HA)
assign (resid 49 and name HN) (resid 49 and name HG22) 2.247 0.631 0.631 weight 1.000 ! spec=HCH, no=1237, id=4273, vol=9.970000e+07
or (resid 49 and name HN) (resid 49 and name HG21)
or (resid 49 and name HN) (resid 49 and name HG23)
assign (resid 49 and name HB) (resid 49 and name HG22) 2.044 0.522 0.522 weight 1.000 ! spec=HCH, no=1239, id=4275, vol=1.760000e+08
or (resid 49 and name HB) (resid 49 and name HG21)
or (resid 49 and name HB) (resid 49 and name HG23)
assign (resid 49 and name HG22) (resid 49 and name HG21) 1.157 0.167 0.167 weight 1.000 ! spec=HCH, no=1240, id=4276, vol=5.340000e+09
or (resid 49 and name HG22) (resid 49 and name HG23)
or (resid 49 and name HG22) (resid 49 and name HG21)
or (resid 49 and name HG21) (resid 49 and name HG23)
or (resid 49 and name HG22) (resid 49 and name HG23)
or (resid 49 and name HG21) (resid 49 and name HG23)
assign (resid 50 and name HN) (resid 49 and name HG22) 2.317 0.671 0.671 weight 1.000 ! spec=HCH, no=1241, id=4277, vol=8.290000e+07
or (resid 50 and name HN) (resid 49 and name HG21)
or (resid 50 and name HN) (resid 49 and name HG23)
assign (resid 49 and name HG22) (resid 50 and name HA) 2.824 0.997 0.997 weight 1.000 ! spec=HCH, no=1242, id=4278, vol=2.530000e+07
or (resid 49 and name HG21) (resid 50 and name HA)
or (resid 49 and name HG23) (resid 50 and name HA)
assign (resid 49 and name HG22) (resid 94 and name HA) 3.763 1.770 1.770 weight 1.000 ! spec=HCH, no=1243, id=4279, vol=4.520000e+06
or (resid 49 and name HG21) (resid 94 and name HA)
or (resid 49 and name HG23) (resid 94 and name HA)
assign (resid 49 and name HG22) (resid 94 and name HD1) 3.672 1.685 1.685 weight 1.000 ! spec=HCH, no=1244, id=4280, vol=5.230000e+06
or (resid 49 and name HG21) (resid 94 and name HD1)
or (resid 49 and name HG23) (resid 94 and name HD1)
assign (resid 49 and name HG22) (resid 105 and name HZ) 2.289 0.655 0.655 weight 1.000 ! spec=HCH, no=1245, id=4281, vol=8.920000e+07
or (resid 49 and name HG21) (resid 105 and name HZ)
or (resid 49 and name HG23) (resid 105 and name HZ)
assign (resid 50 and name HA) (resid 50 and name HG2) 2.646 0.875 0.875 weight 1.000 ! spec=HCH, no=1246, id=4282, vol=3.740000e+07
assign (resid 50 and name HA) (resid 50 and name HB2) 2.313 0.669 0.669 weight 1.000 ! spec=HCH, no=1257, id=4292, vol=8.380000e+07
assign (resid 50 and name HA) (resid 51 and name HA) 3.852 1.854 1.854 weight 1.000 ! spec=HCH, no=1259, id=4294, vol=3.930000e+06
assign (resid 50 and name HA) (resid 52 and name HG12) 3.781 1.787 1.787 weight 1.000 ! spec=HCH, no=1260, id=4295, vol=4.390000e+06
or (resid 50 and name HA) (resid 52 and name HG11)
or (resid 50 and name HA) (resid 52 and name HG13)
assign (resid 50 and name HA) (resid 53 and name HN) 2.878 1.035 1.035 weight 1.000 ! spec=HCH, no=1261, id=4296, vol=2.260000e+07
assign (resid 50 and name HA) (resid 53 and name HD2) 3.675 1.688 1.688 weight 1.000 ! spec=HCH, no=1262, id=4297, vol=5.200000e+06
assign (resid 50 and name HA) (resid 53 and name HG1) 2.780 0.966 0.966 weight 1.000 ! spec=HCH, no=1263, id=4298, vol=2.780000e+07
assign (resid 50 and name HA) (resid 53 and name HB2) 2.726 0.929 0.929 weight 1.000 ! spec=HCH, no=1264, id=4299, vol=3.120000e+07
assign (resid 50 and name HB2) (resid 50 and name HG2) 2.163 0.585 0.585 weight 1.000 ! spec=HCH, no=1268, id=4303, vol=1.250000e+08
assign (resid 49 and name HN) (resid 50 and name HB2) 3.825 1.828 1.828 weight 1.000 ! spec=HCH, no=1272, id=4307, vol=4.100000e+06
assign (resid 49 and name HG22) (resid 50 and name HB2) 3.263 1.331 1.331 weight 1.000 ! spec=HCH, no=1273, id=4308, vol=1.060000e+07
or (resid 49 and name HG21) (resid 50 and name HB2)
or (resid 49 and name HG23) (resid 50 and name HB2)
assign (resid 50 and name HB2) (resid 53 and name HG1) 3.653 1.668 1.668 weight 1.000 ! spec=HCH, no=1278, id=4312, vol=5.400000e+06
assign (resid 50 and name HG1) (resid 50 and name HB2) 2.219 0.615 0.615 weight 1.000 ! spec=HCH, no=1284, id=4318, vol=1.070000e+08
or (resid 50 and name HG1) (resid 50 and name HB1)
assign (resid 50 and name HG1) (resid 49 and name HG22) 3.165 1.252 1.252 weight 1.000 ! spec=HCH, no=1286, id=4320, vol=1.270000e+07
or (resid 50 and name HG1) (resid 49 and name HG21)
or (resid 50 and name HG1) (resid 49 and name HG23)
assign (resid 50 and name HG1) (resid 50 and name HN) 2.938 1.079 1.079 weight 1.000 ! spec=HCH, no=1288, id=4322, vol=1.990000e+07
assign (resid 50 and name HG1) (resid 50 and name HA) 2.808 0.986 0.986 weight 1.000 ! spec=HCH, no=1290, id=4324, vol=2.610000e+07
assign (resid 50 and name HG1) (resid 51 and name HN) 3.507 1.537 1.537 weight 1.000 ! spec=HCH, no=1291, id=4325, vol=6.900000e+06
assign (resid 50 and name HG1) (resid 105 and name HZ) 3.803 1.808 1.808 weight 1.000 ! spec=HCH, no=1293, id=4327, vol=4.240000e+06
assign (resid 51 and name HA) (resid 51 and name HB1) 2.593 0.841 0.841 weight 1.000 ! spec=HCH, no=1295, id=4329, vol=4.220000e+07
assign (resid 51 and name HA) (resid 50 and name HB2) 3.081 1.187 1.187 weight 1.000 ! spec=HCH, no=1297, id=4331, vol=1.500000e+07
assign (resid 51 and name HA) (resid 54 and name HN) 2.960 1.095 1.095 weight 1.000 ! spec=HCH, no=1300, id=4334, vol=1.910000e+07
assign (resid 51 and name HB2) (resid 55 and name HE21) 3.816 1.820 1.820 weight 1.000 ! spec=HCH, no=1303, id=4337, vol=4.150000e+06
assign (resid 48 and name HN) (resid 51 and name HB2) 3.040 1.155 1.155 weight 1.000 ! spec=HCH, no=1305, id=4339, vol=1.630000e+07
assign (resid 46 and name HA) (resid 51 and name HB2) 2.543 0.808 0.808 weight 1.000 ! spec=HCH, no=1308, id=4342, vol=4.740000e+07
assign (resid 46 and name HA) (resid 51 and name HB1) 2.681 0.898 0.898 weight 1.000 ! spec=HCH, no=1309, id=4343, vol=3.460000e+07
assign (resid 51 and name HN) (resid 51 and name HB2) 2.997 1.123 1.123 weight 1.000 ! spec=HCH, no=1315, id=4349, vol=1.770000e+07
assign (resid 51 and name HB2) (resid 51 and name HA) 2.543 0.808 0.808 weight 1.000 ! spec=HCH, no=1317, id=4351, vol=4.740000e+07
assign (resid 46 and name HG22) (resid 52 and name HA) 2.794 0.976 0.976 weight 1.000 ! spec=HCH, no=1323, id=4357, vol=2.690000e+07
or (resid 46 and name HG21) (resid 52 and name HA)
or (resid 46 and name HG23) (resid 52 and name HA)
assign (resid 52 and name HA) (resid 52 and name HB) 2.882 1.039 1.039 weight 1.000 ! spec=HCH, no=1327, id=4360, vol=2.240000e+07
assign (resid 52 and name HA) (resid 52 and name HG12) 2.374 0.704 0.704 weight 1.000 ! spec=HCH, no=1328, id=4361, vol=7.170000e+07
or (resid 52 and name HA) (resid 52 and name HG11)
or (resid 52 and name HA) (resid 52 and name HG13)
assign (resid 52 and name HA) (resid 55 and name HB2) 3.267 1.334 1.334 weight 1.000 ! spec=HCH, no=1332, id=4365, vol=1.050000e+07
assign (resid 52 and name HA) (resid 55 and name HG1) 3.198 1.279 1.279 weight 1.000 ! spec=HCH, no=1335, id=4368, vol=1.200000e+07
assign (resid 52 and name HB) (resid 46 and name HG12) 3.222 1.297 1.297 weight 1.000 ! spec=HCH, no=1336, id=4369, vol=1.150000e+07
or (resid 52 and name HB) (resid 46 and name HG11)
or (resid 52 and name HB) (resid 46 and name HG13)
assign (resid 52 and name HB) (resid 46 and name HG22) 3.289 1.352 1.352 weight 1.000 ! spec=HCH, no=1337, id=4370, vol=1.010000e+07
or (resid 52 and name HB) (resid 46 and name HG21)
or (resid 52 and name HB) (resid 46 and name HG23)
assign (resid 49 and name HA) (resid 52 and name HB) 3.007 1.130 1.130 weight 1.000 ! spec=HCH, no=1338, id=4371, vol=1.740000e+07
assign (resid 52 and name HB) (resid 49 and name HG12) 3.478 1.512 1.512 weight 1.000 ! spec=HCH, no=1339, id=4372, vol=7.250000e+06
assign (resid 52 and name HB) (resid 53 and name HG1) 4.023 2.023 2.023 weight 1.000 ! spec=HCH, no=1347, id=4379, vol=3.020000e+06
assign (resid 52 and name HG12) (resid 48 and name HA) 3.597 1.617 1.617 weight 1.000 ! spec=HCH, no=1350, id=4382, vol=5.920000e+06
or (resid 52 and name HG11) (resid 48 and name HA)
or (resid 52 and name HG13) (resid 48 and name HA)
assign (resid 52 and name HG12) (resid 55 and name HE22) 3.726 1.735 1.735 weight 1.000 ! spec=HCH, no=1351, id=4383, vol=4.790000e+06
or (resid 52 and name HG11) (resid 55 and name HE22)
or (resid 52 and name HG13) (resid 55 and name HE22)
assign (resid 52 and name HG12) (resid 48 and name HN) 3.061 1.171 1.171 weight 1.000 ! spec=HCH, no=1354, id=4385, vol=1.560000e+07
or (resid 52 and name HG11) (resid 48 and name HN)
or (resid 52 and name HG13) (resid 48 and name HN)
assign (resid 49 and name HA) (resid 52 and name HG12) 2.394 0.717 0.717 weight 1.000 ! spec=HCH, no=1360, id=4391, vol=6.810000e+07
or (resid 49 and name HA) (resid 52 and name HG11)
or (resid 49 and name HA) (resid 52 and name HG13)
assign (resid 52 and name HG12) (resid 49 and name HG12) 2.820 0.994 0.994 weight 1.000 ! spec=HCH, no=1362, id=4393, vol=2.550000e+07
or (resid 52 and name HG11) (resid 49 and name HG12)
or (resid 52 and name HG13) (resid 49 and name HG12)
assign (resid 51 and name HB1) (resid 52 and name HG12) 3.005 1.129 1.129 weight 1.000 ! spec=HCH, no=1367, id=4398, vol=1.740000e+07
or (resid 51 and name HB1) (resid 52 and name HG11)
or (resid 51 and name HB1) (resid 52 and name HG13)
assign (resid 52 and name HN) (resid 52 and name HG12) 2.217 0.614 0.614 weight 1.000 ! spec=HCH, no=1368, id=4399, vol=1.080000e+08
or (resid 52 and name HN) (resid 52 and name HG11)
or (resid 52 and name HN) (resid 52 and name HG13)
assign (resid 52 and name HB) (resid 52 and name HG12) 2.128 0.566 0.566 weight 1.000 ! spec=HCH, no=1370, id=4401, vol=1.380000e+08
or (resid 52 and name HB) (resid 52 and name HG11)
or (resid 52 and name HB) (resid 52 and name HG13)
assign (resid 52 and name HG12) (resid 52 and name HG11) 1.294 0.209 0.209 weight 1.000 ! spec=HCH, no=1371, id=4402, vol=2.740000e+09
or (resid 52 and name HG12) (resid 52 and name HG13)
or (resid 52 and name HG12) (resid 52 and name HG11)
or (resid 52 and name HG11) (resid 52 and name HG13)
or (resid 52 and name HG12) (resid 52 and name HG13)
or (resid 52 and name HG11) (resid 52 and name HG13)
assign (resid 52 and name HG12) (resid 53 and name HN) 2.713 0.920 0.920 weight 1.000 ! spec=HCH, no=1372, id=4403, vol=3.220000e+07
or (resid 52 and name HG11) (resid 53 and name HN)
or (resid 52 and name HG13) (resid 53 and name HN)
assign (resid 52 and name HG12) (resid 53 and name HG1) 2.999 1.125 1.125 weight 1.000 ! spec=HCH, no=1374, id=4405, vol=1.760000e+07
or (resid 52 and name HG11) (resid 53 and name HG1)
or (resid 52 and name HG13) (resid 53 and name HG1)
assign (resid 52 and name HG12) (resid 143 and name HB2) 3.040 1.156 1.156 weight 1.000 ! spec=HCH, no=1377, id=4408, vol=1.620000e+07
or (resid 52 and name HG11) (resid 143 and name HB2)
or (resid 52 and name HG13) (resid 143 and name HB2)
assign (resid 52 and name HG22) (resid 149 and name HN) 3.279 1.344 1.344 weight 1.000 ! spec=HCH, no=1383, id=4414, vol=1.030000e+07
or (resid 52 and name HG21) (resid 149 and name HN)
or (resid 52 and name HG23) (resid 149 and name HN)
assign (resid 52 and name HG22) (resid 63 and name HG2) 2.720 0.925 0.925 weight 1.000 ! spec=HCH, no=1384, id=4415, vol=3.170000e+07
or (resid 52 and name HG21) (resid 63 and name HG2)
or (resid 52 and name HG23) (resid 63 and name HG2)
assign (resid 52 and name HG22) (resid 52 and name HN) 2.783 0.968 0.968 weight 1.000 ! spec=HCH, no=1388, id=4419, vol=2.760000e+07
or (resid 52 and name HG21) (resid 52 and name HN)
or (resid 52 and name HG23) (resid 52 and name HN)
assign (resid 52 and name HA) (resid 52 and name HG22) 2.232 0.623 0.623 weight 1.000 ! spec=HCH, no=1389, id=4420, vol=1.040000e+08
or (resid 52 and name HA) (resid 52 and name HG21)
or (resid 52 and name HA) (resid 52 and name HG23)
assign (resid 52 and name HB) (resid 52 and name HG22) 2.162 0.584 0.584 weight 1.000 ! spec=HCH, no=1390, id=4421, vol=1.250000e+08
or (resid 52 and name HB) (resid 52 and name HG21)
or (resid 52 and name HB) (resid 52 and name HG23)
assign (resid 53 and name HN) (resid 52 and name HG22) 2.721 0.926 0.926 weight 1.000 ! spec=HCH, no=1391, id=4422, vol=3.160000e+07
or (resid 53 and name HN) (resid 52 and name HG21)
or (resid 53 and name HN) (resid 52 and name HG23)
assign (resid 53 and name HB2) (resid 53 and name HD2) 3.109 1.208 1.208 weight 1.000 ! spec=HCH, no=1393, id=4424, vol=1.420000e+07
assign (resid 53 and name HB2) (resid 52 and name HN) 3.608 1.628 1.628 weight 1.000 ! spec=HCH, no=1397, id=4428, vol=5.810000e+06
assign (resid 53 and name HB2) (resid 105 and name HD1) 3.585 1.607 1.607 weight 1.000 ! spec=HCH, no=1402, id=4433, vol=6.040000e+06
assign (resid 53 and name HD2) (resid 53 and name HG1) 2.183 0.596 0.596 weight 1.000 ! spec=HCH, no=1409, id=4439, vol=1.180000e+08
assign (resid 63 and name HN) (resid 53 and name HG2) 3.774 1.781 1.781 weight 1.000 ! spec=HCH, no=1411, id=4441, vol=4.440000e+06
assign (resid 53 and name HG2) (resid 51 and name HA) 4.062 2.063 2.063 weight 1.000 ! spec=HCH, no=1414, id=4444, vol=2.850000e+06
assign (resid 53 and name HG2) (resid 52 and name HN) 3.747 1.755 1.755 weight 1.000 ! spec=HCH, no=1417, id=4447, vol=4.630000e+06
assign (resid 53 and name HG2) (resid 53 and name HA) 3.841 1.844 1.844 weight 1.000 ! spec=HCH, no=1418, id=4448, vol=3.990000e+06
assign (resid 53 and name HG2) (resid 53 and name HD2) 2.937 1.079 1.079 weight 1.000 ! spec=HCH, no=1419, id=4449, vol=2.000000e+07
assign (resid 53 and name HG2) (resid 53 and name HD1) 3.032 1.149 1.149 weight 1.000 ! spec=HCH, no=1421, id=4451, vol=1.650000e+07
assign (resid 53 and name HG1) (resid 53 and name HD1) 3.128 1.223 1.223 weight 1.000 ! spec=HCH, no=1422, id=4452, vol=1.370000e+07
assign (resid 53 and name HE) (resid 53 and name HG1) 3.199 1.279 1.279 weight 1.000 ! spec=HCH, no=1424, id=4454, vol=1.200000e+07
assign (resid 53 and name HG2) (resid 53 and name HG1) 2.296 0.659 0.659 weight 1.000 ! spec=HCH, no=1425, id=4455, vol=8.750000e+07
assign (resid 54 and name HB2) (resid 52 and name HG22) 3.704 1.715 1.715 weight 1.000 ! spec=HCH, no=1432, id=4461, vol=4.960000e+06
or (resid 54 and name HB2) (resid 52 and name HG21)
or (resid 54 and name HB2) (resid 52 and name HG23)
assign (resid 54 and name HB2) (resid 57 and name HN) 3.779 1.785 1.785 weight 1.000 ! spec=HCH, no=1433, id=4462, vol=4.400000e+06
assign (resid 51 and name HA) (resid 54 and name HB2) 2.529 0.799 0.799 weight 1.000 ! spec=HCH, no=1438, id=4467, vol=4.900000e+07
assign (resid 54 and name HB2) (resid 53 and name HG1) 3.330 1.386 1.386 weight 1.000 ! spec=HCH, no=1439, id=4468, vol=9.400000e+06
assign (resid 54 and name HA) (resid 54 and name HB2) 2.370 0.702 0.702 weight 1.000 ! spec=HCH, no=1441, id=4470, vol=7.230000e+07
assign (resid 54 and name HD21) (resid 54 and name HB2) 2.442 0.745 0.745 weight 1.000 ! spec=HCH, no=1442, id=4471, vol=6.050000e+07
assign (resid 54 and name HB2) (resid 55 and name HA) 3.479 1.513 1.513 weight 1.000 ! spec=HCH, no=1444, id=4473, vol=7.240000e+06
assign (resid 55 and name HA) (resid 55 and name HB2) 2.411 0.727 0.727 weight 1.000 ! spec=HCH, no=1447, id=4476, vol=6.520000e+07
assign (resid 55 and name HA) (resid 58 and name HB1) 2.874 1.033 1.033 weight 1.000 ! spec=HCH, no=1449, id=4478, vol=2.270000e+07
assign (resid 55 and name HA) (resid 40 and name HD22) 3.210 1.288 1.288 weight 1.000 ! spec=HCH, no=1450, id=4479, vol=1.170000e+07
or (resid 55 and name HA) (resid 40 and name HD21)
or (resid 55 and name HA) (resid 40 and name HD23)
assign (resid 56 and name HN) (resid 55 and name HA) 3.043 1.157 1.157 weight 1.000 ! spec=HCH, no=1453, id=4481, vol=1.620000e+07
assign (resid 55 and name HA) (resid 58 and name HN) 3.167 1.254 1.254 weight 1.000 ! spec=HCH, no=1455, id=4483, vol=1.270000e+07
assign (resid 55 and name HB1) (resid 40 and name HD22) 3.139 1.232 1.232 weight 1.000 ! spec=HCH, no=1460, id=4488, vol=1.340000e+07
or (resid 55 and name HB1) (resid 40 and name HD21)
or (resid 55 and name HB1) (resid 40 and name HD23)
assign (resid 55 and name HN) (resid 55 and name HB1) 2.948 1.086 1.086 weight 1.000 ! spec=HCH, no=1462, id=4490, vol=1.950000e+07
assign (resid 55 and name HB1) (resid 55 and name HA) 2.820 0.994 0.994 weight 1.000 ! spec=HCH, no=1464, id=4492, vol=2.550000e+07
assign (resid 55 and name HB1) (resid 55 and name HB2) 2.077 0.539 0.539 weight 1.000 ! spec=HCH, no=1465, id=4493, vol=1.600000e+08
assign (resid 56 and name HN) (resid 55 and name HB1) 3.156 1.245 1.245 weight 1.000 ! spec=HCH, no=1467, id=4495, vol=1.300000e+07
assign (resid 55 and name HB2) (resid 151 and name HG21) 3.112 1.211 1.211 weight 1.000 ! spec=HCH, no=1468, id=4496, vol=1.410000e+07
or (resid 55 and name HB2) (resid 151 and name HG22)
or (resid 55 and name HB2) (resid 151 and name HG23)
assign (resid 55 and name HB1) (resid 151 and name HG21) 3.171 1.257 1.257 weight 1.000 ! spec=HCH, no=1469, id=4497, vol=1.260000e+07
or (resid 55 and name HB1) (resid 151 and name HG22)
or (resid 55 and name HB1) (resid 151 and name HG23)
assign (resid 55 and name HG2) (resid 54 and name HB2) 3.056 1.168 1.168 weight 1.000 ! spec=HCH, no=1473, id=4501, vol=1.570000e+07
or (resid 55 and name HG2) (resid 54 and name HB1)
assign (resid 55 and name HG1) (resid 151 and name HG21) 3.141 1.233 1.233 weight 1.000 ! spec=HCH, no=1475, id=4503, vol=1.330000e+07
or (resid 55 and name HG1) (resid 151 and name HG22)
or (resid 55 and name HG1) (resid 151 and name HG23)
assign (resid 55 and name HG2) (resid 40 and name HD22) 3.400 1.445 1.445 weight 1.000 ! spec=HCH, no=1477, id=4505, vol=8.300000e+06
or (resid 55 and name HG2) (resid 40 and name HD21)
or (resid 55 and name HG2) (resid 40 and name HD23)
assign (resid 55 and name HG2) (resid 52 and name HA) 3.099 1.201 1.201 weight 1.000 ! spec=HCH, no=1479, id=4507, vol=1.450000e+07
assign (resid 55 and name HN) (resid 55 and name HG1) 2.718 0.924 0.924 weight 1.000 ! spec=HCH, no=1482, id=4510, vol=3.180000e+07
assign (resid 55 and name HG2) (resid 55 and name HA) 2.820 0.994 0.994 weight 1.000 ! spec=HCH, no=1483, id=4511, vol=2.550000e+07
assign (resid 55 and name HG1) (resid 55 and name HA) 2.915 1.062 1.062 weight 1.000 ! spec=HCH, no=1484, id=4512, vol=2.090000e+07
assign (resid 56 and name HB2) (resid 56 and name HA) 2.908 1.057 1.057 weight 1.000 ! spec=HCH, no=1503, id=4529, vol=2.120000e+07
assign (resid 56 and name HB1) (resid 56 and name HA) 3.037 1.153 1.153 weight 1.000 ! spec=HCH, no=1504, id=4530, vol=1.630000e+07
assign (resid 56 and name HB1) (resid 56 and name HB2) 2.389 0.713 0.713 weight 1.000 ! spec=HCH, no=1506, id=4532, vol=6.900000e+07
assign (resid 56 and name HB1) (resid 61 and name HB2) 3.247 1.318 1.318 weight 1.000 ! spec=HCH, no=1511, id=4536, vol=1.100000e+07
or (resid 56 and name HB1) (resid 61 and name HB1)
or (resid 56 and name HB1) (resid 61 and name HB3)
assign (resid 56 and name HB2) (resid 62 and name HN) 3.461 1.497 1.497 weight 1.000 ! spec=HCH, no=1512, id=4537, vol=7.460000e+06
assign (resid 56 and name HB1) (resid 62 and name HN) 3.554 1.579 1.579 weight 1.000 ! spec=HCH, no=1513, id=4538, vol=6.360000e+06
assign (resid 56 and name HB2) (resid 62 and name HA) 2.977 1.108 1.108 weight 1.000 ! spec=HCH, no=1514, id=4539, vol=1.840000e+07
assign (resid 56 and name HB2) (resid 63 and name HN) 3.888 1.889 1.889 weight 1.000 ! spec=HCH, no=1516, id=4541, vol=3.710000e+06
assign (resid 56 and name HB1) (resid 63 and name HN) 3.817 1.822 1.822 weight 1.000 ! spec=HCH, no=1517, id=4542, vol=4.140000e+06
assign (resid 57 and name HA) (resid 56 and name HB2) 3.257 1.326 1.326 weight 1.000 ! spec=HCH, no=1521, id=4546, vol=1.070000e+07
assign (resid 57 and name HA) (resid 58 and name HN) 3.143 1.235 1.235 weight 1.000 ! spec=HCH, no=1526, id=4550, vol=1.330000e+07
assign (resid 57 and name HA) (resid 61 and name HB2) 3.097 1.199 1.199 weight 1.000 ! spec=HCH, no=1530, id=4554, vol=1.450000e+07
or (resid 57 and name HA) (resid 61 and name HB1)
or (resid 57 and name HA) (resid 61 and name HB3)
assign (resid 57 and name HB) (resid 59 and name HN) 3.873 1.875 1.875 weight 1.000 ! spec=HCH, no=1533, id=4557, vol=3.800000e+06
assign (resid 57 and name HB) (resid 53 and name HD2) 3.621 1.639 1.639 weight 1.000 ! spec=HCH, no=1536, id=4560, vol=5.690000e+06
assign (resid 57 and name HA) (resid 57 and name HB) 2.456 0.754 0.754 weight 1.000 ! spec=HCH, no=1539, id=4563, vol=5.840000e+07
assign (resid 57 and name HB) (resid 58 and name HN) 3.059 1.170 1.170 weight 1.000 ! spec=HCH, no=1542, id=4565, vol=1.570000e+07
assign (resid 57 and name HG21) (resid 63 and name HN) 3.512 1.541 1.541 weight 1.000 ! spec=HCH, no=1545, id=4568, vol=6.840000e+06
or (resid 57 and name HG22) (resid 63 and name HN)
or (resid 57 and name HG23) (resid 63 and name HN)
assign (resid 57 and name HG21) (resid 53 and name HD2) 2.746 0.943 0.943 weight 1.000 ! spec=HCH, no=1547, id=4570, vol=2.990000e+07
or (resid 57 and name HG22) (resid 53 and name HD2)
or (resid 57 and name HG23) (resid 53 and name HD2)
assign (resid 57 and name HG21) (resid 62 and name HA) 2.663 0.887 0.887 weight 1.000 ! spec=HCH, no=1549, id=4572, vol=3.590000e+07
or (resid 57 and name HG22) (resid 62 and name HA)
or (resid 57 and name HG23) (resid 62 and name HA)
assign (resid 56 and name HN) (resid 57 and name HG21) 3.114 1.212 1.212 weight 1.000 ! spec=HCH, no=1550, id=4573, vol=1.410000e+07
or (resid 56 and name HN) (resid 57 and name HG22)
or (resid 56 and name HN) (resid 57 and name HG23)
assign (resid 56 and name HB1) (resid 57 and name HG21) 2.944 1.083 1.083 weight 1.000 ! spec=HCH, no=1554, id=4577, vol=1.970000e+07
or (resid 56 and name HB1) (resid 57 and name HG22)
or (resid 56 and name HB1) (resid 57 and name HG23)
assign (resid 57 and name HN) (resid 57 and name HG21) 2.227 0.620 0.620 weight 1.000 ! spec=HCH, no=1555, id=4578, vol=1.050000e+08
or (resid 57 and name HN) (resid 57 and name HG22)
or (resid 57 and name HN) (resid 57 and name HG23)
assign (resid 57 and name HA) (resid 57 and name HG21) 2.211 0.611 0.611 weight 1.000 ! spec=HCH, no=1557, id=4580, vol=1.100000e+08
or (resid 57 and name HA) (resid 57 and name HG22)
or (resid 57 and name HA) (resid 57 and name HG23)
assign (resid 57 and name HB) (resid 57 and name HG21) 2.066 0.534 0.534 weight 1.000 ! spec=HCH, no=1558, id=4581, vol=1.650000e+08
or (resid 57 and name HB) (resid 57 and name HG22)
or (resid 57 and name HB) (resid 57 and name HG23)
assign (resid 58 and name HN) (resid 57 and name HG21) 2.836 1.005 1.005 weight 1.000 ! spec=HCH, no=1559, id=4582, vol=2.470000e+07
or (resid 58 and name HN) (resid 57 and name HG22)
or (resid 58 and name HN) (resid 57 and name HG23)
assign (resid 57 and name HG21) (resid 61 and name HN) 3.126 1.221 1.221 weight 1.000 ! spec=HCH, no=1561, id=4584, vol=1.370000e+07
or (resid 57 and name HG22) (resid 61 and name HN)
or (resid 57 and name HG23) (resid 61 and name HN)
assign (resid 58 and name HA) (resid 58 and name HB2) 2.360 0.696 0.696 weight 1.000 ! spec=HCH, no=1564, id=4586, vol=7.420000e+07
assign (resid 58 and name HA) (resid 58 and name HB1) 2.422 0.733 0.733 weight 1.000 ! spec=HCH, no=1565, id=4587, vol=6.360000e+07
assign (resid 58 and name HA) (resid 59 and name HN) 2.935 1.077 1.077 weight 1.000 ! spec=HCH, no=1566, id=4588, vol=2.010000e+07
assign (resid 58 and name HB2) (resid 55 and name HA) 3.178 1.263 1.263 weight 1.000 ! spec=HCH, no=1570, id=4592, vol=1.240000e+07
assign (resid 58 and name HB2) (resid 57 and name HN) 4.010 2.010 2.010 weight 1.000 ! spec=HCH, no=1572, id=4594, vol=3.080000e+06
assign (resid 58 and name HB1) (resid 58 and name HB2) 2.094 0.548 0.548 weight 1.000 ! spec=HCH, no=1578, id=4600, vol=1.520000e+08
assign (resid 59 and name HB2) (resid 59 and name HA) 3.159 1.247 1.247 weight 1.000 ! spec=HCH, no=1588, id=4610, vol=1.290000e+07
assign (resid 59 and name HB1) (resid 59 and name HA) 2.996 1.122 1.122 weight 1.000 ! spec=HCH, no=1589, id=4611, vol=1.770000e+07
assign (resid 59 and name HB1) (resid 59 and name HB2) 2.434 0.741 0.741 weight 1.000 ! spec=HCH, no=1591, id=4612, vol=6.170000e+07
assign (resid 60 and name HA2) (resid 61 and name HA) 3.818 1.823 1.823 weight 1.000 ! spec=HCH, no=1594, id=4614, vol=4.140000e+06
assign (resid 60 and name HA2) (resid 57 and name HA) 3.602 1.622 1.622 weight 1.000 ! spec=HCH, no=1595, id=4615, vol=5.870000e+06
assign (resid 60 and name HA1) (resid 57 and name HA) 3.664 1.678 1.678 weight 1.000 ! spec=HCH, no=1596, id=4616, vol=5.300000e+06
assign (resid 60 and name HA1) (resid 61 and name HA) 3.691 1.703 1.703 weight 1.000 ! spec=HCH, no=1604, id=4623, vol=5.070000e+06
assign (resid 61 and name HA) (resid 29 and name HZ3) 3.531 1.559 1.559 weight 1.000 ! spec=HCH, no=1609, id=4628, vol=6.620000e+06
assign (resid 61 and name HA) (resid 153 and name HB1) 3.625 1.643 1.643 weight 1.000 ! spec=HCH, no=1613, id=4631, vol=5.650000e+06
assign (resid 61 and name HA) (resid 154 and name HN) 3.644 1.660 1.660 weight 1.000 ! spec=HCH, no=1614, id=4632, vol=5.480000e+06
assign (resid 61 and name HA) (resid 155 and name HA) 3.103 1.204 1.204 weight 1.000 ! spec=HCH, no=1615, id=4633, vol=1.440000e+07
assign (resid 61 and name HA) (resid 155 and name HB) 2.589 0.838 0.838 weight 1.000 ! spec=HCH, no=1616, id=4634, vol=4.250000e+07
assign (resid 61 and name HA) (resid 155 and name HG21) 2.986 1.114 1.114 weight 1.000 ! spec=HCH, no=1617, id=4635, vol=1.810000e+07
or (resid 61 and name HA) (resid 155 and name HG22)
or (resid 61 and name HA) (resid 155 and name HG23)
assign (resid 38 and name HD12) (resid 61 and name HB2) 3.554 1.579 1.579 weight 1.000 ! spec=HCH, no=1618, id=4636, vol=6.370000e+06
or (resid 38 and name HD12) (resid 61 and name HB1)
or (resid 38 and name HD12) (resid 61 and name HB3)
or (resid 38 and name HD11) (resid 61 and name HB2)
or (resid 38 and name HD11) (resid 61 and name HB1)
or (resid 38 and name HD11) (resid 61 and name HB3)
or (resid 38 and name HD13) (resid 61 and name HB2)
or (resid 38 and name HD13) (resid 61 and name HB1)
or (resid 38 and name HD13) (resid 61 and name HB3)
assign (resid 56 and name HB2) (resid 61 and name HB2) 2.772 0.961 0.961 weight 1.000 ! spec=HCH, no=1623, id=4641, vol=2.820000e+07
or (resid 56 and name HB2) (resid 61 and name HB1)
or (resid 56 and name HB2) (resid 61 and name HB3)
assign (resid 38 and name HG22) (resid 61 and name HB2) 2.963 1.097 1.097 weight 1.000 ! spec=HCH, no=1626, id=4644, vol=1.900000e+07
or (resid 38 and name HG22) (resid 61 and name HB1)
or (resid 38 and name HG22) (resid 61 and name HB3)
or (resid 38 and name HG21) (resid 61 and name HB2)
or (resid 38 and name HG21) (resid 61 and name HB1)
or (resid 38 and name HG21) (resid 61 and name HB3)
or (resid 38 and name HG23) (resid 61 and name HB2)
or (resid 38 and name HG23) (resid 61 and name HB1)
or (resid 38 and name HG23) (resid 61 and name HB3)
assign (resid 61 and name HB2) (resid 29 and name HE3) 3.672 1.686 1.686 weight 1.000 ! spec=HCH, no=1633, id=4651, vol=5.230000e+06
or (resid 61 and name HB1) (resid 29 and name HE3)
or (resid 61 and name HB3) (resid 29 and name HE3)
assign (resid 61 and name HB2) (resid 29 and name HZ2) 2.952 1.089 1.089 weight 1.000 ! spec=HCH, no=1634, id=4652, vol=1.940000e+07
or (resid 61 and name HB1) (resid 29 and name HZ2)
or (resid 61 and name HB3) (resid 29 and name HZ2)
assign (resid 61 and name HB2) (resid 40 and name HD12) 3.763 1.770 1.770 weight 1.000 ! spec=HCH, no=1636, id=4654, vol=4.520000e+06
or (resid 61 and name HB2) (resid 40 and name HD11)
or (resid 61 and name HB2) (resid 40 and name HD13)
or (resid 61 and name HB1) (resid 40 and name HD12)
or (resid 61 and name HB1) (resid 40 and name HD11)
or (resid 61 and name HB1) (resid 40 and name HD13)
or (resid 61 and name HB3) (resid 40 and name HD12)
or (resid 61 and name HB3) (resid 40 and name HD11)
or (resid 61 and name HB3) (resid 40 and name HD13)
assign (resid 61 and name HB2) (resid 40 and name HD22) 3.842 1.845 1.845 weight 1.000 ! spec=HCH, no=1637, id=4655, vol=3.990000e+06
or (resid 61 and name HB2) (resid 40 and name HD21)
or (resid 61 and name HB2) (resid 40 and name HD23)
or (resid 61 and name HB1) (resid 40 and name HD22)
or (resid 61 and name HB1) (resid 40 and name HD21)
or (resid 61 and name HB1) (resid 40 and name HD23)
or (resid 61 and name HB3) (resid 40 and name HD22)
or (resid 61 and name HB3) (resid 40 and name HD21)
or (resid 61 and name HB3) (resid 40 and name HD23)
assign (resid 61 and name HB2) (resid 56 and name HN) 3.631 1.648 1.648 weight 1.000 ! spec=HCH, no=1638, id=4656, vol=5.590000e+06
or (resid 61 and name HB1) (resid 56 and name HN)
or (resid 61 and name HB3) (resid 56 and name HN)
assign (resid 61 and name HA) (resid 61 and name HB2) 2.242 0.628 0.628 weight 1.000 ! spec=HCH, no=1640, id=4658, vol=1.010000e+08
or (resid 61 and name HA) (resid 61 and name HB1)
or (resid 61 and name HA) (resid 61 and name HB3)
assign (resid 61 and name HB2) (resid 61 and name HB1) 1.374 0.236 0.236 weight 1.000 ! spec=HCH, no=1641, id=4659, vol=1.910000e+09
or (resid 61 and name HB2) (resid 61 and name HB3)
or (resid 61 and name HB2) (resid 61 and name HB1)
or (resid 61 and name HB1) (resid 61 and name HB3)
or (resid 61 and name HB2) (resid 61 and name HB3)
or (resid 61 and name HB1) (resid 61 and name HB3)
assign (resid 62 and name HN) (resid 61 and name HB2) 2.224 0.618 0.618 weight 1.000 ! spec=HCH, no=1642, id=4660, vol=1.060000e+08
or (resid 62 and name HN) (resid 61 and name HB1)
or (resid 62 and name HN) (resid 61 and name HB3)
assign (resid 61 and name HB2) (resid 153 and name HA) 3.080 1.185 1.185 weight 1.000 ! spec=HCH, no=1643, id=4661, vol=1.500000e+07
or (resid 61 and name HB1) (resid 153 and name HA)
or (resid 61 and name HB3) (resid 153 and name HA)
assign (resid 61 and name HB2) (resid 153 and name HB2) 2.636 0.869 0.869 weight 1.000 ! spec=HCH, no=1644, id=4662, vol=3.820000e+07
or (resid 61 and name HB1) (resid 153 and name HB2)
or (resid 61 and name HB3) (resid 153 and name HB2)
assign (resid 61 and name HB2) (resid 153 and name HB1) 2.366 0.700 0.700 weight 1.000 ! spec=HCH, no=1645, id=4663, vol=7.310000e+07
or (resid 61 and name HB1) (resid 153 and name HB1)
or (resid 61 and name HB3) (resid 153 and name HB1)
assign (resid 61 and name HB2) (resid 154 and name HA) 3.530 1.558 1.558 weight 1.000 ! spec=HCH, no=1646, id=4664, vol=6.620000e+06
or (resid 61 and name HB1) (resid 154 and name HA)
or (resid 61 and name HB3) (resid 154 and name HA)
assign (resid 61 and name HB2) (resid 155 and name HA) 2.812 0.988 0.988 weight 1.000 ! spec=HCH, no=1647, id=4665, vol=2.600000e+07
or (resid 61 and name HB1) (resid 155 and name HA)
or (resid 61 and name HB3) (resid 155 and name HA)
assign (resid 61 and name HB2) (resid 155 and name HB) 2.515 0.790 0.790 weight 1.000 ! spec=HCH, no=1648, id=4666, vol=5.070000e+07
or (resid 61 and name HB1) (resid 155 and name HB)
or (resid 61 and name HB3) (resid 155 and name HB)
assign (resid 62 and name HA) (resid 61 and name HB2) 3.097 1.199 1.199 weight 1.000 ! spec=HCH, no=1653, id=4671, vol=1.450000e+07
or (resid 62 and name HA) (resid 61 and name HB1)
or (resid 62 and name HA) (resid 61 and name HB3)
assign (resid 56 and name HB1) (resid 62 and name HA) 2.743 0.941 0.941 weight 1.000 ! spec=HCH, no=1654, id=4672, vol=3.010000e+07
assign (resid 62 and name HN) (resid 62 and name HA) 2.757 0.950 0.950 weight 1.000 ! spec=HCH, no=1657, id=4675, vol=2.920000e+07
assign (resid 62 and name HA) (resid 62 and name HB1) 2.770 0.959 0.959 weight 1.000 ! spec=HCH, no=1659, id=4676, vol=2.840000e+07
assign (resid 62 and name HB1) (resid 62 and name HB2) 2.284 0.652 0.652 weight 1.000 ! spec=HCH, no=1667, id=4680, vol=9.030000e+07
assign (resid 63 and name HA) (resid 63 and name HG2) 2.565 0.822 0.822 weight 1.000 ! spec=HCH, no=1673, id=4683, vol=4.500000e+07
assign (resid 63 and name HA) (resid 153 and name HA) 2.795 0.976 0.976 weight 1.000 ! spec=HCH, no=1674, id=4684, vol=2.690000e+07
assign (resid 63 and name HB1) (resid 63 and name HE2) 3.067 1.176 1.176 weight 1.000 ! spec=HCH, no=1680, id=4690, vol=1.540000e+07
or (resid 63 and name HB1) (resid 63 and name HE1)
or (resid 63 and name HB1) (resid 63 and name HE3)
assign (resid 52 and name HG22) (resid 63 and name HB1) 3.552 1.577 1.577 weight 1.000 ! spec=HCH, no=1684, id=4694, vol=6.380000e+06
or (resid 52 and name HG21) (resid 63 and name HB1)
or (resid 52 and name HG23) (resid 63 and name HB1)
assign (resid 63 and name HN) (resid 63 and name HB1) 3.369 1.419 1.419 weight 1.000 ! spec=HCH, no=1686, id=4696, vol=8.770000e+06
assign (resid 63 and name HB2) (resid 63 and name HA) 3.229 1.303 1.303 weight 1.000 ! spec=HCH, no=1687, id=4697, vol=1.130000e+07
assign (resid 63 and name HB1) (resid 63 and name HA) 3.180 1.264 1.264 weight 1.000 ! spec=HCH, no=1688, id=4698, vol=1.240000e+07
assign (resid 63 and name HB1) (resid 63 and name HB2) 2.453 0.752 0.752 weight 1.000 ! spec=HCH, no=1690, id=4700, vol=5.880000e+07
assign (resid 63 and name HB1) (resid 92 and name HA2) 3.346 1.399 1.399 weight 1.000 ! spec=HCH, no=1694, id=4703, vol=9.140000e+06
assign (resid 63 and name HB1) (resid 105 and name HD1) 3.681 1.694 1.694 weight 1.000 ! spec=HCH, no=1698, id=4707, vol=5.150000e+06
assign (resid 91 and name HN) (resid 63 and name HE2) 3.165 1.252 1.252 weight 1.000 ! spec=HCH, no=1699, id=4708, vol=1.280000e+07
or (resid 91 and name HN) (resid 63 and name HE1)
or (resid 91 and name HN) (resid 63 and name HE3)
assign (resid 63 and name HE2) (resid 90 and name HB2) 2.181 0.595 0.595 weight 1.000 ! spec=HCH, no=1710, id=4718, vol=1.190000e+08
or (resid 63 and name HE1) (resid 90 and name HB2)
or (resid 63 and name HE3) (resid 90 and name HB2)
assign (resid 63 and name HE2) (resid 49 and name HD12) 2.113 0.558 0.558 weight 1.000 ! spec=HCH, no=1715, id=4723, vol=1.440000e+08
or (resid 63 and name HE2) (resid 49 and name HD11)
or (resid 63 and name HE2) (resid 49 and name HD13)
or (resid 63 and name HE1) (resid 49 and name HD12)
or (resid 63 and name HE1) (resid 49 and name HD11)
or (resid 63 and name HE1) (resid 49 and name HD13)
or (resid 63 and name HE3) (resid 49 and name HD12)
or (resid 63 and name HE3) (resid 49 and name HD11)
or (resid 63 and name HE3) (resid 49 and name HD13)
assign (resid 63 and name HE2) (resid 63 and name HE1) 1.176 0.173 0.173 weight 1.000 ! spec=HCH, no=1721, id=4729, vol=4.850000e+09
or (resid 63 and name HE2) (resid 63 and name HE3)
or (resid 63 and name HE2) (resid 63 and name HE1)
or (resid 63 and name HE1) (resid 63 and name HE3)
or (resid 63 and name HE2) (resid 63 and name HE3)
or (resid 63 and name HE1) (resid 63 and name HE3)
assign (resid 63 and name HE2) (resid 90 and name HD12) 2.257 0.637 0.637 weight 1.000 ! spec=HCH, no=1724, id=4732, vol=9.690000e+07
or (resid 63 and name HE2) (resid 90 and name HD11)
or (resid 63 and name HE2) (resid 90 and name HD13)
or (resid 63 and name HE1) (resid 90 and name HD12)
or (resid 63 and name HE1) (resid 90 and name HD11)
or (resid 63 and name HE1) (resid 90 and name HD13)
or (resid 63 and name HE3) (resid 90 and name HD12)
or (resid 63 and name HE3) (resid 90 and name HD11)
or (resid 63 and name HE3) (resid 90 and name HD13)
assign (resid 63 and name HE2) (resid 90 and name HD22) 2.157 0.582 0.582 weight 1.000 ! spec=HCH, no=1725, id=4733, vol=1.270000e+08
or (resid 63 and name HE2) (resid 90 and name HD21)
or (resid 63 and name HE2) (resid 90 and name HD23)
or (resid 63 and name HE1) (resid 90 and name HD22)
or (resid 63 and name HE1) (resid 90 and name HD21)
or (resid 63 and name HE1) (resid 90 and name HD23)
or (resid 63 and name HE3) (resid 90 and name HD22)
or (resid 63 and name HE3) (resid 90 and name HD21)
or (resid 63 and name HE3) (resid 90 and name HD23)
assign (resid 63 and name HE2) (resid 91 and name HA) 2.868 1.028 1.028 weight 1.000 ! spec=HCH, no=1726, id=4734, vol=2.310000e+07
or (resid 63 and name HE1) (resid 91 and name HA)
or (resid 63 and name HE3) (resid 91 and name HA)
assign (resid 63 and name HE2) (resid 92 and name HA2) 2.518 0.793 0.793 weight 1.000 ! spec=HCH, no=1727, id=4735, vol=5.030000e+07
or (resid 63 and name HE1) (resid 92 and name HA2)
or (resid 63 and name HE3) (resid 92 and name HA2)
assign (resid 63 and name HE2) (resid 92 and name HA1) 2.373 0.704 0.704 weight 1.000 ! spec=HCH, no=1728, id=4736, vol=7.190000e+07
or (resid 63 and name HE1) (resid 92 and name HA1)
or (resid 63 and name HE3) (resid 92 and name HA1)
assign (resid 63 and name HE2) (resid 105 and name HD1) 2.958 1.093 1.093 weight 1.000 ! spec=HCH, no=1729, id=4737, vol=1.920000e+07
or (resid 63 and name HE1) (resid 105 and name HD1)
or (resid 63 and name HE3) (resid 105 and name HD1)
assign (resid 63 and name HE2) (resid 63 and name HG2) 2.744 0.941 0.941 weight 1.000 ! spec=HCH, no=1730, id=4738, vol=3.000000e+07
or (resid 63 and name HE1) (resid 63 and name HG2)
or (resid 63 and name HE3) (resid 63 and name HG2)
assign (resid 56 and name HB1) (resid 63 and name HG1) 3.586 1.607 1.607 weight 1.000 ! spec=HCH, no=1735, id=4743, vol=6.030000e+06
assign (resid 63 and name HG1) (resid 63 and name HA) 3.742 1.750 1.750 weight 1.000 ! spec=HCH, no=1737, id=4745, vol=4.670000e+06
assign (resid 63 and name HG1) (resid 63 and name HB2) 3.480 1.514 1.514 weight 1.000 ! spec=HCH, no=1738, id=4746, vol=7.220000e+06
assign (resid 63 and name HG1) (resid 55 and name HN) 3.691 1.703 1.703 weight 1.000 ! spec=HCH, no=1741, id=4749, vol=5.070000e+06
assign (resid 63 and name HG1) (resid 63 and name HE2) 3.648 1.663 1.663 weight 1.000 ! spec=HCH, no=1743, id=4751, vol=5.440000e+06
or (resid 63 and name HG1) (resid 63 and name HE1)
or (resid 63 and name HG1) (resid 63 and name HE3)
assign (resid 63 and name HG1) (resid 53 and name HB2) 2.906 1.055 1.055 weight 1.000 ! spec=HCH, no=1745, id=4753, vol=2.130000e+07
assign (resid 63 and name HG1) (resid 62 and name HB1) 3.985 1.985 1.985 weight 1.000 ! spec=HCH, no=1746, id=4754, vol=3.200000e+06
assign (resid 63 and name HG2) (resid 63 and name HN) 3.031 1.148 1.148 weight 1.000 ! spec=HCH, no=1747, id=4755, vol=1.650000e+07
assign (resid 63 and name HG2) (resid 63 and name HB2) 2.826 0.999 0.999 weight 1.000 ! spec=HCH, no=1750, id=4758, vol=2.520000e+07
assign (resid 63 and name HG2) (resid 63 and name HG1) 2.575 0.829 0.829 weight 1.000 ! spec=HCH, no=1752, id=4759, vol=4.400000e+07
assign (resid 64 and name HN) (resid 63 and name HG2) 3.078 1.184 1.184 weight 1.000 ! spec=HCH, no=1754, id=4760, vol=1.510000e+07
assign (resid 63 and name HG2) (resid 64 and name HG22) 3.004 1.128 1.128 weight 1.000 ! spec=HCH, no=1756, id=4762, vol=1.740000e+07
or (resid 63 and name HG2) (resid 64 and name HG21)
or (resid 63 and name HG2) (resid 64 and name HG23)
assign (resid 63 and name HG2) (resid 92 and name HA1) 3.329 1.385 1.385 weight 1.000 ! spec=HCH, no=1757, id=4763, vol=9.420000e+06
assign (resid 63 and name HG1) (resid 92 and name HA1) 3.973 1.973 1.973 weight 1.000 ! spec=HCH, no=1758, id=4764, vol=3.260000e+06
assign (resid 63 and name HG1) (resid 151 and name HG21) 3.358 1.410 1.410 weight 1.000 ! spec=HCH, no=1759, id=4765, vol=8.940000e+06
or (resid 63 and name HG1) (resid 151 and name HG22)
or (resid 63 and name HG1) (resid 151 and name HG23)
assign (resid 64 and name HA) (resid 64 and name HG12) 2.963 1.097 1.097 weight 1.000 ! spec=HCH, no=1760, id=4766, vol=1.900000e+07
assign (resid 64 and name HA) (resid 154 and name HB2) 2.946 1.085 1.085 weight 1.000 ! spec=HCH, no=1761, id=4767, vol=1.960000e+07
assign (resid 64 and name HA) (resid 154 and name HG2) 3.392 1.439 1.439 weight 1.000 ! spec=HCH, no=1765, id=4771, vol=8.410000e+06
assign (resid 64 and name HA) (resid 64 and name HB) 2.394 0.716 0.716 weight 1.000 ! spec=HCH, no=1766, id=4772, vol=6.820000e+07
assign (resid 64 and name HB) (resid 152 and name HG) 2.953 1.090 1.090 weight 1.000 ! spec=HCH, no=1768, id=4774, vol=1.940000e+07
assign (resid 64 and name HB) (resid 152 and name HD22) 3.191 1.273 1.273 weight 1.000 ! spec=HCH, no=1769, id=4775, vol=1.210000e+07
or (resid 64 and name HB) (resid 152 and name HD21)
or (resid 64 and name HB) (resid 152 and name HD23)
assign (resid 64 and name HB) (resid 63 and name HA) 3.758 1.765 1.765 weight 1.000 ! spec=HCH, no=1771, id=4777, vol=4.550000e+06
assign (resid 64 and name HB) (resid 64 and name HG11) 2.849 1.014 1.014 weight 1.000 ! spec=HCH, no=1776, id=4781, vol=2.400000e+07
assign (resid 65 and name HN) (resid 64 and name HB) 3.319 1.377 1.377 weight 1.000 ! spec=HCH, no=1777, id=4782, vol=9.600000e+06
assign (resid 64 and name HD12) (resid 130 and name HA) 3.972 1.972 1.972 weight 1.000 ! spec=HCH, no=1780, id=4785, vol=3.260000e+06
or (resid 64 and name HD11) (resid 130 and name HA)
or (resid 64 and name HD13) (resid 130 and name HA)
assign (resid 64 and name HD12) (resid 152 and name HA) 3.855 1.858 1.858 weight 1.000 ! spec=HCH, no=1781, id=4786, vol=3.910000e+06
or (resid 64 and name HD11) (resid 152 and name HA)
or (resid 64 and name HD13) (resid 152 and name HA)
assign (resid 64 and name HD12) (resid 71 and name HB2) 3.885 1.887 1.887 weight 1.000 ! spec=HCH, no=1783, id=4788, vol=3.730000e+06
or (resid 64 and name HD12) (resid 71 and name HB1)
or (resid 64 and name HD11) (resid 71 and name HB2)
or (resid 64 and name HD11) (resid 71 and name HB1)
or (resid 64 and name HD13) (resid 71 and name HB2)
or (resid 64 and name HD13) (resid 71 and name HB1)
assign (resid 64 and name HD12) (resid 74 and name HB1) 3.861 1.863 1.863 weight 1.000 ! spec=HCH, no=1784, id=4789, vol=3.870000e+06
or (resid 64 and name HD11) (resid 74 and name HB1)
or (resid 64 and name HD13) (resid 74 and name HB1)
assign (resid 64 and name HD12) (resid 64 and name HB) 2.181 0.595 0.595 weight 1.000 ! spec=HCH, no=1787, id=4792, vol=1.190000e+08
or (resid 64 and name HD11) (resid 64 and name HB)
or (resid 64 and name HD13) (resid 64 and name HB)
assign (resid 64 and name HD12) (resid 75 and name HG11) 2.481 0.769 0.769 weight 1.000 ! spec=HCH, no=1788, id=4793, vol=5.500000e+07
or (resid 64 and name HD11) (resid 75 and name HG11)
or (resid 64 and name HD13) (resid 75 and name HG11)
assign (resid 64 and name HD12) (resid 91 and name HD12) 2.538 0.805 0.805 weight 1.000 ! spec=HCH, no=1789, id=4794, vol=4.800000e+07
or (resid 64 and name HD12) (resid 91 and name HD11)
or (resid 64 and name HD12) (resid 91 and name HD13)
or (resid 64 and name HD11) (resid 91 and name HD12)
or (resid 64 and name HD11) (resid 91 and name HD11)
or (resid 64 and name HD11) (resid 91 and name HD13)
or (resid 64 and name HD13) (resid 91 and name HD12)
or (resid 64 and name HD13) (resid 91 and name HD11)
or (resid 64 and name HD13) (resid 91 and name HD13)
assign (resid 64 and name HD12) (resid 91 and name HA) 3.313 1.372 1.372 weight 1.000 ! spec=HCH, no=1799, id=4804, vol=9.690000e+06
or (resid 64 and name HD11) (resid 91 and name HA)
or (resid 64 and name HD13) (resid 91 and name HA)
assign (resid 64 and name HD12) (resid 75 and name HN) 3.739 1.747 1.747 weight 1.000 ! spec=HCH, no=1800, id=4805, vol=4.690000e+06
or (resid 64 and name HD11) (resid 75 and name HN)
or (resid 64 and name HD13) (resid 75 and name HN)
assign (resid 64 and name HD12) (resid 75 and name HD12) 2.075 0.538 0.538 weight 1.000 ! spec=HCH, no=1803, id=4808, vol=1.610000e+08
or (resid 64 and name HD12) (resid 75 and name HD11)
or (resid 64 and name HD12) (resid 75 and name HD13)
or (resid 64 and name HD11) (resid 75 and name HD12)
or (resid 64 and name HD11) (resid 75 and name HD11)
or (resid 64 and name HD11) (resid 75 and name HD13)
or (resid 64 and name HD13) (resid 75 and name HD12)
or (resid 64 and name HD13) (resid 75 and name HD11)
or (resid 64 and name HD13) (resid 75 and name HD13)
assign (resid 64 and name HD12) (resid 65 and name HA) 3.774 1.781 1.781 weight 1.000 ! spec=HCH, no=1804, id=4809, vol=4.440000e+06
or (resid 64 and name HD11) (resid 65 and name HA)
or (resid 64 and name HD13) (resid 65 and name HA)
assign (resid 64 and name HD12) (resid 75 and name HB) 3.374 1.423 1.423 weight 1.000 ! spec=HCH, no=1805, id=4810, vol=8.700000e+06
or (resid 64 and name HD11) (resid 75 and name HB)
or (resid 64 and name HD13) (resid 75 and name HB)
assign (resid 64 and name HD12) (resid 74 and name HD1) 3.839 1.842 1.842 weight 1.000 ! spec=HCH, no=1806, id=4811, vol=4.010000e+06
or (resid 64 and name HD12) (resid 74 and name HD2)
or (resid 64 and name HD11) (resid 74 and name HD1)
or (resid 64 and name HD11) (resid 74 and name HD2)
or (resid 64 and name HD13) (resid 74 and name HD1)
or (resid 64 and name HD13) (resid 74 and name HD2)
assign (resid 64 and name HD12) (resid 64 and name HD11) 1.361 0.231 0.231 weight 1.000 ! spec=HCH, no=1810, id=4815, vol=2.020000e+09
or (resid 64 and name HD12) (resid 64 and name HD13)
or (resid 64 and name HD12) (resid 64 and name HD11)
or (resid 64 and name HD11) (resid 64 and name HD13)
or (resid 64 and name HD12) (resid 64 and name HD13)
or (resid 64 and name HD11) (resid 64 and name HD13)
assign (resid 64 and name HD12) (resid 91 and name HD22) 3.582 1.604 1.604 weight 1.000 ! spec=HCH, no=1813, id=4818, vol=6.070000e+06
or (resid 64 and name HD12) (resid 91 and name HD21)
or (resid 64 and name HD12) (resid 91 and name HD23)
or (resid 64 and name HD11) (resid 91 and name HD22)
or (resid 64 and name HD11) (resid 91 and name HD21)
or (resid 64 and name HD11) (resid 91 and name HD23)
or (resid 64 and name HD13) (resid 91 and name HD22)
or (resid 64 and name HD13) (resid 91 and name HD21)
or (resid 64 and name HD13) (resid 91 and name HD23)
assign (resid 64 and name HG12) (resid 91 and name HD12) 3.236 1.309 1.309 weight 1.000 ! spec=HCH, no=1817, id=4821, vol=1.120000e+07
or (resid 64 and name HG12) (resid 91 and name HD11)
or (resid 64 and name HG12) (resid 91 and name HD13)
assign (resid 64 and name HG12) (resid 64 and name HN) 3.274 1.340 1.340 weight 1.000 ! spec=HCH, no=1822, id=4826, vol=1.040000e+07
assign (resid 64 and name HN) (resid 64 and name HG11) 3.204 1.284 1.284 weight 1.000 ! spec=HCH, no=1823, id=4827, vol=1.180000e+07
assign (resid 64 and name HB) (resid 64 and name HG12) 2.538 0.805 0.805 weight 1.000 ! spec=HCH, no=1825, id=4829, vol=4.800000e+07
assign (resid 64 and name HG12) (resid 65 and name HN) 3.443 1.482 1.482 weight 1.000 ! spec=HCH, no=1826, id=4830, vol=7.690000e+06
assign (resid 64 and name HG11) (resid 65 and name HN) 3.454 1.491 1.491 weight 1.000 ! spec=HCH, no=1827, id=4831, vol=7.550000e+06
assign (resid 64 and name HG22) (resid 152 and name HA) 3.416 1.459 1.459 weight 1.000 ! spec=HCH, no=1834, id=4838, vol=8.070000e+06
or (resid 64 and name HG21) (resid 152 and name HA)
or (resid 64 and name HG23) (resid 152 and name HA)
assign (resid 64 and name HG22) (resid 91 and name HA) 2.410 0.726 0.726 weight 1.000 ! spec=HCH, no=1837, id=4841, vol=6.550000e+07
or (resid 64 and name HG21) (resid 91 and name HA)
or (resid 64 and name HG23) (resid 91 and name HA)
assign (resid 64 and name HG22) (resid 151 and name HB) 3.511 1.541 1.541 weight 1.000 ! spec=HCH, no=1838, id=4842, vol=6.840000e+06
or (resid 64 and name HG21) (resid 151 and name HB)
or (resid 64 and name HG23) (resid 151 and name HB)
assign (resid 64 and name HG22) (resid 152 and name HN) 3.139 1.232 1.232 weight 1.000 ! spec=HCH, no=1846, id=4850, vol=1.340000e+07
or (resid 64 and name HG21) (resid 152 and name HN)
or (resid 64 and name HG23) (resid 152 and name HN)
assign (resid 64 and name HG22) (resid 153 and name HA) 3.182 1.266 1.266 weight 1.000 ! spec=HCH, no=1847, id=4851, vol=1.230000e+07
or (resid 64 and name HG21) (resid 153 and name HA)
or (resid 64 and name HG23) (resid 153 and name HA)
assign (resid 64 and name HG22) (resid 63 and name HA) 2.969 1.102 1.102 weight 1.000 ! spec=HCH, no=1855, id=4857, vol=1.870000e+07
or (resid 64 and name HG21) (resid 63 and name HA)
or (resid 64 and name HG23) (resid 63 and name HA)
assign (resid 63 and name HE2) (resid 64 and name HG22) 3.125 1.221 1.221 weight 1.000 ! spec=HCH, no=1857, id=4859, vol=1.380000e+07
or (resid 63 and name HE2) (resid 64 and name HG21)
or (resid 63 and name HE2) (resid 64 and name HG23)
or (resid 63 and name HE1) (resid 64 and name HG22)
or (resid 63 and name HE1) (resid 64 and name HG21)
or (resid 63 and name HE1) (resid 64 and name HG23)
or (resid 63 and name HE3) (resid 64 and name HG22)
or (resid 63 and name HE3) (resid 64 and name HG21)
or (resid 63 and name HE3) (resid 64 and name HG23)
assign (resid 64 and name HN) (resid 64 and name HG22) 2.211 0.611 0.611 weight 1.000 ! spec=HCH, no=1858, id=4860, vol=1.100000e+08
or (resid 64 and name HN) (resid 64 and name HG21)
or (resid 64 and name HN) (resid 64 and name HG23)
assign (resid 64 and name HG22) (resid 64 and name HA) 2.629 0.864 0.864 weight 1.000 ! spec=HCH, no=1859, id=4861, vol=3.880000e+07
or (resid 64 and name HG21) (resid 64 and name HA)
or (resid 64 and name HG23) (resid 64 and name HA)
assign (resid 64 and name HG22) (resid 64 and name HG12) 2.229 0.621 0.621 weight 1.000 ! spec=HCH, no=1860, id=4862, vol=1.050000e+08
or (resid 64 and name HG21) (resid 64 and name HG12)
or (resid 64 and name HG23) (resid 64 and name HG12)
assign (resid 64 and name HG22) (resid 64 and name HG21) 1.363 0.232 0.232 weight 1.000 ! spec=HCH, no=1862, id=4864, vol=2.000000e+09
or (resid 64 and name HG22) (resid 64 and name HG23)
or (resid 64 and name HG22) (resid 64 and name HG21)
or (resid 64 and name HG21) (resid 64 and name HG23)
or (resid 64 and name HG22) (resid 64 and name HG23)
or (resid 64 and name HG21) (resid 64 and name HG23)
assign (resid 64 and name HG22) (resid 65 and name HN) 3.061 1.172 1.172 weight 1.000 ! spec=HCH, no=1863, id=4865, vol=1.560000e+07
or (resid 64 and name HG21) (resid 65 and name HN)
or (resid 64 and name HG23) (resid 65 and name HN)
assign (resid 64 and name HG22) (resid 65 and name HA) 3.492 1.524 1.524 weight 1.000 ! spec=HCH, no=1864, id=4866, vol=7.070000e+06
or (resid 64 and name HG21) (resid 65 and name HA)
or (resid 64 and name HG23) (resid 65 and name HA)
assign (resid 64 and name HG22) (resid 92 and name HA1) 3.456 1.493 1.493 weight 1.000 ! spec=HCH, no=1865, id=4867, vol=7.520000e+06
or (resid 64 and name HG21) (resid 92 and name HA1)
or (resid 64 and name HG23) (resid 92 and name HA1)
assign (resid 65 and name HA) (resid 91 and name HA) 3.703 1.714 1.714 weight 1.000 ! spec=HCH, no=1866, id=4868, vol=4.970000e+06
assign (resid 65 and name HA) (resid 104 and name HA) 3.786 1.792 1.792 weight 1.000 ! spec=HCH, no=1869, id=4871, vol=4.360000e+06
assign (resid 65 and name HA) (resid 64 and name HG12) 3.174 1.259 1.259 weight 1.000 ! spec=HCH, no=1871, id=4872, vol=1.250000e+07
assign (resid 65 and name HA) (resid 67 and name HD2) 3.891 1.892 1.892 weight 1.000 ! spec=HCH, no=1874, id=4875, vol=3.700000e+06
assign (resid 65 and name HA) (resid 104 and name HZ3) 3.213 1.291 1.291 weight 1.000 ! spec=HCH, no=1876, id=4877, vol=1.170000e+07
assign (resid 65 and name HN) (resid 65 and name HA) 3.197 1.278 1.278 weight 1.000 ! spec=HCH, no=1877, id=4878, vol=1.200000e+07
assign (resid 65 and name HA) (resid 65 and name HB2) 3.051 1.164 1.164 weight 1.000 ! spec=HCH, no=1878, id=4879, vol=1.590000e+07
assign (resid 65 and name HA) (resid 65 and name HB1) 2.745 0.942 0.942 weight 1.000 ! spec=HCH, no=1879, id=4880, vol=3.000000e+07
assign (resid 65 and name HA) (resid 66 and name HG12) 3.664 1.678 1.678 weight 1.000 ! spec=HCH, no=1881, id=4882, vol=5.300000e+06
assign (resid 65 and name HA) (resid 66 and name HD12) 3.613 1.631 1.631 weight 1.000 ! spec=HCH, no=1882, id=4883, vol=5.770000e+06
or (resid 65 and name HA) (resid 66 and name HD11)
or (resid 65 and name HA) (resid 66 and name HD13)
assign (resid 65 and name HB2) (resid 104 and name HB1) 3.776 1.782 1.782 weight 1.000 ! spec=HCH, no=1887, id=4888, vol=4.420000e+06
assign (resid 65 and name HB1) (resid 104 and name HE3) 3.977 1.977 1.977 weight 1.000 ! spec=HCH, no=1889, id=4890, vol=3.240000e+06
assign (resid 65 and name HB1) (resid 104 and name HB1) 3.777 1.783 1.783 weight 1.000 ! spec=HCH, no=1890, id=4891, vol=4.420000e+06
assign (resid 65 and name HB1) (resid 65 and name HN) 3.706 1.716 1.716 weight 1.000 ! spec=HCH, no=1892, id=4893, vol=4.950000e+06
assign (resid 65 and name HB1) (resid 65 and name HB2) 2.712 0.920 0.920 weight 1.000 ! spec=HCH, no=1896, id=4897, vol=3.220000e+07
assign (resid 65 and name HB1) (resid 66 and name HN) 3.260 1.328 1.328 weight 1.000 ! spec=HCH, no=1899, id=4899, vol=1.070000e+07
assign (resid 65 and name HB1) (resid 67 and name HD2) 4.024 2.024 2.024 weight 1.000 ! spec=HCH, no=1901, id=4901, vol=3.020000e+06
assign (resid 66 and name HA) (resid 66 and name HB) 3.106 1.206 1.206 weight 1.000 ! spec=HCH, no=1903, id=4903, vol=1.430000e+07
assign (resid 66 and name HA) (resid 66 and name HG12) 2.986 1.114 1.114 weight 1.000 ! spec=HCH, no=1905, id=4905, vol=1.810000e+07
assign (resid 66 and name HA) (resid 154 and name HD2) 3.387 1.434 1.434 weight 1.000 ! spec=HCH, no=1906, id=4906, vol=8.490000e+06
or (resid 66 and name HA) (resid 154 and name HD1)
assign (resid 66 and name HA) (resid 71 and name HB2) 3.362 1.413 1.413 weight 1.000 ! spec=HCH, no=1908, id=4908, vol=8.880000e+06
or (resid 66 and name HA) (resid 71 and name HB1)
assign (resid 66 and name HA) (resid 66 and name HG11) 3.015 1.136 1.136 weight 1.000 ! spec=HCH, no=1911, id=4911, vol=1.710000e+07
assign (resid 66 and name HA) (resid 66 and name HG22) 2.738 0.937 0.937 weight 1.000 ! spec=HCH, no=1913, id=4913, vol=3.040000e+07
or (resid 66 and name HA) (resid 66 and name HG21)
or (resid 66 and name HA) (resid 66 and name HG23)
assign (resid 66 and name HB) (resid 66 and name HG12) 2.912 1.060 1.060 weight 1.000 ! spec=HCH, no=1917, id=4917, vol=2.100000e+07
assign (resid 66 and name HB) (resid 66 and name HG11) 3.012 1.134 1.134 weight 1.000 ! spec=HCH, no=1922, id=4921, vol=1.720000e+07
assign (resid 66 and name HB) (resid 104 and name HH2) 3.497 1.528 1.528 weight 1.000 ! spec=HCH, no=1925, id=4924, vol=7.010000e+06
assign (resid 66 and name HD12) (resid 66 and name HG11) 2.010 0.505 0.505 weight 1.000 ! spec=HCH, no=1939, id=4938, vol=1.940000e+08
or (resid 66 and name HD11) (resid 66 and name HG11)
or (resid 66 and name HD13) (resid 66 and name HG11)
assign (resid 66 and name HD12) (resid 104 and name HZ2) 3.316 1.374 1.374 weight 1.000 ! spec=HCH, no=1940, id=4939, vol=9.650000e+06
or (resid 66 and name HD11) (resid 104 and name HZ2)
or (resid 66 and name HD13) (resid 104 and name HZ2)
assign (resid 66 and name HD12) (resid 65 and name HN) 4.045 2.045 2.045 weight 1.000 ! spec=HCH, no=1944, id=4943, vol=2.930000e+06
or (resid 66 and name HD11) (resid 65 and name HN)
or (resid 66 and name HD13) (resid 65 and name HN)
assign (resid 66 and name HA) (resid 66 and name HD12) 2.897 1.049 1.049 weight 1.000 ! spec=HCH, no=1947, id=4946, vol=2.170000e+07
or (resid 66 and name HA) (resid 66 and name HD11)
or (resid 66 and name HA) (resid 66 and name HD13)
assign (resid 66 and name HB) (resid 66 and name HD12) 2.417 0.730 0.730 weight 1.000 ! spec=HCH, no=1948, id=4947, vol=6.440000e+07
or (resid 66 and name HB) (resid 66 and name HD11)
or (resid 66 and name HB) (resid 66 and name HD13)
assign (resid 66 and name HD12) (resid 66 and name HG12) 1.937 0.469 0.469 weight 1.000 ! spec=HCH, no=1949, id=4948, vol=2.430000e+08
or (resid 66 and name HD11) (resid 66 and name HG12)
or (resid 66 and name HD13) (resid 66 and name HG12)
assign (resid 66 and name HD12) (resid 66 and name HD11) 1.413 0.249 0.249 weight 1.000 ! spec=HCH, no=1950, id=4949, vol=1.610000e+09
or (resid 66 and name HD12) (resid 66 and name HD13)
or (resid 66 and name HD12) (resid 66 and name HD11)
or (resid 66 and name HD11) (resid 66 and name HD13)
or (resid 66 and name HD12) (resid 66 and name HD13)
or (resid 66 and name HD11) (resid 66 and name HD13)
assign (resid 66 and name HD12) (resid 66 and name HG22) 2.109 0.556 0.556 weight 1.000 ! spec=HCH, no=1951, id=4950, vol=1.460000e+08
or (resid 66 and name HD12) (resid 66 and name HG21)
or (resid 66 and name HD12) (resid 66 and name HG23)
or (resid 66 and name HD11) (resid 66 and name HG22)
or (resid 66 and name HD11) (resid 66 and name HG21)
or (resid 66 and name HD11) (resid 66 and name HG23)
or (resid 66 and name HD13) (resid 66 and name HG22)
or (resid 66 and name HD13) (resid 66 and name HG21)
or (resid 66 and name HD13) (resid 66 and name HG23)
assign (resid 66 and name HD12) (resid 71 and name HG1) 3.297 1.359 1.359 weight 1.000 ! spec=HCH, no=1953, id=4952, vol=9.980000e+06
or (resid 66 and name HD11) (resid 71 and name HG1)
or (resid 66 and name HD13) (resid 71 and name HG1)
assign (resid 66 and name HD12) (resid 72 and name HA) 2.677 0.895 0.895 weight 1.000 ! spec=HCH, no=1954, id=4953, vol=3.490000e+07
or (resid 66 and name HD11) (resid 72 and name HA)
or (resid 66 and name HD13) (resid 72 and name HA)
assign (resid 66 and name HD12) (resid 72 and name HB2) 3.297 1.359 1.359 weight 1.000 ! spec=HCH, no=1955, id=4954, vol=9.980000e+06
or (resid 66 and name HD11) (resid 72 and name HB2)
or (resid 66 and name HD13) (resid 72 and name HB2)
assign (resid 66 and name HD12) (resid 72 and name HB1) 3.931 1.932 1.932 weight 1.000 ! spec=HCH, no=1956, id=4955, vol=3.470000e+06
or (resid 66 and name HD11) (resid 72 and name HB1)
or (resid 66 and name HD13) (resid 72 and name HB1)
assign (resid 66 and name HD12) (resid 72 and name HD22) 3.486 1.519 1.519 weight 1.000 ! spec=HCH, no=1957, id=4956, vol=7.150000e+06
or (resid 66 and name HD11) (resid 72 and name HD22)
or (resid 66 and name HD13) (resid 72 and name HD22)
assign (resid 66 and name HD12) (resid 75 and name HA) 4.103 2.105 2.105 weight 1.000 ! spec=HCH, no=1958, id=4957, vol=2.690000e+06
or (resid 66 and name HD11) (resid 75 and name HA)
or (resid 66 and name HD13) (resid 75 and name HA)
assign (resid 66 and name HD12) (resid 76 and name HN) 4.028 2.028 2.028 weight 1.000 ! spec=HCH, no=1959, id=4958, vol=3.000000e+06
or (resid 66 and name HD11) (resid 76 and name HN)
or (resid 66 and name HD13) (resid 76 and name HN)
assign (resid 66 and name HD12) (resid 92 and name HN) 3.760 1.767 1.767 weight 1.000 ! spec=HCH, no=1963, id=4962, vol=4.540000e+06
or (resid 66 and name HD11) (resid 92 and name HN)
or (resid 66 and name HD13) (resid 92 and name HN)
assign (resid 66 and name HD12) (resid 104 and name HH2) 3.374 1.423 1.423 weight 1.000 ! spec=HCH, no=1964, id=4963, vol=8.690000e+06
or (resid 66 and name HD11) (resid 104 and name HH2)
or (resid 66 and name HD13) (resid 104 and name HH2)
assign (resid 66 and name HD12) (resid 138 and name HD1) 3.446 1.484 1.484 weight 1.000 ! spec=HCH, no=1966, id=4965, vol=7.660000e+06
or (resid 66 and name HD11) (resid 138 and name HD1)
or (resid 66 and name HD13) (resid 138 and name HD1)
assign (resid 66 and name HD12) (resid 138 and name HE1) 2.821 0.995 0.995 weight 1.000 ! spec=HCH, no=1967, id=4966, vol=2.540000e+07
or (resid 66 and name HD11) (resid 138 and name HE1)
or (resid 66 and name HD13) (resid 138 and name HE1)
assign (resid 66 and name HD12) (resid 138 and name HE3) 4.064 2.064 2.064 weight 1.000 ! spec=HCH, no=1968, id=4967, vol=2.850000e+06
or (resid 66 and name HD11) (resid 138 and name HE3)
or (resid 66 and name HD13) (resid 138 and name HE3)
assign (resid 66 and name HD12) (resid 138 and name HH2) 3.481 1.515 1.515 weight 1.000 ! spec=HCH, no=1969, id=4968, vol=7.210000e+06
or (resid 66 and name HD11) (resid 138 and name HH2)
or (resid 66 and name HD13) (resid 138 and name HH2)
assign (resid 66 and name HD12) (resid 138 and name HZ3) 3.745 1.753 1.753 weight 1.000 ! spec=HCH, no=1971, id=4970, vol=4.650000e+06
or (resid 66 and name HD11) (resid 138 and name HZ3)
or (resid 66 and name HD13) (resid 138 and name HZ3)
assign (resid 66 and name HG11) (resid 104 and name HZ3) 4.113 2.115 2.115 weight 1.000 ! spec=HCH, no=1980, id=4979, vol=2.650000e+06
assign (resid 66 and name HG11) (resid 66 and name HG12) 2.305 0.664 0.664 weight 1.000 ! spec=HCH, no=1989, id=4988, vol=8.540000e+07
assign (resid 66 and name HG11) (resid 66 and name HG22) 2.614 0.854 0.854 weight 1.000 ! spec=HCH, no=1995, id=4993, vol=4.020000e+07
or (resid 66 and name HG11) (resid 66 and name HG21)
or (resid 66 and name HG11) (resid 66 and name HG23)
assign (resid 66 and name HG12) (resid 91 and name HD12) 3.670 1.683 1.683 weight 1.000 ! spec=HCH, no=1996, id=4994, vol=5.250000e+06
or (resid 66 and name HG12) (resid 91 and name HD11)
or (resid 66 and name HG12) (resid 91 and name HD13)
assign (resid 66 and name HG11) (resid 91 and name HD12) 3.208 1.286 1.286 weight 1.000 ! spec=HCH, no=1997, id=4995, vol=1.180000e+07
or (resid 66 and name HG11) (resid 91 and name HD11)
or (resid 66 and name HG11) (resid 91 and name HD13)
assign (resid 66 and name HG22) (resid 67 and name HN) 2.727 0.930 0.930 weight 1.000 ! spec=HCH, no=2002, id=4999, vol=3.120000e+07
or (resid 66 and name HG21) (resid 67 and name HN)
or (resid 66 and name HG23) (resid 67 and name HN)
assign (resid 66 and name HG22) (resid 69 and name HA) 3.294 1.357 1.357 weight 1.000 ! spec=HCH, no=2005, id=5001, vol=1.000000e+07
or (resid 66 and name HG21) (resid 69 and name HA)
or (resid 66 and name HG23) (resid 69 and name HA)
assign (resid 66 and name HG22) (resid 67 and name HB2) 3.361 1.412 1.412 weight 1.000 ! spec=HCH, no=2010, id=5005, vol=8.900000e+06
or (resid 66 and name HG21) (resid 67 and name HB2)
or (resid 66 and name HG23) (resid 67 and name HB2)
assign (resid 66 and name HG22) (resid 69 and name HN) 3.174 1.259 1.259 weight 1.000 ! spec=HCH, no=2013, id=5008, vol=1.260000e+07
or (resid 66 and name HG21) (resid 69 and name HN)
or (resid 66 and name HG23) (resid 69 and name HN)
assign (resid 66 and name HG22) (resid 113 and name HA) 3.113 1.212 1.212 weight 1.000 ! spec=HCH, no=2018, id=5013, vol=1.410000e+07
or (resid 66 and name HG21) (resid 113 and name HA)
or (resid 66 and name HG23) (resid 113 and name HA)
assign (resid 66 and name HG22) (resid 68 and name HA) 3.394 1.440 1.440 weight 1.000 ! spec=HCH, no=2019, id=5014, vol=8.390000e+06
or (resid 66 and name HG21) (resid 68 and name HA)
or (resid 66 and name HG23) (resid 68 and name HA)
assign (resid 66 and name HG12) (resid 66 and name HG22) 2.343 0.686 0.686 weight 1.000 ! spec=HCH, no=2020, id=5015, vol=7.740000e+07
or (resid 66 and name HG12) (resid 66 and name HG21)
or (resid 66 and name HG12) (resid 66 and name HG23)
assign (resid 72 and name HN) (resid 66 and name HG22) 2.603 0.847 0.847 weight 1.000 ! spec=HCH, no=2021, id=5016, vol=4.130000e+07
or (resid 72 and name HN) (resid 66 and name HG21)
or (resid 72 and name HN) (resid 66 and name HG23)
assign (resid 66 and name HB) (resid 66 and name HG22) 2.271 0.645 0.645 weight 1.000 ! spec=HCH, no=2025, id=5020, vol=9.350000e+07
or (resid 66 and name HB) (resid 66 and name HG21)
or (resid 66 and name HB) (resid 66 and name HG23)
assign (resid 66 and name HG22) (resid 66 and name HG21) 1.262 0.199 0.199 weight 1.000 ! spec=HCH, no=2026, id=5021, vol=3.180000e+09
or (resid 66 and name HG22) (resid 66 and name HG23)
or (resid 66 and name HG22) (resid 66 and name HG21)
or (resid 66 and name HG21) (resid 66 and name HG23)
or (resid 66 and name HG22) (resid 66 and name HG23)
or (resid 66 and name HG21) (resid 66 and name HG23)
assign (resid 66 and name HG22) (resid 71 and name HG1) 2.416 0.730 0.730 weight 1.000 ! spec=HCH, no=2027, id=5022, vol=6.440000e+07
or (resid 66 and name HG21) (resid 71 and name HG1)
or (resid 66 and name HG23) (resid 71 and name HG1)
assign (resid 66 and name HG22) (resid 71 and name HB2) 2.349 0.689 0.689 weight 1.000 ! spec=HCH, no=2028, id=5023, vol=7.640000e+07
or (resid 66 and name HG21) (resid 71 and name HB2)
or (resid 66 and name HG23) (resid 71 and name HB2)
assign (resid 66 and name HG22) (resid 72 and name HA) 2.477 0.767 0.767 weight 1.000 ! spec=HCH, no=2029, id=5024, vol=5.550000e+07
or (resid 66 and name HG21) (resid 72 and name HA)
or (resid 66 and name HG23) (resid 72 and name HA)
assign (resid 66 and name HG22) (resid 72 and name HB2) 2.416 0.730 0.730 weight 1.000 ! spec=HCH, no=2030, id=5025, vol=6.440000e+07
or (resid 66 and name HG21) (resid 72 and name HB2)
or (resid 66 and name HG23) (resid 72 and name HB2)
assign (resid 66 and name HG22) (resid 72 and name HB1) 2.794 0.976 0.976 weight 1.000 ! spec=HCH, no=2031, id=5026, vol=2.700000e+07
or (resid 66 and name HG21) (resid 72 and name HB1)
or (resid 66 and name HG23) (resid 72 and name HB1)
assign (resid 66 and name HG22) (resid 91 and name HD22) 3.624 1.641 1.641 weight 1.000 ! spec=HCH, no=2033, id=5028, vol=5.660000e+06
or (resid 66 and name HG22) (resid 91 and name HD21)
or (resid 66 and name HG22) (resid 91 and name HD23)
or (resid 66 and name HG21) (resid 91 and name HD22)
or (resid 66 and name HG21) (resid 91 and name HD21)
or (resid 66 and name HG21) (resid 91 and name HD23)
or (resid 66 and name HG23) (resid 91 and name HD22)
or (resid 66 and name HG23) (resid 91 and name HD21)
or (resid 66 and name HG23) (resid 91 and name HD23)
assign (resid 66 and name HG22) (resid 112 and name HD1) 2.158 0.582 0.582 weight 1.000 ! spec=HCH, no=2035, id=5030, vol=1.270000e+08
or (resid 66 and name HG21) (resid 112 and name HD1)
or (resid 66 and name HG23) (resid 112 and name HD1)
assign (resid 66 and name HG22) (resid 112 and name HE1) 2.734 0.935 0.935 weight 1.000 ! spec=HCH, no=2036, id=5031, vol=3.070000e+07
or (resid 66 and name HG21) (resid 112 and name HE1)
or (resid 66 and name HG23) (resid 112 and name HE1)
assign (resid 66 and name HG22) (resid 114 and name HB2) 3.726 1.736 1.736 weight 1.000 ! spec=HCH, no=2037, id=5032, vol=4.790000e+06
or (resid 66 and name HG21) (resid 114 and name HB2)
or (resid 66 and name HG23) (resid 114 and name HB2)
assign (resid 66 and name HG22) (resid 138 and name HH2) 2.902 1.053 1.053 weight 1.000 ! spec=HCH, no=2038, id=5033, vol=2.150000e+07
or (resid 66 and name HG21) (resid 138 and name HH2)
or (resid 66 and name HG23) (resid 138 and name HH2)
assign (resid 66 and name HG22) (resid 138 and name HZ2) 2.384 0.711 0.711 weight 1.000 ! spec=HCH, no=2039, id=5034, vol=6.980000e+07
or (resid 66 and name HG21) (resid 138 and name HZ2)
or (resid 66 and name HG23) (resid 138 and name HZ2)
assign (resid 66 and name HG22) (resid 138 and name HZ3) 3.520 1.549 1.549 weight 1.000 ! spec=HCH, no=2040, id=5035, vol=6.740000e+06
or (resid 66 and name HG21) (resid 138 and name HZ3)
or (resid 66 and name HG23) (resid 138 and name HZ3)
assign (resid 68 and name HN) (resid 67 and name HA) 2.886 1.041 1.041 weight 1.000 ! spec=HCH, no=2045, id=5040, vol=2.220000e+07
assign (resid 67 and name HA) (resid 112 and name HB2) 2.941 1.081 1.081 weight 1.000 ! spec=HCH, no=2046, id=5041, vol=1.980000e+07
assign (resid 67 and name HA) (resid 67 and name HB2) 2.968 1.101 1.101 weight 1.000 ! spec=HCH, no=2048, id=5043, vol=1.880000e+07
assign (resid 67 and name HA) (resid 67 and name HB1) 2.864 1.025 1.025 weight 1.000 ! spec=HCH, no=2049, id=5044, vol=2.330000e+07
assign (resid 67 and name HB2) (resid 66 and name HA) 3.904 1.905 1.905 weight 1.000 ! spec=HCH, no=2056, id=5051, vol=3.620000e+06
assign (resid 67 and name HB2) (resid 67 and name HN) 3.161 1.249 1.249 weight 1.000 ! spec=HCH, no=2057, id=5052, vol=1.290000e+07
assign (resid 67 and name HB1) (resid 67 and name HB2) 2.453 0.752 0.752 weight 1.000 ! spec=HCH, no=2062, id=5056, vol=5.880000e+07
assign (resid 68 and name HD21) (resid 68 and name HA) 3.392 1.438 1.438 weight 1.000 ! spec=HCH, no=2069, id=5063, vol=8.420000e+06
assign (resid 68 and name HA) (resid 69 and name HG1) 3.894 1.895 1.895 weight 1.000 ! spec=HCH, no=2070, id=5064, vol=3.680000e+06
assign (resid 68 and name HA) (resid 68 and name HB2) 2.456 0.754 0.754 weight 1.000 ! spec=HCH, no=2072, id=5065, vol=5.840000e+07
assign (resid 68 and name HA) (resid 68 and name HB1) 2.472 0.764 0.764 weight 1.000 ! spec=HCH, no=2073, id=5066, vol=5.620000e+07
assign (resid 68 and name HA) (resid 69 and name HB1) 3.401 1.446 1.446 weight 1.000 ! spec=HCH, no=2076, id=5069, vol=8.290000e+06
assign (resid 68 and name HA) (resid 112 and name HB2) 3.570 1.593 1.593 weight 1.000 ! spec=HCH, no=2077, id=5070, vol=6.200000e+06
assign (resid 68 and name HA) (resid 112 and name HD1) 2.580 0.832 0.832 weight 1.000 ! spec=HCH, no=2078, id=5071, vol=4.340000e+07
assign (resid 68 and name HB2) (resid 71 and name HB2) 3.460 1.497 1.497 weight 1.000 ! spec=HCH, no=2083, id=5075, vol=7.470000e+06
or (resid 68 and name HB2) (resid 71 and name HB1)
assign (resid 68 and name HB1) (resid 68 and name HB2) 2.369 0.702 0.702 weight 1.000 ! spec=HCH, no=2087, id=5079, vol=7.250000e+07
assign (resid 68 and name HD22) (resid 68 and name HB1) 2.920 1.066 1.066 weight 1.000 ! spec=HCH, no=2092, id=5084, vol=2.070000e+07
assign (resid 68 and name HB1) (resid 69 and name HN) 2.846 1.012 1.012 weight 1.000 ! spec=HCH, no=2094, id=5086, vol=2.420000e+07
assign (resid 68 and name HB1) (resid 69 and name HB1) 3.872 1.874 1.874 weight 1.000 ! spec=HCH, no=2095, id=5087, vol=3.810000e+06
assign (resid 69 and name HA) (resid 72 and name HB1) 2.851 1.016 1.016 weight 1.000 ! spec=HCH, no=2097, id=5089, vol=2.390000e+07
assign (resid 69 and name HA) (resid 73 and name HB2) 2.987 1.115 1.115 weight 1.000 ! spec=HCH, no=2099, id=5091, vol=1.810000e+07
or (resid 69 and name HA) (resid 73 and name HB1)
or (resid 69 and name HA) (resid 73 and name HB3)
assign (resid 69 and name HA) (resid 69 and name HG2) 2.795 0.977 0.977 weight 1.000 ! spec=HCH, no=2100, id=5092, vol=2.690000e+07
assign (resid 69 and name HA) (resid 72 and name HB2) 2.671 0.892 0.892 weight 1.000 ! spec=HCH, no=2102, id=5094, vol=3.530000e+07
assign (resid 69 and name HN) (resid 69 and name HA) 2.636 0.868 0.868 weight 1.000 ! spec=HCH, no=2103, id=5095, vol=3.820000e+07
assign (resid 69 and name HA) (resid 69 and name HB2) 2.638 0.870 0.870 weight 1.000 ! spec=HCH, no=2105, id=5096, vol=3.800000e+07
assign (resid 69 and name HA) (resid 69 and name HB1) 2.586 0.836 0.836 weight 1.000 ! spec=HCH, no=2106, id=5097, vol=4.290000e+07
assign (resid 72 and name HD22) (resid 69 and name HA) 3.617 1.636 1.636 weight 1.000 ! spec=HCH, no=2108, id=5099, vol=5.720000e+06
assign (resid 69 and name HA) (resid 112 and name HD1) 2.938 1.079 1.079 weight 1.000 ! spec=HCH, no=2109, id=5100, vol=1.990000e+07
assign (resid 69 and name HA) (resid 112 and name HE1) 2.648 0.877 0.877 weight 1.000 ! spec=HCH, no=2110, id=5101, vol=3.720000e+07
assign (resid 68 and name HA) (resid 69 and name HB2) 3.959 1.959 1.959 weight 1.000 ! spec=HCH, no=2114, id=5105, vol=3.330000e+06
assign (resid 69 and name HB1) (resid 73 and name HB2) 3.624 1.642 1.642 weight 1.000 ! spec=HCH, no=2118, id=5109, vol=5.660000e+06
or (resid 69 and name HB1) (resid 73 and name HB1)
or (resid 69 and name HB1) (resid 73 and name HB3)
assign (resid 69 and name HN) (resid 69 and name HB2) 2.578 0.831 0.831 weight 1.000 ! spec=HCH, no=2119, id=5110, vol=4.370000e+07
assign (resid 69 and name HB1) (resid 69 and name HN) 2.654 0.881 0.881 weight 1.000 ! spec=HCH, no=2120, id=5111, vol=3.670000e+07
assign (resid 69 and name HB1) (resid 69 and name HB2) 2.129 0.567 0.567 weight 1.000 ! spec=HCH, no=2123, id=5114, vol=1.380000e+08
assign (resid 69 and name HB2) (resid 69 and name HG1) 2.602 0.847 0.847 weight 1.000 ! spec=HCH, no=2126, id=5117, vol=4.130000e+07
assign (resid 69 and name HB1) (resid 69 and name HG1) 2.394 0.716 0.716 weight 1.000 ! spec=HCH, no=2127, id=5118, vol=6.810000e+07
assign (resid 69 and name HG2) (resid 73 and name HB2) 3.596 1.616 1.616 weight 1.000 ! spec=HCH, no=2130, id=5121, vol=5.930000e+06
or (resid 69 and name HG2) (resid 73 and name HB1)
or (resid 69 and name HG2) (resid 73 and name HB3)
assign (resid 69 and name HG1) (resid 69 and name HN) 3.166 1.253 1.253 weight 1.000 ! spec=HCH, no=2139, id=5130, vol=1.270000e+07
assign (resid 69 and name HG1) (resid 72 and name HN) 3.920 1.920 1.920 weight 1.000 ! spec=HCH, no=2140, id=5131, vol=3.540000e+06
assign (resid 69 and name HG2) (resid 69 and name HN) 3.148 1.239 1.239 weight 1.000 ! spec=HCH, no=2142, id=5133, vol=1.320000e+07
assign (resid 69 and name HA) (resid 69 and name HG1) 3.281 1.345 1.345 weight 1.000 ! spec=HCH, no=2144, id=5135, vol=1.030000e+07
assign (resid 69 and name HG2) (resid 69 and name HB2) 2.525 0.797 0.797 weight 1.000 ! spec=HCH, no=2145, id=5136, vol=4.940000e+07
assign (resid 69 and name HG1) (resid 69 and name HG2) 1.854 0.430 0.430 weight 1.000 ! spec=HCH, no=2148, id=5139, vol=3.150000e+08
assign (resid 69 and name HB2) (resid 70 and name HA) 3.189 1.271 1.271 weight 1.000 ! spec=HCH, no=2150, id=5140, vol=1.220000e+07
assign (resid 70 and name HA) (resid 70 and name HB2) 2.481 0.769 0.769 weight 1.000 ! spec=HCH, no=2155, id=5145, vol=5.500000e+07
assign (resid 70 and name HB2) (resid 73 and name HB2) 3.798 1.803 1.803 weight 1.000 ! spec=HCH, no=2158, id=5148, vol=4.270000e+06
or (resid 70 and name HB2) (resid 73 and name HB1)
or (resid 70 and name HB2) (resid 73 and name HB3)
assign (resid 70 and name HB2) (resid 70 and name HB1) 1.957 0.479 0.479 weight 1.000 ! spec=HCH, no=2159, id=5149, vol=2.280000e+08
assign (resid 33 and name HE21) (resid 70 and name HB2) 2.932 1.075 1.075 weight 1.000 ! spec=HCH, no=2163, id=5153, vol=2.020000e+07
assign (resid 70 and name HB2) (resid 68 and name HB1) 4.207 2.212 2.212 weight 1.000 ! spec=HCH, no=2167, id=5157, vol=2.310000e+06
assign (resid 70 and name HB1) (resid 68 and name HB1) 4.410 2.431 2.431 weight 1.000 ! spec=HCH, no=2171, id=5161, vol=1.740000e+06
assign (resid 70 and name HB1) (resid 70 and name HG1) 2.395 0.717 0.717 weight 1.000 ! spec=HCH, no=2175, id=5165, vol=6.800000e+07
assign (resid 70 and name HN) (resid 70 and name HB2) 2.752 0.947 0.947 weight 1.000 ! spec=HCH, no=2177, id=5166, vol=2.950000e+07
assign (resid 70 and name HB1) (resid 70 and name HA) 2.801 0.980 0.980 weight 1.000 ! spec=HCH, no=2180, id=5169, vol=2.660000e+07
assign (resid 70 and name HB2) (resid 71 and name HN) 3.203 1.283 1.283 weight 1.000 ! spec=HCH, no=2181, id=5170, vol=1.190000e+07
assign (resid 70 and name HG2) (resid 71 and name HN) 3.516 1.545 1.545 weight 1.000 ! spec=HCH, no=2184, id=5173, vol=6.790000e+06
assign (resid 68 and name HB1) (resid 70 and name HG2) 3.884 1.886 1.886 weight 1.000 ! spec=HCH, no=2185, id=5174, vol=3.730000e+06
assign (resid 70 and name HG2) (resid 33 and name HE22) 4.076 2.077 2.077 weight 1.000 ! spec=HCH, no=2186, id=5175, vol=2.800000e+06
assign (resid 71 and name HN) (resid 70 and name HG1) 3.489 1.522 1.522 weight 1.000 ! spec=HCH, no=2187, id=5176, vol=7.100000e+06
assign (resid 70 and name HG1) (resid 68 and name HB1) 3.925 1.926 1.926 weight 1.000 ! spec=HCH, no=2190, id=5179, vol=3.510000e+06
assign (resid 70 and name HG2) (resid 70 and name HN) 2.853 1.018 1.018 weight 1.000 ! spec=HCH, no=2193, id=5182, vol=2.380000e+07
assign (resid 70 and name HG1) (resid 70 and name HN) 2.886 1.041 1.041 weight 1.000 ! spec=HCH, no=2194, id=5183, vol=2.220000e+07
assign (resid 70 and name HG2) (resid 70 and name HA) 2.552 0.814 0.814 weight 1.000 ! spec=HCH, no=2195, id=5184, vol=4.640000e+07
assign (resid 70 and name HG2) (resid 70 and name HB2) 2.447 0.748 0.748 weight 1.000 ! spec=HCH, no=2197, id=5186, vol=5.980000e+07
assign (resid 70 and name HB2) (resid 70 and name HG1) 2.434 0.741 0.741 weight 1.000 ! spec=HCH, no=2198, id=5187, vol=6.170000e+07
assign (resid 70 and name HG1) (resid 70 and name HG2) 1.814 0.412 0.412 weight 1.000 ! spec=HCH, no=2201, id=5189, vol=3.590000e+08
assign (resid 71 and name HA) (resid 74 and name HD1) 3.357 1.409 1.409 weight 1.000 ! spec=HCH, no=2205, id=5192, vol=8.960000e+06
or (resid 71 and name HA) (resid 74 and name HD2)
assign (resid 71 and name HA) (resid 71 and name HG1) 2.857 1.020 1.020 weight 1.000 ! spec=HCH, no=2206, id=5193, vol=2.360000e+07
assign (resid 71 and name HA) (resid 32 and name HE1) 2.722 0.926 0.926 weight 1.000 ! spec=HCH, no=2207, id=5194, vol=3.150000e+07
or (resid 71 and name HA) (resid 32 and name HE2)
assign (resid 71 and name HA) (resid 71 and name HB2) 2.603 0.847 0.847 weight 1.000 ! spec=HCH, no=2211, id=5198, vol=4.120000e+07
or (resid 71 and name HA) (resid 71 and name HB1)
assign (resid 71 and name HB2) (resid 67 and name HN) 3.655 1.670 1.670 weight 1.000 ! spec=HCH, no=2216, id=5203, vol=5.380000e+06
assign (resid 66 and name HA) (resid 71 and name HB2) 2.444 0.747 0.747 weight 1.000 ! spec=HCH, no=2217, id=5204, vol=6.010000e+07
assign (resid 71 and name HB2) (resid 71 and name HG1) 2.766 0.957 0.957 weight 1.000 ! spec=HCH, no=2219, id=5206, vol=2.860000e+07
assign (resid 71 and name HA) (resid 71 and name HB2) 3.012 1.134 1.134 weight 1.000 ! spec=HCH, no=2223, id=5210, vol=1.720000e+07
assign (resid 71 and name HG2) (resid 32 and name HD1) 3.698 1.709 1.709 weight 1.000 ! spec=HCH, no=2226, id=5213, vol=5.010000e+06
or (resid 71 and name HG2) (resid 32 and name HD2)
assign (resid 71 and name HG2) (resid 32 and name HE1) 3.470 1.505 1.505 weight 1.000 ! spec=HCH, no=2228, id=5215, vol=7.340000e+06
or (resid 71 and name HG2) (resid 32 and name HE2)
assign (resid 71 and name HG1) (resid 66 and name HG12) 3.405 1.449 1.449 weight 1.000 ! spec=HCH, no=2229, id=5216, vol=8.230000e+06
assign (resid 71 and name HG1) (resid 32 and name HD1) 3.701 1.712 1.712 weight 1.000 ! spec=HCH, no=2230, id=5217, vol=4.990000e+06
or (resid 71 and name HG1) (resid 32 and name HD2)
assign (resid 71 and name HB2) (resid 71 and name HG1) 2.799 0.979 0.979 weight 1.000 ! spec=HCH, no=2231, id=5218, vol=2.670000e+07
or (resid 71 and name HG1) (resid 71 and name HB1)
assign (resid 71 and name HG1) (resid 32 and name HE1) 3.390 1.436 1.436 weight 1.000 ! spec=HCH, no=2232, id=5219, vol=8.460000e+06
or (resid 71 and name HG1) (resid 32 and name HE2)
assign (resid 66 and name HG11) (resid 71 and name HG2) 3.750 1.758 1.758 weight 1.000 ! spec=HCH, no=2234, id=5221, vol=4.610000e+06
assign (resid 71 and name HG1) (resid 66 and name HG11) 3.898 1.899 1.899 weight 1.000 ! spec=HCH, no=2235, id=5222, vol=3.660000e+06
assign (resid 71 and name HG2) (resid 66 and name HG22) 3.278 1.344 1.344 weight 1.000 ! spec=HCH, no=2236, id=5223, vol=1.030000e+07
or (resid 71 and name HG2) (resid 66 and name HG21)
or (resid 71 and name HG2) (resid 66 and name HG23)
assign (resid 71 and name HG2) (resid 71 and name HN) 3.619 1.638 1.638 weight 1.000 ! spec=HCH, no=2238, id=5225, vol=5.700000e+06
assign (resid 71 and name HG1) (resid 71 and name HN) 3.642 1.658 1.658 weight 1.000 ! spec=HCH, no=2239, id=5226, vol=5.490000e+06
assign (resid 71 and name HA) (resid 71 and name HG2) 3.226 1.301 1.301 weight 1.000 ! spec=HCH, no=2240, id=5227, vol=1.140000e+07
assign (resid 71 and name HG2) (resid 71 and name HG1) 2.507 0.786 0.786 weight 1.000 ! spec=HCH, no=2242, id=5229, vol=5.160000e+07
assign (resid 72 and name HA) (resid 72 and name HB2) 2.629 0.864 0.864 weight 1.000 ! spec=HCH, no=2249, id=5235, vol=3.890000e+07
assign (resid 72 and name HA) (resid 75 and name HG11) 2.881 1.038 1.038 weight 1.000 ! spec=HCH, no=2251, id=5237, vol=2.240000e+07
assign (resid 72 and name HA) (resid 66 and name HG12) 2.853 1.018 1.018 weight 1.000 ! spec=HCH, no=2254, id=5240, vol=2.380000e+07
assign (resid 72 and name HA) (resid 66 and name HG11) 3.251 1.321 1.321 weight 1.000 ! spec=HCH, no=2255, id=5241, vol=1.090000e+07
assign (resid 72 and name HA) (resid 72 and name HB1) 2.847 1.013 1.013 weight 1.000 ! spec=HCH, no=2257, id=5243, vol=2.410000e+07
assign (resid 72 and name HD22) (resid 72 and name HA) 3.525 1.553 1.553 weight 1.000 ! spec=HCH, no=2258, id=5244, vol=6.680000e+06
assign (resid 73 and name HN) (resid 72 and name HA) 3.252 1.322 1.322 weight 1.000 ! spec=HCH, no=2259, id=5245, vol=1.080000e+07
assign (resid 72 and name HA) (resid 75 and name HN) 2.968 1.101 1.101 weight 1.000 ! spec=HCH, no=2260, id=5246, vol=1.880000e+07
assign (resid 72 and name HB2) (resid 73 and name HB2) 3.414 1.457 1.457 weight 1.000 ! spec=HCH, no=2264, id=5250, vol=8.100000e+06
or (resid 72 and name HB2) (resid 73 and name HB1)
or (resid 72 and name HB2) (resid 73 and name HB3)
assign (resid 72 and name HB2) (resid 113 and name HA) 3.802 1.807 1.807 weight 1.000 ! spec=HCH, no=2265, id=5251, vol=4.250000e+06
assign (resid 72 and name HB1) (resid 76 and name HD12) 3.821 1.825 1.825 weight 1.000 ! spec=HCH, no=2269, id=5255, vol=4.120000e+06
or (resid 72 and name HB1) (resid 76 and name HD11)
or (resid 72 and name HB1) (resid 76 and name HD13)
assign (resid 72 and name HB1) (resid 69 and name HB1) 3.872 1.874 1.874 weight 1.000 ! spec=HCH, no=2270, id=5256, vol=3.810000e+06
assign (resid 72 and name HB1) (resid 72 and name HB2) 2.483 0.771 0.771 weight 1.000 ! spec=HCH, no=2277, id=5263, vol=5.470000e+07
assign (resid 72 and name HD21) (resid 72 and name HB2) 3.078 1.184 1.184 weight 1.000 ! spec=HCH, no=2279, id=5264, vol=1.510000e+07
assign (resid 72 and name HD22) (resid 72 and name HB2) 3.380 1.428 1.428 weight 1.000 ! spec=HCH, no=2281, id=5266, vol=8.600000e+06
assign (resid 72 and name HB1) (resid 112 and name HD1) 3.476 1.511 1.511 weight 1.000 ! spec=HCH, no=2287, id=5272, vol=7.260000e+06
assign (resid 72 and name HB2) (resid 112 and name HE1) 3.448 1.486 1.486 weight 1.000 ! spec=HCH, no=2288, id=5273, vol=7.630000e+06
assign (resid 72 and name HB1) (resid 112 and name HE1) 3.519 1.548 1.548 weight 1.000 ! spec=HCH, no=2289, id=5274, vol=6.760000e+06
assign (resid 77 and name HN) (resid 73 and name HA) 3.268 1.335 1.335 weight 1.000 ! spec=HCH, no=2292, id=5277, vol=1.050000e+07
assign (resid 73 and name HB2) (resid 114 and name HE1) 3.869 1.871 1.871 weight 1.000 ! spec=HCH, no=2306, id=5290, vol=3.820000e+06
or (resid 73 and name HB1) (resid 114 and name HE1)
or (resid 73 and name HB3) (resid 114 and name HE1)
assign (resid 74 and name HN) (resid 73 and name HB2) 2.334 0.681 0.681 weight 1.000 ! spec=HCH, no=2310, id=5294, vol=7.930000e+07
or (resid 74 and name HN) (resid 73 and name HB1)
or (resid 74 and name HN) (resid 73 and name HB3)
assign (resid 72 and name HB1) (resid 73 and name HB2) 3.041 1.156 1.156 weight 1.000 ! spec=HCH, no=2311, id=5295, vol=1.620000e+07
or (resid 72 and name HB1) (resid 73 and name HB1)
or (resid 72 and name HB1) (resid 73 and name HB3)
assign (resid 73 and name HB2) (resid 76 and name HB1) 2.742 0.940 0.940 weight 1.000 ! spec=HCH, no=2314, id=5298, vol=3.020000e+07
or (resid 73 and name HB1) (resid 76 and name HB1)
or (resid 73 and name HB3) (resid 76 and name HB1)
assign (resid 73 and name HB2) (resid 72 and name HD22) 3.499 1.531 1.531 weight 1.000 ! spec=HCH, no=2318, id=5301, vol=6.990000e+06
or (resid 73 and name HB1) (resid 72 and name HD22)
or (resid 73 and name HB3) (resid 72 and name HD22)
assign (resid 73 and name HN) (resid 73 and name HB2) 2.037 0.519 0.519 weight 1.000 ! spec=HCH, no=2325, id=5308, vol=1.800000e+08
or (resid 73 and name HN) (resid 73 and name HB1)
or (resid 73 and name HN) (resid 73 and name HB3)
assign (resid 73 and name HA) (resid 73 and name HB2) 1.857 0.431 0.431 weight 1.000 ! spec=HCH, no=2326, id=5309, vol=3.120000e+08
or (resid 73 and name HA) (resid 73 and name HB1)
or (resid 73 and name HA) (resid 73 and name HB3)
assign (resid 73 and name HB2) (resid 73 and name HB1) 1.224 0.187 0.187 weight 1.000 ! spec=HCH, no=2327, id=5310, vol=3.820000e+09
or (resid 73 and name HB2) (resid 73 and name HB3)
or (resid 73 and name HB2) (resid 73 and name HB1)
or (resid 73 and name HB1) (resid 73 and name HB3)
or (resid 73 and name HB2) (resid 73 and name HB3)
or (resid 73 and name HB1) (resid 73 and name HB3)
assign (resid 74 and name HA) (resid 32 and name HE1) 3.406 1.450 1.450 weight 1.000 ! spec=HCH, no=2328, id=5311, vol=8.210000e+06
or (resid 74 and name HA) (resid 32 and name HE2)
assign (resid 74 and name HA) (resid 78 and name HN) 3.385 1.432 1.432 weight 1.000 ! spec=HCH, no=2331, id=5314, vol=8.530000e+06
assign (resid 76 and name HN) (resid 74 and name HA) 3.451 1.489 1.489 weight 1.000 ! spec=HCH, no=2334, id=5317, vol=7.590000e+06
assign (resid 74 and name HA) (resid 74 and name HB2) 2.269 0.643 0.643 weight 1.000 ! spec=HCH, no=2339, id=5321, vol=9.400000e+07
assign (resid 74 and name HA) (resid 74 and name HB1) 2.222 0.617 0.617 weight 1.000 ! spec=HCH, no=2340, id=5322, vol=1.070000e+08
assign (resid 75 and name HN) (resid 74 and name HA) 2.555 0.816 0.816 weight 1.000 ! spec=HCH, no=2342, id=5324, vol=4.610000e+07
assign (resid 71 and name HA) (resid 74 and name HB2) 3.171 1.257 1.257 weight 1.000 ! spec=HCH, no=2349, id=5331, vol=1.260000e+07
assign (resid 74 and name HB1) (resid 71 and name HA) 3.132 1.226 1.226 weight 1.000 ! spec=HCH, no=2352, id=5334, vol=1.360000e+07
assign (resid 74 and name HB1) (resid 73 and name HN) 3.729 1.738 1.738 weight 1.000 ! spec=HCH, no=2356, id=5338, vol=4.770000e+06
assign (resid 73 and name HB2) (resid 74 and name HB2) 3.735 1.744 1.744 weight 1.000 ! spec=HCH, no=2357, id=5339, vol=4.720000e+06
or (resid 73 and name HB1) (resid 74 and name HB2)
or (resid 73 and name HB3) (resid 74 and name HB2)
assign (resid 74 and name HB1) (resid 73 and name HB2) 3.521 1.550 1.550 weight 1.000 ! spec=HCH, no=2358, id=5340, vol=6.730000e+06
or (resid 74 and name HB1) (resid 73 and name HB1)
or (resid 74 and name HB1) (resid 73 and name HB3)
assign (resid 75 and name HA) (resid 83 and name HZ3) 3.380 1.428 1.428 weight 1.000 ! spec=HCH, no=2364, id=5346, vol=8.600000e+06
assign (resid 75 and name HA) (resid 76 and name HA) 3.965 1.965 1.965 weight 1.000 ! spec=HCH, no=2367, id=5349, vol=3.300000e+06
assign (resid 75 and name HA) (resid 78 and name HG21) 3.501 1.532 1.532 weight 1.000 ! spec=HCH, no=2368, id=5350, vol=6.970000e+06
or (resid 75 and name HA) (resid 78 and name HG22)
or (resid 75 and name HA) (resid 78 and name HG23)
assign (resid 75 and name HA) (resid 79 and name HN) 3.252 1.322 1.322 weight 1.000 ! spec=HCH, no=2369, id=5351, vol=1.080000e+07
assign (resid 75 and name HA) (resid 75 and name HB) 2.927 1.071 1.071 weight 1.000 ! spec=HCH, no=2371, id=5353, vol=2.040000e+07
assign (resid 75 and name HA) (resid 75 and name HG12) 2.896 1.048 1.048 weight 1.000 ! spec=HCH, no=2372, id=5354, vol=2.170000e+07
assign (resid 75 and name HA) (resid 75 and name HG11) 2.913 1.061 1.061 weight 1.000 ! spec=HCH, no=2373, id=5355, vol=2.100000e+07
assign (resid 75 and name HA) (resid 76 and name HD12) 3.547 1.573 1.573 weight 1.000 ! spec=HCH, no=2375, id=5357, vol=6.440000e+06
or (resid 75 and name HA) (resid 76 and name HD11)
or (resid 75 and name HA) (resid 76 and name HD13)
assign (resid 75 and name HA) (resid 79 and name HD22) 2.464 0.759 0.759 weight 1.000 ! spec=HCH, no=2377, id=5359, vol=5.730000e+07
or (resid 75 and name HA) (resid 79 and name HD21)
or (resid 75 and name HA) (resid 79 and name HD23)
assign (resid 75 and name HA) (resid 152 and name HD22) 2.756 0.949 0.949 weight 1.000 ! spec=HCH, no=2379, id=5361, vol=2.930000e+07
or (resid 75 and name HA) (resid 152 and name HD21)
or (resid 75 and name HA) (resid 152 and name HD23)
assign (resid 75 and name HB) (resid 76 and name HD12) 3.237 1.310 1.310 weight 1.000 ! spec=HCH, no=2381, id=5363, vol=1.110000e+07
or (resid 75 and name HB) (resid 76 and name HD11)
or (resid 75 and name HB) (resid 76 and name HD13)
assign (resid 75 and name HB) (resid 78 and name HB) 4.069 2.070 2.070 weight 1.000 ! spec=HCH, no=2382, id=5364, vol=2.820000e+06
assign (resid 75 and name HB) (resid 74 and name HD1) 3.681 1.694 1.694 weight 1.000 ! spec=HCH, no=2386, id=5368, vol=5.150000e+06
assign (resid 75 and name HB) (resid 76 and name HA) 4.033 2.033 2.033 weight 1.000 ! spec=HCH, no=2392, id=5373, vol=2.980000e+06
assign (resid 75 and name HD12) (resid 75 and name HB) 2.416 0.730 0.730 weight 1.000 ! spec=HCH, no=2394, id=5375, vol=6.450000e+07
or (resid 75 and name HD11) (resid 75 and name HB)
or (resid 75 and name HD13) (resid 75 and name HB)
assign (resid 75 and name HD12) (resid 37 and name HB2) 3.368 1.418 1.418 weight 1.000 ! spec=HCH, no=2399, id=5380, vol=8.790000e+06
or (resid 75 and name HD11) (resid 37 and name HB2)
or (resid 75 and name HD13) (resid 37 and name HB2)
assign (resid 71 and name HG1) (resid 75 and name HD12) 2.832 1.003 1.003 weight 1.000 ! spec=HCH, no=2401, id=5382, vol=2.490000e+07
or (resid 71 and name HG1) (resid 75 and name HD11)
or (resid 71 and name HG1) (resid 75 and name HD13)
assign (resid 75 and name HD12) (resid 74 and name HE1) 2.949 1.087 1.087 weight 1.000 ! spec=HCH, no=2405, id=5386, vol=1.950000e+07
or (resid 75 and name HD11) (resid 74 and name HE1)
or (resid 75 and name HD13) (resid 74 and name HE1)
assign (resid 75 and name HD12) (resid 74 and name HD1) 2.836 1.005 1.005 weight 1.000 ! spec=HCH, no=2406, id=5387, vol=2.460000e+07
or (resid 75 and name HD11) (resid 74 and name HD1)
or (resid 75 and name HD13) (resid 74 and name HD1)
assign (resid 75 and name HN) (resid 75 and name HD12) 2.797 0.978 0.978 weight 1.000 ! spec=HCH, no=2407, id=5388, vol=2.680000e+07
or (resid 75 and name HN) (resid 75 and name HD11)
or (resid 75 and name HN) (resid 75 and name HD13)
assign (resid 75 and name HD12) (resid 75 and name HA) 2.491 0.775 0.775 weight 1.000 ! spec=HCH, no=2408, id=5389, vol=5.370000e+07
or (resid 75 and name HD11) (resid 75 and name HA)
or (resid 75 and name HD13) (resid 75 and name HA)
assign (resid 75 and name HD12) (resid 75 and name HG11) 2.244 0.629 0.629 weight 1.000 ! spec=HCH, no=2409, id=5390, vol=1.000000e+08
or (resid 75 and name HD11) (resid 75 and name HG11)
or (resid 75 and name HD13) (resid 75 and name HG11)
assign (resid 75 and name HG12) (resid 72 and name HA) 3.700 1.711 1.711 weight 1.000 ! spec=HCH, no=2411, id=5392, vol=5.000000e+06
assign (resid 75 and name HG12) (resid 74 and name HB1) 3.532 1.559 1.559 weight 1.000 ! spec=HCH, no=2415, id=5396, vol=6.610000e+06
assign (resid 75 and name HG11) (resid 71 and name HG2) 3.340 1.394 1.394 weight 1.000 ! spec=HCH, no=2416, id=5397, vol=9.240000e+06
assign (resid 75 and name HB) (resid 75 and name HG11) 2.744 0.941 0.941 weight 1.000 ! spec=HCH, no=2417, id=5398, vol=3.000000e+07
assign (resid 75 and name HB) (resid 75 and name HG12) 2.934 1.076 1.076 weight 1.000 ! spec=HCH, no=2423, id=5404, vol=2.010000e+07
assign (resid 75 and name HG12) (resid 75 and name HG11) 2.391 0.715 0.715 weight 1.000 ! spec=HCH, no=2424, id=5405, vol=6.860000e+07
assign (resid 75 and name HG11) (resid 76 and name HN) 3.660 1.675 1.675 weight 1.000 ! spec=HCH, no=2426, id=5407, vol=5.330000e+06
assign (resid 75 and name HG22) (resid 78 and name HG21) 3.428 1.469 1.469 weight 1.000 ! spec=HCH, no=2428, id=5408, vol=7.900000e+06
or (resid 75 and name HG22) (resid 78 and name HG22)
or (resid 75 and name HG22) (resid 78 and name HG23)
or (resid 75 and name HG21) (resid 78 and name HG21)
or (resid 75 and name HG21) (resid 78 and name HG22)
or (resid 75 and name HG21) (resid 78 and name HG23)
or (resid 75 and name HG23) (resid 78 and name HG21)
or (resid 75 and name HG23) (resid 78 and name HG22)
or (resid 75 and name HG23) (resid 78 and name HG23)
assign (resid 75 and name HG22) (resid 152 and name HA) 4.099 2.100 2.100 weight 1.000 ! spec=HCH, no=2434, id=5413, vol=2.700000e+06
or (resid 75 and name HG21) (resid 152 and name HA)
or (resid 75 and name HG23) (resid 152 and name HA)
assign (resid 75 and name HB) (resid 75 and name HG22) 2.195 0.602 0.602 weight 1.000 ! spec=HCH, no=2438, id=5416, vol=1.150000e+08
or (resid 75 and name HB) (resid 75 and name HG21)
or (resid 75 and name HB) (resid 75 and name HG23)
assign (resid 75 and name HG22) (resid 79 and name HN) 3.138 1.231 1.231 weight 1.000 ! spec=HCH, no=2441, id=5419, vol=1.340000e+07
or (resid 75 and name HG21) (resid 79 and name HN)
or (resid 75 and name HG23) (resid 79 and name HN)
assign (resid 75 and name HG22) (resid 83 and name HZ3) 3.067 1.176 1.176 weight 1.000 ! spec=HCH, no=2444, id=5422, vol=1.540000e+07
or (resid 75 and name HG21) (resid 83 and name HZ3)
or (resid 75 and name HG23) (resid 83 and name HZ3)
assign (resid 75 and name HG22) (resid 71 and name HG1) 3.917 1.918 1.918 weight 1.000 ! spec=HCH, no=2445, id=5423, vol=3.550000e+06
or (resid 75 and name HG21) (resid 71 and name HG1)
or (resid 75 and name HG23) (resid 71 and name HG1)
assign (resid 75 and name HG22) (resid 78 and name HN) 3.425 1.467 1.467 weight 1.000 ! spec=HCH, no=2447, id=5425, vol=7.940000e+06
or (resid 75 and name HG21) (resid 78 and name HN)
or (resid 75 and name HG23) (resid 78 and name HN)
assign (resid 75 and name HG22) (resid 78 and name HB) 3.233 1.307 1.307 weight 1.000 ! spec=HCH, no=2449, id=5427, vol=1.120000e+07
or (resid 75 and name HG21) (resid 78 and name HB)
or (resid 75 and name HG23) (resid 78 and name HB)
assign (resid 75 and name HG22) (resid 65 and name HN) 3.971 1.971 1.971 weight 1.000 ! spec=HCH, no=2455, id=5433, vol=3.270000e+06
or (resid 75 and name HG21) (resid 65 and name HN)
or (resid 75 and name HG23) (resid 65 and name HN)
assign (resid 75 and name HG22) (resid 74 and name HD1) 3.389 1.436 1.436 weight 1.000 ! spec=HCH, no=2458, id=5436, vol=8.460000e+06
or (resid 75 and name HG21) (resid 74 and name HD1)
or (resid 75 and name HG23) (resid 74 and name HD1)
assign (resid 75 and name HN) (resid 75 and name HG22) 2.706 0.915 0.915 weight 1.000 ! spec=HCH, no=2459, id=5437, vol=3.260000e+07
or (resid 75 and name HN) (resid 75 and name HG21)
or (resid 75 and name HN) (resid 75 and name HG23)
assign (resid 75 and name HG22) (resid 75 and name HA) 2.381 0.709 0.709 weight 1.000 ! spec=HCH, no=2460, id=5438, vol=7.030000e+07
or (resid 75 and name HG21) (resid 75 and name HA)
or (resid 75 and name HG23) (resid 75 and name HA)
assign (resid 75 and name HG22) (resid 75 and name HG11) 2.449 0.749 0.749 weight 1.000 ! spec=HCH, no=2461, id=5439, vol=5.950000e+07
or (resid 75 and name HG21) (resid 75 and name HG11)
or (resid 75 and name HG23) (resid 75 and name HG11)
assign (resid 75 and name HG22) (resid 75 and name HG21) 1.304 0.212 0.212 weight 1.000 ! spec=HCH, no=2462, id=5440, vol=2.610000e+09
or (resid 75 and name HG22) (resid 75 and name HG23)
or (resid 75 and name HG22) (resid 75 and name HG21)
or (resid 75 and name HG21) (resid 75 and name HG23)
or (resid 75 and name HG22) (resid 75 and name HG23)
or (resid 75 and name HG21) (resid 75 and name HG23)
assign (resid 75 and name HG22) (resid 76 and name HN) 2.790 0.973 0.973 weight 1.000 ! spec=HCH, no=2463, id=5441, vol=2.720000e+07
or (resid 75 and name HG21) (resid 76 and name HN)
or (resid 75 and name HG23) (resid 76 and name HN)
assign (resid 75 and name HG22) (resid 76 and name HA) 2.956 1.092 1.092 weight 1.000 ! spec=HCH, no=2464, id=5442, vol=1.920000e+07
or (resid 75 and name HG21) (resid 76 and name HA)
or (resid 75 and name HG23) (resid 76 and name HA)
assign (resid 76 and name HA) (resid 76 and name HB2) 2.565 0.822 0.822 weight 1.000 ! spec=HCH, no=2466, id=5444, vol=4.500000e+07
assign (resid 79 and name HN) (resid 76 and name HA) 3.165 1.252 1.252 weight 1.000 ! spec=HCH, no=2467, id=5445, vol=1.280000e+07
assign (resid 78 and name HN) (resid 76 and name HA) 3.378 1.426 1.426 weight 1.000 ! spec=HCH, no=2468, id=5446, vol=8.630000e+06
assign (resid 76 and name HA) (resid 76 and name HG) 2.504 0.784 0.784 weight 1.000 ! spec=HCH, no=2471, id=5448, vol=5.200000e+07
assign (resid 76 and name HB2) (resid 73 and name HA) 2.970 1.102 1.102 weight 1.000 ! spec=HCH, no=2477, id=5454, vol=1.870000e+07
assign (resid 76 and name HB1) (resid 73 and name HA) 2.867 1.027 1.027 weight 1.000 ! spec=HCH, no=2480, id=5457, vol=2.310000e+07
assign (resid 76 and name HN) (resid 76 and name HB2) 2.818 0.993 0.993 weight 1.000 ! spec=HCH, no=2481, id=5458, vol=2.560000e+07
assign (resid 76 and name HB1) (resid 76 and name HA) 2.844 1.011 1.011 weight 1.000 ! spec=HCH, no=2484, id=5461, vol=2.420000e+07
assign (resid 76 and name HB1) (resid 76 and name HB2) 2.128 0.566 0.566 weight 1.000 ! spec=HCH, no=2487, id=5463, vol=1.380000e+08
assign (resid 76 and name HB2) (resid 76 and name HD12) 2.554 0.815 0.815 weight 1.000 ! spec=HCH, no=2488, id=5464, vol=4.620000e+07
or (resid 76 and name HB2) (resid 76 and name HD11)
or (resid 76 and name HB2) (resid 76 and name HD13)
assign (resid 76 and name HB1) (resid 76 and name HD12) 2.644 0.874 0.874 weight 1.000 ! spec=HCH, no=2489, id=5465, vol=3.750000e+07
or (resid 76 and name HB1) (resid 76 and name HD11)
or (resid 76 and name HB1) (resid 76 and name HD13)
assign (resid 76 and name HB2) (resid 133 and name HA) 3.483 1.516 1.516 weight 1.000 ! spec=HCH, no=2492, id=5468, vol=7.180000e+06
assign (resid 76 and name HD12) (resid 72 and name HD21) 2.896 1.049 1.049 weight 1.000 ! spec=HCH, no=2504, id=5477, vol=2.170000e+07
or (resid 76 and name HD11) (resid 72 and name HD21)
or (resid 76 and name HD13) (resid 72 and name HD21)
assign (resid 76 and name HD12) (resid 138 and name HE1) 3.674 1.688 1.688 weight 1.000 ! spec=HCH, no=2507, id=5480, vol=5.210000e+06
or (resid 76 and name HD11) (resid 138 and name HE1)
or (resid 76 and name HD13) (resid 138 and name HE1)
assign (resid 76 and name HD12) (resid 72 and name HD22) 3.130 1.225 1.225 weight 1.000 ! spec=HCH, no=2508, id=5481, vol=1.360000e+07
or (resid 76 and name HD11) (resid 72 and name HD22)
or (resid 76 and name HD13) (resid 72 and name HD22)
assign (resid 76 and name HA) (resid 76 and name HD12) 2.210 0.610 0.610 weight 1.000 ! spec=HCH, no=2512, id=5484, vol=1.100000e+08
or (resid 76 and name HA) (resid 76 and name HD11)
or (resid 76 and name HA) (resid 76 and name HD13)
assign (resid 76 and name HD12) (resid 76 and name HN) 2.801 0.981 0.981 weight 1.000 ! spec=HCH, no=2517, id=5488, vol=2.650000e+07
or (resid 76 and name HD11) (resid 76 and name HN)
or (resid 76 and name HD13) (resid 76 and name HN)
assign (resid 76 and name HD12) (resid 76 and name HG) 2.105 0.554 0.554 weight 1.000 ! spec=HCH, no=2519, id=5490, vol=1.470000e+08
or (resid 76 and name HD11) (resid 76 and name HG)
or (resid 76 and name HD13) (resid 76 and name HG)
assign (resid 76 and name HD12) (resid 76 and name HD11) 1.139 0.162 0.162 weight 1.000 ! spec=HCH, no=2520, id=5491, vol=5.860000e+09
or (resid 76 and name HD12) (resid 76 and name HD13)
or (resid 76 and name HD12) (resid 76 and name HD11)
or (resid 76 and name HD11) (resid 76 and name HD13)
or (resid 76 and name HD12) (resid 76 and name HD13)
or (resid 76 and name HD11) (resid 76 and name HD13)
assign (resid 76 and name HD12) (resid 89 and name HN) 3.728 1.738 1.738 weight 1.000 ! spec=HCH, no=2521, id=5492, vol=4.770000e+06
or (resid 76 and name HD11) (resid 89 and name HN)
or (resid 76 and name HD13) (resid 89 and name HN)
assign (resid 76 and name HD12) (resid 131 and name HG) 2.365 0.699 0.699 weight 1.000 ! spec=HCH, no=2522, id=5493, vol=7.320000e+07
or (resid 76 and name HD11) (resid 131 and name HG)
or (resid 76 and name HD13) (resid 131 and name HG)
assign (resid 76 and name HD12) (resid 131 and name HD22) 2.068 0.535 0.535 weight 1.000 ! spec=HCH, no=2523, id=5494, vol=1.640000e+08
or (resid 76 and name HD12) (resid 131 and name HD21)
or (resid 76 and name HD12) (resid 131 and name HD23)
or (resid 76 and name HD11) (resid 131 and name HD22)
or (resid 76 and name HD11) (resid 131 and name HD21)
or (resid 76 and name HD11) (resid 131 and name HD23)
or (resid 76 and name HD13) (resid 131 and name HD22)
or (resid 76 and name HD13) (resid 131 and name HD21)
or (resid 76 and name HD13) (resid 131 and name HD23)
assign (resid 76 and name HD12) (resid 132 and name HN) 3.481 1.515 1.515 weight 1.000 ! spec=HCH, no=2524, id=5495, vol=7.200000e+06
or (resid 76 and name HD11) (resid 132 and name HN)
or (resid 76 and name HD13) (resid 132 and name HN)
assign (resid 76 and name HD12) (resid 133 and name HN) 3.151 1.241 1.241 weight 1.000 ! spec=HCH, no=2525, id=5496, vol=1.310000e+07
or (resid 76 and name HD11) (resid 133 and name HN)
or (resid 76 and name HD13) (resid 133 and name HN)
assign (resid 76 and name HD12) (resid 133 and name HA) 2.103 0.553 0.553 weight 1.000 ! spec=HCH, no=2526, id=5497, vol=1.480000e+08
or (resid 76 and name HD11) (resid 133 and name HA)
or (resid 76 and name HD13) (resid 133 and name HA)
assign (resid 76 and name HD12) (resid 136 and name HA2) 2.107 0.555 0.555 weight 1.000 ! spec=HCH, no=2528, id=5499, vol=1.460000e+08
or (resid 76 and name HD11) (resid 136 and name HA2)
or (resid 76 and name HD13) (resid 136 and name HA2)
assign (resid 76 and name HD12) (resid 136 and name HA1) 2.437 0.742 0.742 weight 1.000 ! spec=HCH, no=2529, id=5500, vol=6.120000e+07
or (resid 76 and name HD11) (resid 136 and name HA1)
or (resid 76 and name HD13) (resid 136 and name HA1)
assign (resid 76 and name HD12) (resid 137 and name HN) 3.423 1.465 1.465 weight 1.000 ! spec=HCH, no=2530, id=5501, vol=7.970000e+06
or (resid 76 and name HD11) (resid 137 and name HN)
or (resid 76 and name HD13) (resid 137 and name HN)
assign (resid 76 and name HD12) (resid 138 and name HZ2) 3.959 1.959 1.959 weight 1.000 ! spec=HCH, no=2532, id=5503, vol=3.330000e+06
or (resid 76 and name HD11) (resid 138 and name HZ2)
or (resid 76 and name HD13) (resid 138 and name HZ2)
assign (resid 76 and name HD22) (resid 72 and name HD21) 2.636 0.869 0.869 weight 1.000 ! spec=HCH, no=2535, id=5506, vol=3.820000e+07
or (resid 76 and name HD21) (resid 72 and name HD21)
or (resid 76 and name HD23) (resid 72 and name HD21)
assign (resid 73 and name HA) (resid 76 and name HD22) 2.483 0.771 0.771 weight 1.000 ! spec=HCH, no=2536, id=5507, vol=5.470000e+07
or (resid 73 and name HA) (resid 76 and name HD21)
or (resid 73 and name HA) (resid 76 and name HD23)
assign (resid 76 and name HD22) (resid 72 and name HD22) 2.774 0.962 0.962 weight 1.000 ! spec=HCH, no=2538, id=5509, vol=2.820000e+07
or (resid 76 and name HD21) (resid 72 and name HD22)
or (resid 76 and name HD23) (resid 72 and name HD22)
assign (resid 76 and name HD22) (resid 133 and name HN) 3.428 1.469 1.469 weight 1.000 ! spec=HCH, no=2540, id=5510, vol=7.900000e+06
or (resid 76 and name HD21) (resid 133 and name HN)
or (resid 76 and name HD23) (resid 133 and name HN)
assign (resid 73 and name HN) (resid 76 and name HD22) 3.575 1.598 1.598 weight 1.000 ! spec=HCH, no=2541, id=5511, vol=6.140000e+06
or (resid 73 and name HN) (resid 76 and name HD21)
or (resid 73 and name HN) (resid 76 and name HD23)
assign (resid 76 and name HD22) (resid 76 and name HB2) 2.308 0.666 0.666 weight 1.000 ! spec=HCH, no=2544, id=5514, vol=8.490000e+07
or (resid 76 and name HD21) (resid 76 and name HB2)
or (resid 76 and name HD23) (resid 76 and name HB2)
assign (resid 135 and name HN) (resid 76 and name HD22) 3.359 1.410 1.410 weight 1.000 ! spec=HCH, no=2547, id=5516, vol=8.930000e+06
or (resid 135 and name HN) (resid 76 and name HD21)
or (resid 135 and name HN) (resid 76 and name HD23)
assign (resid 76 and name HD22) (resid 72 and name HB1) 3.613 1.632 1.632 weight 1.000 ! spec=HCH, no=2548, id=5517, vol=5.770000e+06
or (resid 76 and name HD21) (resid 72 and name HB1)
or (resid 76 and name HD23) (resid 72 and name HB1)
assign (resid 76 and name HD22) (resid 76 and name HA) 2.688 0.903 0.903 weight 1.000 ! spec=HCH, no=2553, id=5521, vol=3.400000e+07
or (resid 76 and name HD21) (resid 76 and name HA)
or (resid 76 and name HD23) (resid 76 and name HA)
assign (resid 76 and name HD22) (resid 76 and name HB1) 2.202 0.606 0.606 weight 1.000 ! spec=HCH, no=2554, id=5522, vol=1.130000e+08
or (resid 76 and name HD21) (resid 76 and name HB1)
or (resid 76 and name HD23) (resid 76 and name HB1)
assign (resid 76 and name HD22) (resid 76 and name HG) 2.222 0.617 0.617 weight 1.000 ! spec=HCH, no=2555, id=5523, vol=1.060000e+08
or (resid 76 and name HD21) (resid 76 and name HG)
or (resid 76 and name HD23) (resid 76 and name HG)
assign (resid 76 and name HD22) (resid 76 and name HD21) 1.216 0.185 0.185 weight 1.000 ! spec=HCH, no=2556, id=5524, vol=3.970000e+09
or (resid 76 and name HD22) (resid 76 and name HD23)
or (resid 76 and name HD22) (resid 76 and name HD21)
or (resid 76 and name HD21) (resid 76 and name HD23)
or (resid 76 and name HD22) (resid 76 and name HD23)
or (resid 76 and name HD21) (resid 76 and name HD23)
assign (resid 76 and name HD22) (resid 132 and name HN) 4.071 2.072 2.072 weight 1.000 ! spec=HCH, no=2557, id=5525, vol=2.820000e+06
or (resid 76 and name HD21) (resid 132 and name HN)
or (resid 76 and name HD23) (resid 132 and name HN)
assign (resid 76 and name HD22) (resid 135 and name HA) 3.674 1.687 1.687 weight 1.000 ! spec=HCH, no=2560, id=5528, vol=5.210000e+06
or (resid 76 and name HD21) (resid 135 and name HA)
or (resid 76 and name HD23) (resid 135 and name HA)
assign (resid 76 and name HD22) (resid 136 and name HA2) 2.312 0.668 0.668 weight 1.000 ! spec=HCH, no=2562, id=5530, vol=8.390000e+07
or (resid 76 and name HD21) (resid 136 and name HA2)
or (resid 76 and name HD23) (resid 136 and name HA2)
assign (resid 76 and name HD22) (resid 136 and name HA1) 2.433 0.740 0.740 weight 1.000 ! spec=HCH, no=2563, id=5531, vol=6.190000e+07
or (resid 76 and name HD21) (resid 136 and name HA1)
or (resid 76 and name HD23) (resid 136 and name HA1)
assign (resid 76 and name HG) (resid 72 and name HD22) 3.871 1.873 1.873 weight 1.000 ! spec=HCH, no=2566, id=5534, vol=3.810000e+06
assign (resid 76 and name HG) (resid 76 and name HB2) 2.673 0.893 0.893 weight 1.000 ! spec=HCH, no=2569, id=5537, vol=3.520000e+07
assign (resid 76 and name HG) (resid 77 and name HN) 3.426 1.468 1.468 weight 1.000 ! spec=HCH, no=2570, id=5538, vol=7.920000e+06
assign (resid 76 and name HG) (resid 131 and name HD22) 3.015 1.136 1.136 weight 1.000 ! spec=HCH, no=2572, id=5540, vol=1.710000e+07
or (resid 76 and name HG) (resid 131 and name HD21)
or (resid 76 and name HG) (resid 131 and name HD23)
assign (resid 77 and name HA) (resid 80 and name HB2) 2.490 0.775 0.775 weight 1.000 ! spec=HCH, no=2573, id=5541, vol=5.380000e+07
assign (resid 77 and name HA) (resid 81 and name HN) 3.333 1.389 1.389 weight 1.000 ! spec=HCH, no=2576, id=5544, vol=9.360000e+06
assign (resid 77 and name HA) (resid 80 and name HE2) 3.080 1.186 1.186 weight 1.000 ! spec=HCH, no=2579, id=5547, vol=1.500000e+07
or (resid 77 and name HA) (resid 80 and name HE1)
assign (resid 77 and name HA) (resid 76 and name HD22) 3.674 1.687 1.687 weight 1.000 ! spec=HCH, no=2581, id=5549, vol=5.220000e+06
or (resid 77 and name HA) (resid 76 and name HD21)
or (resid 77 and name HA) (resid 76 and name HD23)
assign (resid 77 and name HA) (resid 77 and name HB2) 2.463 0.759 0.759 weight 1.000 ! spec=HCH, no=2586, id=5554, vol=5.740000e+07
assign (resid 77 and name HA) (resid 77 and name HB1) 2.360 0.696 0.696 weight 1.000 ! spec=HCH, no=2587, id=5555, vol=7.430000e+07
assign (resid 78 and name HN) (resid 77 and name HA) 2.841 1.009 1.009 weight 1.000 ! spec=HCH, no=2588, id=5556, vol=2.440000e+07
assign (resid 77 and name HA) (resid 78 and name HA) 3.537 1.564 1.564 weight 1.000 ! spec=HCH, no=2589, id=5557, vol=6.550000e+06
assign (resid 80 and name HN) (resid 77 and name HA) 2.835 1.005 1.005 weight 1.000 ! spec=HCH, no=2590, id=5558, vol=2.470000e+07
assign (resid 77 and name HA) (resid 133 and name HD12) 3.692 1.704 1.704 weight 1.000 ! spec=HCH, no=2591, id=5559, vol=5.060000e+06
or (resid 77 and name HA) (resid 133 and name HD11)
or (resid 77 and name HA) (resid 133 and name HD13)
assign (resid 77 and name HB2) (resid 81 and name HB1) 3.441 1.480 1.480 weight 1.000 ! spec=HCH, no=2593, id=5561, vol=7.720000e+06
assign (resid 77 and name HB2) (resid 78 and name HA) 3.902 1.903 1.903 weight 1.000 ! spec=HCH, no=2597, id=5565, vol=3.640000e+06
assign (resid 74 and name HA) (resid 77 and name HB1) 2.864 1.026 1.026 weight 1.000 ! spec=HCH, no=2605, id=5573, vol=2.320000e+07
assign (resid 77 and name HB1) (resid 77 and name HB2) 1.956 0.478 0.478 weight 1.000 ! spec=HCH, no=2614, id=5581, vol=2.290000e+08
assign (resid 78 and name HN) (resid 77 and name HB2) 2.789 0.973 0.973 weight 1.000 ! spec=HCH, no=2615, id=5582, vol=2.720000e+07
assign (resid 78 and name HA) (resid 81 and name HG1) 3.473 1.508 1.508 weight 1.000 ! spec=HCH, no=2617, id=5584, vol=7.310000e+06
assign (resid 78 and name HA) (resid 77 and name HB1) 4.124 2.126 2.126 weight 1.000 ! spec=HCH, no=2621, id=5588, vol=2.600000e+06
assign (resid 78 and name HA) (resid 81 and name HB2) 2.812 0.989 0.989 weight 1.000 ! spec=HCH, no=2622, id=5589, vol=2.590000e+07
assign (resid 78 and name HA) (resid 78 and name HB) 2.523 0.796 0.796 weight 1.000 ! spec=HCH, no=2625, id=5591, vol=4.970000e+07
assign (resid 78 and name HA) (resid 78 and name HG21) 2.481 0.769 0.769 weight 1.000 ! spec=HCH, no=2626, id=5592, vol=5.500000e+07
or (resid 78 and name HA) (resid 78 and name HG22)
or (resid 78 and name HA) (resid 78 and name HG23)
assign (resid 82 and name HN) (resid 78 and name HA) 3.283 1.347 1.347 weight 1.000 ! spec=HCH, no=2629, id=5595, vol=1.020000e+07
assign (resid 75 and name HN) (resid 78 and name HB) 3.601 1.621 1.621 weight 1.000 ! spec=HCH, no=2632, id=5598, vol=5.880000e+06
assign (resid 30 and name HG12) (resid 78 and name HG21) 3.419 1.461 1.461 weight 1.000 ! spec=HCH, no=2639, id=5604, vol=8.030000e+06
or (resid 30 and name HG12) (resid 78 and name HG22)
or (resid 30 and name HG12) (resid 78 and name HG23)
assign (resid 78 and name HG21) (resid 79 and name HA) 3.693 1.705 1.705 weight 1.000 ! spec=HCH, no=2640, id=5605, vol=5.060000e+06
or (resid 78 and name HG22) (resid 79 and name HA)
or (resid 78 and name HG23) (resid 79 and name HA)
assign (resid 78 and name HG21) (resid 30 and name HB) 3.111 1.209 1.209 weight 1.000 ! spec=HCH, no=2641, id=5606, vol=1.420000e+07
or (resid 78 and name HG22) (resid 30 and name HB)
or (resid 78 and name HG23) (resid 30 and name HB)
assign (resid 78 and name HG21) (resid 82 and name HA) 3.852 1.855 1.855 weight 1.000 ! spec=HCH, no=2642, id=5607, vol=3.920000e+06
or (resid 78 and name HG22) (resid 82 and name HA)
or (resid 78 and name HG23) (resid 82 and name HA)
assign (resid 81 and name HN) (resid 78 and name HG21) 3.733 1.742 1.742 weight 1.000 ! spec=HCH, no=2644, id=5609, vol=4.740000e+06
or (resid 81 and name HN) (resid 78 and name HG22)
or (resid 81 and name HN) (resid 78 and name HG23)
assign (resid 78 and name HG21) (resid 37 and name HD1) 3.732 1.741 1.741 weight 1.000 ! spec=HCH, no=2649, id=5613, vol=4.750000e+06
or (resid 78 and name HG22) (resid 37 and name HD1)
or (resid 78 and name HG23) (resid 37 and name HD1)
assign (resid 78 and name HG21) (resid 74 and name HZ) 3.426 1.467 1.467 weight 1.000 ! spec=HCH, no=2651, id=5615, vol=7.930000e+06
or (resid 78 and name HG22) (resid 74 and name HZ)
or (resid 78 and name HG23) (resid 74 and name HZ)
assign (resid 78 and name HB) (resid 78 and name HG21) 2.528 0.799 0.799 weight 1.000 ! spec=HCH, no=2654, id=5618, vol=4.920000e+07
or (resid 78 and name HB) (resid 78 and name HG22)
or (resid 78 and name HB) (resid 78 and name HG23)
assign (resid 78 and name HG21) (resid 78 and name HG22) 1.549 0.300 0.300 weight 1.000 ! spec=HCH, no=2655, id=5619, vol=9.290000e+08
or (resid 78 and name HG21) (resid 78 and name HG23)
or (resid 78 and name HG21) (resid 78 and name HG22)
or (resid 78 and name HG22) (resid 78 and name HG23)
or (resid 78 and name HG21) (resid 78 and name HG23)
or (resid 78 and name HG22) (resid 78 and name HG23)
assign (resid 78 and name HG21) (resid 82 and name HB2) 2.976 1.107 1.107 weight 1.000 ! spec=HCH, no=2656, id=5620, vol=1.850000e+07
or (resid 78 and name HG22) (resid 82 and name HB2)
or (resid 78 and name HG23) (resid 82 and name HB2)
assign (resid 78 and name HG21) (resid 82 and name HB1) 2.838 1.007 1.007 weight 1.000 ! spec=HCH, no=2657, id=5621, vol=2.450000e+07
or (resid 78 and name HG22) (resid 82 and name HB1)
or (resid 78 and name HG23) (resid 82 and name HB1)
assign (resid 79 and name HA) (resid 79 and name HG) 2.923 1.068 1.068 weight 1.000 ! spec=HCH, no=2662, id=5626, vol=2.060000e+07
assign (resid 79 and name HA) (resid 79 and name HB2) 2.751 0.946 0.946 weight 1.000 ! spec=HCH, no=2665, id=5628, vol=2.960000e+07
assign (resid 79 and name HA) (resid 79 and name HB1) 2.925 1.070 1.070 weight 1.000 ! spec=HCH, no=2666, id=5629, vol=2.050000e+07
assign (resid 79 and name HA) (resid 79 and name HD22) 3.028 1.146 1.146 weight 1.000 ! spec=HCH, no=2668, id=5631, vol=1.660000e+07
or (resid 79 and name HA) (resid 79 and name HD21)
or (resid 79 and name HA) (resid 79 and name HD23)
assign (resid 83 and name HN) (resid 79 and name HA) 3.100 1.201 1.201 weight 1.000 ! spec=HCH, no=2669, id=5632, vol=1.450000e+07
assign (resid 79 and name HA) (resid 83 and name HB2) 2.557 0.817 0.817 weight 1.000 ! spec=HCH, no=2671, id=5634, vol=4.590000e+07
assign (resid 79 and name HB2) (resid 79 and name HG) 2.947 1.085 1.085 weight 1.000 ! spec=HCH, no=2672, id=5635, vol=1.960000e+07
assign (resid 79 and name HB1) (resid 81 and name HN) 3.552 1.577 1.577 weight 1.000 ! spec=HCH, no=2673, id=5636, vol=6.380000e+06
assign (resid 79 and name HB1) (resid 85 and name HA1) 3.612 1.631 1.631 weight 1.000 ! spec=HCH, no=2675, id=5638, vol=5.780000e+06
assign (resid 79 and name HB1) (resid 76 and name HA) 3.303 1.363 1.363 weight 1.000 ! spec=HCH, no=2676, id=5639, vol=9.880000e+06
assign (resid 79 and name HB1) (resid 79 and name HB2) 2.355 0.693 0.693 weight 1.000 ! spec=HCH, no=2681, id=5644, vol=7.530000e+07
assign (resid 79 and name HB1) (resid 80 and name HN) 3.287 1.351 1.351 weight 1.000 ! spec=HCH, no=2687, id=5650, vol=1.020000e+07
assign (resid 83 and name HN) (resid 79 and name HD12) 3.151 1.241 1.241 weight 1.000 ! spec=HCH, no=2691, id=5654, vol=1.310000e+07
or (resid 83 and name HN) (resid 79 and name HD11)
or (resid 83 and name HN) (resid 79 and name HD13)
assign (resid 79 and name HD12) (resid 86 and name HB1) 3.569 1.592 1.592 weight 1.000 ! spec=HCH, no=2693, id=5656, vol=6.210000e+06
or (resid 79 and name HD11) (resid 86 and name HB1)
or (resid 79 and name HD13) (resid 86 and name HB1)
assign (resid 78 and name HG21) (resid 79 and name HD12) 3.135 1.229 1.229 weight 1.000 ! spec=HCH, no=2709, id=5671, vol=1.350000e+07
or (resid 78 and name HG21) (resid 79 and name HD11)
or (resid 78 and name HG21) (resid 79 and name HD13)
or (resid 78 and name HG22) (resid 79 and name HD12)
or (resid 78 and name HG22) (resid 79 and name HD11)
or (resid 78 and name HG22) (resid 79 and name HD13)
or (resid 78 and name HG23) (resid 79 and name HD12)
or (resid 78 and name HG23) (resid 79 and name HD11)
or (resid 78 and name HG23) (resid 79 and name HD13)
assign (resid 79 and name HD12) (resid 39 and name HD1) 2.787 0.971 0.971 weight 1.000 ! spec=HCH, no=2712, id=5674, vol=2.740000e+07
or (resid 79 and name HD11) (resid 39 and name HD1)
or (resid 79 and name HD13) (resid 39 and name HD1)
assign (resid 79 and name HN) (resid 79 and name HD12) 2.852 1.017 1.017 weight 1.000 ! spec=HCH, no=2713, id=5675, vol=2.380000e+07
or (resid 79 and name HN) (resid 79 and name HD11)
or (resid 79 and name HN) (resid 79 and name HD13)
assign (resid 79 and name HA) (resid 79 and name HD12) 2.190 0.600 0.600 weight 1.000 ! spec=HCH, no=2714, id=5676, vol=1.160000e+08
or (resid 79 and name HA) (resid 79 and name HD11)
or (resid 79 and name HA) (resid 79 and name HD13)
assign (resid 79 and name HB2) (resid 79 and name HD12) 2.354 0.693 0.693 weight 1.000 ! spec=HCH, no=2715, id=5677, vol=7.530000e+07
or (resid 79 and name HB2) (resid 79 and name HD11)
or (resid 79 and name HB2) (resid 79 and name HD13)
assign (resid 79 and name HB1) (resid 79 and name HD12) 2.549 0.812 0.812 weight 1.000 ! spec=HCH, no=2716, id=5678, vol=4.680000e+07
or (resid 79 and name HB1) (resid 79 and name HD11)
or (resid 79 and name HB1) (resid 79 and name HD13)
assign (resid 79 and name HD12) (resid 79 and name HG) 2.225 0.619 0.619 weight 1.000 ! spec=HCH, no=2717, id=5679, vol=1.060000e+08
or (resid 79 and name HD11) (resid 79 and name HG)
or (resid 79 and name HD13) (resid 79 and name HG)
assign (resid 79 and name HD12) (resid 79 and name HD11) 1.303 0.212 0.212 weight 1.000 ! spec=HCH, no=2718, id=5680, vol=2.620000e+09
or (resid 79 and name HD12) (resid 79 and name HD13)
or (resid 79 and name HD12) (resid 79 and name HD11)
or (resid 79 and name HD11) (resid 79 and name HD13)
or (resid 79 and name HD12) (resid 79 and name HD13)
or (resid 79 and name HD11) (resid 79 and name HD13)
assign (resid 79 and name HD12) (resid 79 and name HD22) 1.914 0.458 0.458 weight 1.000 ! spec=HCH, no=2719, id=5681, vol=2.610000e+08
or (resid 79 and name HD12) (resid 79 and name HD21)
or (resid 79 and name HD12) (resid 79 and name HD23)
or (resid 79 and name HD11) (resid 79 and name HD22)
or (resid 79 and name HD11) (resid 79 and name HD21)
or (resid 79 and name HD11) (resid 79 and name HD23)
or (resid 79 and name HD13) (resid 79 and name HD22)
or (resid 79 and name HD13) (resid 79 and name HD21)
or (resid 79 and name HD13) (resid 79 and name HD23)
assign (resid 79 and name HD12) (resid 81 and name HN) 3.743 1.751 1.751 weight 1.000 ! spec=HCH, no=2721, id=5683, vol=4.660000e+06
or (resid 79 and name HD11) (resid 81 and name HN)
or (resid 79 and name HD13) (resid 81 and name HN)
assign (resid 79 and name HD12) (resid 83 and name HB2) 2.336 0.682 0.682 weight 1.000 ! spec=HCH, no=2722, id=5684, vol=7.890000e+07
or (resid 79 and name HD11) (resid 83 and name HB2)
or (resid 79 and name HD13) (resid 83 and name HB2)
assign (resid 79 and name HD12) (resid 86 and name HD2) 2.781 0.967 0.967 weight 1.000 ! spec=HCH, no=2725, id=5687, vol=2.770000e+07
or (resid 79 and name HD11) (resid 86 and name HD2)
or (resid 79 and name HD13) (resid 86 and name HD2)
assign (resid 79 and name HD12) (resid 89 and name HN) 4.043 2.043 2.043 weight 1.000 ! spec=HCH, no=2726, id=5688, vol=2.940000e+06
or (resid 79 and name HD11) (resid 89 and name HN)
or (resid 79 and name HD13) (resid 89 and name HN)
assign (resid 79 and name HD12) (resid 89 and name HG22) 2.458 0.755 0.755 weight 1.000 ! spec=HCH, no=2727, id=5689, vol=5.810000e+07
or (resid 79 and name HD12) (resid 89 and name HG21)
or (resid 79 and name HD12) (resid 89 and name HG23)
or (resid 79 and name HD11) (resid 89 and name HG22)
or (resid 79 and name HD11) (resid 89 and name HG21)
or (resid 79 and name HD11) (resid 89 and name HG23)
or (resid 79 and name HD13) (resid 89 and name HG22)
or (resid 79 and name HD13) (resid 89 and name HG21)
or (resid 79 and name HD13) (resid 89 and name HG23)
assign (resid 79 and name HD12) (resid 152 and name HA) 4.123 2.125 2.125 weight 1.000 ! spec=HCH, no=2728, id=5690, vol=2.610000e+06
or (resid 79 and name HD11) (resid 152 and name HA)
or (resid 79 and name HD13) (resid 152 and name HA)
assign (resid 79 and name HD22) (resid 83 and name HB2) 3.233 1.307 1.307 weight 1.000 ! spec=HCH, no=2729, id=5691, vol=1.120000e+07
or (resid 79 and name HD22) (resid 83 and name HB1)
or (resid 79 and name HD21) (resid 83 and name HB2)
or (resid 79 and name HD21) (resid 83 and name HB1)
or (resid 79 and name HD23) (resid 83 and name HB2)
or (resid 79 and name HD23) (resid 83 and name HB1)
assign (resid 79 and name HB1) (resid 79 and name HD22) 2.511 0.788 0.788 weight 1.000 ! spec=HCH, no=2730, id=5692, vol=5.110000e+07
or (resid 79 and name HB1) (resid 79 and name HD21)
or (resid 79 and name HB1) (resid 79 and name HD23)
assign (resid 79 and name HD22) (resid 83 and name HZ3) 3.607 1.627 1.627 weight 1.000 ! spec=HCH, no=2731, id=5693, vol=5.820000e+06
or (resid 79 and name HD21) (resid 83 and name HZ3)
or (resid 79 and name HD23) (resid 83 and name HZ3)
assign (resid 79 and name HD22) (resid 78 and name HG21) 3.621 1.639 1.639 weight 1.000 ! spec=HCH, no=2735, id=5697, vol=5.690000e+06
or (resid 79 and name HD22) (resid 78 and name HG22)
or (resid 79 and name HD22) (resid 78 and name HG23)
or (resid 79 and name HD21) (resid 78 and name HG21)
or (resid 79 and name HD21) (resid 78 and name HG22)
or (resid 79 and name HD21) (resid 78 and name HG23)
or (resid 79 and name HD23) (resid 78 and name HG21)
or (resid 79 and name HD23) (resid 78 and name HG22)
or (resid 79 and name HD23) (resid 78 and name HG23)
assign (resid 79 and name HD22) (resid 76 and name HA) 2.840 1.008 1.008 weight 1.000 ! spec=HCH, no=2736, id=5698, vol=2.440000e+07
or (resid 79 and name HD21) (resid 76 and name HA)
or (resid 79 and name HD23) (resid 76 and name HA)
assign (resid 79 and name HD22) (resid 76 and name HN) 3.558 1.583 1.583 weight 1.000 ! spec=HCH, no=2738, id=5700, vol=6.320000e+06
or (resid 79 and name HD21) (resid 76 and name HN)
or (resid 79 and name HD23) (resid 76 and name HN)
assign (resid 79 and name HD22) (resid 75 and name HN) 3.720 1.730 1.730 weight 1.000 ! spec=HCH, no=2740, id=5701, vol=4.840000e+06
or (resid 79 and name HD21) (resid 75 and name HN)
or (resid 79 and name HD23) (resid 75 and name HN)
assign (resid 79 and name HD22) (resid 78 and name HB) 3.711 1.722 1.722 weight 1.000 ! spec=HCH, no=2741, id=5702, vol=4.910000e+06
or (resid 79 and name HD21) (resid 78 and name HB)
or (resid 79 and name HD23) (resid 78 and name HB)
assign (resid 79 and name HB2) (resid 79 and name HD22) 2.543 0.809 0.809 weight 1.000 ! spec=HCH, no=2744, id=5705, vol=4.740000e+07
or (resid 79 and name HB2) (resid 79 and name HD21)
or (resid 79 and name HB2) (resid 79 and name HD23)
assign (resid 79 and name HD22) (resid 79 and name HG) 2.241 0.628 0.628 weight 1.000 ! spec=HCH, no=2745, id=5706, vol=1.010000e+08
or (resid 79 and name HD21) (resid 79 and name HG)
or (resid 79 and name HD23) (resid 79 and name HG)
assign (resid 79 and name HD22) (resid 79 and name HD21) 1.463 0.268 0.268 weight 1.000 ! spec=HCH, no=2747, id=5708, vol=1.310000e+09
or (resid 79 and name HD22) (resid 79 and name HD23)
or (resid 79 and name HD22) (resid 79 and name HD21)
or (resid 79 and name HD21) (resid 79 and name HD23)
or (resid 79 and name HD22) (resid 79 and name HD23)
or (resid 79 and name HD21) (resid 79 and name HD23)
assign (resid 79 and name HD22) (resid 86 and name HD2) 3.360 1.411 1.411 weight 1.000 ! spec=HCH, no=2748, id=5709, vol=8.920000e+06
or (resid 79 and name HD21) (resid 86 and name HD2)
or (resid 79 and name HD23) (resid 86 and name HD2)
assign (resid 79 and name HD22) (resid 89 and name HG12) 2.831 1.002 1.002 weight 1.000 ! spec=HCH, no=2749, id=5710, vol=2.490000e+07
or (resid 79 and name HD21) (resid 89 and name HG12)
or (resid 79 and name HD23) (resid 89 and name HG12)
assign (resid 79 and name HD22) (resid 89 and name HG22) 2.505 0.784 0.784 weight 1.000 ! spec=HCH, no=2750, id=5711, vol=5.190000e+07
or (resid 79 and name HD22) (resid 89 and name HG21)
or (resid 79 and name HD22) (resid 89 and name HG23)
or (resid 79 and name HD21) (resid 89 and name HG22)
or (resid 79 and name HD21) (resid 89 and name HG21)
or (resid 79 and name HD21) (resid 89 and name HG23)
or (resid 79 and name HD23) (resid 89 and name HG22)
or (resid 79 and name HD23) (resid 89 and name HG21)
or (resid 79 and name HD23) (resid 89 and name HG23)
assign (resid 79 and name HG) (resid 76 and name HA) 3.723 1.732 1.732 weight 1.000 ! spec=HCH, no=2752, id=5713, vol=4.820000e+06
assign (resid 79 and name HG) (resid 83 and name HB2) 3.632 1.649 1.649 weight 1.000 ! spec=HCH, no=2754, id=5715, vol=5.580000e+06
or (resid 79 and name HG) (resid 83 and name HB1)
assign (resid 79 and name HN) (resid 79 and name HG) 3.149 1.239 1.239 weight 1.000 ! spec=HCH, no=2756, id=5717, vol=1.320000e+07
assign (resid 80 and name HA) (resid 80 and name HE2) 3.335 1.390 1.390 weight 1.000 ! spec=HCH, no=2761, id=5721, vol=9.320000e+06
or (resid 80 and name HA) (resid 80 and name HE1)
assign (resid 80 and name HA) (resid 80 and name HG2) 2.445 0.748 0.748 weight 1.000 ! spec=HCH, no=2765, id=5725, vol=6.000000e+07
assign (resid 80 and name HA) (resid 79 and name HN) 3.703 1.714 1.714 weight 1.000 ! spec=HCH, no=2771, id=5731, vol=4.970000e+06
assign (resid 80 and name HN) (resid 80 and name HA) 2.608 0.850 0.850 weight 1.000 ! spec=HCH, no=2772, id=5732, vol=4.080000e+07
assign (resid 80 and name HA) (resid 80 and name HB2) 2.265 0.642 0.642 weight 1.000 ! spec=HCH, no=2774, id=5733, vol=9.480000e+07
assign (resid 80 and name HA) (resid 80 and name HB1) 2.286 0.653 0.653 weight 1.000 ! spec=HCH, no=2775, id=5734, vol=8.990000e+07
assign (resid 81 and name HN) (resid 80 and name HA) 2.926 1.070 1.070 weight 1.000 ! spec=HCH, no=2776, id=5735, vol=2.040000e+07
assign (resid 80 and name HB2) (resid 80 and name HD2) 2.215 0.613 0.613 weight 1.000 ! spec=HCH, no=2780, id=5739, vol=1.080000e+08
or (resid 80 and name HB2) (resid 80 and name HD1)
assign (resid 80 and name HB1) (resid 80 and name HN) 2.771 0.960 0.960 weight 1.000 ! spec=HCH, no=2783, id=5742, vol=2.830000e+07
assign (resid 80 and name HB1) (resid 80 and name HE2) 3.249 1.319 1.319 weight 1.000 ! spec=HCH, no=2788, id=5746, vol=1.090000e+07
assign (resid 80 and name HB2) (resid 81 and name HN) 3.061 1.171 1.171 weight 1.000 ! spec=HCH, no=2789, id=5747, vol=1.560000e+07
assign (resid 80 and name HB1) (resid 81 and name HN) 3.033 1.150 1.150 weight 1.000 ! spec=HCH, no=2790, id=5748, vol=1.650000e+07
assign (resid 80 and name HB1) (resid 133 and name HG22) 3.191 1.273 1.273 weight 1.000 ! spec=HCH, no=2793, id=5751, vol=1.210000e+07
or (resid 80 and name HB1) (resid 133 and name HG21)
or (resid 80 and name HB1) (resid 133 and name HG23)
assign (resid 80 and name HD2) (resid 80 and name HE2) 2.395 0.717 0.717 weight 1.000 ! spec=HCH, no=2799, id=5756, vol=6.800000e+07
assign (resid 80 and name HD2) (resid 85 and name HA2) 3.255 1.324 1.324 weight 1.000 ! spec=HCH, no=2800, id=5757, vol=1.080000e+07
assign (resid 77 and name HA) (resid 80 and name HE2) 3.078 1.185 1.185 weight 1.000 ! spec=HCH, no=2803, id=5760, vol=1.510000e+07
assign (resid 80 and name HN) (resid 80 and name HE2) 3.230 1.304 1.304 weight 1.000 ! spec=HCH, no=2806, id=5763, vol=1.130000e+07
assign (resid 80 and name HB2) (resid 80 and name HE2) 2.526 0.798 0.798 weight 1.000 ! spec=HCH, no=2811, id=5768, vol=4.940000e+07
assign (resid 80 and name HE2) (resid 80 and name HG2) 2.538 0.805 0.805 weight 1.000 ! spec=HCH, no=2812, id=5769, vol=4.800000e+07
assign (resid 80 and name HE2) (resid 81 and name HN) 3.660 1.674 1.674 weight 1.000 ! spec=HCH, no=2815, id=5771, vol=5.330000e+06
assign (resid 80 and name HG1) (resid 80 and name HN) 3.019 1.139 1.139 weight 1.000 ! spec=HCH, no=2825, id=5781, vol=1.690000e+07
assign (resid 80 and name HG1) (resid 80 and name HA) 3.009 1.132 1.132 weight 1.000 ! spec=HCH, no=2827, id=5783, vol=1.730000e+07
assign (resid 80 and name HB2) (resid 80 and name HG2) 2.336 0.682 0.682 weight 1.000 ! spec=HCH, no=2828, id=5784, vol=7.890000e+07
assign (resid 80 and name HG1) (resid 80 and name HB2) 2.420 0.732 0.732 weight 1.000 ! spec=HCH, no=2829, id=5785, vol=6.380000e+07
assign (resid 80 and name HB1) (resid 80 and name HG2) 2.303 0.663 0.663 weight 1.000 ! spec=HCH, no=2830, id=5786, vol=8.600000e+07
assign (resid 80 and name HG1) (resid 80 and name HB1) 2.437 0.742 0.742 weight 1.000 ! spec=HCH, no=2831, id=5787, vol=6.130000e+07
assign (resid 80 and name HG1) (resid 80 and name HG2) 1.886 0.445 0.445 weight 1.000 ! spec=HCH, no=2833, id=5789, vol=2.850000e+08
assign (resid 80 and name HE2) (resid 80 and name HG1) 3.162 1.250 1.250 weight 1.000 ! spec=HCH, no=2836, id=5791, vol=1.280000e+07
assign (resid 81 and name HN) (resid 80 and name HG1) 3.947 1.947 1.947 weight 1.000 ! spec=HCH, no=2837, id=5792, vol=3.390000e+06
assign (resid 81 and name HA) (resid 81 and name HG2) 2.522 0.795 0.795 weight 1.000 ! spec=HCH, no=2839, id=5794, vol=4.990000e+07
assign (resid 81 and name HA) (resid 81 and name HB1) 2.266 0.642 0.642 weight 1.000 ! spec=HCH, no=2842, id=5797, vol=9.460000e+07
assign (resid 81 and name HA) (resid 81 and name HG1) 2.792 0.974 0.974 weight 1.000 ! spec=HCH, no=2843, id=5798, vol=2.710000e+07
assign (resid 81 and name HB1) (resid 81 and name HG2) 2.444 0.747 0.747 weight 1.000 ! spec=HCH, no=2851, id=5806, vol=6.010000e+07
assign (resid 81 and name HB1) (resid 78 and name HA) 3.435 1.475 1.475 weight 1.000 ! spec=HCH, no=2853, id=5808, vol=7.810000e+06
assign (resid 81 and name HB1) (resid 80 and name HN) 3.391 1.437 1.437 weight 1.000 ! spec=HCH, no=2854, id=5809, vol=8.430000e+06
assign (resid 81 and name HB2) (resid 81 and name HA) 2.664 0.887 0.887 weight 1.000 ! spec=HCH, no=2857, id=5812, vol=3.590000e+07
assign (resid 81 and name HB2) (resid 82 and name HN) 2.979 1.110 1.110 weight 1.000 ! spec=HCH, no=2859, id=5814, vol=1.830000e+07
assign (resid 81 and name HB1) (resid 82 and name HN) 2.946 1.085 1.085 weight 1.000 ! spec=HCH, no=2860, id=5815, vol=1.960000e+07
assign (resid 78 and name HA) (resid 81 and name HD2) 3.533 1.560 1.560 weight 1.000 ! spec=HCH, no=2862, id=5817, vol=6.590000e+06
assign (resid 81 and name HD2) (resid 77 and name HB2) 3.340 1.395 1.395 weight 1.000 ! spec=HCH, no=2863, id=5818, vol=9.230000e+06
assign (resid 81 and name HE2) (resid 81 and name HN) 3.635 1.652 1.652 weight 1.000 ! spec=HCH, no=2867, id=5822, vol=5.560000e+06
assign (resid 81 and name HE2) (resid 78 and name HA) 3.077 1.184 1.184 weight 1.000 ! spec=HCH, no=2873, id=5827, vol=1.510000e+07
assign (resid 81 and name HA) (resid 81 and name HE2) 3.267 1.335 1.335 weight 1.000 ! spec=HCH, no=2874, id=5828, vol=1.050000e+07
assign (resid 81 and name HE2) (resid 81 and name HG1) 2.563 0.821 0.821 weight 1.000 ! spec=HCH, no=2875, id=5829, vol=4.530000e+07
assign (resid 81 and name HE2) (resid 81 and name HD2) 2.234 0.624 0.624 weight 1.000 ! spec=HCH, no=2876, id=5830, vol=1.030000e+08
assign (resid 82 and name HE21) (resid 81 and name HE2) 3.437 1.477 1.477 weight 1.000 ! spec=HCH, no=2878, id=5831, vol=7.780000e+06
assign (resid 81 and name HE2) (resid 81 and name HG1) 3.041 1.156 1.156 weight 1.000 ! spec=HCH, no=2880, id=5833, vol=1.620000e+07
or (resid 81 and name HG1) (resid 81 and name HE1)
assign (resid 81 and name HN) (resid 81 and name HG1) 3.104 1.204 1.204 weight 1.000 ! spec=HCH, no=2885, id=5838, vol=1.430000e+07
assign (resid 81 and name HG2) (resid 82 and name HN) 3.499 1.531 1.531 weight 1.000 ! spec=HCH, no=2889, id=5841, vol=6.980000e+06
assign (resid 81 and name HG1) (resid 82 and name HN) 3.080 1.186 1.186 weight 1.000 ! spec=HCH, no=2890, id=5842, vol=1.500000e+07
assign (resid 82 and name HA) (resid 82 and name HN) 2.574 0.828 0.828 weight 1.000 ! spec=HCH, no=2893, id=5845, vol=4.410000e+07
assign (resid 82 and name HA) (resid 82 and name HB2) 2.550 0.813 0.813 weight 1.000 ! spec=HCH, no=2894, id=5846, vol=4.660000e+07
assign (resid 82 and name HA) (resid 82 and name HB1) 2.409 0.725 0.725 weight 1.000 ! spec=HCH, no=2895, id=5847, vol=6.560000e+07
assign (resid 82 and name HA) (resid 82 and name HG2) 2.718 0.923 0.923 weight 1.000 ! spec=HCH, no=2896, id=5848, vol=3.180000e+07
assign (resid 82 and name HA) (resid 82 and name HG1) 2.638 0.870 0.870 weight 1.000 ! spec=HCH, no=2897, id=5849, vol=3.810000e+07
assign (resid 82 and name HA) (resid 83 and name HN) 2.645 0.875 0.875 weight 1.000 ! spec=HCH, no=2898, id=5850, vol=3.740000e+07
assign (resid 82 and name HB1) (resid 81 and name HN) 3.910 1.911 1.911 weight 1.000 ! spec=HCH, no=2901, id=5853, vol=3.590000e+06
assign (resid 82 and name HB2) (resid 82 and name HG2) 2.568 0.824 0.824 weight 1.000 ! spec=HCH, no=2904, id=5856, vol=4.470000e+07
assign (resid 83 and name HN) (resid 82 and name HB2) 2.759 0.952 0.952 weight 1.000 ! spec=HCH, no=2905, id=5857, vol=2.910000e+07
assign (resid 83 and name HN) (resid 82 and name HB1) 2.825 0.997 0.997 weight 1.000 ! spec=HCH, no=2906, id=5858, vol=2.520000e+07
assign (resid 82 and name HG2) (resid 78 and name HG21) 3.320 1.378 1.378 weight 1.000 ! spec=HCH, no=2907, id=5859, vol=9.570000e+06
or (resid 82 and name HG2) (resid 78 and name HG22)
or (resid 82 and name HG2) (resid 78 and name HG23)
assign (resid 82 and name HG1) (resid 30 and name HD12) 3.074 1.181 1.181 weight 1.000 ! spec=HCH, no=2912, id=5864, vol=1.520000e+07
or (resid 82 and name HG1) (resid 30 and name HD11)
or (resid 82 and name HG1) (resid 30 and name HD13)
assign (resid 82 and name HG1) (resid 28 and name HG21) 3.598 1.618 1.618 weight 1.000 ! spec=HCH, no=2913, id=5865, vol=5.910000e+06
or (resid 82 and name HG1) (resid 28 and name HG22)
or (resid 82 and name HG1) (resid 28 and name HG23)
assign (resid 82 and name HG1) (resid 82 and name HB2) 2.722 0.926 0.926 weight 1.000 ! spec=HCH, no=2914, id=5866, vol=3.150000e+07
assign (resid 82 and name HG2) (resid 30 and name HG12) 3.434 1.474 1.474 weight 1.000 ! spec=HCH, no=2916, id=5868, vol=7.810000e+06
assign (resid 82 and name HG1) (resid 30 and name HG12) 3.576 1.598 1.598 weight 1.000 ! spec=HCH, no=2917, id=5869, vol=6.130000e+06
assign (resid 82 and name HG2) (resid 30 and name HG11) 2.478 0.768 0.768 weight 1.000 ! spec=HCH, no=2918, id=5870, vol=5.540000e+07
assign (resid 84 and name HN) (resid 83 and name HA) 2.637 0.869 0.869 weight 1.000 ! spec=HCH, no=2935, id=5886, vol=3.810000e+07
assign (resid 84 and name HN) (resid 83 and name HB2) 3.612 1.631 1.631 weight 1.000 ! spec=HCH, no=2936, id=5887, vol=5.770000e+06
assign (resid 79 and name HD22) (resid 83 and name HB2) 3.325 1.382 1.382 weight 1.000 ! spec=HCH, no=2943, id=5894, vol=9.490000e+06
or (resid 79 and name HD21) (resid 83 and name HB2)
or (resid 79 and name HD23) (resid 83 and name HB2)
assign (resid 83 and name HB2) (resid 83 and name HA) 2.867 1.028 1.028 weight 1.000 ! spec=HCH, no=2945, id=5896, vol=2.310000e+07
assign (resid 83 and name HB2) (resid 84 and name HA) 3.827 1.830 1.830 weight 1.000 ! spec=HCH, no=2947, id=5897, vol=4.080000e+06
assign (resid 84 and name HN) (resid 84 and name HA) 2.491 0.776 0.776 weight 1.000 ! spec=HCH, no=2951, id=5901, vol=5.370000e+07
assign (resid 84 and name HA) (resid 84 and name HB1) 2.324 0.675 0.675 weight 1.000 ! spec=HCH, no=2952, id=5902, vol=8.140000e+07
assign (resid 84 and name HA) (resid 84 and name HG2) 2.515 0.791 0.791 weight 1.000 ! spec=HCH, no=2954, id=5904, vol=5.060000e+07
assign (resid 85 and name HN) (resid 84 and name HA) 2.625 0.862 0.862 weight 1.000 ! spec=HCH, no=2955, id=5905, vol=3.920000e+07
assign (resid 84 and name HA) (resid 85 and name HA2) 3.411 1.455 1.455 weight 1.000 ! spec=HCH, no=2956, id=5906, vol=8.140000e+06
assign (resid 84 and name HB2) (resid 84 and name HN) 3.055 1.166 1.166 weight 1.000 ! spec=HCH, no=2960, id=5910, vol=1.580000e+07
assign (resid 84 and name HB2) (resid 84 and name HA) 2.718 0.923 0.923 weight 1.000 ! spec=HCH, no=2961, id=5911, vol=3.180000e+07
assign (resid 84 and name HB2) (resid 84 and name HG2) 2.498 0.780 0.780 weight 1.000 ! spec=HCH, no=2962, id=5912, vol=5.280000e+07
assign (resid 84 and name HD2) (resid 84 and name HE2) 2.303 0.663 0.663 weight 1.000 ! spec=HCH, no=2966, id=5916, vol=8.610000e+07
or (resid 84 and name HD2) (resid 84 and name HE1)
assign (resid 84 and name HD2) (resid 84 and name HN) 3.343 1.397 1.397 weight 1.000 ! spec=HCH, no=2969, id=5919, vol=9.190000e+06
assign (resid 84 and name HE2) (resid 84 and name HB1) 2.360 0.696 0.696 weight 1.000 ! spec=HCH, no=2980, id=5927, vol=7.420000e+07
assign (resid 84 and name HE2) (resid 84 and name HG2) 2.474 0.765 0.765 weight 1.000 ! spec=HCH, no=2981, id=5928, vol=5.590000e+07
assign (resid 84 and name HG2) (resid 83 and name HA) 3.805 1.810 1.810 weight 1.000 ! spec=HCH, no=2985, id=5932, vol=4.220000e+06
assign (resid 84 and name HG2) (resid 84 and name HB1) 2.207 0.609 0.609 weight 1.000 ! spec=HCH, no=2995, id=5942, vol=1.110000e+08
assign (resid 84 and name HG2) (resid 84 and name HD2) 2.114 0.559 0.559 weight 1.000 ! spec=HCH, no=2996, id=5943, vol=1.440000e+08
assign (resid 85 and name HN) (resid 84 and name HG2) 3.584 1.605 1.605 weight 1.000 ! spec=HCH, no=2998, id=5945, vol=6.060000e+06
assign (resid 85 and name HA2) (resid 79 and name HB2) 3.729 1.738 1.738 weight 1.000 ! spec=HCH, no=3000, id=5947, vol=4.770000e+06
assign (resid 85 and name HA2) (resid 133 and name HD12) 3.576 1.599 1.599 weight 1.000 ! spec=HCH, no=3002, id=5949, vol=6.130000e+06
or (resid 85 and name HA2) (resid 133 and name HD11)
or (resid 85 and name HA2) (resid 133 and name HD13)
assign (resid 85 and name HA1) (resid 86 and name HG1) 3.453 1.490 1.490 weight 1.000 ! spec=HCH, no=3004, id=5951, vol=7.570000e+06
assign (resid 85 and name HA2) (resid 79 and name HG) 3.678 1.691 1.691 weight 1.000 ! spec=HCH, no=3009, id=5956, vol=5.180000e+06
assign (resid 85 and name HA1) (resid 79 and name HG) 3.406 1.450 1.450 weight 1.000 ! spec=HCH, no=3010, id=5957, vol=8.220000e+06
assign (resid 79 and name HD12) (resid 85 and name HA2) 3.411 1.454 1.454 weight 1.000 ! spec=HCH, no=3011, id=5958, vol=8.140000e+06
or (resid 79 and name HD11) (resid 85 and name HA2)
or (resid 79 and name HD13) (resid 85 and name HA2)
assign (resid 85 and name HA1) (resid 79 and name HD12) 3.538 1.565 1.565 weight 1.000 ! spec=HCH, no=3012, id=5959, vol=6.540000e+06
or (resid 85 and name HA1) (resid 79 and name HD11)
or (resid 85 and name HA1) (resid 79 and name HD13)
assign (resid 85 and name HN) (resid 85 and name HA2) 2.940 1.081 1.081 weight 1.000 ! spec=HCH, no=3013, id=5960, vol=1.980000e+07
assign (resid 85 and name HN) (resid 85 and name HA1) 2.972 1.104 1.104 weight 1.000 ! spec=HCH, no=3014, id=5961, vol=1.860000e+07
assign (resid 85 and name HA1) (resid 85 and name HA2) 2.122 0.563 0.563 weight 1.000 ! spec=HCH, no=3016, id=5962, vol=1.400000e+08
assign (resid 85 and name HA1) (resid 86 and name HD2) 2.102 0.553 0.553 weight 1.000 ! spec=HCH, no=3019, id=5964, vol=1.480000e+08
assign (resid 85 and name HA1) (resid 133 and name HG12) 3.468 1.504 1.504 weight 1.000 ! spec=HCH, no=3022, id=5967, vol=7.360000e+06
assign (resid 86 and name HA) (resid 86 and name HB1) 2.390 0.714 0.714 weight 1.000 ! spec=HCH, no=3028, id=5972, vol=6.880000e+07
assign (resid 86 and name HB1) (resid 39 and name HZ) 3.924 1.925 1.925 weight 1.000 ! spec=HCH, no=3032, id=5976, vol=3.510000e+06
assign (resid 86 and name HB1) (resid 85 and name HN) 3.247 1.318 1.318 weight 1.000 ! spec=HCH, no=3036, id=5980, vol=1.090000e+07
assign (resid 86 and name HB1) (resid 85 and name HA1) 3.519 1.548 1.548 weight 1.000 ! spec=HCH, no=3038, id=5982, vol=6.750000e+06
assign (resid 86 and name HA) (resid 86 and name HB2) 2.592 0.840 0.840 weight 1.000 ! spec=HCH, no=3039, id=5983, vol=4.230000e+07
assign (resid 86 and name HB1) (resid 86 and name HB2) 2.016 0.508 0.508 weight 1.000 ! spec=HCH, no=3043, id=5986, vol=1.910000e+08
assign (resid 86 and name HB2) (resid 86 and name HD2) 3.108 1.207 1.207 weight 1.000 ! spec=HCH, no=3045, id=5987, vol=1.420000e+07
assign (resid 86 and name HB1) (resid 86 and name HD2) 3.170 1.256 1.256 weight 1.000 ! spec=HCH, no=3046, id=5988, vol=1.260000e+07
assign (resid 86 and name HB2) (resid 86 and name HD1) 3.123 1.219 1.219 weight 1.000 ! spec=HCH, no=3047, id=5989, vol=1.380000e+07
assign (resid 86 and name HB2) (resid 86 and name HG2) 2.434 0.741 0.741 weight 1.000 ! spec=HCH, no=3049, id=5991, vol=6.160000e+07
assign (resid 86 and name HB1) (resid 86 and name HG2) 2.635 0.868 0.868 weight 1.000 ! spec=HCH, no=3050, id=5992, vol=3.830000e+07
assign (resid 85 and name HN) (resid 86 and name HD1) 3.615 1.633 1.633 weight 1.000 ! spec=HCH, no=3058, id=6000, vol=5.750000e+06
assign (resid 86 and name HD1) (resid 39 and name HZ) 3.137 1.230 1.230 weight 1.000 ! spec=HCH, no=3061, id=6003, vol=1.350000e+07
assign (resid 86 and name HD2) (resid 79 and name HB2) 3.697 1.709 1.709 weight 1.000 ! spec=HCH, no=3062, id=6004, vol=5.020000e+06
assign (resid 86 and name HD1) (resid 79 and name HB2) 3.670 1.684 1.684 weight 1.000 ! spec=HCH, no=3063, id=6005, vol=5.240000e+06
assign (resid 86 and name HD2) (resid 79 and name HB1) 2.890 1.044 1.044 weight 1.000 ! spec=HCH, no=3064, id=6006, vol=2.200000e+07
assign (resid 86 and name HD1) (resid 79 and name HD12) 3.643 1.659 1.659 weight 1.000 ! spec=HCH, no=3066, id=6008, vol=5.490000e+06
or (resid 86 and name HD1) (resid 79 and name HD11)
or (resid 86 and name HD1) (resid 79 and name HD13)
assign (resid 86 and name HD2) (resid 80 and name HG2) 3.697 1.709 1.709 weight 1.000 ! spec=HCH, no=3067, id=6009, vol=5.020000e+06
assign (resid 86 and name HD2) (resid 85 and name HN) 3.501 1.532 1.532 weight 1.000 ! spec=HCH, no=3069, id=6011, vol=6.960000e+06
assign (resid 85 and name HA1) (resid 86 and name HD1) 2.595 0.842 0.842 weight 1.000 ! spec=HCH, no=3072, id=6014, vol=4.200000e+07
assign (resid 86 and name HD2) (resid 86 and name HA) 3.602 1.622 1.622 weight 1.000 ! spec=HCH, no=3073, id=6015, vol=5.870000e+06
assign (resid 86 and name HD1) (resid 86 and name HA) 3.374 1.423 1.423 weight 1.000 ! spec=HCH, no=3074, id=6016, vol=8.700000e+06
assign (resid 86 and name HB1) (resid 86 and name HD1) 3.081 1.186 1.186 weight 1.000 ! spec=HCH, no=3075, id=6017, vol=1.500000e+07
assign (resid 86 and name HD1) (resid 86 and name HD2) 2.059 0.530 0.530 weight 1.000 ! spec=HCH, no=3076, id=6018, vol=1.680000e+08
assign (resid 86 and name HD2) (resid 86 and name HG2) 2.672 0.893 0.893 weight 1.000 ! spec=HCH, no=3077, id=6019, vol=3.520000e+07
assign (resid 86 and name HD1) (resid 86 and name HG2) 2.748 0.944 0.944 weight 1.000 ! spec=HCH, no=3078, id=6020, vol=2.980000e+07
assign (resid 86 and name HD2) (resid 86 and name HG1) 2.670 0.891 0.891 weight 1.000 ! spec=HCH, no=3079, id=6021, vol=3.540000e+07
assign (resid 86 and name HD1) (resid 86 and name HG1) 2.596 0.842 0.842 weight 1.000 ! spec=HCH, no=3080, id=6022, vol=4.190000e+07
assign (resid 86 and name HD1) (resid 89 and name HG22) 3.720 1.730 1.730 weight 1.000 ! spec=HCH, no=3082, id=6024, vol=4.840000e+06
or (resid 86 and name HD1) (resid 89 and name HG21)
or (resid 86 and name HD1) (resid 89 and name HG23)
assign (resid 86 and name HG2) (resid 89 and name HA) 4.010 2.010 2.010 weight 1.000 ! spec=HCH, no=3084, id=6026, vol=3.090000e+06
assign (resid 86 and name HG1) (resid 89 and name HA) 3.960 1.961 1.961 weight 1.000 ! spec=HCH, no=3094, id=6036, vol=3.320000e+06
assign (resid 86 and name HG2) (resid 39 and name HZ) 3.633 1.650 1.650 weight 1.000 ! spec=HCH, no=3096, id=6038, vol=5.580000e+06
assign (resid 86 and name HG1) (resid 39 and name HZ) 3.607 1.627 1.627 weight 1.000 ! spec=HCH, no=3097, id=6039, vol=5.820000e+06
assign (resid 86 and name HG2) (resid 79 and name HD12) 3.901 1.902 1.902 weight 1.000 ! spec=HCH, no=3098, id=6040, vol=3.640000e+06
or (resid 86 and name HG2) (resid 79 and name HD11)
or (resid 86 and name HG2) (resid 79 and name HD13)
assign (resid 86 and name HG1) (resid 79 and name HD12) 3.795 1.800 1.800 weight 1.000 ! spec=HCH, no=3099, id=6041, vol=4.290000e+06
or (resid 86 and name HG1) (resid 79 and name HD11)
or (resid 86 and name HG1) (resid 79 and name HD13)
assign (resid 86 and name HG2) (resid 85 and name HN) 3.607 1.627 1.627 weight 1.000 ! spec=HCH, no=3100, id=6042, vol=5.820000e+06
assign (resid 86 and name HG2) (resid 85 and name HA1) 3.796 1.801 1.801 weight 1.000 ! spec=HCH, no=3101, id=6043, vol=4.290000e+06
assign (resid 86 and name HG2) (resid 86 and name HA) 3.556 1.581 1.581 weight 1.000 ! spec=HCH, no=3103, id=6045, vol=6.340000e+06
assign (resid 86 and name HG1) (resid 86 and name HA) 3.269 1.336 1.336 weight 1.000 ! spec=HCH, no=3104, id=6046, vol=1.050000e+07
assign (resid 86 and name HG1) (resid 86 and name HB1) 2.540 0.806 0.806 weight 1.000 ! spec=HCH, no=3106, id=6048, vol=4.780000e+07
assign (resid 86 and name HG1) (resid 86 and name HG2) 2.102 0.552 0.552 weight 1.000 ! spec=HCH, no=3112, id=6053, vol=1.490000e+08
assign (resid 86 and name HG1) (resid 87 and name HN) 3.641 1.657 1.657 weight 1.000 ! spec=HCH, no=3116, id=6056, vol=5.510000e+06
assign (resid 86 and name HG2) (resid 89 and name HD12) 3.240 1.313 1.313 weight 1.000 ! spec=HCH, no=3118, id=6058, vol=1.110000e+07
or (resid 86 and name HG2) (resid 89 and name HD11)
or (resid 86 and name HG2) (resid 89 and name HD13)
assign (resid 86 and name HG1) (resid 89 and name HG22) 3.513 1.543 1.543 weight 1.000 ! spec=HCH, no=3121, id=6061, vol=6.820000e+06
or (resid 86 and name HG1) (resid 89 and name HG21)
or (resid 86 and name HG1) (resid 89 and name HG23)
assign (resid 87 and name HA) (resid 88 and name HN) 3.092 1.195 1.195 weight 1.000 ! spec=HCH, no=3123, id=6063, vol=1.470000e+07
assign (resid 87 and name HA) (resid 87 and name HB2) 2.309 0.666 0.666 weight 1.000 ! spec=HCH, no=3128, id=6068, vol=8.460000e+07
assign (resid 87 and name HA) (resid 133 and name HB) 2.824 0.997 0.997 weight 1.000 ! spec=HCH, no=3129, id=6069, vol=2.530000e+07
assign (resid 88 and name HA) (resid 87 and name HA) 3.990 1.990 1.990 weight 1.000 ! spec=HCH, no=3138, id=6078, vol=3.180000e+06
assign (resid 133 and name HN) (resid 88 and name HA) 3.135 1.229 1.229 weight 1.000 ! spec=HCH, no=3139, id=6079, vol=1.350000e+07
assign (resid 88 and name HA) (resid 86 and name HG2) 4.162 2.165 2.165 weight 1.000 ! spec=HCH, no=3142, id=6082, vol=2.470000e+06
assign (resid 88 and name HA) (resid 88 and name HB2) 2.550 0.813 0.813 weight 1.000 ! spec=HCH, no=3145, id=6084, vol=4.660000e+07
assign (resid 88 and name HA) (resid 130 and name HB2) 3.325 1.382 1.382 weight 1.000 ! spec=HCH, no=3150, id=6089, vol=9.490000e+06
assign (resid 88 and name HB2) (resid 89 and name HA) 3.931 1.932 1.932 weight 1.000 ! spec=HCH, no=3161, id=6099, vol=3.480000e+06
assign (resid 88 and name HB2) (resid 130 and name HB2) 2.657 0.883 0.883 weight 1.000 ! spec=HCH, no=3163, id=6101, vol=3.640000e+07
assign (resid 88 and name HB2) (resid 132 and name HA) 3.495 1.527 1.527 weight 1.000 ! spec=HCH, no=3165, id=6103, vol=7.040000e+06
assign (resid 89 and name HA) (resid 89 and name HB) 2.685 0.901 0.901 weight 1.000 ! spec=HCH, no=3171, id=6107, vol=3.420000e+07
assign (resid 89 and name HB) (resid 89 and name HG12) 2.824 0.997 0.997 weight 1.000 ! spec=HCH, no=3177, id=6112, vol=2.530000e+07
assign (resid 89 and name HB) (resid 39 and name HD1) 3.975 1.975 1.975 weight 1.000 ! spec=HCH, no=3178, id=6113, vol=3.250000e+06
assign (resid 88 and name HA) (resid 89 and name HB) 3.769 1.776 1.776 weight 1.000 ! spec=HCH, no=3179, id=6114, vol=4.470000e+06
assign (resid 89 and name HN) (resid 89 and name HB) 2.773 0.961 0.961 weight 1.000 ! spec=HCH, no=3180, id=6115, vol=2.820000e+07
assign (resid 89 and name HB) (resid 89 and name HD12) 2.567 0.824 0.824 weight 1.000 ! spec=HCH, no=3184, id=6118, vol=4.480000e+07
or (resid 89 and name HB) (resid 89 and name HD11)
or (resid 89 and name HB) (resid 89 and name HD13)
assign (resid 89 and name HB) (resid 130 and name HA) 3.889 1.891 1.891 weight 1.000 ! spec=HCH, no=3186, id=6120, vol=3.710000e+06
assign (resid 89 and name HB) (resid 131 and name HN) 3.600 1.620 1.620 weight 1.000 ! spec=HCH, no=3187, id=6121, vol=5.890000e+06
assign (resid 89 and name HD12) (resid 131 and name HA) 2.903 1.054 1.054 weight 1.000 ! spec=HCH, no=3188, id=6122, vol=2.140000e+07
or (resid 89 and name HD11) (resid 131 and name HA)
or (resid 89 and name HD13) (resid 131 and name HA)
assign (resid 89 and name HD12) (resid 131 and name HG) 2.012 0.506 0.506 weight 1.000 ! spec=HCH, no=3190, id=6124, vol=1.930000e+08
or (resid 89 and name HD11) (resid 131 and name HG)
or (resid 89 and name HD13) (resid 131 and name HG)
assign (resid 89 and name HD12) (resid 88 and name HB2) 2.835 1.005 1.005 weight 1.000 ! spec=HCH, no=3197, id=6131, vol=2.470000e+07
or (resid 89 and name HD12) (resid 88 and name HB1)
or (resid 89 and name HD11) (resid 88 and name HB2)
or (resid 89 and name HD11) (resid 88 and name HB1)
or (resid 89 and name HD13) (resid 88 and name HB2)
or (resid 89 and name HD13) (resid 88 and name HB1)
assign (resid 88 and name HA) (resid 89 and name HD12) 3.015 1.136 1.136 weight 1.000 ! spec=HCH, no=3202, id=6136, vol=1.710000e+07
or (resid 88 and name HA) (resid 89 and name HD11)
or (resid 88 and name HA) (resid 89 and name HD13)
assign (resid 89 and name HA) (resid 89 and name HD12) 2.699 0.911 0.911 weight 1.000 ! spec=HCH, no=3204, id=6138, vol=3.320000e+07
or (resid 89 and name HA) (resid 89 and name HD11)
or (resid 89 and name HA) (resid 89 and name HD13)
assign (resid 89 and name HD12) (resid 89 and name HG12) 2.164 0.585 0.585 weight 1.000 ! spec=HCH, no=3206, id=6140, vol=1.250000e+08
or (resid 89 and name HD11) (resid 89 and name HG12)
or (resid 89 and name HD13) (resid 89 and name HG12)
assign (resid 89 and name HD12) (resid 89 and name HD11) 1.093 0.149 0.149 weight 1.000 ! spec=HCH, no=3207, id=6141, vol=7.540000e+09
or (resid 89 and name HD12) (resid 89 and name HD13)
or (resid 89 and name HD12) (resid 89 and name HD11)
or (resid 89 and name HD11) (resid 89 and name HD13)
or (resid 89 and name HD12) (resid 89 and name HD13)
or (resid 89 and name HD11) (resid 89 and name HD13)
assign (resid 89 and name HD12) (resid 130 and name HA) 3.640 1.656 1.656 weight 1.000 ! spec=HCH, no=3209, id=6143, vol=5.510000e+06
or (resid 89 and name HD11) (resid 130 and name HA)
or (resid 89 and name HD13) (resid 130 and name HA)
assign (resid 89 and name HG12) (resid 89 and name HA) 3.346 1.400 1.400 weight 1.000 ! spec=HCH, no=3211, id=6144, vol=9.130000e+06
assign (resid 89 and name HB) (resid 89 and name HG11) 2.665 0.888 0.888 weight 1.000 ! spec=HCH, no=3216, id=6149, vol=3.580000e+07
assign (resid 89 and name HG11) (resid 90 and name HA) 3.363 1.414 1.414 weight 1.000 ! spec=HCH, no=3217, id=6150, vol=8.860000e+06
assign (resid 89 and name HG11) (resid 89 and name HN) 3.092 1.195 1.195 weight 1.000 ! spec=HCH, no=3221, id=6154, vol=1.470000e+07
assign (resid 89 and name HG11) (resid 89 and name HA) 3.112 1.210 1.210 weight 1.000 ! spec=HCH, no=3222, id=6155, vol=1.410000e+07
assign (resid 89 and name HG11) (resid 89 and name HG12) 2.177 0.592 0.592 weight 1.000 ! spec=HCH, no=3225, id=6157, vol=1.200000e+08
assign (resid 89 and name HG11) (resid 89 and name HD12) 2.445 0.747 0.747 weight 1.000 ! spec=HCH, no=3228, id=6159, vol=6.010000e+07
or (resid 89 and name HG11) (resid 89 and name HD11)
or (resid 89 and name HG11) (resid 89 and name HD13)
assign (resid 89 and name HG12) (resid 131 and name HN) 3.949 1.950 1.950 weight 1.000 ! spec=HCH, no=3230, id=6161, vol=3.380000e+06
assign (resid 89 and name HG11) (resid 131 and name HN) 3.735 1.744 1.744 weight 1.000 ! spec=HCH, no=3231, id=6162, vol=4.730000e+06
assign (resid 89 and name HG22) (resid 89 and name HD12) 1.901 0.452 0.452 weight 1.000 ! spec=HCH, no=3235, id=6165, vol=2.710000e+08
or (resid 89 and name HG22) (resid 89 and name HD11)
or (resid 89 and name HG22) (resid 89 and name HD13)
or (resid 89 and name HG21) (resid 89 and name HD12)
or (resid 89 and name HG21) (resid 89 and name HD11)
or (resid 89 and name HG21) (resid 89 and name HD13)
or (resid 89 and name HG23) (resid 89 and name HD12)
or (resid 89 and name HG23) (resid 89 and name HD11)
or (resid 89 and name HG23) (resid 89 and name HD13)
assign (resid 89 and name HG22) (resid 88 and name HN) 3.565 1.589 1.589 weight 1.000 ! spec=HCH, no=3241, id=6171, vol=6.240000e+06
or (resid 89 and name HG21) (resid 88 and name HN)
or (resid 89 and name HG23) (resid 88 and name HN)
assign (resid 89 and name HG22) (resid 39 and name HD1) 3.420 1.462 1.462 weight 1.000 ! spec=HCH, no=3246, id=6176, vol=8.010000e+06
or (resid 89 and name HG22) (resid 39 and name HD2)
or (resid 89 and name HG21) (resid 39 and name HD1)
or (resid 89 and name HG21) (resid 39 and name HD2)
or (resid 89 and name HG23) (resid 39 and name HD1)
or (resid 89 and name HG23) (resid 39 and name HD2)
assign (resid 89 and name HG22) (resid 89 and name HG11) 2.400 0.720 0.720 weight 1.000 ! spec=HCH, no=3249, id=6179, vol=6.710000e+07
or (resid 89 and name HG21) (resid 89 and name HG11)
or (resid 89 and name HG23) (resid 89 and name HG11)
assign (resid 86 and name HD2) (resid 89 and name HG22) 3.146 1.238 1.238 weight 1.000 ! spec=HCH, no=3253, id=6182, vol=1.320000e+07
or (resid 86 and name HD2) (resid 89 and name HG21)
or (resid 86 and name HD2) (resid 89 and name HG23)
assign (resid 89 and name HG22) (resid 39 and name HZ) 2.775 0.963 0.963 weight 1.000 ! spec=HCH, no=3256, id=6184, vol=2.810000e+07
or (resid 89 and name HG21) (resid 39 and name HZ)
or (resid 89 and name HG23) (resid 39 and name HZ)
assign (resid 86 and name HG2) (resid 89 and name HG22) 2.837 1.006 1.006 weight 1.000 ! spec=HCH, no=3257, id=6185, vol=2.460000e+07
or (resid 86 and name HG2) (resid 89 and name HG21)
or (resid 86 and name HG2) (resid 89 and name HG23)
assign (resid 89 and name HG22) (resid 83 and name HB2) 3.891 1.893 1.893 weight 1.000 ! spec=HCH, no=3261, id=6189, vol=3.690000e+06
or (resid 89 and name HG21) (resid 83 and name HB2)
or (resid 89 and name HG23) (resid 83 and name HB2)
assign (resid 88 and name HA) (resid 89 and name HG22) 3.387 1.434 1.434 weight 1.000 ! spec=HCH, no=3262, id=6190, vol=8.490000e+06
or (resid 88 and name HA) (resid 89 and name HG21)
or (resid 88 and name HA) (resid 89 and name HG23)
assign (resid 89 and name HN) (resid 89 and name HG22) 2.573 0.828 0.828 weight 1.000 ! spec=HCH, no=3263, id=6191, vol=4.420000e+07
or (resid 89 and name HN) (resid 89 and name HG21)
or (resid 89 and name HN) (resid 89 and name HG23)
assign (resid 89 and name HA) (resid 89 and name HG22) 2.469 0.762 0.762 weight 1.000 ! spec=HCH, no=3264, id=6192, vol=5.660000e+07
or (resid 89 and name HA) (resid 89 and name HG21)
or (resid 89 and name HA) (resid 89 and name HG23)
assign (resid 89 and name HB) (resid 89 and name HG22) 2.172 0.590 0.590 weight 1.000 ! spec=HCH, no=3265, id=6193, vol=1.220000e+08
or (resid 89 and name HB) (resid 89 and name HG21)
or (resid 89 and name HB) (resid 89 and name HG23)
assign (resid 89 and name HG12) (resid 89 and name HG22) 2.233 0.623 0.623 weight 1.000 ! spec=HCH, no=3266, id=6194, vol=1.030000e+08
or (resid 89 and name HG12) (resid 89 and name HG21)
or (resid 89 and name HG12) (resid 89 and name HG23)
assign (resid 89 and name HG22) (resid 89 and name HG21) 1.222 0.187 0.187 weight 1.000 ! spec=HCH, no=3267, id=6195, vol=3.850000e+09
or (resid 89 and name HG22) (resid 89 and name HG23)
or (resid 89 and name HG22) (resid 89 and name HG21)
or (resid 89 and name HG21) (resid 89 and name HG23)
or (resid 89 and name HG22) (resid 89 and name HG23)
or (resid 89 and name HG21) (resid 89 and name HG23)
assign (resid 89 and name HG22) (resid 133 and name HG11) 2.545 0.809 0.809 weight 1.000 ! spec=HCH, no=3270, id=6198, vol=4.720000e+07
or (resid 89 and name HG21) (resid 133 and name HG11)
or (resid 89 and name HG23) (resid 133 and name HG11)
assign (resid 90 and name HA) (resid 90 and name HB1) 2.627 0.863 0.863 weight 1.000 ! spec=HCH, no=3273, id=6200, vol=3.900000e+07
assign (resid 90 and name HA) (resid 90 and name HD12) 2.867 1.027 1.027 weight 1.000 ! spec=HCH, no=3274, id=6201, vol=2.310000e+07
or (resid 90 and name HA) (resid 90 and name HD11)
or (resid 90 and name HA) (resid 90 and name HD13)
assign (resid 90 and name HA) (resid 130 and name HA) 2.813 0.989 0.989 weight 1.000 ! spec=HCH, no=3278, id=6205, vol=2.590000e+07
assign (resid 90 and name HA) (resid 130 and name HD1) 3.208 1.286 1.286 weight 1.000 ! spec=HCH, no=3279, id=6206, vol=1.180000e+07
assign (resid 90 and name HB1) (resid 63 and name HE2) 2.818 0.993 0.993 weight 1.000 ! spec=HCH, no=3289, id=6215, vol=2.560000e+07
or (resid 90 and name HB1) (resid 63 and name HE1)
or (resid 90 and name HB1) (resid 63 and name HE3)
assign (resid 90 and name HB1) (resid 148 and name HB) 4.088 2.089 2.089 weight 1.000 ! spec=HCH, no=3291, id=6217, vol=2.750000e+06
assign (resid 90 and name HB2) (resid 89 and name HA) 3.593 1.614 1.614 weight 1.000 ! spec=HCH, no=3294, id=6220, vol=5.960000e+06
assign (resid 90 and name HB2) (resid 90 and name HD12) 2.611 0.852 0.852 weight 1.000 ! spec=HCH, no=3298, id=6224, vol=4.040000e+07
or (resid 90 and name HB2) (resid 90 and name HD11)
or (resid 90 and name HB2) (resid 90 and name HD13)
assign (resid 90 and name HB1) (resid 90 and name HD22) 2.700 0.911 0.911 weight 1.000 ! spec=HCH, no=3301, id=6227, vol=3.310000e+07
or (resid 90 and name HB1) (resid 90 and name HD21)
or (resid 90 and name HB1) (resid 90 and name HD23)
assign (resid 90 and name HB1) (resid 91 and name HN) 3.416 1.459 1.459 weight 1.000 ! spec=HCH, no=3302, id=6228, vol=8.070000e+06
assign (resid 90 and name HB1) (resid 130 and name HD1) 3.870 1.872 1.872 weight 1.000 ! spec=HCH, no=3304, id=6230, vol=3.820000e+06
assign (resid 90 and name HB1) (resid 130 and name HE1) 3.763 1.770 1.770 weight 1.000 ! spec=HCH, no=3305, id=6231, vol=4.510000e+06
assign (resid 90 and name HD12) (resid 143 and name HB2) 3.545 1.571 1.571 weight 1.000 ! spec=HCH, no=3306, id=6232, vol=6.460000e+06
or (resid 90 and name HD11) (resid 143 and name HB2)
or (resid 90 and name HD13) (resid 143 and name HB2)
assign (resid 90 and name HD12) (resid 148 and name HG12) 1.959 0.480 0.480 weight 1.000 ! spec=HCH, no=3307, id=6233, vol=2.270000e+08
or (resid 90 and name HD12) (resid 148 and name HG11)
or (resid 90 and name HD12) (resid 148 and name HG13)
or (resid 90 and name HD11) (resid 148 and name HG12)
or (resid 90 and name HD11) (resid 148 and name HG11)
or (resid 90 and name HD11) (resid 148 and name HG13)
or (resid 90 and name HD13) (resid 148 and name HG12)
or (resid 90 and name HD13) (resid 148 and name HG11)
or (resid 90 and name HD13) (resid 148 and name HG13)
assign (resid 90 and name HD12) (resid 143 and name HN) 3.497 1.529 1.529 weight 1.000 ! spec=HCH, no=3313, id=6239, vol=7.010000e+06
or (resid 90 and name HD11) (resid 143 and name HN)
or (resid 90 and name HD13) (resid 143 and name HN)
assign (resid 90 and name HD12) (resid 148 and name HA) 3.300 1.361 1.361 weight 1.000 ! spec=HCH, no=3318, id=6244, vol=9.920000e+06
or (resid 90 and name HD11) (resid 148 and name HA)
or (resid 90 and name HD13) (resid 148 and name HA)
assign (resid 90 and name HD12) (resid 148 and name HN) 3.582 1.603 1.603 weight 1.000 ! spec=HCH, no=3319, id=6245, vol=6.080000e+06
or (resid 90 and name HD11) (resid 148 and name HN)
or (resid 90 and name HD13) (resid 148 and name HN)
assign (resid 90 and name HD12) (resid 151 and name HB) 3.527 1.555 1.555 weight 1.000 ! spec=HCH, no=3321, id=6247, vol=6.660000e+06
or (resid 90 and name HD11) (resid 151 and name HB)
or (resid 90 and name HD13) (resid 151 and name HB)
assign (resid 90 and name HD12) (resid 143 and name HB1) 3.532 1.560 1.560 weight 1.000 ! spec=HCH, no=3322, id=6248, vol=6.600000e+06
or (resid 90 and name HD11) (resid 143 and name HB1)
or (resid 90 and name HD13) (resid 143 and name HB1)
assign (resid 90 and name HD12) (resid 148 and name HB) 3.062 1.172 1.172 weight 1.000 ! spec=HCH, no=3331, id=6256, vol=1.550000e+07
or (resid 90 and name HD11) (resid 148 and name HB)
or (resid 90 and name HD13) (resid 148 and name HB)
assign (resid 90 and name HD12) (resid 52 and name HB) 3.148 1.238 1.238 weight 1.000 ! spec=HCH, no=3333, id=6258, vol=1.320000e+07
or (resid 90 and name HD11) (resid 52 and name HB)
or (resid 90 and name HD13) (resid 52 and name HB)
assign (resid 90 and name HD12) (resid 90 and name HN) 2.920 1.066 1.066 weight 1.000 ! spec=HCH, no=3337, id=6262, vol=2.070000e+07
or (resid 90 and name HD11) (resid 90 and name HN)
or (resid 90 and name HD13) (resid 90 and name HN)
assign (resid 90 and name HB1) (resid 90 and name HD12) 2.050 0.525 0.525 weight 1.000 ! spec=HCH, no=3339, id=6264, vol=1.730000e+08
or (resid 90 and name HB1) (resid 90 and name HD11)
or (resid 90 and name HB1) (resid 90 and name HD13)
assign (resid 90 and name HD12) (resid 90 and name HD11) 1.237 0.191 0.191 weight 1.000 ! spec=HCH, no=3340, id=6265, vol=3.590000e+09
or (resid 90 and name HD12) (resid 90 and name HD13)
or (resid 90 and name HD12) (resid 90 and name HD11)
or (resid 90 and name HD11) (resid 90 and name HD13)
or (resid 90 and name HD12) (resid 90 and name HD13)
or (resid 90 and name HD11) (resid 90 and name HD13)
assign (resid 90 and name HD12) (resid 130 and name HZ) 3.026 1.145 1.145 weight 1.000 ! spec=HCH, no=3347, id=6272, vol=1.670000e+07
or (resid 90 and name HD11) (resid 130 and name HZ)
or (resid 90 and name HD13) (resid 130 and name HZ)
assign (resid 90 and name HD12) (resid 130 and name HE1) 2.893 1.046 1.046 weight 1.000 ! spec=HCH, no=3349, id=6274, vol=2.190000e+07
or (resid 90 and name HD11) (resid 130 and name HE1)
or (resid 90 and name HD13) (resid 130 and name HE1)
assign (resid 90 and name HD22) (resid 143 and name HN) 3.813 1.818 1.818 weight 1.000 ! spec=HCH, no=3357, id=6282, vol=4.170000e+06
or (resid 90 and name HD21) (resid 143 and name HN)
or (resid 90 and name HD23) (resid 143 and name HN)
assign (resid 90 and name HD22) (resid 90 and name HD12) 1.972 0.486 0.486 weight 1.000 ! spec=HCH, no=3359, id=6284, vol=2.180000e+08
or (resid 90 and name HD22) (resid 90 and name HD11)
or (resid 90 and name HD22) (resid 90 and name HD13)
or (resid 90 and name HD21) (resid 90 and name HD12)
or (resid 90 and name HD21) (resid 90 and name HD11)
or (resid 90 and name HD21) (resid 90 and name HD13)
or (resid 90 and name HD23) (resid 90 and name HD12)
or (resid 90 and name HD23) (resid 90 and name HD11)
or (resid 90 and name HD23) (resid 90 and name HD13)
assign (resid 90 and name HD22) (resid 131 and name HN) 3.916 1.917 1.917 weight 1.000 ! spec=HCH, no=3361, id=6286, vol=3.560000e+06
or (resid 90 and name HD21) (resid 131 and name HN)
or (resid 90 and name HD23) (resid 131 and name HN)
assign (resid 90 and name HD22) (resid 91 and name HA) 3.467 1.503 1.503 weight 1.000 ! spec=HCH, no=3363, id=6288, vol=7.380000e+06
or (resid 90 and name HD21) (resid 91 and name HA)
or (resid 90 and name HD23) (resid 91 and name HA)
assign (resid 90 and name HD22) (resid 130 and name HA) 3.505 1.535 1.535 weight 1.000 ! spec=HCH, no=3364, id=6289, vol=6.920000e+06
or (resid 90 and name HD21) (resid 130 and name HA)
or (resid 90 and name HD23) (resid 130 and name HA)
assign (resid 90 and name HD22) (resid 143 and name HB1) 3.722 1.732 1.732 weight 1.000 ! spec=HCH, no=3365, id=6290, vol=4.820000e+06
or (resid 90 and name HD21) (resid 143 and name HB1)
or (resid 90 and name HD23) (resid 143 and name HB1)
assign (resid 129 and name HN) (resid 90 and name HD22) 3.277 1.342 1.342 weight 1.000 ! spec=HCH, no=3368, id=6293, vol=1.040000e+07
or (resid 129 and name HN) (resid 90 and name HD21)
or (resid 129 and name HN) (resid 90 and name HD23)
assign (resid 49 and name HD12) (resid 90 and name HD22) 2.466 0.760 0.760 weight 1.000 ! spec=HCH, no=3369, id=6294, vol=5.710000e+07
or (resid 49 and name HD12) (resid 90 and name HD21)
or (resid 49 and name HD12) (resid 90 and name HD23)
or (resid 49 and name HD11) (resid 90 and name HD22)
or (resid 49 and name HD11) (resid 90 and name HD21)
or (resid 49 and name HD11) (resid 90 and name HD23)
or (resid 49 and name HD13) (resid 90 and name HD22)
or (resid 49 and name HD13) (resid 90 and name HD21)
or (resid 49 and name HD13) (resid 90 and name HD23)
assign (resid 90 and name HD22) (resid 63 and name HB1) 3.484 1.517 1.517 weight 1.000 ! spec=HCH, no=3371, id=6296, vol=7.170000e+06
or (resid 90 and name HD21) (resid 63 and name HB1)
or (resid 90 and name HD23) (resid 63 and name HB1)
assign (resid 90 and name HD22) (resid 90 and name HN) 3.132 1.226 1.226 weight 1.000 ! spec=HCH, no=3373, id=6298, vol=1.360000e+07
or (resid 90 and name HD21) (resid 90 and name HN)
or (resid 90 and name HD23) (resid 90 and name HN)
assign (resid 90 and name HA) (resid 90 and name HD22) 2.619 0.858 0.858 weight 1.000 ! spec=HCH, no=3374, id=6299, vol=3.970000e+07
or (resid 90 and name HA) (resid 90 and name HD21)
or (resid 90 and name HA) (resid 90 and name HD23)
assign (resid 90 and name HB2) (resid 90 and name HD22) 2.347 0.689 0.689 weight 1.000 ! spec=HCH, no=3375, id=6300, vol=7.660000e+07
or (resid 90 and name HB2) (resid 90 and name HD21)
or (resid 90 and name HB2) (resid 90 and name HD23)
assign (resid 90 and name HD22) (resid 90 and name HD21) 1.301 0.212 0.212 weight 1.000 ! spec=HCH, no=3377, id=6302, vol=2.640000e+09
or (resid 90 and name HD22) (resid 90 and name HD23)
or (resid 90 and name HD22) (resid 90 and name HD21)
or (resid 90 and name HD21) (resid 90 and name HD23)
or (resid 90 and name HD22) (resid 90 and name HD23)
or (resid 90 and name HD21) (resid 90 and name HD23)
assign (resid 90 and name HD22) (resid 128 and name HA) 3.424 1.465 1.465 weight 1.000 ! spec=HCH, no=3381, id=6306, vol=7.960000e+06
or (resid 90 and name HD21) (resid 128 and name HA)
or (resid 90 and name HD23) (resid 128 and name HA)
assign (resid 90 and name HD22) (resid 128 and name HB2) 2.570 0.826 0.826 weight 1.000 ! spec=HCH, no=3382, id=6307, vol=4.450000e+07
or (resid 90 and name HD21) (resid 128 and name HB2)
or (resid 90 and name HD23) (resid 128 and name HB2)
assign (resid 90 and name HD22) (resid 130 and name HZ) 3.128 1.223 1.223 weight 1.000 ! spec=HCH, no=3383, id=6308, vol=1.370000e+07
or (resid 90 and name HD21) (resid 130 and name HZ)
or (resid 90 and name HD23) (resid 130 and name HZ)
assign (resid 90 and name HD22) (resid 130 and name HD1) 3.280 1.344 1.344 weight 1.000 ! spec=HCH, no=3384, id=6309, vol=1.030000e+07
or (resid 90 and name HD21) (resid 130 and name HD1)
or (resid 90 and name HD23) (resid 130 and name HD1)
assign (resid 90 and name HD22) (resid 130 and name HE1) 3.015 1.136 1.136 weight 1.000 ! spec=HCH, no=3385, id=6310, vol=1.710000e+07
or (resid 90 and name HD21) (resid 130 and name HE1)
or (resid 90 and name HD23) (resid 130 and name HE1)
assign (resid 90 and name HD22) (resid 143 and name HB2) 3.980 1.980 1.980 weight 1.000 ! spec=HCH, no=3387, id=6312, vol=3.230000e+06
or (resid 90 and name HD21) (resid 143 and name HB2)
or (resid 90 and name HD23) (resid 143 and name HB2)
assign (resid 90 and name HG) (resid 148 and name HG22) 3.547 1.573 1.573 weight 1.000 ! spec=HCH, no=3389, id=6314, vol=6.440000e+06
or (resid 90 and name HG) (resid 148 and name HG21)
or (resid 90 and name HG) (resid 148 and name HG23)
assign (resid 63 and name HE2) (resid 90 and name HG) 3.147 1.238 1.238 weight 1.000 ! spec=HCH, no=3390, id=6315, vol=1.320000e+07
or (resid 63 and name HE1) (resid 90 and name HG)
or (resid 63 and name HE3) (resid 90 and name HG)
assign (resid 90 and name HG) (resid 90 and name HD12) 2.733 0.934 0.934 weight 1.000 ! spec=HCH, no=3392, id=6317, vol=3.080000e+07
or (resid 90 and name HG) (resid 90 and name HD11)
or (resid 90 and name HG) (resid 90 and name HD13)
assign (resid 90 and name HG) (resid 90 and name HN) 3.122 1.218 1.218 weight 1.000 ! spec=HCH, no=3393, id=6318, vol=1.390000e+07
assign (resid 90 and name HG) (resid 90 and name HA) 3.492 1.524 1.524 weight 1.000 ! spec=HCH, no=3394, id=6319, vol=7.080000e+06
assign (resid 90 and name HG) (resid 90 and name HD22) 2.796 0.977 0.977 weight 1.000 ! spec=HCH, no=3395, id=6320, vol=2.690000e+07
or (resid 90 and name HG) (resid 90 and name HD21)
or (resid 90 and name HG) (resid 90 and name HD23)
assign (resid 90 and name HG) (resid 91 and name HN) 3.615 1.633 1.633 weight 1.000 ! spec=HCH, no=3396, id=6321, vol=5.750000e+06
assign (resid 90 and name HG) (resid 130 and name HE1) 3.630 1.647 1.647 weight 1.000 ! spec=HCH, no=3397, id=6322, vol=5.600000e+06
assign (resid 91 and name HA) (resid 91 and name HG) 2.764 0.955 0.955 weight 1.000 ! spec=HCH, no=3399, id=6324, vol=2.880000e+07
assign (resid 91 and name HA) (resid 131 and name HB1) 3.244 1.316 1.316 weight 1.000 ! spec=HCH, no=3401, id=6326, vol=1.100000e+07
assign (resid 91 and name HA) (resid 91 and name HB2) 2.504 0.784 0.784 weight 1.000 ! spec=HCH, no=3406, id=6329, vol=5.200000e+07
assign (resid 91 and name HA) (resid 91 and name HB1) 2.977 1.108 1.108 weight 1.000 ! spec=HCH, no=3407, id=6330, vol=1.840000e+07
assign (resid 91 and name HB1) (resid 91 and name HB2) 2.583 0.834 0.834 weight 1.000 ! spec=HCH, no=3431, id=6351, vol=4.320000e+07
assign (resid 91 and name HB2) (resid 91 and name HD22) 2.797 0.978 0.978 weight 1.000 ! spec=HCH, no=3435, id=6354, vol=2.680000e+07
or (resid 91 and name HB2) (resid 91 and name HD21)
or (resid 91 and name HB2) (resid 91 and name HD23)
assign (resid 91 and name HB1) (resid 104 and name HH2) 4.155 2.158 2.158 weight 1.000 ! spec=HCH, no=3438, id=6357, vol=2.490000e+06
assign (resid 91 and name HB1) (resid 104 and name HZ3) 3.332 1.388 1.388 weight 1.000 ! spec=HCH, no=3440, id=6359, vol=9.370000e+06
assign (resid 91 and name HB1) (resid 129 and name HN) 4.100 2.101 2.101 weight 1.000 ! spec=HCH, no=3441, id=6360, vol=2.700000e+06
assign (resid 91 and name HB1) (resid 130 and name HA) 3.887 1.888 1.888 weight 1.000 ! spec=HCH, no=3442, id=6361, vol=3.720000e+06
assign (resid 91 and name HD12) (resid 136 and name HA2) 3.850 1.853 1.853 weight 1.000 ! spec=HCH, no=3448, id=6364, vol=3.940000e+06
or (resid 91 and name HD11) (resid 136 and name HA2)
or (resid 91 and name HD13) (resid 136 and name HA2)
assign (resid 92 and name HN) (resid 91 and name HD12) 2.772 0.961 0.961 weight 1.000 ! spec=HCH, no=3451, id=6367, vol=2.820000e+07
or (resid 92 and name HN) (resid 91 and name HD11)
or (resid 92 and name HN) (resid 91 and name HD13)
assign (resid 66 and name HD12) (resid 91 and name HD12) 2.111 0.557 0.557 weight 1.000 ! spec=HCH, no=3453, id=6369, vol=1.450000e+08
or (resid 66 and name HD12) (resid 91 and name HD11)
or (resid 66 and name HD12) (resid 91 and name HD13)
or (resid 66 and name HD11) (resid 91 and name HD12)
or (resid 66 and name HD11) (resid 91 and name HD11)
or (resid 66 and name HD11) (resid 91 and name HD13)
or (resid 66 and name HD13) (resid 91 and name HD12)
or (resid 66 and name HD13) (resid 91 and name HD11)
or (resid 66 and name HD13) (resid 91 and name HD13)
assign (resid 91 and name HD12) (resid 91 and name HD22) 2.062 0.532 0.532 weight 1.000 ! spec=HCH, no=3455, id=6371, vol=1.670000e+08
or (resid 91 and name HD12) (resid 91 and name HD21)
or (resid 91 and name HD12) (resid 91 and name HD23)
or (resid 91 and name HD11) (resid 91 and name HD22)
or (resid 91 and name HD11) (resid 91 and name HD21)
or (resid 91 and name HD11) (resid 91 and name HD23)
or (resid 91 and name HD13) (resid 91 and name HD22)
or (resid 91 and name HD13) (resid 91 and name HD21)
or (resid 91 and name HD13) (resid 91 and name HD23)
assign (resid 131 and name HN) (resid 91 and name HD12) 2.920 1.066 1.066 weight 1.000 ! spec=HCH, no=3460, id=6374, vol=2.070000e+07
or (resid 131 and name HN) (resid 91 and name HD11)
or (resid 131 and name HN) (resid 91 and name HD13)
assign (resid 91 and name HD12) (resid 90 and name HA) 3.313 1.372 1.372 weight 1.000 ! spec=HCH, no=3461, id=6375, vol=9.690000e+06
or (resid 91 and name HD11) (resid 90 and name HA)
or (resid 91 and name HD13) (resid 90 and name HA)
assign (resid 138 and name HE1) (resid 91 and name HD12) 3.593 1.614 1.614 weight 1.000 ! spec=HCH, no=3467, id=6381, vol=5.960000e+06
or (resid 138 and name HE1) (resid 91 and name HD11)
or (resid 138 and name HE1) (resid 91 and name HD13)
assign (resid 91 and name HD12) (resid 65 and name HA) 3.314 1.373 1.373 weight 1.000 ! spec=HCH, no=3473, id=6387, vol=9.680000e+06
or (resid 91 and name HD11) (resid 65 and name HA)
or (resid 91 and name HD13) (resid 65 and name HA)
assign (resid 91 and name HD12) (resid 66 and name HN) 3.733 1.742 1.742 weight 1.000 ! spec=HCH, no=3475, id=6389, vol=4.740000e+06
or (resid 91 and name HD11) (resid 66 and name HN)
or (resid 91 and name HD13) (resid 66 and name HN)
assign (resid 91 and name HD12) (resid 66 and name HB) 3.123 1.220 1.220 weight 1.000 ! spec=HCH, no=3476, id=6390, vol=1.380000e+07
or (resid 91 and name HD11) (resid 66 and name HB)
or (resid 91 and name HD13) (resid 66 and name HB)
assign (resid 91 and name HD12) (resid 90 and name HN) 3.719 1.729 1.729 weight 1.000 ! spec=HCH, no=3477, id=6391, vol=4.850000e+06
or (resid 91 and name HD11) (resid 90 and name HN)
or (resid 91 and name HD13) (resid 90 and name HN)
assign (resid 91 and name HN) (resid 91 and name HD12) 2.931 1.074 1.074 weight 1.000 ! spec=HCH, no=3479, id=6393, vol=2.020000e+07
or (resid 91 and name HN) (resid 91 and name HD11)
or (resid 91 and name HN) (resid 91 and name HD13)
assign (resid 91 and name HA) (resid 91 and name HD12) 2.246 0.631 0.631 weight 1.000 ! spec=HCH, no=3480, id=6394, vol=9.980000e+07
or (resid 91 and name HA) (resid 91 and name HD11)
or (resid 91 and name HA) (resid 91 and name HD13)
assign (resid 91 and name HD12) (resid 91 and name HB1) 2.470 0.763 0.763 weight 1.000 ! spec=HCH, no=3481, id=6395, vol=5.650000e+07
or (resid 91 and name HD11) (resid 91 and name HB1)
or (resid 91 and name HD13) (resid 91 and name HB1)
assign (resid 91 and name HD12) (resid 91 and name HD11) 1.363 0.232 0.232 weight 1.000 ! spec=HCH, no=3482, id=6396, vol=2.000000e+09
or (resid 91 and name HD12) (resid 91 and name HD13)
or (resid 91 and name HD12) (resid 91 and name HD11)
or (resid 91 and name HD11) (resid 91 and name HD13)
or (resid 91 and name HD12) (resid 91 and name HD13)
or (resid 91 and name HD11) (resid 91 and name HD13)
assign (resid 91 and name HD12) (resid 104 and name HH2) 3.069 1.177 1.177 weight 1.000 ! spec=HCH, no=3483, id=6397, vol=1.530000e+07
or (resid 91 and name HD11) (resid 104 and name HH2)
or (resid 91 and name HD13) (resid 104 and name HH2)
assign (resid 91 and name HD12) (resid 104 and name HZ2) 3.590 1.611 1.611 weight 1.000 ! spec=HCH, no=3484, id=6398, vol=5.990000e+06
or (resid 91 and name HD11) (resid 104 and name HZ2)
or (resid 91 and name HD13) (resid 104 and name HZ2)
assign (resid 91 and name HD12) (resid 104 and name HZ3) 3.000 1.125 1.125 weight 1.000 ! spec=HCH, no=3485, id=6399, vol=1.760000e+07
or (resid 91 and name HD11) (resid 104 and name HZ3)
or (resid 91 and name HD13) (resid 104 and name HZ3)
assign (resid 91 and name HD12) (resid 130 and name HA) 3.164 1.251 1.251 weight 1.000 ! spec=HCH, no=3486, id=6400, vol=1.280000e+07
or (resid 91 and name HD11) (resid 130 and name HA)
or (resid 91 and name HD13) (resid 130 and name HA)
assign (resid 91 and name HD12) (resid 131 and name HA) 3.138 1.231 1.231 weight 1.000 ! spec=HCH, no=3487, id=6401, vol=1.340000e+07
or (resid 91 and name HD11) (resid 131 and name HA)
or (resid 91 and name HD13) (resid 131 and name HA)
assign (resid 91 and name HD12) (resid 131 and name HB2) 1.972 0.486 0.486 weight 1.000 ! spec=HCH, no=3488, id=6402, vol=2.180000e+08
or (resid 91 and name HD11) (resid 131 and name HB2)
or (resid 91 and name HD13) (resid 131 and name HB2)
assign (resid 91 and name HD12) (resid 131 and name HB1) 2.498 0.780 0.780 weight 1.000 ! spec=HCH, no=3489, id=6403, vol=5.270000e+07
or (resid 91 and name HD11) (resid 131 and name HB1)
or (resid 91 and name HD13) (resid 131 and name HB1)
assign (resid 91 and name HD12) (resid 138 and name HA) 4.010 2.010 2.010 weight 1.000 ! spec=HCH, no=3491, id=6405, vol=3.080000e+06
or (resid 91 and name HD11) (resid 138 and name HA)
or (resid 91 and name HD13) (resid 138 and name HA)
assign (resid 91 and name HD22) (resid 138 and name HB2) 2.944 1.083 1.083 weight 1.000 ! spec=HCH, no=3492, id=6406, vol=1.970000e+07
or (resid 91 and name HD21) (resid 138 and name HB2)
or (resid 91 and name HD23) (resid 138 and name HB2)
assign (resid 91 and name HD12) (resid 138 and name HB1) 3.512 1.542 1.542 weight 1.000 ! spec=HCH, no=3493, id=6407, vol=6.830000e+06
or (resid 91 and name HD11) (resid 138 and name HB1)
or (resid 91 and name HD13) (resid 138 and name HB1)
assign (resid 91 and name HD12) (resid 138 and name HZ2) 3.594 1.615 1.615 weight 1.000 ! spec=HCH, no=3496, id=6410, vol=5.950000e+06
or (resid 91 and name HD11) (resid 138 and name HZ2)
or (resid 91 and name HD13) (resid 138 and name HZ2)
assign (resid 91 and name HD12) (resid 138 and name HZ3) 3.896 1.897 1.897 weight 1.000 ! spec=HCH, no=3497, id=6411, vol=3.670000e+06
or (resid 91 and name HD11) (resid 138 and name HZ3)
or (resid 91 and name HD13) (resid 138 and name HZ3)
assign (resid 91 and name HD22) (resid 138 and name HZ3) 3.525 1.553 1.553 weight 1.000 ! spec=HCH, no=3498, id=6412, vol=6.690000e+06
or (resid 91 and name HD21) (resid 138 and name HZ3)
or (resid 91 and name HD23) (resid 138 and name HZ3)
assign (resid 92 and name HN) (resid 91 and name HD22) 3.315 1.374 1.374 weight 1.000 ! spec=HCH, no=3499, id=6413, vol=9.660000e+06
or (resid 92 and name HN) (resid 91 and name HD21)
or (resid 92 and name HN) (resid 91 and name HD23)
assign (resid 66 and name HD12) (resid 91 and name HD22) 2.532 0.801 0.801 weight 1.000 ! spec=HCH, no=3501, id=6415, vol=4.870000e+07
or (resid 66 and name HD12) (resid 91 and name HD21)
or (resid 66 and name HD12) (resid 91 and name HD23)
or (resid 66 and name HD11) (resid 91 and name HD22)
or (resid 66 and name HD11) (resid 91 and name HD21)
or (resid 66 and name HD11) (resid 91 and name HD23)
or (resid 66 and name HD13) (resid 91 and name HD22)
or (resid 66 and name HD13) (resid 91 and name HD21)
or (resid 66 and name HD13) (resid 91 and name HD23)
assign (resid 91 and name HD22) (resid 138 and name HE3) 2.883 1.039 1.039 weight 1.000 ! spec=HCH, no=3505, id=6419, vol=2.230000e+07
or (resid 91 and name HD21) (resid 138 and name HE3)
or (resid 91 and name HD23) (resid 138 and name HE3)
assign (resid 139 and name HN) (resid 91 and name HD22) 3.552 1.577 1.577 weight 1.000 ! spec=HCH, no=3509, id=6422, vol=6.390000e+06
or (resid 139 and name HN) (resid 91 and name HD21)
or (resid 139 and name HN) (resid 91 and name HD23)
assign (resid 138 and name HE1) (resid 91 and name HD22) 3.492 1.524 1.524 weight 1.000 ! spec=HCH, no=3510, id=6423, vol=7.070000e+06
or (resid 138 and name HE1) (resid 91 and name HD21)
or (resid 138 and name HE1) (resid 91 and name HD23)
assign (resid 91 and name HD22) (resid 91 and name HG) 2.227 0.620 0.620 weight 1.000 ! spec=HCH, no=3511, id=6424, vol=1.050000e+08
or (resid 91 and name HD21) (resid 91 and name HG)
or (resid 91 and name HD23) (resid 91 and name HG)
assign (resid 91 and name HD22) (resid 66 and name HB) 3.375 1.424 1.424 weight 1.000 ! spec=HCH, no=3516, id=6428, vol=8.670000e+06
or (resid 91 and name HD21) (resid 66 and name HB)
or (resid 91 and name HD23) (resid 66 and name HB)
assign (resid 91 and name HN) (resid 91 and name HD22) 3.008 1.131 1.131 weight 1.000 ! spec=HCH, no=3517, id=6429, vol=1.730000e+07
or (resid 91 and name HN) (resid 91 and name HD21)
or (resid 91 and name HN) (resid 91 and name HD23)
assign (resid 91 and name HA) (resid 91 and name HD22) 2.972 1.104 1.104 weight 1.000 ! spec=HCH, no=3518, id=6430, vol=1.860000e+07
or (resid 91 and name HA) (resid 91 and name HD21)
or (resid 91 and name HA) (resid 91 and name HD23)
assign (resid 91 and name HB1) (resid 91 and name HD22) 2.389 0.714 0.714 weight 1.000 ! spec=HCH, no=3519, id=6431, vol=6.890000e+07
or (resid 91 and name HB1) (resid 91 and name HD21)
or (resid 91 and name HB1) (resid 91 and name HD23)
assign (resid 91 and name HD22) (resid 91 and name HD21) 1.360 0.231 0.231 weight 1.000 ! spec=HCH, no=3521, id=6433, vol=2.030000e+09
or (resid 91 and name HD22) (resid 91 and name HD23)
or (resid 91 and name HD22) (resid 91 and name HD21)
or (resid 91 and name HD21) (resid 91 and name HD23)
or (resid 91 and name HD22) (resid 91 and name HD23)
or (resid 91 and name HD21) (resid 91 and name HD23)
assign (resid 91 and name HD22) (resid 104 and name HH2) 2.879 1.036 1.036 weight 1.000 ! spec=HCH, no=3522, id=6434, vol=2.250000e+07
or (resid 91 and name HD21) (resid 104 and name HH2)
or (resid 91 and name HD23) (resid 104 and name HH2)
assign (resid 91 and name HD22) (resid 104 and name HZ3) 3.051 1.164 1.164 weight 1.000 ! spec=HCH, no=3524, id=6436, vol=1.590000e+07
or (resid 91 and name HD21) (resid 104 and name HZ3)
or (resid 91 and name HD23) (resid 104 and name HZ3)
assign (resid 91 and name HD22) (resid 114 and name HN) 3.248 1.319 1.319 weight 1.000 ! spec=HCH, no=3525, id=6437, vol=1.090000e+07
or (resid 91 and name HD21) (resid 114 and name HN)
or (resid 91 and name HD23) (resid 114 and name HN)
assign (resid 91 and name HD22) (resid 131 and name HA) 3.121 1.217 1.217 weight 1.000 ! spec=HCH, no=3527, id=6439, vol=1.390000e+07
or (resid 91 and name HD21) (resid 131 and name HA)
or (resid 91 and name HD23) (resid 131 and name HA)
assign (resid 91 and name HD22) (resid 131 and name HB2) 2.264 0.641 0.641 weight 1.000 ! spec=HCH, no=3528, id=6440, vol=9.530000e+07
or (resid 91 and name HD21) (resid 131 and name HB2)
or (resid 91 and name HD23) (resid 131 and name HB2)
assign (resid 91 and name HD22) (resid 138 and name HA) 3.182 1.266 1.266 weight 1.000 ! spec=HCH, no=3532, id=6444, vol=1.240000e+07
or (resid 91 and name HD21) (resid 138 and name HA)
or (resid 91 and name HD23) (resid 138 and name HA)
assign (resid 91 and name HD22) (resid 138 and name HB1) 2.828 1.000 1.000 weight 1.000 ! spec=HCH, no=3533, id=6445, vol=2.510000e+07
or (resid 91 and name HD21) (resid 138 and name HB1)
or (resid 91 and name HD23) (resid 138 and name HB1)
assign (resid 91 and name HD22) (resid 138 and name HH2) 3.995 1.995 1.995 weight 1.000 ! spec=HCH, no=3535, id=6447, vol=3.160000e+06
or (resid 91 and name HD21) (resid 138 and name HH2)
or (resid 91 and name HD23) (resid 138 and name HH2)
assign (resid 91 and name HD22) (resid 138 and name HZ2) 3.763 1.770 1.770 weight 1.000 ! spec=HCH, no=3536, id=6448, vol=4.520000e+06
or (resid 91 and name HD21) (resid 138 and name HZ2)
or (resid 91 and name HD23) (resid 138 and name HZ2)
assign (resid 91 and name HG) (resid 104 and name HZ2) 3.516 1.546 1.546 weight 1.000 ! spec=HCH, no=3538, id=6450, vol=6.780000e+06
assign (resid 91 and name HG) (resid 92 and name HN) 3.316 1.374 1.374 weight 1.000 ! spec=HCH, no=3542, id=6454, vol=9.650000e+06
assign (resid 91 and name HG) (resid 91 and name HD12) 2.780 0.966 0.966 weight 1.000 ! spec=HCH, no=3545, id=6457, vol=2.780000e+07
or (resid 91 and name HG) (resid 91 and name HD11)
or (resid 91 and name HG) (resid 91 and name HD13)
assign (resid 92 and name HA2) (resid 92 and name HA1) 2.554 0.816 0.816 weight 1.000 ! spec=HCH, no=3548, id=6460, vol=4.620000e+07
assign (resid 63 and name HB2) (resid 92 and name HA2) 3.046 1.160 1.160 weight 1.000 ! spec=HCH, no=3549, id=6461, vol=1.600000e+07
assign (resid 92 and name HA2) (resid 64 and name HG12) 3.670 1.684 1.684 weight 1.000 ! spec=HCH, no=3550, id=6462, vol=5.250000e+06
assign (resid 63 and name HB1) (resid 92 and name HA1) 2.912 1.060 1.060 weight 1.000 ! spec=HCH, no=3552, id=6464, vol=2.100000e+07
assign (resid 92 and name HA1) (resid 105 and name HD1) 3.084 1.189 1.189 weight 1.000 ! spec=HCH, no=3553, id=6465, vol=1.490000e+07
or (resid 92 and name HA1) (resid 105 and name HD2)
assign (resid 63 and name HB2) (resid 92 and name HA1) 3.115 1.213 1.213 weight 1.000 ! spec=HCH, no=3555, id=6466, vol=1.400000e+07
assign (resid 92 and name HA2) (resid 91 and name HB2) 3.431 1.471 1.471 weight 1.000 ! spec=HCH, no=3557, id=6468, vol=7.860000e+06
assign (resid 92 and name HN) (resid 92 and name HA2) 2.682 0.899 0.899 weight 1.000 ! spec=HCH, no=3559, id=6470, vol=3.440000e+07
assign (resid 92 and name HN) (resid 92 and name HA1) 2.681 0.898 0.898 weight 1.000 ! spec=HCH, no=3560, id=6471, vol=3.460000e+07
assign (resid 92 and name HA2) (resid 105 and name HE1) 3.550 1.576 1.576 weight 1.000 ! spec=HCH, no=3564, id=6475, vol=6.400000e+06
assign (resid 92 and name HA1) (resid 105 and name HE1) 3.427 1.468 1.468 weight 1.000 ! spec=HCH, no=3565, id=6476, vol=7.910000e+06
assign (resid 93 and name HA) (resid 93 and name HG2) 2.922 1.067 1.067 weight 1.000 ! spec=HCH, no=3568, id=6479, vol=2.060000e+07
or (resid 93 and name HA) (resid 93 and name HG1)
assign (resid 93 and name HA) (resid 91 and name HB2) 3.488 1.521 1.521 weight 1.000 ! spec=HCH, no=3569, id=6480, vol=7.120000e+06
assign (resid 93 and name HA) (resid 93 and name HB2) 2.796 0.977 0.977 weight 1.000 ! spec=HCH, no=3572, id=6482, vol=2.680000e+07
assign (resid 93 and name HA) (resid 93 and name HB1) 2.885 1.040 1.040 weight 1.000 ! spec=HCH, no=3573, id=6483, vol=2.220000e+07
assign (resid 93 and name HA) (resid 94 and name HD1) 3.361 1.412 1.412 weight 1.000 ! spec=HCH, no=3576, id=6486, vol=8.890000e+06
assign (resid 93 and name HA) (resid 104 and name HN) 3.447 1.485 1.485 weight 1.000 ! spec=HCH, no=3577, id=6487, vol=7.650000e+06
assign (resid 93 and name HA) (resid 104 and name HE3) 3.428 1.469 1.469 weight 1.000 ! spec=HCH, no=3578, id=6488, vol=7.900000e+06
assign (resid 93 and name HA) (resid 105 and name HN) 2.972 1.104 1.104 weight 1.000 ! spec=HCH, no=3579, id=6489, vol=1.860000e+07
assign (resid 93 and name HB2) (resid 91 and name HD12) 4.255 2.263 2.263 weight 1.000 ! spec=HCH, no=3580, id=6490, vol=2.160000e+06
or (resid 93 and name HB2) (resid 91 and name HD11)
or (resid 93 and name HB2) (resid 91 and name HD13)
assign (resid 93 and name HB2) (resid 102 and name HD1) 3.424 1.465 1.465 weight 1.000 ! spec=HCH, no=3581, id=6491, vol=7.960000e+06
or (resid 93 and name HB2) (resid 102 and name HD2)
assign (resid 93 and name HB2) (resid 93 and name HE2) 2.061 0.531 0.531 weight 1.000 ! spec=HCH, no=3582, id=6492, vol=1.670000e+08
or (resid 93 and name HB2) (resid 93 and name HE1)
or (resid 93 and name HB2) (resid 93 and name HE3)
assign (resid 93 and name HB2) (resid 93 and name HN) 3.303 1.363 1.363 weight 1.000 ! spec=HCH, no=3589, id=6499, vol=9.880000e+06
assign (resid 93 and name HB1) (resid 93 and name HN) 3.452 1.490 1.490 weight 1.000 ! spec=HCH, no=3590, id=6500, vol=7.570000e+06
assign (resid 93 and name HB2) (resid 94 and name HD1) 3.917 1.918 1.918 weight 1.000 ! spec=HCH, no=3595, id=6505, vol=3.550000e+06
assign (resid 93 and name HB2) (resid 102 and name HA) 4.106 2.107 2.107 weight 1.000 ! spec=HCH, no=3596, id=6506, vol=2.680000e+06
assign (resid 93 and name HB1) (resid 104 and name HE3) 3.371 1.420 1.420 weight 1.000 ! spec=HCH, no=3599, id=6509, vol=8.740000e+06
assign (resid 93 and name HB1) (resid 115 and name HZ2) 3.887 1.889 1.889 weight 1.000 ! spec=HCH, no=3600, id=6510, vol=3.720000e+06
assign (resid 93 and name HG2) (resid 91 and name HD22) 3.598 1.618 1.618 weight 1.000 ! spec=HCH, no=3615, id=6522, vol=5.910000e+06
or (resid 93 and name HG2) (resid 91 and name HD21)
or (resid 93 and name HG2) (resid 91 and name HD23)
assign (resid 93 and name HN) (resid 93 and name HG2) 2.951 1.089 1.089 weight 1.000 ! spec=HCH, no=3616, id=6523, vol=1.940000e+07
assign (resid 93 and name HA) (resid 93 and name HG2) 2.859 1.022 1.022 weight 1.000 ! spec=HCH, no=3617, id=6524, vol=2.350000e+07
assign (resid 93 and name HG2) (resid 102 and name HD1) 2.666 0.888 0.888 weight 1.000 ! spec=HCH, no=3619, id=6526, vol=3.570000e+07
assign (resid 93 and name HG2) (resid 104 and name HZ3) 3.512 1.541 1.541 weight 1.000 ! spec=HCH, no=3620, id=6527, vol=6.840000e+06
assign (resid 94 and name HA) (resid 94 and name HB2) 2.437 0.743 0.743 weight 1.000 ! spec=HCH, no=3625, id=6531, vol=6.110000e+07
assign (resid 94 and name HA) (resid 94 and name HB1) 2.492 0.776 0.776 weight 1.000 ! spec=HCH, no=3626, id=6532, vol=5.350000e+07
assign (resid 94 and name HA) (resid 94 and name HD1) 3.001 1.125 1.125 weight 1.000 ! spec=HCH, no=3628, id=6534, vol=1.760000e+07
assign (resid 95 and name HN) (resid 94 and name HA) 2.341 0.685 0.685 weight 1.000 ! spec=HCH, no=3629, id=6535, vol=7.790000e+07
assign (resid 95 and name HN) (resid 94 and name HB2) 2.956 1.092 1.092 weight 1.000 ! spec=HCH, no=3632, id=6538, vol=1.920000e+07
assign (resid 94 and name HB1) (resid 94 and name HE1) 3.476 1.510 1.510 weight 1.000 ! spec=HCH, no=3637, id=6543, vol=7.270000e+06
or (resid 94 and name HB1) (resid 94 and name HE2)
assign (resid 94 and name HB1) (resid 94 and name HB2) 2.370 0.702 0.702 weight 1.000 ! spec=HCH, no=3642, id=6548, vol=7.240000e+07
assign (resid 94 and name HB1) (resid 94 and name HD1) 2.727 0.929 0.929 weight 1.000 ! spec=HCH, no=3646, id=6552, vol=3.120000e+07
assign (resid 95 and name HA) (resid 94 and name HN) 3.744 1.752 1.752 weight 1.000 ! spec=HCH, no=3657, id=6562, vol=4.660000e+06
assign (resid 95 and name HA) (resid 95 and name HB2) 2.833 1.003 1.003 weight 1.000 ! spec=HCH, no=3661, id=6565, vol=2.480000e+07
assign (resid 95 and name HA) (resid 95 and name HB1) 2.914 1.061 1.061 weight 1.000 ! spec=HCH, no=3662, id=6566, vol=2.090000e+07
assign (resid 95 and name HA) (resid 96 and name HB1) 3.230 1.304 1.304 weight 1.000 ! spec=HCH, no=3665, id=6569, vol=1.130000e+07
assign (resid 95 and name HA) (resid 103 and name HG2) 3.677 1.690 1.690 weight 1.000 ! spec=HCH, no=3670, id=6574, vol=5.190000e+06
assign (resid 95 and name HB2) (resid 94 and name HA) 3.864 1.866 1.866 weight 1.000 ! spec=HCH, no=3672, id=6575, vol=3.850000e+06
assign (resid 95 and name HB1) (resid 94 and name HA) 3.860 1.863 1.863 weight 1.000 ! spec=HCH, no=3673, id=6576, vol=3.870000e+06
assign (resid 95 and name HB2) (resid 95 and name HN) 2.928 1.072 1.072 weight 1.000 ! spec=HCH, no=3674, id=6577, vol=2.040000e+07
assign (resid 95 and name HB2) (resid 95 and name HB1) 2.379 0.707 0.707 weight 1.000 ! spec=HCH, no=3678, id=6581, vol=7.080000e+07
assign (resid 95 and name HB1) (resid 95 and name HD1) 2.700 0.911 0.911 weight 1.000 ! spec=HCH, no=3680, id=6583, vol=3.310000e+07
assign (resid 95 and name HB2) (resid 102 and name HA) 3.939 1.940 1.940 weight 1.000 ! spec=HCH, no=3682, id=6585, vol=3.430000e+06
assign (resid 95 and name HB1) (resid 102 and name HE1) 3.379 1.427 1.427 weight 1.000 ! spec=HCH, no=3684, id=6587, vol=8.610000e+06
assign (resid 95 and name HB1) (resid 124 and name HB2) 4.225 2.231 2.231 weight 1.000 ! spec=HCH, no=3687, id=6590, vol=2.260000e+06
assign (resid 95 and name HB1) (resid 125 and name HG12) 4.012 2.012 2.012 weight 1.000 ! spec=HCH, no=3688, id=6591, vol=3.080000e+06
or (resid 95 and name HB1) (resid 125 and name HG11)
or (resid 95 and name HB1) (resid 125 and name HG13)
assign (resid 96 and name HB2) (resid 94 and name HD1) 3.559 1.584 1.584 weight 1.000 ! spec=HCH, no=3692, id=6595, vol=6.310000e+06
or (resid 96 and name HB2) (resid 94 and name HD2)
assign (resid 97 and name HN) (resid 96 and name HB2) 3.588 1.609 1.609 weight 1.000 ! spec=HCH, no=3695, id=6598, vol=6.010000e+06
assign (resid 96 and name HB2) (resid 96 and name HB1) 2.258 0.637 0.637 weight 1.000 ! spec=HCH, no=3696, id=6599, vol=9.670000e+07
assign (resid 96 and name HB1) (resid 96 and name HA) 2.755 0.949 0.949 weight 1.000 ! spec=HCH, no=3702, id=6603, vol=2.930000e+07
assign (resid 96 and name HB1) (resid 99 and name HB2) 3.630 1.647 1.647 weight 1.000 ! spec=HCH, no=3705, id=6606, vol=5.600000e+06
assign (resid 96 and name HB1) (resid 95 and name HD1) 3.801 1.806 1.806 weight 1.000 ! spec=HCH, no=3709, id=6610, vol=4.250000e+06
assign (resid 96 and name HB2) (resid 96 and name HA) 2.929 1.072 1.072 weight 1.000 ! spec=HCH, no=3711, id=6612, vol=2.030000e+07
assign (resid 97 and name HA) (resid 96 and name HN) 3.693 1.704 1.704 weight 1.000 ! spec=HCH, no=3718, id=6619, vol=5.060000e+06
assign (resid 97 and name HA) (resid 96 and name HA) 3.238 1.311 1.311 weight 1.000 ! spec=HCH, no=3719, id=6620, vol=1.110000e+07
assign (resid 97 and name HA) (resid 125 and name HG22) 3.741 1.749 1.749 weight 1.000 ! spec=HCH, no=3728, id=6628, vol=4.680000e+06
or (resid 97 and name HA) (resid 125 and name HG21)
or (resid 97 and name HA) (resid 125 and name HG23)
assign (resid 97 and name HB) (resid 95 and name HD1) 3.604 1.623 1.623 weight 1.000 ! spec=HCH, no=3729, id=6629, vol=5.850000e+06
or (resid 97 and name HB) (resid 95 and name HD2)
assign (resid 97 and name HB) (resid 100 and name HN) 3.723 1.733 1.733 weight 1.000 ! spec=HCH, no=3730, id=6630, vol=4.820000e+06
assign (resid 97 and name HB) (resid 95 and name HE1) 3.402 1.447 1.447 weight 1.000 ! spec=HCH, no=3731, id=6631, vol=8.260000e+06
or (resid 97 and name HB) (resid 95 and name HE2)
assign (resid 97 and name HN) (resid 97 and name HB) 2.714 0.921 0.921 weight 1.000 ! spec=HCH, no=3732, id=6632, vol=3.210000e+07
assign (resid 97 and name HA) (resid 97 and name HB) 2.290 0.656 0.656 weight 1.000 ! spec=HCH, no=3733, id=6633, vol=8.880000e+07
assign (resid 97 and name HB) (resid 98 and name HN) 3.087 1.192 1.192 weight 1.000 ! spec=HCH, no=3736, id=6635, vol=1.480000e+07
assign (resid 97 and name HB) (resid 99 and name HN) 3.868 1.870 1.870 weight 1.000 ! spec=HCH, no=3737, id=6636, vol=3.830000e+06
assign (resid 97 and name HG21) (resid 124 and name HD22) 3.097 1.199 1.199 weight 1.000 ! spec=HCH, no=3739, id=6638, vol=1.450000e+07
or (resid 97 and name HG21) (resid 124 and name HD21)
or (resid 97 and name HG21) (resid 124 and name HD23)
or (resid 97 and name HG22) (resid 124 and name HD22)
or (resid 97 and name HG22) (resid 124 and name HD21)
or (resid 97 and name HG22) (resid 124 and name HD23)
or (resid 97 and name HG23) (resid 124 and name HD22)
or (resid 97 and name HG23) (resid 124 and name HD21)
or (resid 97 and name HG23) (resid 124 and name HD23)
assign (resid 97 and name HG21) (resid 95 and name HE1) 2.371 0.703 0.703 weight 1.000 ! spec=HCH, no=3742, id=6641, vol=7.220000e+07
or (resid 97 and name HG21) (resid 95 and name HE2)
or (resid 97 and name HG22) (resid 95 and name HE1)
or (resid 97 and name HG22) (resid 95 and name HE2)
or (resid 97 and name HG23) (resid 95 and name HE1)
or (resid 97 and name HG23) (resid 95 and name HE2)
assign (resid 96 and name HN) (resid 97 and name HG21) 3.432 1.472 1.472 weight 1.000 ! spec=HCH, no=3743, id=6642, vol=7.850000e+06
or (resid 96 and name HN) (resid 97 and name HG22)
or (resid 96 and name HN) (resid 97 and name HG23)
assign (resid 98 and name HN) (resid 97 and name HG21) 2.881 1.037 1.037 weight 1.000 ! spec=HCH, no=3748, id=6646, vol=2.240000e+07
or (resid 98 and name HN) (resid 97 and name HG22)
or (resid 98 and name HN) (resid 97 and name HG23)
assign (resid 97 and name HG21) (resid 101 and name HN) 3.566 1.589 1.589 weight 1.000 ! spec=HCH, no=3749, id=6647, vol=6.240000e+06
or (resid 97 and name HG22) (resid 101 and name HN)
or (resid 97 and name HG23) (resid 101 and name HN)
assign (resid 97 and name HG21) (resid 96 and name HA) 2.741 0.939 0.939 weight 1.000 ! spec=HCH, no=3750, id=6648, vol=3.020000e+07
or (resid 97 and name HG22) (resid 96 and name HA)
or (resid 97 and name HG23) (resid 96 and name HA)
assign (resid 97 and name HG21) (resid 95 and name HB1) 3.199 1.279 1.279 weight 1.000 ! spec=HCH, no=3752, id=6650, vol=1.200000e+07
or (resid 97 and name HG22) (resid 95 and name HB1)
or (resid 97 and name HG23) (resid 95 and name HB1)
assign (resid 97 and name HN) (resid 97 and name HG21) 2.263 0.640 0.640 weight 1.000 ! spec=HCH, no=3754, id=6652, vol=9.550000e+07
or (resid 97 and name HN) (resid 97 and name HG22)
or (resid 97 and name HN) (resid 97 and name HG23)
assign (resid 97 and name HA) (resid 97 and name HG21) 2.231 0.622 0.622 weight 1.000 ! spec=HCH, no=3755, id=6653, vol=1.040000e+08
or (resid 97 and name HA) (resid 97 and name HG22)
or (resid 97 and name HA) (resid 97 and name HG23)
assign (resid 97 and name HB) (resid 97 and name HG21) 2.059 0.530 0.530 weight 1.000 ! spec=HCH, no=3756, id=6654, vol=1.680000e+08
or (resid 97 and name HB) (resid 97 and name HG22)
or (resid 97 and name HB) (resid 97 and name HG23)
assign (resid 97 and name HG21) (resid 97 and name HG22) 1.108 0.153 0.153 weight 1.000 ! spec=HCH, no=3757, id=6655, vol=6.940000e+09
or (resid 97 and name HG21) (resid 97 and name HG23)
or (resid 97 and name HG21) (resid 97 and name HG22)
or (resid 97 and name HG22) (resid 97 and name HG23)
or (resid 97 and name HG21) (resid 97 and name HG23)
or (resid 97 and name HG22) (resid 97 and name HG23)
assign (resid 97 and name HG21) (resid 125 and name HG22) 2.293 0.657 0.657 weight 1.000 ! spec=HCH, no=3760, id=6658, vol=8.830000e+07
or (resid 97 and name HG21) (resid 125 and name HG21)
or (resid 97 and name HG21) (resid 125 and name HG23)
or (resid 97 and name HG22) (resid 125 and name HG22)
or (resid 97 and name HG22) (resid 125 and name HG21)
or (resid 97 and name HG22) (resid 125 and name HG23)
or (resid 97 and name HG23) (resid 125 and name HG22)
or (resid 97 and name HG23) (resid 125 and name HG21)
or (resid 97 and name HG23) (resid 125 and name HG23)
assign (resid 98 and name HA) (resid 98 and name HN) 2.541 0.807 0.807 weight 1.000 ! spec=HCH, no=3763, id=6661, vol=4.760000e+07
assign (resid 98 and name HA) (resid 98 and name HB2) 2.313 0.669 0.669 weight 1.000 ! spec=HCH, no=3764, id=6662, vol=8.370000e+07
assign (resid 98 and name HB2) (resid 98 and name HN) 2.673 0.893 0.893 weight 1.000 ! spec=HCH, no=3770, id=6668, vol=3.520000e+07
assign (resid 98 and name HB1) (resid 98 and name HA) 2.554 0.816 0.816 weight 1.000 ! spec=HCH, no=3771, id=6669, vol=4.610000e+07
assign (resid 98 and name HB2) (resid 98 and name HB1) 1.951 0.476 0.476 weight 1.000 ! spec=HCH, no=3773, id=6670, vol=2.330000e+08
assign (resid 99 and name HN) (resid 98 and name HB1) 2.941 1.081 1.081 weight 1.000 ! spec=HCH, no=3775, id=6672, vol=1.980000e+07
assign (resid 99 and name HA) (resid 99 and name HB2) 2.246 0.630 0.630 weight 1.000 ! spec=HCH, no=3777, id=6673, vol=1.000000e+08
assign (resid 99 and name HB2) (resid 99 and name HB1) 2.066 0.533 0.533 weight 1.000 ! spec=HCH, no=3780, id=6676, vol=1.650000e+08
assign (resid 100 and name HA) (resid 95 and name HD1) 3.803 1.808 1.808 weight 1.000 ! spec=HCH, no=3790, id=6685, vol=4.240000e+06
assign (resid 100 and name HA) (resid 99 and name HB2) 3.789 1.795 1.795 weight 1.000 ! spec=HCH, no=3792, id=6687, vol=4.330000e+06
assign (resid 100 and name HA) (resid 103 and name HE2) 4.101 2.103 2.103 weight 1.000 ! spec=HCH, no=3796, id=6690, vol=2.690000e+06
assign (resid 100 and name HB2) (resid 97 and name HB) 3.335 1.390 1.390 weight 1.000 ! spec=HCH, no=3797, id=6691, vol=9.320000e+06
or (resid 100 and name HB1) (resid 97 and name HB)
or (resid 100 and name HB3) (resid 97 and name HB)
assign (resid 97 and name HA) (resid 100 and name HB2) 2.915 1.062 1.062 weight 1.000 ! spec=HCH, no=3801, id=6695, vol=2.090000e+07
or (resid 97 and name HA) (resid 100 and name HB1)
or (resid 97 and name HA) (resid 100 and name HB3)
assign (resid 100 and name HB2) (resid 95 and name HE1) 2.933 1.075 1.075 weight 1.000 ! spec=HCH, no=3805, id=6698, vol=2.010000e+07
or (resid 100 and name HB1) (resid 95 and name HE1)
or (resid 100 and name HB3) (resid 95 and name HE1)
assign (resid 99 and name HN) (resid 100 and name HB2) 3.278 1.343 1.343 weight 1.000 ! spec=HCH, no=3806, id=6699, vol=1.030000e+07
or (resid 99 and name HN) (resid 100 and name HB1)
or (resid 99 and name HN) (resid 100 and name HB3)
assign (resid 100 and name HB2) (resid 99 and name HA) 3.084 1.189 1.189 weight 1.000 ! spec=HCH, no=3807, id=6700, vol=1.490000e+07
or (resid 100 and name HB1) (resid 99 and name HA)
or (resid 100 and name HB3) (resid 99 and name HA)
assign (resid 100 and name HN) (resid 100 and name HB2) 2.347 0.688 0.688 weight 1.000 ! spec=HCH, no=3808, id=6701, vol=7.680000e+07
or (resid 100 and name HN) (resid 100 and name HB1)
or (resid 100 and name HN) (resid 100 and name HB3)
assign (resid 100 and name HA) (resid 100 and name HB2) 1.997 0.499 0.499 weight 1.000 ! spec=HCH, no=3809, id=6702, vol=2.020000e+08
or (resid 100 and name HA) (resid 100 and name HB1)
or (resid 100 and name HA) (resid 100 and name HB3)
assign (resid 100 and name HB2) (resid 100 and name HB1) 1.192 0.178 0.178 weight 1.000 ! spec=HCH, no=3810, id=6703, vol=4.470000e+09
or (resid 100 and name HB2) (resid 100 and name HB3)
or (resid 100 and name HB2) (resid 100 and name HB1)
or (resid 100 and name HB1) (resid 100 and name HB3)
or (resid 100 and name HB2) (resid 100 and name HB3)
or (resid 100 and name HB1) (resid 100 and name HB3)
assign (resid 101 and name HN) (resid 100 and name HB2) 2.758 0.951 0.951 weight 1.000 ! spec=HCH, no=3811, id=6704, vol=2.920000e+07
or (resid 101 and name HN) (resid 100 and name HB1)
or (resid 101 and name HN) (resid 100 and name HB3)
assign (resid 101 and name HA) (resid 95 and name HE1) 2.760 0.952 0.952 weight 1.000 ! spec=HCH, no=3823, id=6714, vol=2.900000e+07
assign (resid 101 and name HN) (resid 101 and name HA) 2.641 0.872 0.872 weight 1.000 ! spec=HCH, no=3824, id=6715, vol=3.780000e+07
assign (resid 102 and name HN) (resid 101 and name HA) 2.244 0.629 0.629 weight 1.000 ! spec=HCH, no=3827, id=6717, vol=1.000000e+08
assign (resid 101 and name HB2) (resid 103 and name HG2) 3.228 1.302 1.302 weight 1.000 ! spec=HCH, no=3828, id=6718, vol=1.130000e+07
or (resid 101 and name HB2) (resid 103 and name HG1)
assign (resid 101 and name HB2) (resid 100 and name HB2) 3.868 1.870 1.870 weight 1.000 ! spec=HCH, no=3829, id=6719, vol=3.830000e+06
or (resid 101 and name HB2) (resid 100 and name HB1)
or (resid 101 and name HB2) (resid 100 and name HB3)
assign (resid 101 and name HB2) (resid 99 and name HB2) 3.385 1.432 1.432 weight 1.000 ! spec=HCH, no=3831, id=6721, vol=8.520000e+06
assign (resid 101 and name HB1) (resid 100 and name HB2) 3.925 1.926 1.926 weight 1.000 ! spec=HCH, no=3833, id=6723, vol=3.510000e+06
or (resid 101 and name HB1) (resid 100 and name HB1)
or (resid 101 and name HB1) (resid 100 and name HB3)
assign (resid 101 and name HB1) (resid 103 and name HG2) 3.069 1.177 1.177 weight 1.000 ! spec=HCH, no=3834, id=6724, vol=1.540000e+07
or (resid 101 and name HB1) (resid 103 and name HG1)
assign (resid 99 and name HB2) (resid 101 and name HB1) 3.342 1.396 1.396 weight 1.000 ! spec=HCH, no=3835, id=6725, vol=9.200000e+06
assign (resid 101 and name HB2) (resid 101 and name HN) 3.003 1.127 1.127 weight 1.000 ! spec=HCH, no=3838, id=6728, vol=1.750000e+07
assign (resid 101 and name HB1) (resid 101 and name HN) 2.984 1.113 1.113 weight 1.000 ! spec=HCH, no=3839, id=6729, vol=1.820000e+07
assign (resid 101 and name HB2) (resid 101 and name HA) 2.482 0.770 0.770 weight 1.000 ! spec=HCH, no=3840, id=6730, vol=5.490000e+07
assign (resid 101 and name HA) (resid 101 and name HB1) 2.518 0.792 0.792 weight 1.000 ! spec=HCH, no=3841, id=6731, vol=5.030000e+07
assign (resid 101 and name HB2) (resid 102 and name HA) 3.648 1.663 1.663 weight 1.000 ! spec=HCH, no=3846, id=6734, vol=5.440000e+06
assign (resid 101 and name HB2) (resid 103 and name HE2) 3.248 1.319 1.319 weight 1.000 ! spec=HCH, no=3848, id=6736, vol=1.090000e+07
assign (resid 102 and name HA) (resid 102 and name HB2) 3.012 1.134 1.134 weight 1.000 ! spec=HCH, no=3851, id=6738, vol=1.720000e+07
assign (resid 95 and name HA) (resid 102 and name HA) 2.620 0.858 0.858 weight 1.000 ! spec=HCH, no=3855, id=6741, vol=3.970000e+07
assign (resid 101 and name HB1) (resid 102 and name HA) 3.506 1.537 1.537 weight 1.000 ! spec=HCH, no=3857, id=6743, vol=6.900000e+06
assign (resid 102 and name HN) (resid 102 and name HA) 2.361 0.697 0.697 weight 1.000 ! spec=HCH, no=3858, id=6744, vol=7.400000e+07
assign (resid 102 and name HA) (resid 102 and name HB1) 2.840 1.008 1.008 weight 1.000 ! spec=HCH, no=3859, id=6745, vol=2.440000e+07
assign (resid 102 and name HA) (resid 102 and name HD1) 2.889 1.043 1.043 weight 1.000 ! spec=HCH, no=3860, id=6746, vol=2.210000e+07
assign (resid 103 and name HN) (resid 102 and name HA) 2.360 0.696 0.696 weight 1.000 ! spec=HCH, no=3861, id=6747, vol=7.430000e+07
assign (resid 102 and name HA) (resid 103 and name HG2) 3.013 1.135 1.135 weight 1.000 ! spec=HCH, no=3862, id=6748, vol=1.710000e+07
assign (resid 102 and name HB1) (resid 93 and name HB2) 3.361 1.412 1.412 weight 1.000 ! spec=HCH, no=3868, id=6754, vol=8.890000e+06
assign (resid 103 and name HA) (resid 103 and name HB1) 2.609 0.851 0.851 weight 1.000 ! spec=HCH, no=3880, id=6766, vol=4.060000e+07
assign (resid 103 and name HA) (resid 103 and name HB2) 2.868 1.028 1.028 weight 1.000 ! spec=HCH, no=3886, id=6771, vol=2.310000e+07
assign (resid 103 and name HA) (resid 103 and name HG2) 2.397 0.718 0.718 weight 1.000 ! spec=HCH, no=3887, id=6772, vol=6.770000e+07
assign (resid 103 and name HA) (resid 104 and name HB2) 3.546 1.572 1.572 weight 1.000 ! spec=HCH, no=3889, id=6774, vol=6.450000e+06
assign (resid 103 and name HA) (resid 110 and name HB2) 3.665 1.679 1.679 weight 1.000 ! spec=HCH, no=3890, id=6775, vol=5.290000e+06
assign (resid 96 and name HN) (resid 103 and name HB2) 4.120 2.122 2.122 weight 1.000 ! spec=HCH, no=3895, id=6780, vol=2.620000e+06
assign (resid 103 and name HB2) (resid 93 and name HA) 4.182 2.187 2.187 weight 1.000 ! spec=HCH, no=3896, id=6781, vol=2.400000e+06
assign (resid 103 and name HB1) (resid 94 and name HZ) 3.831 1.834 1.834 weight 1.000 ! spec=HCH, no=3897, id=6782, vol=4.060000e+06
assign (resid 103 and name HB1) (resid 94 and name HE1) 3.576 1.599 1.599 weight 1.000 ! spec=HCH, no=3898, id=6783, vol=6.130000e+06
or (resid 103 and name HB1) (resid 94 and name HE2)
assign (resid 103 and name HB1) (resid 103 and name HE1) 3.905 1.906 1.906 weight 1.000 ! spec=HCH, no=3899, id=6784, vol=3.620000e+06
assign (resid 103 and name HB2) (resid 102 and name HA) 4.077 2.078 2.078 weight 1.000 ! spec=HCH, no=3906, id=6791, vol=2.790000e+06
assign (resid 103 and name HB1) (resid 103 and name HB2) 2.279 0.649 0.649 weight 1.000 ! spec=HCH, no=3908, id=6792, vol=9.160000e+07
assign (resid 103 and name HB1) (resid 103 and name HD1) 3.068 1.177 1.177 weight 1.000 ! spec=HCH, no=3912, id=6795, vol=1.540000e+07
assign (resid 103 and name HB1) (resid 103 and name HG2) 2.628 0.864 0.864 weight 1.000 ! spec=HCH, no=3915, id=6798, vol=3.890000e+07
assign (resid 103 and name HD2) (resid 103 and name HD1) 2.156 0.581 0.581 weight 1.000 ! spec=HCH, no=3916, id=6799, vol=1.280000e+08
assign (resid 103 and name HD2) (resid 103 and name HG2) 2.645 0.874 0.874 weight 1.000 ! spec=HCH, no=3918, id=6801, vol=3.750000e+07
or (resid 103 and name HD2) (resid 103 and name HG1)
assign (resid 103 and name HD2) (resid 94 and name HE1) 3.312 1.371 1.371 weight 1.000 ! spec=HCH, no=3921, id=6804, vol=9.720000e+06
or (resid 103 and name HD2) (resid 94 and name HE2)
assign (resid 103 and name HD1) (resid 96 and name HA) 3.778 1.784 1.784 weight 1.000 ! spec=HCH, no=3924, id=6807, vol=4.410000e+06
assign (resid 103 and name HD2) (resid 103 and name HB2) 3.057 1.168 1.168 weight 1.000 ! spec=HCH, no=3925, id=6808, vol=1.570000e+07
assign (resid 103 and name HB2) (resid 103 and name HD1) 3.147 1.238 1.238 weight 1.000 ! spec=HCH, no=3926, id=6809, vol=1.320000e+07
assign (resid 101 and name HB1) (resid 103 and name HE2) 3.113 1.211 1.211 weight 1.000 ! spec=HCH, no=3929, id=6812, vol=1.410000e+07
assign (resid 103 and name HE1) (resid 101 and name HB1) 3.034 1.151 1.151 weight 1.000 ! spec=HCH, no=3930, id=6813, vol=1.640000e+07
assign (resid 103 and name HE1) (resid 99 and name HB2) 3.060 1.170 1.170 weight 1.000 ! spec=HCH, no=3932, id=6815, vol=1.560000e+07
assign (resid 103 and name HB2) (resid 103 and name HE2) 3.630 1.647 1.647 weight 1.000 ! spec=HCH, no=3933, id=6816, vol=5.610000e+06
assign (resid 103 and name HE1) (resid 103 and name HB2) 3.529 1.557 1.557 weight 1.000 ! spec=HCH, no=3934, id=6817, vol=6.640000e+06
assign (resid 103 and name HE2) (resid 103 and name HD2) 2.806 0.984 0.984 weight 1.000 ! spec=HCH, no=3935, id=6818, vol=2.630000e+07
assign (resid 103 and name HE2) (resid 103 and name HD1) 2.861 1.023 1.023 weight 1.000 ! spec=HCH, no=3936, id=6819, vol=2.340000e+07
assign (resid 103 and name HE2) (resid 103 and name HE1) 1.823 0.415 0.415 weight 1.000 ! spec=HCH, no=3937, id=6820, vol=3.500000e+08
assign (resid 103 and name HE2) (resid 103 and name HG2) 2.690 0.905 0.905 weight 1.000 ! spec=HCH, no=3938, id=6821, vol=3.380000e+07
assign (resid 103 and name HE1) (resid 103 and name HG2) 2.453 0.752 0.752 weight 1.000 ! spec=HCH, no=3939, id=6822, vol=5.880000e+07
assign (resid 103 and name HG2) (resid 94 and name HD1) 4.034 2.034 2.034 weight 1.000 ! spec=HCH, no=3950, id=6832, vol=2.970000e+06
assign (resid 103 and name HG2) (resid 96 and name HB2) 2.935 1.077 1.077 weight 1.000 ! spec=HCH, no=3951, id=6833, vol=2.000000e+07
assign (resid 103 and name HB2) (resid 103 and name HG2) 2.669 0.890 0.890 weight 1.000 ! spec=HCH, no=3953, id=6835, vol=3.550000e+07
assign (resid 103 and name HD2) (resid 103 and name HG2) 2.377 0.706 0.706 weight 1.000 ! spec=HCH, no=3954, id=6836, vol=7.110000e+07
assign (resid 103 and name HD1) (resid 103 and name HG2) 2.553 0.815 0.815 weight 1.000 ! spec=HCH, no=3955, id=6837, vol=4.630000e+07
assign (resid 104 and name HA) (resid 105 and name HB2) 3.442 1.481 1.481 weight 1.000 ! spec=HCH, no=3962, id=6843, vol=7.710000e+06
assign (resid 104 and name HA) (resid 93 and name HN) 3.783 1.789 1.789 weight 1.000 ! spec=HCH, no=3964, id=6845, vol=4.380000e+06
assign (resid 104 and name HA) (resid 93 and name HG2) 3.502 1.533 1.533 weight 1.000 ! spec=HCH, no=3967, id=6848, vol=6.950000e+06
or (resid 104 and name HA) (resid 93 and name HG1)
assign (resid 104 and name HA) (resid 94 and name HN) 3.372 1.421 1.421 weight 1.000 ! spec=HCH, no=3968, id=6849, vol=8.730000e+06
assign (resid 104 and name HA) (resid 104 and name HB2) 3.115 1.213 1.213 weight 1.000 ! spec=HCH, no=3970, id=6851, vol=1.400000e+07
assign (resid 104 and name HA) (resid 104 and name HB1) 3.073 1.180 1.180 weight 1.000 ! spec=HCH, no=3971, id=6852, vol=1.520000e+07
assign (resid 104 and name HB2) (resid 107 and name HN) 3.871 1.873 1.873 weight 1.000 ! spec=HCH, no=3975, id=6856, vol=3.810000e+06
assign (resid 104 and name HB1) (resid 103 and name HA) 3.955 1.956 1.956 weight 1.000 ! spec=HCH, no=3978, id=6859, vol=3.350000e+06
assign (resid 104 and name HB1) (resid 104 and name HB2) 2.797 0.978 0.978 weight 1.000 ! spec=HCH, no=3988, id=6868, vol=2.680000e+07
assign (resid 104 and name HB1) (resid 105 and name HN) 3.663 1.677 1.677 weight 1.000 ! spec=HCH, no=3994, id=6874, vol=5.310000e+06
assign (resid 105 and name HA) (resid 105 and name HB2) 2.963 1.098 1.098 weight 1.000 ! spec=HCH, no=4002, id=6880, vol=1.890000e+07
assign (resid 105 and name HB2) (resid 107 and name HN) 4.040 2.040 2.040 weight 1.000 ! spec=HCH, no=4004, id=6882, vol=2.950000e+06
assign (resid 105 and name HB1) (resid 62 and name HA) 4.119 2.121 2.121 weight 1.000 ! spec=HCH, no=4013, id=6891, vol=2.620000e+06
assign (resid 105 and name HB1) (resid 104 and name HA) 3.967 1.967 1.967 weight 1.000 ! spec=HCH, no=4017, id=6895, vol=3.290000e+06
assign (resid 105 and name HB1) (resid 63 and name HN) 3.935 1.935 1.935 weight 1.000 ! spec=HCH, no=4020, id=6898, vol=3.460000e+06
assign (resid 105 and name HB2) (resid 104 and name HE3) 3.632 1.649 1.649 weight 1.000 ! spec=HCH, no=4021, id=6899, vol=5.590000e+06
assign (resid 105 and name HB1) (resid 105 and name HA) 3.022 1.141 1.141 weight 1.000 ! spec=HCH, no=4025, id=6903, vol=1.680000e+07
assign (resid 105 and name HB1) (resid 105 and name HB2) 2.578 0.831 0.831 weight 1.000 ! spec=HCH, no=4026, id=6904, vol=4.370000e+07
assign (resid 105 and name HB1) (resid 106 and name HA) 3.458 1.495 1.495 weight 1.000 ! spec=HCH, no=4032, id=6910, vol=7.500000e+06
assign (resid 106 and name HA) (resid 106 and name HB2) 2.451 0.751 0.751 weight 1.000 ! spec=HCH, no=4035, id=6912, vol=5.920000e+07
assign (resid 106 and name HA) (resid 106 and name HB1) 2.403 0.722 0.722 weight 1.000 ! spec=HCH, no=4036, id=6913, vol=6.670000e+07
assign (resid 106 and name HA) (resid 107 and name HN) 3.109 1.208 1.208 weight 1.000 ! spec=HCH, no=4037, id=6914, vol=1.420000e+07
assign (resid 106 and name HB1) (resid 106 and name HN) 3.320 1.378 1.378 weight 1.000 ! spec=HCH, no=4043, id=6920, vol=9.570000e+06
assign (resid 106 and name HB1) (resid 106 and name HB2) 2.524 0.796 0.796 weight 1.000 ! spec=HCH, no=4046, id=6923, vol=4.960000e+07
assign (resid 107 and name HA) (resid 107 and name HB1) 2.505 0.784 0.784 weight 1.000 ! spec=HCH, no=4051, id=6927, vol=5.190000e+07
assign (resid 107 and name HN) (resid 107 and name HB1) 3.110 1.209 1.209 weight 1.000 ! spec=HCH, no=4060, id=6936, vol=1.420000e+07
assign (resid 107 and name HA) (resid 107 and name HB2) 2.616 0.855 0.855 weight 1.000 ! spec=HCH, no=4061, id=6937, vol=4.000000e+07
assign (resid 107 and name HB1) (resid 107 and name HB2) 1.766 0.390 0.390 weight 1.000 ! spec=HCH, no=4065, id=6940, vol=4.220000e+08
assign (resid 107 and name HD22) (resid 107 and name HB1) 3.255 1.324 1.324 weight 1.000 ! spec=HCH, no=4071, id=6945, vol=1.080000e+07
assign (resid 108 and name HN) (resid 107 and name HB1) 3.899 1.900 1.900 weight 1.000 ! spec=HCH, no=4073, id=6947, vol=3.650000e+06
assign (resid 108 and name HA) (resid 104 and name HB2) 3.455 1.492 1.492 weight 1.000 ! spec=HCH, no=4074, id=6948, vol=7.540000e+06
assign (resid 108 and name HA) (resid 108 and name HB2) 2.624 0.861 0.861 weight 1.000 ! spec=HCH, no=4076, id=6950, vol=3.920000e+07
assign (resid 108 and name HA) (resid 108 and name HB1) 2.557 0.818 0.818 weight 1.000 ! spec=HCH, no=4077, id=6951, vol=4.580000e+07
assign (resid 109 and name HN) (resid 108 and name HA) 2.522 0.795 0.795 weight 1.000 ! spec=HCH, no=4078, id=6952, vol=4.990000e+07
assign (resid 108 and name HN) (resid 108 and name HB1) 3.017 1.137 1.137 weight 1.000 ! spec=HCH, no=4083, id=6957, vol=1.700000e+07
assign (resid 109 and name HN) (resid 109 and name HA) 2.737 0.936 0.936 weight 1.000 ! spec=HCH, no=4087, id=6961, vol=3.050000e+07
assign (resid 109 and name HA) (resid 109 and name HB2) 2.350 0.690 0.690 weight 1.000 ! spec=HCH, no=4089, id=6962, vol=7.610000e+07
assign (resid 109 and name HB2) (resid 111 and name HG21) 2.530 0.800 0.800 weight 1.000 ! spec=HCH, no=4094, id=6967, vol=4.890000e+07
or (resid 109 and name HB2) (resid 111 and name HG22)
or (resid 109 and name HB2) (resid 111 and name HG23)
assign (resid 110 and name HN) (resid 109 and name HB2) 2.977 1.108 1.108 weight 1.000 ! spec=HCH, no=4097, id=6970, vol=1.840000e+07
assign (resid 110 and name HA) (resid 111 and name HA) 3.219 1.295 1.295 weight 1.000 ! spec=HCH, no=4100, id=6973, vol=1.150000e+07
assign (resid 110 and name HA) (resid 110 and name HB2) 2.741 0.939 0.939 weight 1.000 ! spec=HCH, no=4105, id=6977, vol=3.030000e+07
assign (resid 110 and name HA) (resid 110 and name HB1) 2.874 1.033 1.033 weight 1.000 ! spec=HCH, no=4106, id=6978, vol=2.270000e+07
assign (resid 110 and name HA) (resid 110 and name HG2) 3.036 1.153 1.153 weight 1.000 ! spec=HCH, no=4107, id=6979, vol=1.640000e+07
assign (resid 110 and name HA) (resid 110 and name HG1) 3.072 1.179 1.179 weight 1.000 ! spec=HCH, no=4108, id=6980, vol=1.530000e+07
assign (resid 110 and name HB1) (resid 110 and name HB2) 2.300 0.661 0.661 weight 1.000 ! spec=HCH, no=4126, id=6998, vol=8.660000e+07
assign (resid 110 and name HE2) (resid 104 and name HN) 3.518 1.547 1.547 weight 1.000 ! spec=HCH, no=4133, id=7004, vol=6.770000e+06
or (resid 110 and name HE1) (resid 104 and name HN)
or (resid 110 and name HE3) (resid 104 and name HN)
assign (resid 110 and name HE2) (resid 104 and name HZ2) 3.298 1.360 1.360 weight 1.000 ! spec=HCH, no=4135, id=7006, vol=9.960000e+06
or (resid 110 and name HE1) (resid 104 and name HZ2)
or (resid 110 and name HE3) (resid 104 and name HZ2)
assign (resid 110 and name HE2) (resid 104 and name HB2) 3.243 1.315 1.315 weight 1.000 ! spec=HCH, no=4137, id=7008, vol=1.100000e+07
or (resid 110 and name HE1) (resid 104 and name HB2)
or (resid 110 and name HE3) (resid 104 and name HB2)
assign (resid 110 and name HE2) (resid 102 and name HB2) 2.768 0.958 0.958 weight 1.000 ! spec=HCH, no=4148, id=7018, vol=2.850000e+07
or (resid 110 and name HE1) (resid 102 and name HB2)
or (resid 110 and name HE3) (resid 102 and name HB2)
assign (resid 110 and name HG2) (resid 113 and name HB2) 3.660 1.675 1.675 weight 1.000 ! spec=HCH, no=4158, id=7028, vol=5.330000e+06
assign (resid 110 and name HG1) (resid 113 and name HB2) 3.894 1.895 1.895 weight 1.000 ! spec=HCH, no=4159, id=7029, vol=3.680000e+06
assign (resid 110 and name HG1) (resid 111 and name HA) 4.040 2.040 2.040 weight 1.000 ! spec=HCH, no=4163, id=7033, vol=2.950000e+06
assign (resid 110 and name HG2) (resid 104 and name HD1) 3.990 1.990 1.990 weight 1.000 ! spec=HCH, no=4166, id=7036, vol=3.180000e+06
assign (resid 110 and name HG2) (resid 110 and name HB1) 2.541 0.807 0.807 weight 1.000 ! spec=HCH, no=4174, id=7044, vol=4.770000e+07
assign (resid 110 and name HB1) (resid 110 and name HG1) 2.590 0.838 0.838 weight 1.000 ! spec=HCH, no=4175, id=7045, vol=4.250000e+07
assign (resid 110 and name HG1) (resid 110 and name HG2) 1.904 0.453 0.453 weight 1.000 ! spec=HCH, no=4177, id=7046, vol=2.690000e+08
assign (resid 110 and name HG2) (resid 110 and name HE2) 2.861 1.023 1.023 weight 1.000 ! spec=HCH, no=4180, id=7048, vol=2.340000e+07
or (resid 110 and name HG2) (resid 110 and name HE1)
or (resid 110 and name HG2) (resid 110 and name HE3)
assign (resid 110 and name HG1) (resid 110 and name HE2) 2.792 0.975 0.975 weight 1.000 ! spec=HCH, no=4181, id=7049, vol=2.700000e+07
or (resid 110 and name HG1) (resid 110 and name HE1)
or (resid 110 and name HG1) (resid 110 and name HE3)
assign (resid 111 and name HG21) (resid 67 and name HB1) 3.651 1.666 1.666 weight 1.000 ! spec=HCH, no=4190, id=7057, vol=5.420000e+06
or (resid 111 and name HG22) (resid 67 and name HB1)
or (resid 111 and name HG23) (resid 67 and name HB1)
assign (resid 109 and name HB2) (resid 111 and name HG21) 2.206 0.608 0.608 weight 1.000 ! spec=HCH, no=4192, id=7059, vol=1.110000e+08
or (resid 111 and name HG21) (resid 109 and name HB1)
or (resid 109 and name HB2) (resid 111 and name HG22)
or (resid 111 and name HG22) (resid 109 and name HB1)
or (resid 109 and name HB2) (resid 111 and name HG23)
or (resid 111 and name HG23) (resid 109 and name HB1)
assign (resid 109 and name HN) (resid 111 and name HG21) 3.508 1.538 1.538 weight 1.000 ! spec=HCH, no=4195, id=7062, vol=6.880000e+06
or (resid 109 and name HN) (resid 111 and name HG22)
or (resid 109 and name HN) (resid 111 and name HG23)
assign (resid 111 and name HG21) (resid 104 and name HD1) 3.619 1.637 1.637 weight 1.000 ! spec=HCH, no=4196, id=7063, vol=5.710000e+06
or (resid 111 and name HG22) (resid 104 and name HD1)
or (resid 111 and name HG23) (resid 104 and name HD1)
assign (resid 111 and name HG21) (resid 104 and name HE1) 3.730 1.739 1.739 weight 1.000 ! spec=HCH, no=4197, id=7064, vol=4.760000e+06
or (resid 111 and name HG22) (resid 104 and name HE1)
or (resid 111 and name HG23) (resid 104 and name HE1)
assign (resid 110 and name HN) (resid 111 and name HG21) 3.472 1.507 1.507 weight 1.000 ! spec=HCH, no=4198, id=7065, vol=7.320000e+06
or (resid 110 and name HN) (resid 111 and name HG22)
or (resid 110 and name HN) (resid 111 and name HG23)
assign (resid 111 and name HG21) (resid 110 and name HA) 3.701 1.712 1.712 weight 1.000 ! spec=HCH, no=4199, id=7066, vol=4.990000e+06
or (resid 111 and name HG22) (resid 110 and name HA)
or (resid 111 and name HG23) (resid 110 and name HA)
assign (resid 111 and name HG21) (resid 111 and name HA) 2.015 0.508 0.508 weight 1.000 ! spec=HCH, no=4200, id=7067, vol=1.910000e+08
or (resid 111 and name HG22) (resid 111 and name HA)
or (resid 111 and name HG23) (resid 111 and name HA)
assign (resid 111 and name HG21) (resid 111 and name HB) 2.232 0.623 0.623 weight 1.000 ! spec=HCH, no=4201, id=7068, vol=1.040000e+08
or (resid 111 and name HG22) (resid 111 and name HB)
or (resid 111 and name HG23) (resid 111 and name HB)
assign (resid 111 and name HG21) (resid 111 and name HG22) 1.155 0.167 0.167 weight 1.000 ! spec=HCH, no=4202, id=7069, vol=5.410000e+09
or (resid 111 and name HG21) (resid 111 and name HG23)
or (resid 111 and name HG21) (resid 111 and name HG22)
or (resid 111 and name HG22) (resid 111 and name HG23)
or (resid 111 and name HG21) (resid 111 and name HG23)
or (resid 111 and name HG22) (resid 111 and name HG23)
assign (resid 112 and name HB2) (resid 112 and name HD1) 2.709 0.917 0.917 weight 1.000 ! spec=HCH, no=4205, id=7072, vol=3.240000e+07
or (resid 112 and name HB2) (resid 112 and name HD2)
assign (resid 112 and name HB1) (resid 67 and name HA) 3.209 1.287 1.287 weight 1.000 ! spec=HCH, no=4211, id=7078, vol=1.180000e+07
assign (resid 113 and name HN) (resid 112 and name HB1) 3.489 1.522 1.522 weight 1.000 ! spec=HCH, no=4212, id=7079, vol=7.110000e+06
assign (resid 112 and name HB1) (resid 68 and name HD21) 3.933 1.933 1.933 weight 1.000 ! spec=HCH, no=4213, id=7080, vol=3.470000e+06
assign (resid 112 and name HB1) (resid 112 and name HD1) 2.649 0.877 0.877 weight 1.000 ! spec=HCH, no=4214, id=7081, vol=3.710000e+07
or (resid 112 and name HB1) (resid 112 and name HD2)
assign (resid 112 and name HB2) (resid 66 and name HB) 3.765 1.772 1.772 weight 1.000 ! spec=HCH, no=4215, id=7082, vol=4.500000e+06
assign (resid 112 and name HB1) (resid 66 and name HG22) 3.620 1.638 1.638 weight 1.000 ! spec=HCH, no=4216, id=7083, vol=5.700000e+06
or (resid 112 and name HB1) (resid 66 and name HG21)
or (resid 112 and name HB1) (resid 66 and name HG23)
assign (resid 112 and name HB1) (resid 68 and name HA) 3.454 1.491 1.491 weight 1.000 ! spec=HCH, no=4217, id=7084, vol=7.560000e+06
assign (resid 112 and name HB2) (resid 112 and name HA) 2.948 1.086 1.086 weight 1.000 ! spec=HCH, no=4220, id=7087, vol=1.950000e+07
assign (resid 112 and name HB1) (resid 112 and name HA) 2.758 0.951 0.951 weight 1.000 ! spec=HCH, no=4221, id=7088, vol=2.920000e+07
assign (resid 112 and name HB1) (resid 112 and name HB2) 2.440 0.744 0.744 weight 1.000 ! spec=HCH, no=4223, id=7089, vol=6.070000e+07
assign (resid 113 and name HA) (resid 113 and name HN) 3.118 1.215 1.215 weight 1.000 ! spec=HCH, no=4226, id=7092, vol=1.390000e+07
assign (resid 113 and name HA) (resid 112 and name HD1) 3.180 1.264 1.264 weight 1.000 ! spec=HCH, no=4227, id=7093, vol=1.240000e+07
or (resid 113 and name HA) (resid 112 and name HD2)
assign (resid 113 and name HA) (resid 114 and name HB2) 4.069 2.069 2.069 weight 1.000 ! spec=HCH, no=4228, id=7094, vol=2.830000e+06
assign (resid 113 and name HA) (resid 114 and name HG2) 3.515 1.545 1.545 weight 1.000 ! spec=HCH, no=4229, id=7095, vol=6.800000e+06
assign (resid 113 and name HA) (resid 115 and name HN) 3.408 1.452 1.452 weight 1.000 ! spec=HCH, no=4231, id=7097, vol=8.180000e+06
assign (resid 113 and name HA) (resid 114 and name HB1) 3.642 1.658 1.658 weight 1.000 ! spec=HCH, no=4232, id=7098, vol=5.500000e+06
assign (resid 113 and name HA) (resid 66 and name HB) 3.987 1.987 1.987 weight 1.000 ! spec=HCH, no=4233, id=7099, vol=3.190000e+06
assign (resid 113 and name HA) (resid 113 and name HB2) 2.560 0.819 0.819 weight 1.000 ! spec=HCH, no=4236, id=7101, vol=4.550000e+07
assign (resid 113 and name HA) (resid 113 and name HB1) 2.563 0.821 0.821 weight 1.000 ! spec=HCH, no=4237, id=7102, vol=4.530000e+07
assign (resid 113 and name HA) (resid 114 and name HA) 3.664 1.678 1.678 weight 1.000 ! spec=HCH, no=4239, id=7104, vol=5.300000e+06
assign (resid 115 and name HE1) (resid 113 and name HA) 3.880 1.882 1.882 weight 1.000 ! spec=HCH, no=4240, id=7105, vol=3.760000e+06
assign (resid 113 and name HB2) (resid 114 and name HA) 3.759 1.766 1.766 weight 1.000 ! spec=HCH, no=4245, id=7110, vol=4.540000e+06
assign (resid 113 and name HB2) (resid 91 and name HD22) 3.870 1.873 1.873 weight 1.000 ! spec=HCH, no=4248, id=7113, vol=3.810000e+06
or (resid 113 and name HB2) (resid 91 and name HD21)
or (resid 113 and name HB2) (resid 91 and name HD23)
assign (resid 114 and name HN) (resid 113 and name HB1) 2.917 1.063 1.063 weight 1.000 ! spec=HCH, no=4259, id=7124, vol=2.080000e+07
assign (resid 113 and name HB1) (resid 115 and name HN) 3.499 1.530 1.530 weight 1.000 ! spec=HCH, no=4264, id=7129, vol=6.990000e+06
assign (resid 113 and name HB1) (resid 104 and name HZ2) 4.191 2.196 2.196 weight 1.000 ! spec=HCH, no=4265, id=7130, vol=2.370000e+06
assign (resid 113 and name HB1) (resid 113 and name HB2) 2.295 0.658 0.658 weight 1.000 ! spec=HCH, no=4269, id=7134, vol=8.790000e+07
assign (resid 113 and name HB1) (resid 138 and name HE3) 3.587 1.609 1.609 weight 1.000 ! spec=HCH, no=4273, id=7137, vol=6.020000e+06
assign (resid 113 and name HB2) (resid 138 and name HH2) 3.784 1.790 1.790 weight 1.000 ! spec=HCH, no=4274, id=7138, vol=4.370000e+06
assign (resid 114 and name HA) (resid 112 and name HD1) 3.715 1.726 1.726 weight 1.000 ! spec=HCH, no=4279, id=7143, vol=4.870000e+06
or (resid 114 and name HA) (resid 112 and name HD2)
assign (resid 114 and name HA) (resid 114 and name HB2) 2.698 0.910 0.910 weight 1.000 ! spec=HCH, no=4284, id=7147, vol=3.320000e+07
assign (resid 114 and name HA) (resid 114 and name HB1) 2.625 0.861 0.861 weight 1.000 ! spec=HCH, no=4285, id=7148, vol=3.920000e+07
assign (resid 114 and name HA) (resid 114 and name HG2) 2.726 0.929 0.929 weight 1.000 ! spec=HCH, no=4286, id=7149, vol=3.120000e+07
assign (resid 114 and name HA) (resid 114 and name HG1) 2.759 0.952 0.952 weight 1.000 ! spec=HCH, no=4287, id=7150, vol=2.910000e+07
assign (resid 114 and name HA) (resid 115 and name HA) 3.715 1.725 1.725 weight 1.000 ! spec=HCH, no=4289, id=7152, vol=4.880000e+06
assign (resid 114 and name HB2) (resid 138 and name HB1) 3.805 1.810 1.810 weight 1.000 ! spec=HCH, no=4290, id=7153, vol=4.220000e+06
assign (resid 114 and name HB2) (resid 113 and name HB2) 3.672 1.686 1.686 weight 1.000 ! spec=HCH, no=4302, id=7165, vol=5.230000e+06
assign (resid 114 and name HN) (resid 114 and name HB1) 3.022 1.142 1.142 weight 1.000 ! spec=HCH, no=4305, id=7168, vol=1.680000e+07
assign (resid 114 and name HB1) (resid 114 and name HB2) 2.313 0.669 0.669 weight 1.000 ! spec=HCH, no=4309, id=7171, vol=8.360000e+07
assign (resid 114 and name HB2) (resid 114 and name HG1) 2.773 0.961 0.961 weight 1.000 ! spec=HCH, no=4312, id=7173, vol=2.820000e+07
assign (resid 114 and name HB1) (resid 114 and name HG1) 2.588 0.837 0.837 weight 1.000 ! spec=HCH, no=4313, id=7174, vol=4.270000e+07
assign (resid 114 and name HB2) (resid 137 and name HA) 3.352 1.405 1.405 weight 1.000 ! spec=HCH, no=4314, id=7175, vol=9.040000e+06
assign (resid 114 and name HB1) (resid 138 and name HN) 3.415 1.458 1.458 weight 1.000 ! spec=HCH, no=4318, id=7179, vol=8.090000e+06
assign (resid 114 and name HD2) (resid 114 and name HB2) 3.296 1.358 1.358 weight 1.000 ! spec=HCH, no=4322, id=7183, vol=1.000000e+07
assign (resid 114 and name HD1) (resid 112 and name HD1) 3.308 1.368 1.368 weight 1.000 ! spec=HCH, no=4325, id=7186, vol=9.790000e+06
or (resid 114 and name HD1) (resid 112 and name HD2)
assign (resid 114 and name HD1) (resid 114 and name HB2) 3.322 1.379 1.379 weight 1.000 ! spec=HCH, no=4327, id=7188, vol=9.540000e+06
assign (resid 114 and name HD2) (resid 112 and name HE1) 2.919 1.065 1.065 weight 1.000 ! spec=HCH, no=4328, id=7189, vol=2.070000e+07
assign (resid 114 and name HD1) (resid 112 and name HE1) 2.927 1.071 1.071 weight 1.000 ! spec=HCH, no=4329, id=7190, vol=2.040000e+07
assign (resid 114 and name HD2) (resid 114 and name HA) 3.110 1.209 1.209 weight 1.000 ! spec=HCH, no=4332, id=7193, vol=1.420000e+07
assign (resid 114 and name HD1) (resid 114 and name HA) 3.066 1.175 1.175 weight 1.000 ! spec=HCH, no=4333, id=7194, vol=1.540000e+07
assign (resid 114 and name HD2) (resid 114 and name HE1) 2.692 0.906 0.906 weight 1.000 ! spec=HCH, no=4334, id=7195, vol=3.370000e+07
assign (resid 114 and name HD1) (resid 114 and name HE1) 2.628 0.864 0.864 weight 1.000 ! spec=HCH, no=4335, id=7196, vol=3.890000e+07
assign (resid 72 and name HD21) (resid 114 and name HE2) 3.327 1.383 1.383 weight 1.000 ! spec=HCH, no=4336, id=7197, vol=9.460000e+06
assign (resid 72 and name HD22) (resid 114 and name HE2) 3.374 1.423 1.423 weight 1.000 ! spec=HCH, no=4339, id=7200, vol=8.690000e+06
assign (resid 114 and name HE1) (resid 114 and name HG1) 2.620 0.858 0.858 weight 1.000 ! spec=HCH, no=4341, id=7202, vol=3.970000e+07
assign (resid 114 and name HE2) (resid 114 and name HA) 3.652 1.667 1.667 weight 1.000 ! spec=HCH, no=4343, id=7204, vol=5.410000e+06
assign (resid 114 and name HE2) (resid 114 and name HB2) 3.310 1.370 1.370 weight 1.000 ! spec=HCH, no=4344, id=7205, vol=9.740000e+06
assign (resid 114 and name HB2) (resid 114 and name HE1) 3.425 1.466 1.466 weight 1.000 ! spec=HCH, no=4345, id=7206, vol=7.950000e+06
assign (resid 114 and name HE2) (resid 114 and name HB1) 2.822 0.996 0.996 weight 1.000 ! spec=HCH, no=4346, id=7207, vol=2.540000e+07
assign (resid 114 and name HB1) (resid 114 and name HE1) 2.614 0.854 0.854 weight 1.000 ! spec=HCH, no=4347, id=7208, vol=4.020000e+07
assign (resid 114 and name HE2) (resid 114 and name HD2) 2.719 0.924 0.924 weight 1.000 ! spec=HCH, no=4348, id=7209, vol=3.180000e+07
assign (resid 114 and name HD1) (resid 114 and name HE2) 2.806 0.984 0.984 weight 1.000 ! spec=HCH, no=4349, id=7210, vol=2.630000e+07
assign (resid 114 and name HE2) (resid 114 and name HE1) 1.808 0.408 0.408 weight 1.000 ! spec=HCH, no=4351, id=7211, vol=3.680000e+08
assign (resid 114 and name HE2) (resid 136 and name HA2) 3.793 1.799 1.799 weight 1.000 ! spec=HCH, no=4352, id=7212, vol=4.310000e+06
assign (resid 114 and name HE2) (resid 136 and name HA1) 3.605 1.625 1.625 weight 1.000 ! spec=HCH, no=4353, id=7213, vol=5.840000e+06
assign (resid 114 and name HE2) (resid 137 and name HA) 3.133 1.227 1.227 weight 1.000 ! spec=HCH, no=4354, id=7214, vol=1.350000e+07
assign (resid 114 and name HE2) (resid 137 and name HG2) 3.263 1.331 1.331 weight 1.000 ! spec=HCH, no=4355, id=7215, vol=1.060000e+07
assign (resid 114 and name HG2) (resid 114 and name HB2) 2.858 1.021 1.021 weight 1.000 ! spec=HCH, no=4356, id=7216, vol=2.350000e+07
assign (resid 114 and name HG2) (resid 114 and name HB1) 2.566 0.823 0.823 weight 1.000 ! spec=HCH, no=4357, id=7217, vol=4.490000e+07
assign (resid 114 and name HG1) (resid 137 and name HA) 3.448 1.486 1.486 weight 1.000 ! spec=HCH, no=4364, id=7224, vol=7.630000e+06
assign (resid 114 and name HG1) (resid 138 and name HN) 3.882 1.884 1.884 weight 1.000 ! spec=HCH, no=4365, id=7225, vol=3.750000e+06
assign (resid 114 and name HG2) (resid 138 and name HE1) 3.879 1.881 1.881 weight 1.000 ! spec=HCH, no=4366, id=7226, vol=3.760000e+06
assign (resid 114 and name HG1) (resid 138 and name HE1) 3.832 1.835 1.835 weight 1.000 ! spec=HCH, no=4367, id=7227, vol=4.050000e+06
assign (resid 115 and name HA) (resid 115 and name HZ3) 3.371 1.420 1.420 weight 1.000 ! spec=HCH, no=4372, id=7232, vol=8.750000e+06
assign (resid 115 and name HA) (resid 115 and name HB2) 2.813 0.989 0.989 weight 1.000 ! spec=HCH, no=4374, id=7234, vol=2.590000e+07
assign (resid 115 and name HA) (resid 115 and name HB1) 2.682 0.899 0.899 weight 1.000 ! spec=HCH, no=4378, id=7237, vol=3.450000e+07
assign (resid 115 and name HA) (resid 115 and name HE3) 2.648 0.876 0.876 weight 1.000 ! spec=HCH, no=4379, id=7238, vol=3.720000e+07
assign (resid 115 and name HA) (resid 138 and name HB2) 2.754 0.948 0.948 weight 1.000 ! spec=HCH, no=4381, id=7240, vol=2.940000e+07
assign (resid 115 and name HB1) (resid 140 and name HE2) 3.993 1.993 1.993 weight 1.000 ! spec=HCH, no=4387, id=7246, vol=3.160000e+06
assign (resid 115 and name HB1) (resid 115 and name HZ3) 3.452 1.490 1.490 weight 1.000 ! spec=HCH, no=4388, id=7247, vol=7.580000e+06
assign (resid 115 and name HB1) (resid 138 and name HB2) 3.779 1.785 1.785 weight 1.000 ! spec=HCH, no=4389, id=7248, vol=4.400000e+06
assign (resid 115 and name HN) (resid 115 and name HB1) 3.087 1.191 1.191 weight 1.000 ! spec=HCH, no=4393, id=7252, vol=1.480000e+07
assign (resid 115 and name HB1) (resid 115 and name HB2) 2.298 0.660 0.660 weight 1.000 ! spec=HCH, no=4397, id=7255, vol=8.720000e+07
assign (resid 115 and name HE1) (resid 115 and name HB1) 3.947 1.947 1.947 weight 1.000 ! spec=HCH, no=4400, id=7257, vol=3.390000e+06
assign (resid 115 and name HB1) (resid 115 and name HE3) 3.265 1.332 1.332 weight 1.000 ! spec=HCH, no=4401, id=7258, vol=1.060000e+07
assign (resid 116 and name HA) (resid 117 and name HB2) 3.216 1.292 1.292 weight 1.000 ! spec=HCH, no=4407, id=7264, vol=1.160000e+07
or (resid 116 and name HA) (resid 117 and name HB1)
assign (resid 116 and name HA) (resid 116 and name HG21) 2.482 0.770 0.770 weight 1.000 ! spec=HCH, no=4409, id=7266, vol=5.480000e+07
or (resid 116 and name HA) (resid 116 and name HG22)
or (resid 116 and name HA) (resid 116 and name HG23)
assign (resid 116 and name HN) (resid 116 and name HA) 2.600 0.845 0.845 weight 1.000 ! spec=HCH, no=4411, id=7268, vol=4.150000e+07
assign (resid 116 and name HA) (resid 116 and name HB) 2.324 0.675 0.675 weight 1.000 ! spec=HCH, no=4413, id=7269, vol=8.140000e+07
assign (resid 116 and name HA) (resid 137 and name HB1) 3.140 1.232 1.232 weight 1.000 ! spec=HCH, no=4414, id=7270, vol=1.340000e+07
assign (resid 116 and name HA) (resid 137 and name HG2) 3.014 1.135 1.135 weight 1.000 ! spec=HCH, no=4415, id=7271, vol=1.710000e+07
assign (resid 115 and name HA) (resid 116 and name HB) 3.543 1.569 1.569 weight 1.000 ! spec=HCH, no=4422, id=7278, vol=6.480000e+06
assign (resid 117 and name HN) (resid 116 and name HB) 2.783 0.968 0.968 weight 1.000 ! spec=HCH, no=4427, id=7282, vol=2.760000e+07
assign (resid 116 and name HB) (resid 137 and name HB2) 2.790 0.973 0.973 weight 1.000 ! spec=HCH, no=4429, id=7284, vol=2.720000e+07
assign (resid 116 and name HB) (resid 137 and name HB1) 3.075 1.182 1.182 weight 1.000 ! spec=HCH, no=4430, id=7285, vol=1.520000e+07
assign (resid 116 and name HG21) (resid 118 and name HB2) 2.567 0.824 0.824 weight 1.000 ! spec=HCH, no=4439, id=7291, vol=4.480000e+07
or (resid 116 and name HG22) (resid 118 and name HB2)
or (resid 116 and name HG23) (resid 118 and name HB2)
assign (resid 115 and name HA) (resid 116 and name HG21) 3.004 1.128 1.128 weight 1.000 ! spec=HCH, no=4441, id=7293, vol=1.740000e+07
or (resid 115 and name HA) (resid 116 and name HG22)
or (resid 115 and name HA) (resid 116 and name HG23)
assign (resid 115 and name HB1) (resid 116 and name HG21) 3.422 1.463 1.463 weight 1.000 ! spec=HCH, no=4442, id=7294, vol=7.990000e+06
or (resid 115 and name HB1) (resid 116 and name HG22)
or (resid 115 and name HB1) (resid 116 and name HG23)
assign (resid 116 and name HN) (resid 116 and name HG21) 2.386 0.712 0.712 weight 1.000 ! spec=HCH, no=4444, id=7296, vol=6.950000e+07
or (resid 116 and name HN) (resid 116 and name HG22)
or (resid 116 and name HN) (resid 116 and name HG23)
assign (resid 116 and name HB) (resid 116 and name HG21) 2.146 0.576 0.576 weight 1.000 ! spec=HCH, no=4445, id=7297, vol=1.310000e+08
or (resid 116 and name HB) (resid 116 and name HG22)
or (resid 116 and name HB) (resid 116 and name HG23)
assign (resid 117 and name HN) (resid 116 and name HG21) 2.620 0.858 0.858 weight 1.000 ! spec=HCH, no=4446, id=7298, vol=3.970000e+07
or (resid 117 and name HN) (resid 116 and name HG22)
or (resid 117 and name HN) (resid 116 and name HG23)
assign (resid 116 and name HG21) (resid 139 and name HA) 2.608 0.850 0.850 weight 1.000 ! spec=HCH, no=4451, id=7303, vol=4.080000e+07
or (resid 116 and name HG22) (resid 139 and name HA)
or (resid 116 and name HG23) (resid 139 and name HA)
assign (resid 117 and name HN) (resid 117 and name HA) 2.397 0.718 0.718 weight 1.000 ! spec=HCH, no=4454, id=7306, vol=6.770000e+07
assign (resid 117 and name HA) (resid 118 and name HN) 2.308 0.666 0.666 weight 1.000 ! spec=HCH, no=4455, id=7307, vol=8.490000e+07
assign (resid 118 and name HA) (resid 118 and name HB2) 2.330 0.679 0.679 weight 1.000 ! spec=HCH, no=4463, id=7314, vol=8.000000e+07
assign (resid 118 and name HA) (resid 118 and name HB1) 2.232 0.623 0.623 weight 1.000 ! spec=HCH, no=4464, id=7315, vol=1.040000e+08
assign (resid 118 and name HB1) (resid 118 and name HG2) 1.915 0.458 0.458 weight 1.000 ! spec=HCH, no=4470, id=7321, vol=2.600000e+08
or (resid 118 and name HB1) (resid 118 and name HG1)
assign (resid 118 and name HN) (resid 118 and name HB1) 3.047 1.161 1.161 weight 1.000 ! spec=HCH, no=4473, id=7324, vol=1.600000e+07
assign (resid 118 and name HB1) (resid 118 and name HB2) 1.770 0.392 0.392 weight 1.000 ! spec=HCH, no=4476, id=7327, vol=4.170000e+08
assign (resid 118 and name HA) (resid 118 and name HG2) 2.681 0.899 0.899 weight 1.000 ! spec=HCH, no=4485, id=7335, vol=3.450000e+07
assign (resid 118 and name HG2) (resid 118 and name HB2) 2.297 0.659 0.659 weight 1.000 ! spec=HCH, no=4486, id=7336, vol=8.740000e+07
assign (resid 118 and name HB1) (resid 118 and name HG2) 1.916 0.459 0.459 weight 1.000 ! spec=HCH, no=4487, id=7337, vol=2.590000e+08
assign (resid 119 and name HN) (resid 118 and name HG2) 3.224 1.299 1.299 weight 1.000 ! spec=HCH, no=4490, id=7340, vol=1.140000e+07
assign (resid 118 and name HG2) (resid 119 and name HA) 3.119 1.216 1.216 weight 1.000 ! spec=HCH, no=4491, id=7341, vol=1.390000e+07
assign (resid 119 and name HN) (resid 119 and name HA) 2.245 0.630 0.630 weight 1.000 ! spec=HCH, no=4493, id=7343, vol=1.000000e+08
assign (resid 119 and name HB1) (resid 118 and name HB1) 3.259 1.327 1.327 weight 1.000 ! spec=HCH, no=4498, id=7348, vol=1.070000e+07
assign (resid 119 and name HN) (resid 119 and name HB1) 2.463 0.758 0.758 weight 1.000 ! spec=HCH, no=4499, id=7349, vol=5.750000e+07
assign (resid 119 and name HB2) (resid 120 and name HN) 2.428 0.737 0.737 weight 1.000 ! spec=HCH, no=4500, id=7350, vol=6.250000e+07
assign (resid 118 and name HE21) (resid 120 and name HB2) 2.920 1.066 1.066 weight 1.000 ! spec=HCH, no=4509, id=7359, vol=2.070000e+07
assign (resid 121 and name HA) (resid 121 and name HB2) 2.216 0.614 0.614 weight 1.000 ! spec=HCH, no=4510, id=7360, vol=1.080000e+08
or (resid 121 and name HA) (resid 121 and name HB1)
assign (resid 121 and name HA) (resid 121 and name HB2) 2.315 0.670 0.670 weight 1.000 ! spec=HCH, no=4514, id=7364, vol=8.320000e+07
assign (resid 122 and name HA) (resid 122 and name HB2) 2.433 0.740 0.740 weight 1.000 ! spec=HCH, no=4519, id=7368, vol=6.180000e+07
assign (resid 122 and name HA) (resid 122 and name HB1) 2.403 0.722 0.722 weight 1.000 ! spec=HCH, no=4520, id=7369, vol=6.670000e+07
assign (resid 122 and name HA) (resid 122 and name HG2) 2.586 0.836 0.836 weight 1.000 ! spec=HCH, no=4521, id=7370, vol=4.290000e+07
assign (resid 122 and name HA) (resid 123 and name HA) 3.296 1.358 1.358 weight 1.000 ! spec=HCH, no=4523, id=7372, vol=1.000000e+07
assign (resid 122 and name HN) (resid 122 and name HB1) 2.611 0.852 0.852 weight 1.000 ! spec=HCH, no=4529, id=7378, vol=4.040000e+07
assign (resid 122 and name HB2) (resid 123 and name HA) 3.344 1.398 1.398 weight 1.000 ! spec=HCH, no=4532, id=7381, vol=9.160000e+06
assign (resid 122 and name HG1) (resid 122 and name HN) 3.138 1.231 1.231 weight 1.000 ! spec=HCH, no=4537, id=7386, vol=1.340000e+07
assign (resid 122 and name HG1) (resid 122 and name HA) 2.902 1.053 1.053 weight 1.000 ! spec=HCH, no=4539, id=7388, vol=2.150000e+07
assign (resid 123 and name HA) (resid 123 and name HB2) 2.320 0.673 0.673 weight 1.000 ! spec=HCH, no=4541, id=7390, vol=8.220000e+07
assign (resid 123 and name HN) (resid 123 and name HB2) 2.731 0.933 0.933 weight 1.000 ! spec=HCH, no=4545, id=7394, vol=3.090000e+07
assign (resid 123 and name HB2) (resid 124 and name HA) 3.131 1.226 1.226 weight 1.000 ! spec=HCH, no=4548, id=7396, vol=1.360000e+07
assign (resid 124 and name HA) (resid 123 and name HA) 3.622 1.640 1.640 weight 1.000 ! spec=HCH, no=4553, id=7400, vol=5.680000e+06
assign (resid 124 and name HA) (resid 124 and name HB2) 2.479 0.768 0.768 weight 1.000 ! spec=HCH, no=4556, id=7402, vol=5.530000e+07
assign (resid 124 and name HA) (resid 124 and name HB1) 2.511 0.788 0.788 weight 1.000 ! spec=HCH, no=4557, id=7403, vol=5.120000e+07
assign (resid 124 and name HA) (resid 125 and name HA) 3.375 1.424 1.424 weight 1.000 ! spec=HCH, no=4562, id=7408, vol=8.670000e+06
assign (resid 124 and name HB2) (resid 126 and name HN) 3.676 1.689 1.689 weight 1.000 ! spec=HCH, no=4565, id=7411, vol=5.200000e+06
assign (resid 124 and name HB2) (resid 124 and name HG) 2.525 0.797 0.797 weight 1.000 ! spec=HCH, no=4566, id=7412, vol=4.950000e+07
assign (resid 124 and name HB1) (resid 124 and name HG) 2.444 0.746 0.746 weight 1.000 ! spec=HCH, no=4567, id=7413, vol=6.020000e+07
assign (resid 124 and name HB1) (resid 126 and name HN) 3.646 1.662 1.662 weight 1.000 ! spec=HCH, no=4568, id=7414, vol=5.460000e+06
assign (resid 124 and name HB2) (resid 123 and name HA) 3.719 1.729 1.729 weight 1.000 ! spec=HCH, no=4569, id=7415, vol=4.840000e+06
assign (resid 123 and name HA) (resid 124 and name HB1) 3.594 1.615 1.615 weight 1.000 ! spec=HCH, no=4570, id=7416, vol=5.950000e+06
assign (resid 124 and name HN) (resid 124 and name HB2) 2.854 1.018 1.018 weight 1.000 ! spec=HCH, no=4571, id=7417, vol=2.370000e+07
assign (resid 124 and name HN) (resid 124 and name HB1) 2.809 0.986 0.986 weight 1.000 ! spec=HCH, no=4572, id=7418, vol=2.610000e+07
assign (resid 124 and name HB1) (resid 124 and name HD22) 2.428 0.737 0.737 weight 1.000 ! spec=HCH, no=4576, id=7422, vol=6.260000e+07
or (resid 124 and name HB1) (resid 124 and name HD21)
or (resid 124 and name HB1) (resid 124 and name HD23)
assign (resid 124 and name HD12) (resid 120 and name HB2) 2.966 1.100 1.100 weight 1.000 ! spec=HCH, no=4586, id=7432, vol=1.880000e+07
or (resid 124 and name HD12) (resid 120 and name HB1)
or (resid 124 and name HD11) (resid 120 and name HB2)
or (resid 124 and name HD11) (resid 120 and name HB1)
or (resid 124 and name HD13) (resid 120 and name HB2)
or (resid 124 and name HD13) (resid 120 and name HB1)
assign (resid 124 and name HD12) (resid 95 and name HD1) 3.667 1.681 1.681 weight 1.000 ! spec=HCH, no=4601, id=7447, vol=5.270000e+06
or (resid 124 and name HD11) (resid 95 and name HD1)
or (resid 124 and name HD13) (resid 95 and name HD1)
assign (resid 124 and name HD12) (resid 95 and name HE1) 3.525 1.553 1.553 weight 1.000 ! spec=HCH, no=4602, id=7448, vol=6.680000e+06
or (resid 124 and name HD11) (resid 95 and name HE1)
or (resid 124 and name HD13) (resid 95 and name HE1)
assign (resid 124 and name HD12) (resid 102 and name HZ) 2.926 1.070 1.070 weight 1.000 ! spec=HCH, no=4604, id=7450, vol=2.050000e+07
or (resid 124 and name HD11) (resid 102 and name HZ)
or (resid 124 and name HD13) (resid 102 and name HZ)
assign (resid 124 and name HD12) (resid 123 and name HA) 2.899 1.050 1.050 weight 1.000 ! spec=HCH, no=4608, id=7454, vol=2.160000e+07
or (resid 124 and name HD11) (resid 123 and name HA)
or (resid 124 and name HD13) (resid 123 and name HA)
assign (resid 124 and name HD12) (resid 124 and name HN) 2.825 0.998 0.998 weight 1.000 ! spec=HCH, no=4609, id=7455, vol=2.520000e+07
or (resid 124 and name HD11) (resid 124 and name HN)
or (resid 124 and name HD13) (resid 124 and name HN)
assign (resid 124 and name HD12) (resid 124 and name HB1) 2.246 0.630 0.630 weight 1.000 ! spec=HCH, no=4612, id=7458, vol=1.000000e+08
or (resid 124 and name HD11) (resid 124 and name HB1)
or (resid 124 and name HD13) (resid 124 and name HB1)
assign (resid 124 and name HD12) (resid 124 and name HG) 2.066 0.533 0.533 weight 1.000 ! spec=HCH, no=4613, id=7459, vol=1.650000e+08
or (resid 124 and name HD11) (resid 124 and name HG)
or (resid 124 and name HD13) (resid 124 and name HG)
assign (resid 124 and name HD12) (resid 124 and name HD11) 1.113 0.155 0.155 weight 1.000 ! spec=HCH, no=4614, id=7460, vol=6.730000e+09
or (resid 124 and name HD12) (resid 124 and name HD13)
or (resid 124 and name HD12) (resid 124 and name HD11)
or (resid 124 and name HD11) (resid 124 and name HD13)
or (resid 124 and name HD12) (resid 124 and name HD13)
or (resid 124 and name HD11) (resid 124 and name HD13)
assign (resid 124 and name HD22) (resid 141 and name HA1) 3.367 1.417 1.417 weight 1.000 ! spec=HCH, no=4630, id=7475, vol=8.800000e+06
or (resid 124 and name HD21) (resid 141 and name HA1)
or (resid 124 and name HD23) (resid 141 and name HA1)
assign (resid 124 and name HD22) (resid 123 and name HA) 2.928 1.071 1.071 weight 1.000 ! spec=HCH, no=4640, id=7484, vol=2.040000e+07
or (resid 124 and name HD21) (resid 123 and name HA)
or (resid 124 and name HD23) (resid 123 and name HA)
assign (resid 124 and name HA) (resid 124 and name HD22) 2.849 1.014 1.014 weight 1.000 ! spec=HCH, no=4642, id=7486, vol=2.400000e+07
or (resid 124 and name HA) (resid 124 and name HD21)
or (resid 124 and name HA) (resid 124 and name HD23)
assign (resid 124 and name HB2) (resid 124 and name HD22) 2.184 0.596 0.596 weight 1.000 ! spec=HCH, no=4643, id=7487, vol=1.180000e+08
or (resid 124 and name HB2) (resid 124 and name HD21)
or (resid 124 and name HB2) (resid 124 and name HD23)
assign (resid 124 and name HD22) (resid 124 and name HG) 2.168 0.587 0.587 weight 1.000 ! spec=HCH, no=4645, id=7489, vol=1.240000e+08
or (resid 124 and name HD21) (resid 124 and name HG)
or (resid 124 and name HD23) (resid 124 and name HG)
assign (resid 124 and name HD22) (resid 124 and name HD21) 1.179 0.174 0.174 weight 1.000 ! spec=HCH, no=4646, id=7490, vol=4.780000e+09
or (resid 124 and name HD22) (resid 124 and name HD23)
or (resid 124 and name HD22) (resid 124 and name HD21)
or (resid 124 and name HD21) (resid 124 and name HD23)
or (resid 124 and name HD22) (resid 124 and name HD23)
or (resid 124 and name HD21) (resid 124 and name HD23)
assign (resid 124 and name HG) (resid 120 and name HB2) 3.505 1.536 1.536 weight 1.000 ! spec=HCH, no=4651, id=7495, vol=6.920000e+06
or (resid 124 and name HG) (resid 120 and name HB1)
assign (resid 124 and name HN) (resid 124 and name HG) 2.794 0.976 0.976 weight 1.000 ! spec=HCH, no=4653, id=7497, vol=2.690000e+07
assign (resid 124 and name HA) (resid 124 and name HG) 3.055 1.167 1.167 weight 1.000 ! spec=HCH, no=4654, id=7498, vol=1.580000e+07
assign (resid 125 and name HA) (resid 95 and name HD1) 2.856 1.019 1.019 weight 1.000 ! spec=HCH, no=4658, id=7502, vol=2.360000e+07
or (resid 125 and name HA) (resid 95 and name HD2)
assign (resid 125 and name HA) (resid 97 and name HG21) 3.191 1.273 1.273 weight 1.000 ! spec=HCH, no=4659, id=7503, vol=1.210000e+07
or (resid 125 and name HA) (resid 97 and name HG22)
or (resid 125 and name HA) (resid 97 and name HG23)
assign (resid 125 and name HA) (resid 95 and name HE1) 3.565 1.589 1.589 weight 1.000 ! spec=HCH, no=4661, id=7505, vol=6.240000e+06
or (resid 125 and name HA) (resid 95 and name HE2)
assign (resid 125 and name HA) (resid 123 and name HB2) 3.763 1.770 1.770 weight 1.000 ! spec=HCH, no=4662, id=7506, vol=4.510000e+06
or (resid 125 and name HA) (resid 123 and name HB1)
assign (resid 125 and name HN) (resid 125 and name HA) 2.496 0.779 0.779 weight 1.000 ! spec=HCH, no=4665, id=7509, vol=5.300000e+07
assign (resid 125 and name HA) (resid 95 and name HB1) 3.308 1.368 1.368 weight 1.000 ! spec=HCH, no=4672, id=7516, vol=9.790000e+06
assign (resid 125 and name HA) (resid 102 and name HE1) 4.165 2.169 2.169 weight 1.000 ! spec=HCH, no=4673, id=7517, vol=2.460000e+06
assign (resid 125 and name HA) (resid 125 and name HB) 2.398 0.719 0.719 weight 1.000 ! spec=HCH, no=4675, id=7519, vol=6.740000e+07
assign (resid 125 and name HA) (resid 125 and name HG12) 2.264 0.641 0.641 weight 1.000 ! spec=HCH, no=4676, id=7520, vol=9.530000e+07
or (resid 125 and name HA) (resid 125 and name HG11)
or (resid 125 and name HA) (resid 125 and name HG13)
assign (resid 125 and name HB) (resid 95 and name HE1) 3.896 1.897 1.897 weight 1.000 ! spec=HCH, no=4687, id=7531, vol=3.670000e+06
or (resid 125 and name HB) (resid 95 and name HE2)
assign (resid 97 and name HG21) (resid 125 and name HB) 3.356 1.408 1.408 weight 1.000 ! spec=HCH, no=4688, id=7532, vol=8.970000e+06
or (resid 97 and name HG22) (resid 125 and name HB)
or (resid 97 and name HG23) (resid 125 and name HB)
assign (resid 125 and name HB) (resid 126 and name HB1) 3.714 1.724 1.724 weight 1.000 ! spec=HCH, no=4696, id=7539, vol=4.890000e+06
assign (resid 125 and name HG12) (resid 97 and name HG21) 2.683 0.900 0.900 weight 1.000 ! spec=HCH, no=4711, id=7553, vol=3.430000e+07
or (resid 125 and name HG12) (resid 97 and name HG22)
or (resid 125 and name HG12) (resid 97 and name HG23)
or (resid 125 and name HG11) (resid 97 and name HG21)
or (resid 125 and name HG11) (resid 97 and name HG22)
or (resid 125 and name HG11) (resid 97 and name HG23)
or (resid 125 and name HG13) (resid 97 and name HG21)
or (resid 125 and name HG13) (resid 97 and name HG22)
or (resid 125 and name HG13) (resid 97 and name HG23)
assign (resid 125 and name HB) (resid 125 and name HG12) 2.019 0.509 0.509 weight 1.000 ! spec=HCH, no=4723, id=7565, vol=1.890000e+08
or (resid 125 and name HB) (resid 125 and name HG11)
or (resid 125 and name HB) (resid 125 and name HG13)
assign (resid 125 and name HG12) (resid 126 and name HA) 3.154 1.244 1.244 weight 1.000 ! spec=HCH, no=4726, id=7568, vol=1.300000e+07
or (resid 125 and name HG11) (resid 126 and name HA)
or (resid 125 and name HG13) (resid 126 and name HA)
assign (resid 127 and name HN) (resid 125 and name HG12) 3.303 1.363 1.363 weight 1.000 ! spec=HCH, no=4729, id=7571, vol=9.880000e+06
or (resid 127 and name HN) (resid 125 and name HG11)
or (resid 127 and name HN) (resid 125 and name HG13)
assign (resid 142 and name HD22) (resid 125 and name HG22) 3.180 1.264 1.264 weight 1.000 ! spec=HCH, no=4757, id=7594, vol=1.240000e+07
or (resid 142 and name HD22) (resid 125 and name HG21)
or (resid 142 and name HD22) (resid 125 and name HG23)
assign (resid 142 and name HD21) (resid 125 and name HG22) 3.292 1.355 1.355 weight 1.000 ! spec=HCH, no=4765, id=7601, vol=1.010000e+07
or (resid 142 and name HD21) (resid 125 and name HG21)
or (resid 142 and name HD21) (resid 125 and name HG23)
assign (resid 125 and name HG22) (resid 123 and name HB2) 2.887 1.042 1.042 weight 1.000 ! spec=HCH, no=4772, id=7607, vol=2.220000e+07
or (resid 125 and name HG21) (resid 123 and name HB2)
or (resid 125 and name HG23) (resid 123 and name HB2)
assign (resid 125 and name HN) (resid 125 and name HG22) 2.216 0.614 0.614 weight 1.000 ! spec=HCH, no=4776, id=7611, vol=1.080000e+08
or (resid 125 and name HN) (resid 125 and name HG21)
or (resid 125 and name HN) (resid 125 and name HG23)
assign (resid 125 and name HA) (resid 125 and name HG22) 2.193 0.601 0.601 weight 1.000 ! spec=HCH, no=4777, id=7612, vol=1.150000e+08
or (resid 125 and name HA) (resid 125 and name HG21)
or (resid 125 and name HA) (resid 125 and name HG23)
assign (resid 125 and name HB) (resid 125 and name HG22) 2.011 0.506 0.506 weight 1.000 ! spec=HCH, no=4778, id=7613, vol=1.940000e+08
or (resid 125 and name HB) (resid 125 and name HG21)
or (resid 125 and name HB) (resid 125 and name HG23)
assign (resid 126 and name HN) (resid 126 and name HA) 2.371 0.703 0.703 weight 1.000 ! spec=HCH, no=4784, id=7619, vol=7.220000e+07
assign (resid 126 and name HA) (resid 126 and name HB2) 2.444 0.747 0.747 weight 1.000 ! spec=HCH, no=4786, id=7620, vol=6.020000e+07
assign (resid 126 and name HA) (resid 126 and name HB1) 2.417 0.730 0.730 weight 1.000 ! spec=HCH, no=4787, id=7621, vol=6.430000e+07
assign (resid 127 and name HN) (resid 126 and name HA) 2.468 0.761 0.761 weight 1.000 ! spec=HCH, no=4788, id=7622, vol=5.680000e+07
assign (resid 127 and name HA) (resid 127 and name HG21) 2.431 0.739 0.739 weight 1.000 ! spec=HCH, no=4811, id=7643, vol=6.220000e+07
or (resid 127 and name HA) (resid 127 and name HG22)
or (resid 127 and name HA) (resid 127 and name HG23)
assign (resid 128 and name HN) (resid 127 and name HA) 2.217 0.615 0.615 weight 1.000 ! spec=HCH, no=4812, id=7644, vol=1.080000e+08
assign (resid 127 and name HB) (resid 126 and name HN) 3.978 1.978 1.978 weight 1.000 ! spec=HCH, no=4824, id=7656, vol=3.240000e+06
assign (resid 127 and name HA) (resid 127 and name HB) 2.683 0.899 0.899 weight 1.000 ! spec=HCH, no=4826, id=7658, vol=3.440000e+07
assign (resid 128 and name HN) (resid 127 and name HB) 2.925 1.070 1.070 weight 1.000 ! spec=HCH, no=4829, id=7660, vol=2.050000e+07
assign (resid 127 and name HB) (resid 128 and name HA) 3.824 1.828 1.828 weight 1.000 ! spec=HCH, no=4830, id=7661, vol=4.100000e+06
assign (resid 127 and name HG21) (resid 139 and name HA) 3.670 1.684 1.684 weight 1.000 ! spec=HCH, no=4841, id=7671, vol=5.250000e+06
or (resid 127 and name HG22) (resid 139 and name HA)
or (resid 127 and name HG23) (resid 139 and name HA)
assign (resid 125 and name HN) (resid 127 and name HG21) 3.464 1.500 1.500 weight 1.000 ! spec=HCH, no=4845, id=7675, vol=7.420000e+06
or (resid 125 and name HN) (resid 127 and name HG22)
or (resid 125 and name HN) (resid 127 and name HG23)
assign (resid 127 and name HG21) (resid 125 and name HA) 3.033 1.150 1.150 weight 1.000 ! spec=HCH, no=4850, id=7680, vol=1.650000e+07
or (resid 127 and name HG22) (resid 125 and name HA)
or (resid 127 and name HG23) (resid 125 and name HA)
assign (resid 127 and name HB) (resid 127 and name HG21) 2.108 0.555 0.555 weight 1.000 ! spec=HCH, no=4854, id=7684, vol=1.460000e+08
or (resid 127 and name HB) (resid 127 and name HG22)
or (resid 127 and name HB) (resid 127 and name HG23)
assign (resid 127 and name HG21) (resid 127 and name HG22) 1.230 0.189 0.189 weight 1.000 ! spec=HCH, no=4855, id=7685, vol=3.700000e+09
or (resid 127 and name HG21) (resid 127 and name HG23)
or (resid 127 and name HG21) (resid 127 and name HG22)
or (resid 127 and name HG22) (resid 127 and name HG23)
or (resid 127 and name HG21) (resid 127 and name HG23)
or (resid 127 and name HG22) (resid 127 and name HG23)
assign (resid 128 and name HN) (resid 127 and name HG21) 2.498 0.780 0.780 weight 1.000 ! spec=HCH, no=4856, id=7686, vol=5.270000e+07
or (resid 128 and name HN) (resid 127 and name HG22)
or (resid 128 and name HN) (resid 127 and name HG23)
assign (resid 127 and name HG21) (resid 128 and name HA) 3.003 1.127 1.127 weight 1.000 ! spec=HCH, no=4857, id=7687, vol=1.750000e+07
or (resid 127 and name HG22) (resid 128 and name HA)
or (resid 127 and name HG23) (resid 128 and name HA)
assign (resid 128 and name HA) (resid 128 and name HB2) 2.453 0.752 0.752 weight 1.000 ! spec=HCH, no=4866, id=7695, vol=5.890000e+07
assign (resid 128 and name HA) (resid 129 and name HA) 3.373 1.422 1.422 weight 1.000 ! spec=HCH, no=4868, id=7697, vol=8.710000e+06
assign (resid 90 and name HD12) (resid 128 and name HB2) 2.890 1.044 1.044 weight 1.000 ! spec=HCH, no=4871, id=7700, vol=2.200000e+07
or (resid 90 and name HD11) (resid 128 and name HB2)
or (resid 90 and name HD13) (resid 128 and name HB2)
assign (resid 128 and name HN) (resid 128 and name HB2) 2.746 0.943 0.943 weight 1.000 ! spec=HCH, no=4873, id=7702, vol=2.990000e+07
assign (resid 128 and name HB2) (resid 129 and name HA) 3.690 1.702 1.702 weight 1.000 ! spec=HCH, no=4877, id=7705, vol=5.080000e+06
assign (resid 128 and name HB2) (resid 130 and name HZ) 3.413 1.456 1.456 weight 1.000 ! spec=HCH, no=4879, id=7707, vol=8.110000e+06
assign (resid 128 and name HB2) (resid 130 and name HE1) 3.085 1.189 1.189 weight 1.000 ! spec=HCH, no=4880, id=7708, vol=1.490000e+07
assign (resid 128 and name HB2) (resid 143 and name HA) 2.818 0.993 0.993 weight 1.000 ! spec=HCH, no=4881, id=7709, vol=2.560000e+07
assign (resid 128 and name HB2) (resid 144 and name HN) 3.874 1.876 1.876 weight 1.000 ! spec=HCH, no=4882, id=7710, vol=3.790000e+06
assign (resid 129 and name HA) (resid 130 and name HE1) 3.945 1.945 1.945 weight 1.000 ! spec=HCH, no=4883, id=7711, vol=3.400000e+06
or (resid 129 and name HA) (resid 130 and name HE2)
assign (resid 129 and name HA) (resid 130 and name HD1) 3.155 1.244 1.244 weight 1.000 ! spec=HCH, no=4884, id=7712, vol=1.300000e+07
or (resid 129 and name HA) (resid 130 and name HD2)
assign (resid 129 and name HA) (resid 91 and name HD22) 4.041 2.041 2.041 weight 1.000 ! spec=HCH, no=4885, id=7713, vol=2.950000e+06
or (resid 129 and name HA) (resid 91 and name HD21)
or (resid 129 and name HA) (resid 91 and name HD23)
assign (resid 129 and name HA) (resid 115 and name HH2) 3.578 1.600 1.600 weight 1.000 ! spec=HCH, no=4886, id=7714, vol=6.120000e+06
assign (resid 129 and name HA) (resid 115 and name HZ3) 3.504 1.535 1.535 weight 1.000 ! spec=HCH, no=4888, id=7716, vol=6.920000e+06
assign (resid 129 and name HA) (resid 139 and name HN) 3.857 1.859 1.859 weight 1.000 ! spec=HCH, no=4892, id=7719, vol=3.900000e+06
assign (resid 129 and name HA) (resid 139 and name HE1) 3.276 1.342 1.342 weight 1.000 ! spec=HCH, no=4893, id=7720, vol=1.040000e+07
assign (resid 129 and name HA) (resid 141 and name HN) 3.191 1.273 1.273 weight 1.000 ! spec=HCH, no=4898, id=7725, vol=1.210000e+07
assign (resid 129 and name HB2) (resid 102 and name HB1) 3.859 1.861 1.861 weight 1.000 ! spec=HCH, no=4905, id=7730, vol=3.880000e+06
or (resid 129 and name HB1) (resid 102 and name HB1)
or (resid 129 and name HB3) (resid 102 and name HB1)
assign (resid 129 and name HB2) (resid 102 and name HD1) 3.077 1.183 1.183 weight 1.000 ! spec=HCH, no=4908, id=7733, vol=1.510000e+07
or (resid 129 and name HB2) (resid 102 and name HD2)
or (resid 129 and name HB1) (resid 102 and name HD1)
or (resid 129 and name HB1) (resid 102 and name HD2)
or (resid 129 and name HB3) (resid 102 and name HD1)
or (resid 129 and name HB3) (resid 102 and name HD2)
assign (resid 129 and name HB2) (resid 90 and name HA) 3.593 1.613 1.613 weight 1.000 ! spec=HCH, no=4910, id=7735, vol=5.960000e+06
or (resid 129 and name HB1) (resid 90 and name HA)
or (resid 129 and name HB3) (resid 90 and name HA)
assign (resid 129 and name HB2) (resid 91 and name HN) 3.156 1.245 1.245 weight 1.000 ! spec=HCH, no=4911, id=7736, vol=1.300000e+07
or (resid 129 and name HB1) (resid 91 and name HN)
or (resid 129 and name HB3) (resid 91 and name HN)
assign (resid 129 and name HB2) (resid 91 and name HA) 3.523 1.551 1.551 weight 1.000 ! spec=HCH, no=4912, id=7737, vol=6.710000e+06
or (resid 129 and name HB1) (resid 91 and name HA)
or (resid 129 and name HB3) (resid 91 and name HA)
assign (resid 129 and name HB2) (resid 91 and name HB1) 2.415 0.729 0.729 weight 1.000 ! spec=HCH, no=4913, id=7738, vol=6.470000e+07
or (resid 129 and name HB1) (resid 91 and name HB1)
or (resid 129 and name HB3) (resid 91 and name HB1)
assign (resid 129 and name HB2) (resid 91 and name HD12) 3.168 1.254 1.254 weight 1.000 ! spec=HCH, no=4914, id=7739, vol=1.270000e+07
or (resid 129 and name HB2) (resid 91 and name HD11)
or (resid 129 and name HB2) (resid 91 and name HD13)
or (resid 129 and name HB1) (resid 91 and name HD12)
or (resid 129 and name HB1) (resid 91 and name HD11)
or (resid 129 and name HB1) (resid 91 and name HD13)
or (resid 129 and name HB3) (resid 91 and name HD12)
or (resid 129 and name HB3) (resid 91 and name HD11)
or (resid 129 and name HB3) (resid 91 and name HD13)
assign (resid 129 and name HB2) (resid 91 and name HD22) 2.340 0.685 0.685 weight 1.000 ! spec=HCH, no=4915, id=7740, vol=7.810000e+07
or (resid 129 and name HB2) (resid 91 and name HD21)
or (resid 129 and name HB2) (resid 91 and name HD23)
or (resid 129 and name HB1) (resid 91 and name HD22)
or (resid 129 and name HB1) (resid 91 and name HD21)
or (resid 129 and name HB1) (resid 91 and name HD23)
or (resid 129 and name HB3) (resid 91 and name HD22)
or (resid 129 and name HB3) (resid 91 and name HD21)
or (resid 129 and name HB3) (resid 91 and name HD23)
assign (resid 129 and name HB2) (resid 93 and name HN) 3.409 1.453 1.453 weight 1.000 ! spec=HCH, no=4916, id=7741, vol=8.170000e+06
or (resid 129 and name HB1) (resid 93 and name HN)
or (resid 129 and name HB3) (resid 93 and name HN)
assign (resid 129 and name HB2) (resid 93 and name HG2) 2.533 0.802 0.802 weight 1.000 ! spec=HCH, no=4917, id=7742, vol=4.860000e+07
or (resid 129 and name HB1) (resid 93 and name HG2)
or (resid 129 and name HB3) (resid 93 and name HG2)
assign (resid 129 and name HB2) (resid 104 and name HH2) 3.784 1.790 1.790 weight 1.000 ! spec=HCH, no=4918, id=7743, vol=4.370000e+06
or (resid 129 and name HB1) (resid 104 and name HH2)
or (resid 129 and name HB3) (resid 104 and name HH2)
assign (resid 128 and name HA) (resid 129 and name HB2) 3.040 1.155 1.155 weight 1.000 ! spec=HCH, no=4923, id=7748, vol=1.620000e+07
or (resid 128 and name HA) (resid 129 and name HB1)
or (resid 128 and name HA) (resid 129 and name HB3)
assign (resid 128 and name HB2) (resid 129 and name HB2) 3.054 1.166 1.166 weight 1.000 ! spec=HCH, no=4924, id=7749, vol=1.580000e+07
or (resid 128 and name HB2) (resid 129 and name HB1)
or (resid 128 and name HB2) (resid 129 and name HB3)
assign (resid 129 and name HN) (resid 129 and name HB2) 2.505 0.784 0.784 weight 1.000 ! spec=HCH, no=4925, id=7750, vol=5.190000e+07
or (resid 129 and name HN) (resid 129 and name HB1)
or (resid 129 and name HN) (resid 129 and name HB3)
assign (resid 129 and name HA) (resid 129 and name HB2) 2.205 0.608 0.608 weight 1.000 ! spec=HCH, no=4926, id=7751, vol=1.120000e+08
or (resid 129 and name HA) (resid 129 and name HB1)
or (resid 129 and name HA) (resid 129 and name HB3)
assign (resid 129 and name HB2) (resid 129 and name HB1) 1.382 0.239 0.239 weight 1.000 ! spec=HCH, no=4927, id=7752, vol=1.840000e+09
or (resid 129 and name HB2) (resid 129 and name HB3)
or (resid 129 and name HB2) (resid 129 and name HB1)
or (resid 129 and name HB1) (resid 129 and name HB3)
or (resid 129 and name HB2) (resid 129 and name HB3)
or (resid 129 and name HB1) (resid 129 and name HB3)
assign (resid 130 and name HN) (resid 129 and name HB2) 2.504 0.784 0.784 weight 1.000 ! spec=HCH, no=4928, id=7753, vol=5.210000e+07
or (resid 130 and name HN) (resid 129 and name HB1)
or (resid 130 and name HN) (resid 129 and name HB3)
assign (resid 129 and name HB2) (resid 130 and name HA) 2.962 1.096 1.096 weight 1.000 ! spec=HCH, no=4929, id=7754, vol=1.900000e+07
or (resid 129 and name HB1) (resid 130 and name HA)
or (resid 129 and name HB3) (resid 130 and name HA)
assign (resid 129 and name HB2) (resid 130 and name HD1) 3.250 1.321 1.321 weight 1.000 ! spec=HCH, no=4931, id=7756, vol=1.090000e+07
or (resid 129 and name HB1) (resid 130 and name HD1)
or (resid 129 and name HB3) (resid 130 and name HD1)
assign (resid 129 and name HB2) (resid 138 and name HA) 3.693 1.705 1.705 weight 1.000 ! spec=HCH, no=4932, id=7757, vol=5.050000e+06
or (resid 129 and name HB1) (resid 138 and name HA)
or (resid 129 and name HB3) (resid 138 and name HA)
assign (resid 129 and name HB2) (resid 138 and name HB1) 3.171 1.257 1.257 weight 1.000 ! spec=HCH, no=4934, id=7759, vol=1.260000e+07
or (resid 129 and name HB1) (resid 138 and name HB1)
or (resid 129 and name HB3) (resid 138 and name HB1)
assign (resid 129 and name HB2) (resid 139 and name HN) 3.571 1.594 1.594 weight 1.000 ! spec=HCH, no=4935, id=7760, vol=6.180000e+06
or (resid 129 and name HB1) (resid 139 and name HN)
or (resid 129 and name HB3) (resid 139 and name HN)
assign (resid 90 and name HD12) (resid 130 and name HA) 3.666 1.680 1.680 weight 1.000 ! spec=HCH, no=4938, id=7763, vol=5.280000e+06
or (resid 90 and name HD11) (resid 130 and name HA)
or (resid 90 and name HD13) (resid 130 and name HA)
assign (resid 130 and name HA) (resid 130 and name HD1) 3.370 1.419 1.419 weight 1.000 ! spec=HCH, no=4939, id=7764, vol=8.760000e+06
or (resid 130 and name HA) (resid 130 and name HD2)
assign (resid 130 and name HA) (resid 131 and name HB1) 3.202 1.282 1.282 weight 1.000 ! spec=HCH, no=4940, id=7765, vol=1.190000e+07
assign (resid 130 and name HA) (resid 91 and name HB2) 3.162 1.250 1.250 weight 1.000 ! spec=HCH, no=4941, id=7766, vol=1.280000e+07
assign (resid 88 and name HB2) (resid 130 and name HA) 3.583 1.605 1.605 weight 1.000 ! spec=HCH, no=4942, id=7767, vol=6.060000e+06
assign (resid 130 and name HA) (resid 91 and name HD22) 3.340 1.394 1.394 weight 1.000 ! spec=HCH, no=4946, id=7771, vol=9.240000e+06
or (resid 130 and name HA) (resid 91 and name HD21)
or (resid 130 and name HA) (resid 91 and name HD23)
assign (resid 130 and name HA) (resid 130 and name HB2) 2.652 0.879 0.879 weight 1.000 ! spec=HCH, no=4947, id=7772, vol=3.680000e+07
assign (resid 130 and name HN) (resid 130 and name HB2) 2.683 0.900 0.900 weight 1.000 ! spec=HCH, no=4950, id=7775, vol=3.440000e+07
assign (resid 130 and name HB2) (resid 130 and name HD1) 2.709 0.918 0.918 weight 1.000 ! spec=HCH, no=4952, id=7777, vol=3.240000e+07
assign (resid 91 and name HD22) (resid 131 and name HB1) 3.514 1.543 1.543 weight 1.000 ! spec=HCH, no=4959, id=7784, vol=6.810000e+06
or (resid 91 and name HD21) (resid 131 and name HB1)
or (resid 91 and name HD23) (resid 131 and name HB1)
assign (resid 131 and name HB2) (resid 130 and name HA) 3.808 1.813 1.813 weight 1.000 ! spec=HCH, no=4960, id=7785, vol=4.200000e+06
assign (resid 131 and name HB2) (resid 131 and name HA) 3.076 1.182 1.182 weight 1.000 ! spec=HCH, no=4964, id=7789, vol=1.520000e+07
assign (resid 131 and name HB1) (resid 131 and name HA) 3.162 1.250 1.250 weight 1.000 ! spec=HCH, no=4965, id=7790, vol=1.280000e+07
assign (resid 131 and name HB1) (resid 131 and name HB2) 2.449 0.750 0.750 weight 1.000 ! spec=HCH, no=4966, id=7791, vol=5.940000e+07
assign (resid 131 and name HB1) (resid 138 and name HE1) 3.940 1.940 1.940 weight 1.000 ! spec=HCH, no=4972, id=7797, vol=3.430000e+06
assign (resid 72 and name HD22) (resid 131 and name HD12) 2.575 0.829 0.829 weight 1.000 ! spec=HCH, no=4986, id=7810, vol=4.400000e+07
or (resid 72 and name HD22) (resid 131 and name HD11)
or (resid 72 and name HD22) (resid 131 and name HD13)
assign (resid 76 and name HN) (resid 131 and name HD12) 3.353 1.405 1.405 weight 1.000 ! spec=HCH, no=4997, id=7819, vol=9.030000e+06
or (resid 76 and name HN) (resid 131 and name HD11)
or (resid 76 and name HN) (resid 131 and name HD13)
assign (resid 72 and name HB2) (resid 131 and name HD12) 3.567 1.591 1.591 weight 1.000 ! spec=HCH, no=4998, id=7820, vol=6.220000e+06
or (resid 72 and name HB2) (resid 131 and name HD11)
or (resid 72 and name HB2) (resid 131 and name HD13)
assign (resid 131 and name HD12) (resid 72 and name HB1) 3.784 1.790 1.790 weight 1.000 ! spec=HCH, no=4999, id=7821, vol=4.370000e+06
or (resid 131 and name HD11) (resid 72 and name HB1)
or (resid 131 and name HD13) (resid 72 and name HB1)
assign (resid 131 and name HD12) (resid 89 and name HN) 3.639 1.655 1.655 weight 1.000 ! spec=HCH, no=5001, id=7823, vol=5.530000e+06
or (resid 131 and name HD11) (resid 89 and name HN)
or (resid 131 and name HD13) (resid 89 and name HN)
assign (resid 131 and name HD12) (resid 91 and name HD12) 2.653 0.880 0.880 weight 1.000 ! spec=HCH, no=5002, id=7824, vol=3.680000e+07
or (resid 131 and name HD12) (resid 91 and name HD11)
or (resid 131 and name HD12) (resid 91 and name HD13)
or (resid 131 and name HD11) (resid 91 and name HD12)
or (resid 131 and name HD11) (resid 91 and name HD11)
or (resid 131 and name HD11) (resid 91 and name HD13)
or (resid 131 and name HD13) (resid 91 and name HD12)
or (resid 131 and name HD13) (resid 91 and name HD11)
or (resid 131 and name HD13) (resid 91 and name HD13)
assign (resid 131 and name HD12) (resid 91 and name HD22) 2.908 1.057 1.057 weight 1.000 ! spec=HCH, no=5003, id=7825, vol=2.120000e+07
or (resid 131 and name HD12) (resid 91 and name HD21)
or (resid 131 and name HD12) (resid 91 and name HD23)
or (resid 131 and name HD11) (resid 91 and name HD22)
or (resid 131 and name HD11) (resid 91 and name HD21)
or (resid 131 and name HD11) (resid 91 and name HD23)
or (resid 131 and name HD13) (resid 91 and name HD22)
or (resid 131 and name HD13) (resid 91 and name HD21)
or (resid 131 and name HD13) (resid 91 and name HD23)
assign (resid 131 and name HD12) (resid 114 and name HB2) 3.411 1.454 1.454 weight 1.000 ! spec=HCH, no=5004, id=7826, vol=8.140000e+06
or (resid 131 and name HD11) (resid 114 and name HB2)
or (resid 131 and name HD13) (resid 114 and name HB2)
assign (resid 131 and name HD12) (resid 131 and name HA) 2.331 0.679 0.679 weight 1.000 ! spec=HCH, no=5006, id=7828, vol=7.990000e+07
or (resid 131 and name HD11) (resid 131 and name HA)
or (resid 131 and name HD13) (resid 131 and name HA)
assign (resid 131 and name HB1) (resid 131 and name HD12) 2.555 0.816 0.816 weight 1.000 ! spec=HCH, no=5007, id=7829, vol=4.610000e+07
or (resid 131 and name HB1) (resid 131 and name HD11)
or (resid 131 and name HB1) (resid 131 and name HD13)
assign (resid 131 and name HD12) (resid 131 and name HG) 2.124 0.564 0.564 weight 1.000 ! spec=HCH, no=5008, id=7830, vol=1.400000e+08
or (resid 131 and name HD11) (resid 131 and name HG)
or (resid 131 and name HD13) (resid 131 and name HG)
assign (resid 131 and name HD12) (resid 131 and name HD11) 1.136 0.161 0.161 weight 1.000 ! spec=HCH, no=5009, id=7831, vol=5.980000e+09
or (resid 131 and name HD12) (resid 131 and name HD13)
or (resid 131 and name HD12) (resid 131 and name HD11)
or (resid 131 and name HD11) (resid 131 and name HD13)
or (resid 131 and name HD12) (resid 131 and name HD13)
or (resid 131 and name HD11) (resid 131 and name HD13)
assign (resid 132 and name HN) (resid 131 and name HD12) 2.432 0.739 0.739 weight 1.000 ! spec=HCH, no=5011, id=7833, vol=6.190000e+07
or (resid 132 and name HN) (resid 131 and name HD11)
or (resid 132 and name HN) (resid 131 and name HD13)
assign (resid 131 and name HD12) (resid 132 and name HA) 3.610 1.629 1.629 weight 1.000 ! spec=HCH, no=5012, id=7834, vol=5.790000e+06
or (resid 131 and name HD11) (resid 132 and name HA)
or (resid 131 and name HD13) (resid 132 and name HA)
assign (resid 131 and name HD12) (resid 132 and name HB2) 3.174 1.259 1.259 weight 1.000 ! spec=HCH, no=5013, id=7835, vol=1.250000e+07
or (resid 131 and name HD11) (resid 132 and name HB2)
or (resid 131 and name HD13) (resid 132 and name HB2)
assign (resid 131 and name HD12) (resid 136 and name HA2) 2.443 0.746 0.746 weight 1.000 ! spec=HCH, no=5014, id=7836, vol=6.030000e+07
or (resid 131 and name HD11) (resid 136 and name HA2)
or (resid 131 and name HD13) (resid 136 and name HA2)
assign (resid 131 and name HD12) (resid 137 and name HA) 3.104 1.205 1.205 weight 1.000 ! spec=HCH, no=5016, id=7838, vol=1.430000e+07
or (resid 131 and name HD11) (resid 137 and name HA)
or (resid 131 and name HD13) (resid 137 and name HA)
assign (resid 131 and name HD12) (resid 138 and name HN) 3.285 1.349 1.349 weight 1.000 ! spec=HCH, no=5017, id=7839, vol=1.020000e+07
or (resid 131 and name HD11) (resid 138 and name HN)
or (resid 131 and name HD13) (resid 138 and name HN)
assign (resid 131 and name HD12) (resid 138 and name HA) 2.935 1.077 1.077 weight 1.000 ! spec=HCH, no=5018, id=7840, vol=2.010000e+07
or (resid 131 and name HD11) (resid 138 and name HA)
or (resid 131 and name HD13) (resid 138 and name HA)
assign (resid 131 and name HD12) (resid 138 and name HD1) 2.186 0.597 0.597 weight 1.000 ! spec=HCH, no=5019, id=7841, vol=1.180000e+08
or (resid 131 and name HD11) (resid 138 and name HD1)
or (resid 131 and name HD13) (resid 138 and name HD1)
assign (resid 131 and name HD12) (resid 138 and name HZ2) 3.463 1.499 1.499 weight 1.000 ! spec=HCH, no=5021, id=7843, vol=7.430000e+06
or (resid 131 and name HD11) (resid 138 and name HZ2)
or (resid 131 and name HD13) (resid 138 and name HZ2)
assign (resid 131 and name HD22) (resid 73 and name HA) 3.301 1.362 1.362 weight 1.000 ! spec=HCH, no=5024, id=7846, vol=9.900000e+06
or (resid 131 and name HD21) (resid 73 and name HA)
or (resid 131 and name HD23) (resid 73 and name HA)
assign (resid 131 and name HB2) (resid 131 and name HD22) 2.290 0.656 0.656 weight 1.000 ! spec=HCH, no=5025, id=7847, vol=8.890000e+07
or (resid 131 and name HB2) (resid 131 and name HD21)
or (resid 131 and name HB2) (resid 131 and name HD23)
assign (resid 76 and name HA) (resid 131 and name HD22) 2.995 1.122 1.122 weight 1.000 ! spec=HCH, no=5030, id=7852, vol=1.780000e+07
or (resid 76 and name HA) (resid 131 and name HD21)
or (resid 76 and name HA) (resid 131 and name HD23)
assign (resid 131 and name HD22) (resid 132 and name HA) 3.991 1.991 1.991 weight 1.000 ! spec=HCH, no=5035, id=7856, vol=3.170000e+06
or (resid 131 and name HD21) (resid 132 and name HA)
or (resid 131 and name HD23) (resid 132 and name HA)
assign (resid 131 and name HD22) (resid 130 and name HA) 3.884 1.886 1.886 weight 1.000 ! spec=HCH, no=5038, id=7859, vol=3.740000e+06
or (resid 131 and name HD21) (resid 130 and name HA)
or (resid 131 and name HD23) (resid 130 and name HA)
assign (resid 131 and name HD22) (resid 72 and name HA) 3.174 1.260 1.260 weight 1.000 ! spec=HCH, no=5040, id=7861, vol=1.250000e+07
or (resid 131 and name HD21) (resid 72 and name HA)
or (resid 131 and name HD23) (resid 72 and name HA)
assign (resid 131 and name HD22) (resid 72 and name HB2) 3.783 1.789 1.789 weight 1.000 ! spec=HCH, no=5041, id=7862, vol=4.380000e+06
or (resid 131 and name HD21) (resid 72 and name HB2)
or (resid 131 and name HD23) (resid 72 and name HB2)
assign (resid 131 and name HD22) (resid 72 and name HB1) 3.990 1.990 1.990 weight 1.000 ! spec=HCH, no=5042, id=7863, vol=3.180000e+06
or (resid 131 and name HD21) (resid 72 and name HB1)
or (resid 131 and name HD23) (resid 72 and name HB1)
assign (resid 131 and name HD22) (resid 72 and name HD21) 3.301 1.362 1.362 weight 1.000 ! spec=HCH, no=5043, id=7864, vol=9.920000e+06
or (resid 131 and name HD21) (resid 72 and name HD21)
or (resid 131 and name HD23) (resid 72 and name HD21)
assign (resid 131 and name HD22) (resid 72 and name HD22) 3.446 1.484 1.484 weight 1.000 ! spec=HCH, no=5044, id=7865, vol=7.660000e+06
or (resid 131 and name HD21) (resid 72 and name HD22)
or (resid 131 and name HD23) (resid 72 and name HD22)
assign (resid 131 and name HD22) (resid 88 and name HA) 3.897 1.899 1.899 weight 1.000 ! spec=HCH, no=5045, id=7866, vol=3.660000e+06
or (resid 131 and name HD21) (resid 88 and name HA)
or (resid 131 and name HD23) (resid 88 and name HA)
assign (resid 131 and name HD22) (resid 89 and name HN) 3.464 1.500 1.500 weight 1.000 ! spec=HCH, no=5046, id=7867, vol=7.420000e+06
or (resid 131 and name HD21) (resid 89 and name HN)
or (resid 131 and name HD23) (resid 89 and name HN)
assign (resid 131 and name HD22) (resid 91 and name HD12) 2.580 0.832 0.832 weight 1.000 ! spec=HCH, no=5048, id=7869, vol=4.350000e+07
or (resid 131 and name HD22) (resid 91 and name HD11)
or (resid 131 and name HD22) (resid 91 and name HD13)
or (resid 131 and name HD21) (resid 91 and name HD12)
or (resid 131 and name HD21) (resid 91 and name HD11)
or (resid 131 and name HD21) (resid 91 and name HD13)
or (resid 131 and name HD23) (resid 91 and name HD12)
or (resid 131 and name HD23) (resid 91 and name HD11)
or (resid 131 and name HD23) (resid 91 and name HD13)
assign (resid 131 and name HD22) (resid 91 and name HD22) 3.264 1.332 1.332 weight 1.000 ! spec=HCH, no=5049, id=7870, vol=1.060000e+07
or (resid 131 and name HD22) (resid 91 and name HD21)
or (resid 131 and name HD22) (resid 91 and name HD23)
or (resid 131 and name HD21) (resid 91 and name HD22)
or (resid 131 and name HD21) (resid 91 and name HD21)
or (resid 131 and name HD21) (resid 91 and name HD23)
or (resid 131 and name HD23) (resid 91 and name HD22)
or (resid 131 and name HD23) (resid 91 and name HD21)
or (resid 131 and name HD23) (resid 91 and name HD23)
assign (resid 131 and name HN) (resid 131 and name HD22) 3.035 1.151 1.151 weight 1.000 ! spec=HCH, no=5050, id=7871, vol=1.640000e+07
or (resid 131 and name HN) (resid 131 and name HD21)
or (resid 131 and name HN) (resid 131 and name HD23)
assign (resid 131 and name HD22) (resid 131 and name HA) 3.076 1.182 1.182 weight 1.000 ! spec=HCH, no=5051, id=7872, vol=1.510000e+07
or (resid 131 and name HD21) (resid 131 and name HA)
or (resid 131 and name HD23) (resid 131 and name HA)
assign (resid 131 and name HB1) (resid 131 and name HD22) 2.359 0.696 0.696 weight 1.000 ! spec=HCH, no=5052, id=7873, vol=7.430000e+07
or (resid 131 and name HB1) (resid 131 and name HD21)
or (resid 131 and name HB1) (resid 131 and name HD23)
assign (resid 131 and name HD22) (resid 131 and name HG) 2.189 0.599 0.599 weight 1.000 ! spec=HCH, no=5053, id=7874, vol=1.170000e+08
or (resid 131 and name HD21) (resid 131 and name HG)
or (resid 131 and name HD23) (resid 131 and name HG)
assign (resid 131 and name HD12) (resid 131 and name HD22) 1.891 0.447 0.447 weight 1.000 ! spec=HCH, no=5054, id=7875, vol=2.800000e+08
or (resid 131 and name HD12) (resid 131 and name HD21)
or (resid 131 and name HD12) (resid 131 and name HD23)
or (resid 131 and name HD11) (resid 131 and name HD22)
or (resid 131 and name HD11) (resid 131 and name HD21)
or (resid 131 and name HD11) (resid 131 and name HD23)
or (resid 131 and name HD13) (resid 131 and name HD22)
or (resid 131 and name HD13) (resid 131 and name HD21)
or (resid 131 and name HD13) (resid 131 and name HD23)
assign (resid 131 and name HD22) (resid 131 and name HD21) 1.236 0.191 0.191 weight 1.000 ! spec=HCH, no=5055, id=7876, vol=3.590000e+09
or (resid 131 and name HD22) (resid 131 and name HD23)
or (resid 131 and name HD22) (resid 131 and name HD21)
or (resid 131 and name HD21) (resid 131 and name HD23)
or (resid 131 and name HD22) (resid 131 and name HD23)
or (resid 131 and name HD21) (resid 131 and name HD23)
assign (resid 136 and name HN) (resid 131 and name HD22) 3.698 1.710 1.710 weight 1.000 ! spec=HCH, no=5058, id=7879, vol=5.010000e+06
or (resid 136 and name HN) (resid 131 and name HD21)
or (resid 136 and name HN) (resid 131 and name HD23)
assign (resid 131 and name HD22) (resid 136 and name HA2) 2.823 0.996 0.996 weight 1.000 ! spec=HCH, no=5059, id=7880, vol=2.530000e+07
or (resid 131 and name HD21) (resid 136 and name HA2)
or (resid 131 and name HD23) (resid 136 and name HA2)
assign (resid 131 and name HD22) (resid 138 and name HA) 3.874 1.876 1.876 weight 1.000 ! spec=HCH, no=5060, id=7881, vol=3.800000e+06
or (resid 131 and name HD21) (resid 138 and name HA)
or (resid 131 and name HD23) (resid 138 and name HA)
assign (resid 131 and name HG) (resid 138 and name HE1) 3.932 1.932 1.932 weight 1.000 ! spec=HCH, no=5066, id=7887, vol=3.470000e+06
assign (resid 131 and name HG) (resid 88 and name HA) 3.814 1.819 1.819 weight 1.000 ! spec=HCH, no=5068, id=7889, vol=4.160000e+06
assign (resid 91 and name HD12) (resid 131 and name HG) 3.204 1.283 1.283 weight 1.000 ! spec=HCH, no=5069, id=7890, vol=1.190000e+07
or (resid 91 and name HD11) (resid 131 and name HG)
or (resid 91 and name HD13) (resid 131 and name HG)
assign (resid 91 and name HD22) (resid 131 and name HG) 3.836 1.839 1.839 weight 1.000 ! spec=HCH, no=5070, id=7891, vol=4.020000e+06
or (resid 91 and name HD21) (resid 131 and name HG)
or (resid 91 and name HD23) (resid 131 and name HG)
assign (resid 131 and name HN) (resid 131 and name HG) 3.392 1.438 1.438 weight 1.000 ! spec=HCH, no=5071, id=7892, vol=8.420000e+06
assign (resid 131 and name HG) (resid 131 and name HA) 3.053 1.165 1.165 weight 1.000 ! spec=HCH, no=5072, id=7893, vol=1.580000e+07
assign (resid 131 and name HG) (resid 136 and name HN) 3.785 1.790 1.790 weight 1.000 ! spec=HCH, no=5075, id=7896, vol=4.360000e+06
assign (resid 131 and name HG) (resid 136 and name HA2) 3.384 1.432 1.432 weight 1.000 ! spec=HCH, no=5076, id=7897, vol=8.540000e+06
assign (resid 88 and name HA) (resid 132 and name HA) 2.870 1.029 1.029 weight 1.000 ! spec=HCH, no=5084, id=7905, vol=2.300000e+07
assign (resid 132 and name HA) (resid 132 and name HB1) 3.081 1.187 1.187 weight 1.000 ! spec=HCH, no=5088, id=7908, vol=1.500000e+07
assign (resid 133 and name HN) (resid 132 and name HA) 2.480 0.769 0.769 weight 1.000 ! spec=HCH, no=5090, id=7910, vol=5.510000e+07
assign (resid 132 and name HA) (resid 133 and name HB) 3.474 1.508 1.508 weight 1.000 ! spec=HCH, no=5092, id=7912, vol=7.300000e+06
assign (resid 134 and name HN) (resid 132 and name HA) 3.667 1.681 1.681 weight 1.000 ! spec=HCH, no=5094, id=7914, vol=5.270000e+06
assign (resid 132 and name HB1) (resid 137 and name HB1) 3.644 1.660 1.660 weight 1.000 ! spec=HCH, no=5098, id=7918, vol=5.480000e+06
assign (resid 132 and name HB2) (resid 88 and name HA) 3.828 1.832 1.832 weight 1.000 ! spec=HCH, no=5100, id=7920, vol=4.070000e+06
assign (resid 132 and name HB2) (resid 132 and name HA) 3.068 1.176 1.176 weight 1.000 ! spec=HCH, no=5103, id=7923, vol=1.540000e+07
assign (resid 132 and name HB1) (resid 132 and name HB2) 2.439 0.744 0.744 weight 1.000 ! spec=HCH, no=5107, id=7926, vol=6.090000e+07
assign (resid 132 and name HB2) (resid 137 and name HB1) 3.340 1.395 1.395 weight 1.000 ! spec=HCH, no=5108, id=7927, vol=9.230000e+06
assign (resid 133 and name HA) (resid 133 and name HG11) 2.746 0.942 0.942 weight 1.000 ! spec=HCH, no=5113, id=7931, vol=2.990000e+07
assign (resid 133 and name HA) (resid 88 and name HA) 4.101 2.102 2.102 weight 1.000 ! spec=HCH, no=5116, id=7934, vol=2.700000e+06
assign (resid 132 and name HA) (resid 133 and name HA) 3.482 1.515 1.515 weight 1.000 ! spec=HCH, no=5117, id=7935, vol=7.200000e+06
assign (resid 133 and name HN) (resid 133 and name HA) 2.756 0.949 0.949 weight 1.000 ! spec=HCH, no=5118, id=7936, vol=2.930000e+07
assign (resid 133 and name HA) (resid 133 and name HB) 2.535 0.804 0.804 weight 1.000 ! spec=HCH, no=5120, id=7937, vol=4.830000e+07
assign (resid 134 and name HN) (resid 133 and name HA) 3.458 1.495 1.495 weight 1.000 ! spec=HCH, no=5121, id=7938, vol=7.500000e+06
assign (resid 133 and name HA) (resid 136 and name HN) 3.273 1.339 1.339 weight 1.000 ! spec=HCH, no=5122, id=7939, vol=1.040000e+07
assign (resid 133 and name HA) (resid 136 and name HA1) 3.929 1.930 1.930 weight 1.000 ! spec=HCH, no=5123, id=7940, vol=3.490000e+06
assign (resid 133 and name HB) (resid 133 and name HD12) 2.577 0.830 0.830 weight 1.000 ! spec=HCH, no=5133, id=7949, vol=4.370000e+07
or (resid 133 and name HB) (resid 133 and name HD11)
or (resid 133 and name HB) (resid 133 and name HD13)
assign (resid 134 and name HN) (resid 133 and name HB) 3.207 1.286 1.286 weight 1.000 ! spec=HCH, no=5135, id=7951, vol=1.180000e+07
assign (resid 85 and name HA1) (resid 133 and name HD12) 2.816 0.991 0.991 weight 1.000 ! spec=HCH, no=5136, id=7952, vol=2.570000e+07
or (resid 85 and name HA1) (resid 133 and name HD11)
or (resid 85 and name HA1) (resid 133 and name HD13)
assign (resid 133 and name HD12) (resid 80 and name HE2) 2.933 1.075 1.075 weight 1.000 ! spec=HCH, no=5140, id=7956, vol=2.020000e+07
or (resid 133 and name HD11) (resid 80 and name HE2)
or (resid 133 and name HD13) (resid 80 and name HE2)
assign (resid 133 and name HD12) (resid 132 and name HA) 3.396 1.442 1.442 weight 1.000 ! spec=HCH, no=5143, id=7959, vol=8.360000e+06
or (resid 133 and name HD11) (resid 132 and name HA)
or (resid 133 and name HD13) (resid 132 and name HA)
assign (resid 133 and name HD12) (resid 133 and name HA) 2.420 0.732 0.732 weight 1.000 ! spec=HCH, no=5146, id=7962, vol=6.380000e+07
or (resid 133 and name HD11) (resid 133 and name HA)
or (resid 133 and name HD13) (resid 133 and name HA)
assign (resid 133 and name HD12) (resid 133 and name HG11) 2.012 0.506 0.506 weight 1.000 ! spec=HCH, no=5147, id=7963, vol=1.930000e+08
or (resid 133 and name HD11) (resid 133 and name HG11)
or (resid 133 and name HD13) (resid 133 and name HG11)
assign (resid 133 and name HG12) (resid 76 and name HA) 3.974 1.974 1.974 weight 1.000 ! spec=HCH, no=5149, id=7965, vol=3.260000e+06
assign (resid 133 and name HG11) (resid 76 and name HA) 3.737 1.746 1.746 weight 1.000 ! spec=HCH, no=5150, id=7966, vol=4.710000e+06
assign (resid 133 and name HG12) (resid 80 and name HN) 3.891 1.892 1.892 weight 1.000 ! spec=HCH, no=5151, id=7967, vol=3.700000e+06
assign (resid 133 and name HG12) (resid 87 and name HA) 3.343 1.397 1.397 weight 1.000 ! spec=HCH, no=5153, id=7969, vol=9.190000e+06
assign (resid 133 and name HG11) (resid 87 and name HA) 3.417 1.459 1.459 weight 1.000 ! spec=HCH, no=5154, id=7970, vol=8.060000e+06
assign (resid 133 and name HG12) (resid 88 and name HA) 3.711 1.722 1.722 weight 1.000 ! spec=HCH, no=5155, id=7971, vol=4.910000e+06
assign (resid 133 and name HG11) (resid 88 and name HA) 3.706 1.717 1.717 weight 1.000 ! spec=HCH, no=5156, id=7972, vol=4.950000e+06
assign (resid 132 and name HA) (resid 133 and name HG12) 3.937 1.937 1.937 weight 1.000 ! spec=HCH, no=5157, id=7973, vol=3.440000e+06
assign (resid 133 and name HG11) (resid 132 and name HA) 3.934 1.934 1.934 weight 1.000 ! spec=HCH, no=5158, id=7974, vol=3.460000e+06
assign (resid 133 and name HG11) (resid 133 and name HN) 2.917 1.063 1.063 weight 1.000 ! spec=HCH, no=5160, id=7976, vol=2.080000e+07
assign (resid 133 and name HG12) (resid 133 and name HA) 3.121 1.217 1.217 weight 1.000 ! spec=HCH, no=5161, id=7977, vol=1.390000e+07
assign (resid 133 and name HB) (resid 133 and name HG12) 2.856 1.019 1.019 weight 1.000 ! spec=HCH, no=5163, id=7979, vol=2.360000e+07
assign (resid 133 and name HB) (resid 133 and name HG11) 2.703 0.913 0.913 weight 1.000 ! spec=HCH, no=5164, id=7980, vol=3.290000e+07
assign (resid 133 and name HG11) (resid 133 and name HG12) 2.093 0.548 0.548 weight 1.000 ! spec=HCH, no=5166, id=7981, vol=1.520000e+08
assign (resid 133 and name HG12) (resid 133 and name HD12) 2.599 0.844 0.844 weight 1.000 ! spec=HCH, no=5169, id=7983, vol=4.160000e+07
or (resid 133 and name HG12) (resid 133 and name HD11)
or (resid 133 and name HG12) (resid 133 and name HD13)
assign (resid 133 and name HG12) (resid 133 and name HG22) 2.695 0.908 0.908 weight 1.000 ! spec=HCH, no=5171, id=7985, vol=3.350000e+07
or (resid 133 and name HG12) (resid 133 and name HG21)
or (resid 133 and name HG12) (resid 133 and name HG23)
assign (resid 133 and name HG11) (resid 133 and name HG22) 2.677 0.896 0.896 weight 1.000 ! spec=HCH, no=5172, id=7986, vol=3.480000e+07
or (resid 133 and name HG11) (resid 133 and name HG21)
or (resid 133 and name HG11) (resid 133 and name HG23)
assign (resid 133 and name HG11) (resid 134 and name HN) 3.615 1.634 1.634 weight 1.000 ! spec=HCH, no=5173, id=7987, vol=5.740000e+06
assign (resid 133 and name HG22) (resid 134 and name HA) 2.744 0.941 0.941 weight 1.000 ! spec=HCH, no=5174, id=7988, vol=3.000000e+07
or (resid 133 and name HG21) (resid 134 and name HA)
or (resid 133 and name HG23) (resid 134 and name HA)
assign (resid 133 and name HG22) (resid 88 and name HA) 3.359 1.411 1.411 weight 1.000 ! spec=HCH, no=5178, id=7992, vol=8.920000e+06
or (resid 133 and name HG21) (resid 88 and name HA)
or (resid 133 and name HG23) (resid 88 and name HA)
assign (resid 133 and name HG22) (resid 77 and name HA) 3.314 1.373 1.373 weight 1.000 ! spec=HCH, no=5182, id=7995, vol=9.680000e+06
or (resid 133 and name HG21) (resid 77 and name HA)
or (resid 133 and name HG23) (resid 77 and name HA)
assign (resid 133 and name HG22) (resid 80 and name HN) 3.129 1.224 1.224 weight 1.000 ! spec=HCH, no=5183, id=7996, vol=1.370000e+07
or (resid 133 and name HG21) (resid 80 and name HN)
or (resid 133 and name HG23) (resid 80 and name HN)
assign (resid 133 and name HG22) (resid 80 and name HG2) 2.122 0.563 0.563 weight 1.000 ! spec=HCH, no=5185, id=7998, vol=1.400000e+08
or (resid 133 and name HG21) (resid 80 and name HG2)
or (resid 133 and name HG23) (resid 80 and name HG2)
assign (resid 133 and name HG22) (resid 80 and name HD2) 2.363 0.698 0.698 weight 1.000 ! spec=HCH, no=5186, id=7999, vol=7.360000e+07
or (resid 133 and name HG21) (resid 80 and name HD2)
or (resid 133 and name HG23) (resid 80 and name HD2)
assign (resid 80 and name HE2) (resid 133 and name HG22) 2.647 0.876 0.876 weight 1.000 ! spec=HCH, no=5187, id=8000, vol=3.730000e+07
or (resid 80 and name HE2) (resid 133 and name HG21)
or (resid 80 and name HE2) (resid 133 and name HG23)
assign (resid 133 and name HA) (resid 133 and name HG22) 2.270 0.644 0.644 weight 1.000 ! spec=HCH, no=5191, id=8004, vol=9.380000e+07
or (resid 133 and name HA) (resid 133 and name HG21)
or (resid 133 and name HA) (resid 133 and name HG23)
assign (resid 133 and name HB) (resid 133 and name HG22) 2.007 0.503 0.503 weight 1.000 ! spec=HCH, no=5192, id=8005, vol=1.960000e+08
or (resid 133 and name HB) (resid 133 and name HG21)
or (resid 133 and name HB) (resid 133 and name HG23)
assign (resid 134 and name HN) (resid 133 and name HG22) 2.780 0.966 0.966 weight 1.000 ! spec=HCH, no=5193, id=8006, vol=2.780000e+07
or (resid 134 and name HN) (resid 133 and name HG21)
or (resid 134 and name HN) (resid 133 and name HG23)
assign (resid 134 and name HA) (resid 80 and name HE2) 3.518 1.547 1.547 weight 1.000 ! spec=HCH, no=5196, id=8009, vol=6.770000e+06
or (resid 134 and name HA) (resid 80 and name HE1)
assign (resid 134 and name HN) (resid 134 and name HA) 2.708 0.917 0.917 weight 1.000 ! spec=HCH, no=5198, id=8011, vol=3.250000e+07
assign (resid 134 and name HA) (resid 76 and name HD22) 3.834 1.838 1.838 weight 1.000 ! spec=HCH, no=5203, id=8016, vol=4.040000e+06
or (resid 134 and name HA) (resid 76 and name HD21)
or (resid 134 and name HA) (resid 76 and name HD23)
assign (resid 134 and name HN) (resid 134 and name HB2) 2.435 0.741 0.741 weight 1.000 ! spec=HCH, no=5214, id=8026, vol=6.150000e+07
assign (resid 134 and name HA) (resid 134 and name HB2) 2.287 0.654 0.654 weight 1.000 ! spec=HCH, no=5215, id=8027, vol=8.970000e+07
assign (resid 134 and name HB2) (resid 134 and name HE2) 3.345 1.398 1.398 weight 1.000 ! spec=HCH, no=5217, id=8029, vol=9.160000e+06
assign (resid 134 and name HB2) (resid 135 and name HA) 3.591 1.612 1.612 weight 1.000 ! spec=HCH, no=5219, id=8031, vol=5.980000e+06
assign (resid 134 and name HE2) (resid 134 and name HG1) 2.559 0.819 0.819 weight 1.000 ! spec=HCH, no=5227, id=8037, vol=4.560000e+07
assign (resid 134 and name HE2) (resid 134 and name HG2) 2.397 0.718 0.718 weight 1.000 ! spec=HCH, no=5230, id=8040, vol=6.760000e+07
assign (resid 134 and name HG2) (resid 132 and name HD2) 3.574 1.597 1.597 weight 1.000 ! spec=HCH, no=5234, id=8043, vol=6.150000e+06
assign (resid 134 and name HG1) (resid 132 and name HE1) 3.747 1.755 1.755 weight 1.000 ! spec=HCH, no=5237, id=8046, vol=4.640000e+06
assign (resid 134 and name HG2) (resid 134 and name HN) 3.174 1.259 1.259 weight 1.000 ! spec=HCH, no=5238, id=8047, vol=1.250000e+07
assign (resid 134 and name HG2) (resid 134 and name HA) 2.834 1.004 1.004 weight 1.000 ! spec=HCH, no=5239, id=8048, vol=2.470000e+07
assign (resid 134 and name HG1) (resid 134 and name HA) 2.875 1.033 1.033 weight 1.000 ! spec=HCH, no=5240, id=8049, vol=2.270000e+07
assign (resid 134 and name HB2) (resid 134 and name HG1) 1.985 0.493 0.493 weight 1.000 ! spec=HCH, no=5242, id=8051, vol=2.100000e+08
assign (resid 134 and name HG2) (resid 135 and name HN) 3.755 1.763 1.763 weight 1.000 ! spec=HCH, no=5245, id=8054, vol=4.570000e+06
assign (resid 135 and name HB) (resid 135 and name HN) 3.372 1.421 1.421 weight 1.000 ! spec=HCH, no=5251, id=8059, vol=8.720000e+06
assign (resid 135 and name HA) (resid 135 and name HB) 2.354 0.693 0.693 weight 1.000 ! spec=HCH, no=5252, id=8060, vol=7.530000e+07
assign (resid 135 and name HB) (resid 136 and name HN) 3.582 1.604 1.604 weight 1.000 ! spec=HCH, no=5255, id=8062, vol=6.070000e+06
assign (resid 135 and name HB) (resid 137 and name HN) 3.157 1.246 1.246 weight 1.000 ! spec=HCH, no=5256, id=8063, vol=1.300000e+07
assign (resid 135 and name HB) (resid 137 and name HG1) 2.925 1.070 1.070 weight 1.000 ! spec=HCH, no=5258, id=8065, vol=2.050000e+07
assign (resid 135 and name HG21) (resid 134 and name HN) 3.395 1.441 1.441 weight 1.000 ! spec=HCH, no=5265, id=8072, vol=8.370000e+06
or (resid 135 and name HG22) (resid 134 and name HN)
or (resid 135 and name HG23) (resid 134 and name HN)
assign (resid 135 and name HG21) (resid 134 and name HA) 3.274 1.340 1.340 weight 1.000 ! spec=HCH, no=5266, id=8073, vol=1.040000e+07
or (resid 135 and name HG22) (resid 134 and name HA)
or (resid 135 and name HG23) (resid 134 and name HA)
assign (resid 135 and name HG21) (resid 134 and name HB2) 2.296 0.659 0.659 weight 1.000 ! spec=HCH, no=5267, id=8074, vol=8.760000e+07
or (resid 135 and name HG22) (resid 134 and name HB2)
or (resid 135 and name HG23) (resid 134 and name HB2)
assign (resid 135 and name HG21) (resid 134 and name HE2) 3.543 1.569 1.569 weight 1.000 ! spec=HCH, no=5268, id=8075, vol=6.480000e+06
or (resid 135 and name HG22) (resid 134 and name HE2)
or (resid 135 and name HG23) (resid 134 and name HE2)
assign (resid 135 and name HN) (resid 135 and name HG21) 2.540 0.806 0.806 weight 1.000 ! spec=HCH, no=5269, id=8076, vol=4.770000e+07
or (resid 135 and name HN) (resid 135 and name HG22)
or (resid 135 and name HN) (resid 135 and name HG23)
assign (resid 135 and name HA) (resid 135 and name HG21) 2.134 0.569 0.569 weight 1.000 ! spec=HCH, no=5270, id=8077, vol=1.360000e+08
or (resid 135 and name HA) (resid 135 and name HG22)
or (resid 135 and name HA) (resid 135 and name HG23)
assign (resid 135 and name HB) (resid 135 and name HG21) 2.098 0.550 0.550 weight 1.000 ! spec=HCH, no=5271, id=8078, vol=1.500000e+08
or (resid 135 and name HB) (resid 135 and name HG22)
or (resid 135 and name HB) (resid 135 and name HG23)
assign (resid 135 and name HG21) (resid 135 and name HG22) 1.216 0.185 0.185 weight 1.000 ! spec=HCH, no=5272, id=8079, vol=3.960000e+09
or (resid 135 and name HG21) (resid 135 and name HG23)
or (resid 135 and name HG21) (resid 135 and name HG22)
or (resid 135 and name HG22) (resid 135 and name HG23)
or (resid 135 and name HG21) (resid 135 and name HG23)
or (resid 135 and name HG22) (resid 135 and name HG23)
assign (resid 136 and name HN) (resid 135 and name HG21) 3.042 1.157 1.157 weight 1.000 ! spec=HCH, no=5273, id=8080, vol=1.620000e+07
or (resid 136 and name HN) (resid 135 and name HG22)
or (resid 136 and name HN) (resid 135 and name HG23)
assign (resid 136 and name HA2) (resid 137 and name HG1) 4.048 2.048 2.048 weight 1.000 ! spec=HCH, no=5275, id=8082, vol=2.920000e+06
assign (resid 72 and name HD22) (resid 136 and name HA2) 3.438 1.478 1.478 weight 1.000 ! spec=HCH, no=5279, id=8086, vol=7.760000e+06
assign (resid 136 and name HA1) (resid 132 and name HB2) 3.985 1.985 1.985 weight 1.000 ! spec=HCH, no=5281, id=8088, vol=3.200000e+06
assign (resid 136 and name HA1) (resid 135 and name HA) 3.746 1.754 1.754 weight 1.000 ! spec=HCH, no=5282, id=8089, vol=4.640000e+06
assign (resid 72 and name HD22) (resid 136 and name HA1) 3.352 1.405 1.405 weight 1.000 ! spec=HCH, no=5283, id=8090, vol=9.030000e+06
assign (resid 136 and name HA2) (resid 76 and name HB2) 3.895 1.896 1.896 weight 1.000 ! spec=HCH, no=5284, id=8091, vol=3.670000e+06
assign (resid 136 and name HA1) (resid 76 and name HB2) 3.884 1.886 1.886 weight 1.000 ! spec=HCH, no=5285, id=8092, vol=3.730000e+06
assign (resid 136 and name HA1) (resid 76 and name HB1) 3.971 1.971 1.971 weight 1.000 ! spec=HCH, no=5286, id=8093, vol=3.270000e+06
assign (resid 136 and name HA2) (resid 76 and name HG) 3.773 1.779 1.779 weight 1.000 ! spec=HCH, no=5287, id=8094, vol=4.450000e+06
assign (resid 131 and name HD12) (resid 136 and name HA1) 2.565 0.822 0.822 weight 1.000 ! spec=HCH, no=5289, id=8096, vol=4.510000e+07
or (resid 131 and name HD11) (resid 136 and name HA1)
or (resid 131 and name HD13) (resid 136 and name HA1)
assign (resid 136 and name HA1) (resid 131 and name HD22) 3.552 1.577 1.577 weight 1.000 ! spec=HCH, no=5291, id=8098, vol=6.380000e+06
or (resid 136 and name HA1) (resid 131 and name HD21)
or (resid 136 and name HA1) (resid 131 and name HD23)
assign (resid 135 and name HN) (resid 136 and name HA1) 3.469 1.504 1.504 weight 1.000 ! spec=HCH, no=5293, id=8100, vol=7.360000e+06
assign (resid 136 and name HA2) (resid 135 and name HA) 3.744 1.753 1.753 weight 1.000 ! spec=HCH, no=5294, id=8101, vol=4.650000e+06
assign (resid 136 and name HA1) (resid 136 and name HA2) 2.249 0.632 0.632 weight 1.000 ! spec=HCH, no=5298, id=8104, vol=9.920000e+07
assign (resid 136 and name HA1) (resid 137 and name HN) 3.437 1.477 1.477 weight 1.000 ! spec=HCH, no=5302, id=8107, vol=7.770000e+06
assign (resid 136 and name HA2) (resid 137 and name HA) 3.844 1.847 1.847 weight 1.000 ! spec=HCH, no=5303, id=8108, vol=3.980000e+06
assign (resid 136 and name HA1) (resid 137 and name HG1) 3.885 1.887 1.887 weight 1.000 ! spec=HCH, no=5304, id=8109, vol=3.730000e+06
assign (resid 114 and name HB1) (resid 137 and name HA) 2.700 0.911 0.911 weight 1.000 ! spec=HCH, no=5305, id=8110, vol=3.310000e+07
assign (resid 138 and name HN) (resid 137 and name HA) 2.291 0.656 0.656 weight 1.000 ! spec=HCH, no=5310, id=8115, vol=8.860000e+07
assign (resid 137 and name HA) (resid 138 and name HA) 3.465 1.501 1.501 weight 1.000 ! spec=HCH, no=5311, id=8116, vol=7.410000e+06
assign (resid 137 and name HB2) (resid 116 and name HG21) 3.050 1.162 1.162 weight 1.000 ! spec=HCH, no=5314, id=8119, vol=1.590000e+07
or (resid 137 and name HB2) (resid 116 and name HG22)
or (resid 137 and name HB2) (resid 116 and name HG23)
assign (resid 137 and name HB1) (resid 116 and name HG21) 3.250 1.320 1.320 weight 1.000 ! spec=HCH, no=5320, id=8125, vol=1.090000e+07
or (resid 137 and name HB1) (resid 116 and name HG22)
or (resid 137 and name HB1) (resid 116 and name HG23)
assign (resid 136 and name HN) (resid 137 and name HB1) 3.866 1.869 1.869 weight 1.000 ! spec=HCH, no=5323, id=8128, vol=3.840000e+06
assign (resid 137 and name HN) (resid 137 and name HB1) 3.097 1.199 1.199 weight 1.000 ! spec=HCH, no=5325, id=8130, vol=1.450000e+07
assign (resid 137 and name HB2) (resid 137 and name HA) 2.840 1.008 1.008 weight 1.000 ! spec=HCH, no=5326, id=8131, vol=2.440000e+07
assign (resid 137 and name HB1) (resid 137 and name HA) 2.935 1.077 1.077 weight 1.000 ! spec=HCH, no=5327, id=8132, vol=2.010000e+07
assign (resid 138 and name HN) (resid 137 and name HB2) 3.133 1.227 1.227 weight 1.000 ! spec=HCH, no=5328, id=8133, vol=1.360000e+07
assign (resid 116 and name HG21) (resid 137 and name HG2) 3.150 1.240 1.240 weight 1.000 ! spec=HCH, no=5330, id=8135, vol=1.310000e+07
or (resid 116 and name HG22) (resid 137 and name HG2)
or (resid 116 and name HG23) (resid 137 and name HG2)
assign (resid 137 and name HG2) (resid 137 and name HA) 2.804 0.983 0.983 weight 1.000 ! spec=HCH, no=5331, id=8136, vol=2.640000e+07
assign (resid 137 and name HG2) (resid 137 and name HN) 3.045 1.159 1.159 weight 1.000 ! spec=HCH, no=5334, id=8139, vol=1.610000e+07
assign (resid 137 and name HG2) (resid 138 and name HN) 3.383 1.431 1.431 weight 1.000 ! spec=HCH, no=5335, id=8140, vol=8.550000e+06
assign (resid 138 and name HA) (resid 139 and name HB2) 3.621 1.639 1.639 weight 1.000 ! spec=HCH, no=5339, id=8144, vol=5.690000e+06
assign (resid 138 and name HA) (resid 114 and name HB2) 4.193 2.198 2.198 weight 1.000 ! spec=HCH, no=5347, id=8152, vol=2.360000e+06
assign (resid 138 and name HA) (resid 115 and name HA) 3.834 1.837 1.837 weight 1.000 ! spec=HCH, no=5348, id=8153, vol=4.040000e+06
assign (resid 138 and name HA) (resid 115 and name HE3) 3.952 1.953 1.953 weight 1.000 ! spec=HCH, no=5349, id=8154, vol=3.360000e+06
assign (resid 130 and name HN) (resid 138 and name HA) 2.986 1.115 1.115 weight 1.000 ! spec=HCH, no=5350, id=8155, vol=1.810000e+07
assign (resid 138 and name HA) (resid 131 and name HA) 2.825 0.998 0.998 weight 1.000 ! spec=HCH, no=5351, id=8156, vol=2.520000e+07
assign (resid 132 and name HN) (resid 138 and name HA) 2.986 1.115 1.115 weight 1.000 ! spec=HCH, no=5352, id=8157, vol=1.810000e+07
assign (resid 138 and name HA) (resid 138 and name HB1) 2.711 0.918 0.918 weight 1.000 ! spec=HCH, no=5356, id=8160, vol=3.230000e+07
assign (resid 138 and name HA) (resid 139 and name HE1) 3.673 1.686 1.686 weight 1.000 ! spec=HCH, no=5360, id=8164, vol=5.230000e+06
assign (resid 138 and name HA) (resid 139 and name HG1) 3.783 1.789 1.789 weight 1.000 ! spec=HCH, no=5361, id=8165, vol=4.380000e+06
assign (resid 138 and name HB2) (resid 138 and name HD1) 3.976 1.977 1.977 weight 1.000 ! spec=HCH, no=5363, id=8167, vol=3.240000e+06
assign (resid 115 and name HA) (resid 138 and name HB1) 3.181 1.265 1.265 weight 1.000 ! spec=HCH, no=5370, id=8174, vol=1.240000e+07
assign (resid 138 and name HB2) (resid 115 and name HE3) 3.406 1.450 1.450 weight 1.000 ! spec=HCH, no=5371, id=8175, vol=8.210000e+06
assign (resid 138 and name HB1) (resid 115 and name HE3) 3.363 1.413 1.413 weight 1.000 ! spec=HCH, no=5372, id=8176, vol=8.870000e+06
assign (resid 138 and name HB2) (resid 115 and name HZ2) 3.758 1.766 1.766 weight 1.000 ! spec=HCH, no=5373, id=8177, vol=4.550000e+06
assign (resid 138 and name HB1) (resid 115 and name HZ2) 3.660 1.674 1.674 weight 1.000 ! spec=HCH, no=5374, id=8178, vol=5.340000e+06
assign (resid 138 and name HB2) (resid 115 and name HZ3) 3.733 1.742 1.742 weight 1.000 ! spec=HCH, no=5375, id=8179, vol=4.740000e+06
assign (resid 138 and name HB1) (resid 115 and name HZ3) 3.652 1.667 1.667 weight 1.000 ! spec=HCH, no=5376, id=8180, vol=5.400000e+06
assign (resid 138 and name HB1) (resid 138 and name HN) 3.294 1.356 1.356 weight 1.000 ! spec=HCH, no=5378, id=8182, vol=1.000000e+07
assign (resid 138 and name HB2) (resid 138 and name HA) 3.220 1.296 1.296 weight 1.000 ! spec=HCH, no=5379, id=8183, vol=1.150000e+07
assign (resid 138 and name HB1) (resid 138 and name HE3) 3.195 1.276 1.276 weight 1.000 ! spec=HCH, no=5383, id=8187, vol=1.210000e+07
assign (resid 139 and name HA) (resid 115 and name HE3) 3.097 1.199 1.199 weight 1.000 ! spec=HCH, no=5388, id=8192, vol=1.450000e+07
assign (resid 139 and name HA) (resid 138 and name HB2) 3.417 1.460 1.460 weight 1.000 ! spec=HCH, no=5389, id=8193, vol=8.060000e+06
assign (resid 139 and name HA) (resid 139 and name HB2) 2.561 0.820 0.820 weight 1.000 ! spec=HCH, no=5391, id=8195, vol=4.550000e+07
assign (resid 139 and name HA) (resid 139 and name HB1) 2.604 0.847 0.847 weight 1.000 ! spec=HCH, no=5392, id=8196, vol=4.120000e+07
assign (resid 139 and name HA) (resid 139 and name HG1) 2.836 1.005 1.005 weight 1.000 ! spec=HCH, no=5393, id=8197, vol=2.470000e+07
assign (resid 127 and name HG21) (resid 139 and name HB2) 3.778 1.785 1.785 weight 1.000 ! spec=HCH, no=5396, id=8200, vol=4.410000e+06
or (resid 127 and name HG22) (resid 139 and name HB2)
or (resid 127 and name HG23) (resid 139 and name HB2)
assign (resid 139 and name HB1) (resid 130 and name HD1) 4.019 2.019 2.019 weight 1.000 ! spec=HCH, no=5399, id=8203, vol=3.040000e+06
or (resid 139 and name HB1) (resid 130 and name HD2)
assign (resid 139 and name HB2) (resid 118 and name HE22) 3.872 1.874 1.874 weight 1.000 ! spec=HCH, no=5401, id=8205, vol=3.810000e+06
assign (resid 139 and name HB1) (resid 118 and name HE22) 4.011 2.011 2.011 weight 1.000 ! spec=HCH, no=5402, id=8206, vol=3.080000e+06
assign (resid 130 and name HN) (resid 139 and name HB1) 3.723 1.733 1.733 weight 1.000 ! spec=HCH, no=5404, id=8208, vol=4.820000e+06
assign (resid 139 and name HB1) (resid 138 and name HA) 3.839 1.842 1.842 weight 1.000 ! spec=HCH, no=5407, id=8211, vol=4.000000e+06
assign (resid 139 and name HB1) (resid 139 and name HE2) 2.941 1.081 1.081 weight 1.000 ! spec=HCH, no=5414, id=8216, vol=1.980000e+07
assign (resid 139 and name HB2) (resid 139 and name HE1) 3.006 1.130 1.130 weight 1.000 ! spec=HCH, no=5415, id=8217, vol=1.740000e+07
assign (resid 139 and name HB2) (resid 139 and name HG2) 2.719 0.924 0.924 weight 1.000 ! spec=HCH, no=5416, id=8218, vol=3.180000e+07
assign (resid 139 and name HB1) (resid 139 and name HG2) 2.727 0.930 0.930 weight 1.000 ! spec=HCH, no=5417, id=8219, vol=3.120000e+07
assign (resid 139 and name HB2) (resid 139 and name HG1) 2.592 0.840 0.840 weight 1.000 ! spec=HCH, no=5418, id=8220, vol=4.220000e+07
assign (resid 139 and name HB1) (resid 139 and name HG1) 2.608 0.850 0.850 weight 1.000 ! spec=HCH, no=5419, id=8221, vol=4.080000e+07
assign (resid 139 and name HB2) (resid 140 and name HN) 3.041 1.156 1.156 weight 1.000 ! spec=HCH, no=5420, id=8222, vol=1.620000e+07
assign (resid 139 and name HB1) (resid 140 and name HN) 3.034 1.150 1.150 weight 1.000 ! spec=HCH, no=5421, id=8223, vol=1.640000e+07
assign (resid 139 and name HD2) (resid 139 and name HA) 3.801 1.806 1.806 weight 1.000 ! spec=HCH, no=5422, id=8224, vol=4.250000e+06
assign (resid 139 and name HD2) (resid 128 and name HN) 3.862 1.865 1.865 weight 1.000 ! spec=HCH, no=5423, id=8225, vol=3.860000e+06
assign (resid 139 and name HD2) (resid 139 and name HE1) 2.720 0.925 0.925 weight 1.000 ! spec=HCH, no=5426, id=8228, vol=3.170000e+07
assign (resid 139 and name HE1) (resid 139 and name HB1) 3.321 1.378 1.378 weight 1.000 ! spec=HCH, no=5434, id=8236, vol=9.560000e+06
assign (resid 139 and name HE2) (resid 139 and name HG2) 2.801 0.981 0.981 weight 1.000 ! spec=HCH, no=5435, id=8237, vol=2.660000e+07
assign (resid 139 and name HE1) (resid 139 and name HG2) 2.876 1.034 1.034 weight 1.000 ! spec=HCH, no=5436, id=8238, vol=2.270000e+07
assign (resid 130 and name HN) (resid 139 and name HG1) 3.718 1.728 1.728 weight 1.000 ! spec=HCH, no=5443, id=8245, vol=4.860000e+06
assign (resid 139 and name HG1) (resid 132 and name HB1) 4.220 2.226 2.226 weight 1.000 ! spec=HCH, no=5445, id=8247, vol=2.270000e+06
assign (resid 139 and name HG2) (resid 138 and name HA) 3.902 1.903 1.903 weight 1.000 ! spec=HCH, no=5447, id=8249, vol=3.630000e+06
assign (resid 139 and name HG2) (resid 139 and name HA) 3.355 1.407 1.407 weight 1.000 ! spec=HCH, no=5451, id=8253, vol=8.980000e+06
assign (resid 139 and name HE1) (resid 139 and name HG1) 2.889 1.043 1.043 weight 1.000 ! spec=HCH, no=5454, id=8256, vol=2.210000e+07
assign (resid 118 and name HE22) (resid 140 and name HA) 3.563 1.587 1.587 weight 1.000 ! spec=HCH, no=5457, id=8259, vol=6.270000e+06
assign (resid 140 and name HA) (resid 140 and name HG2) 2.802 0.982 0.982 weight 1.000 ! spec=HCH, no=5460, id=8262, vol=2.650000e+07
assign (resid 140 and name HA) (resid 140 and name HB2) 2.796 0.977 0.977 weight 1.000 ! spec=HCH, no=5461, id=8263, vol=2.680000e+07
assign (resid 124 and name HD22) (resid 140 and name HA) 3.673 1.687 1.687 weight 1.000 ! spec=HCH, no=5462, id=8264, vol=5.220000e+06
or (resid 124 and name HD21) (resid 140 and name HA)
or (resid 124 and name HD23) (resid 140 and name HA)
assign (resid 140 and name HA) (resid 115 and name HH2) 3.800 1.805 1.805 weight 1.000 ! spec=HCH, no=5463, id=8265, vol=4.260000e+06
assign (resid 140 and name HA) (resid 115 and name HZ2) 3.704 1.715 1.715 weight 1.000 ! spec=HCH, no=5464, id=8266, vol=4.970000e+06
assign (resid 140 and name HA) (resid 129 and name HB2) 2.711 0.919 0.919 weight 1.000 ! spec=HCH, no=5466, id=8268, vol=3.230000e+07
or (resid 140 and name HA) (resid 129 and name HB1)
or (resid 140 and name HA) (resid 129 and name HB3)
assign (resid 140 and name HA) (resid 140 and name HB1) 2.685 0.901 0.901 weight 1.000 ! spec=HCH, no=5468, id=8270, vol=3.420000e+07
assign (resid 140 and name HB2) (resid 141 and name HA2) 3.910 1.911 1.911 weight 1.000 ! spec=HCH, no=5471, id=8273, vol=3.590000e+06
assign (resid 140 and name HB2) (resid 124 and name HB2) 2.915 1.062 1.062 weight 1.000 ! spec=HCH, no=5473, id=8275, vol=2.090000e+07
assign (resid 140 and name HB1) (resid 124 and name HB2) 2.841 1.009 1.009 weight 1.000 ! spec=HCH, no=5474, id=8276, vol=2.440000e+07
assign (resid 140 and name HB1) (resid 139 and name HA) 3.944 1.944 1.944 weight 1.000 ! spec=HCH, no=5476, id=8278, vol=3.410000e+06
assign (resid 140 and name HB2) (resid 124 and name HD22) 3.352 1.405 1.405 weight 1.000 ! spec=HCH, no=5480, id=8282, vol=9.040000e+06
or (resid 140 and name HB2) (resid 124 and name HD21)
or (resid 140 and name HB2) (resid 124 and name HD23)
assign (resid 140 and name HN) (resid 140 and name HB1) 2.984 1.113 1.113 weight 1.000 ! spec=HCH, no=5484, id=8286, vol=1.820000e+07
assign (resid 141 and name HN) (resid 140 and name HB2) 3.379 1.427 1.427 weight 1.000 ! spec=HCH, no=5487, id=8289, vol=8.620000e+06
assign (resid 139 and name HA) (resid 140 and name HD2) 3.847 1.850 1.850 weight 1.000 ! spec=HCH, no=5489, id=8291, vol=3.960000e+06
assign (resid 118 and name HG2) (resid 140 and name HD2) 3.939 1.940 1.940 weight 1.000 ! spec=HCH, no=5496, id=8298, vol=3.430000e+06
assign (resid 140 and name HD2) (resid 124 and name HD12) 2.910 1.058 1.058 weight 1.000 ! spec=HCH, no=5497, id=8299, vol=2.110000e+07
or (resid 140 and name HD2) (resid 124 and name HD11)
or (resid 140 and name HD2) (resid 124 and name HD13)
assign (resid 140 and name HD2) (resid 140 and name HN) 3.063 1.173 1.173 weight 1.000 ! spec=HCH, no=5501, id=8303, vol=1.550000e+07
assign (resid 140 and name HD2) (resid 140 and name HA) 3.198 1.279 1.279 weight 1.000 ! spec=HCH, no=5502, id=8304, vol=1.200000e+07
assign (resid 140 and name HD2) (resid 140 and name HE2) 2.588 0.837 0.837 weight 1.000 ! spec=HCH, no=5503, id=8305, vol=4.270000e+07
assign (resid 140 and name HD2) (resid 140 and name HG2) 2.391 0.714 0.714 weight 1.000 ! spec=HCH, no=5504, id=8306, vol=6.870000e+07
assign (resid 140 and name HE1) (resid 115 and name HE3) 3.886 1.888 1.888 weight 1.000 ! spec=HCH, no=5507, id=8308, vol=3.720000e+06
assign (resid 140 and name HE1) (resid 140 and name HN) 3.855 1.858 1.858 weight 1.000 ! spec=HCH, no=5519, id=8320, vol=3.900000e+06
assign (resid 140 and name HE1) (resid 140 and name HA) 3.979 1.979 1.979 weight 1.000 ! spec=HCH, no=5520, id=8321, vol=3.230000e+06
assign (resid 140 and name HE1) (resid 140 and name HE2) 2.052 0.526 0.526 weight 1.000 ! spec=HCH, no=5523, id=8324, vol=1.720000e+08
assign (resid 140 and name HE2) (resid 140 and name HG2) 2.907 1.056 1.056 weight 1.000 ! spec=HCH, no=5525, id=8325, vol=2.130000e+07
assign (resid 140 and name HE1) (resid 140 and name HG2) 2.974 1.106 1.106 weight 1.000 ! spec=HCH, no=5526, id=8326, vol=1.850000e+07
assign (resid 140 and name HE2) (resid 140 and name HG1) 2.672 0.892 0.892 weight 1.000 ! spec=HCH, no=5527, id=8327, vol=3.530000e+07
assign (resid 140 and name HG2) (resid 102 and name HZ) 3.735 1.744 1.744 weight 1.000 ! spec=HCH, no=5530, id=8330, vol=4.720000e+06
assign (resid 140 and name HG1) (resid 102 and name HZ) 3.793 1.798 1.798 weight 1.000 ! spec=HCH, no=5532, id=8332, vol=4.310000e+06
assign (resid 140 and name HG1) (resid 115 and name HH2) 3.997 1.997 1.997 weight 1.000 ! spec=HCH, no=5535, id=8335, vol=3.150000e+06
assign (resid 140 and name HG2) (resid 115 and name HZ3) 3.424 1.465 1.465 weight 1.000 ! spec=HCH, no=5536, id=8336, vol=7.960000e+06
assign (resid 140 and name HG1) (resid 115 and name HZ3) 3.387 1.434 1.434 weight 1.000 ! spec=HCH, no=5537, id=8337, vol=8.490000e+06
assign (resid 140 and name HG2) (resid 139 and name HA) 3.728 1.737 1.737 weight 1.000 ! spec=HCH, no=5538, id=8338, vol=4.780000e+06
assign (resid 140 and name HG1) (resid 139 and name HA) 3.611 1.630 1.630 weight 1.000 ! spec=HCH, no=5539, id=8339, vol=5.780000e+06
assign (resid 140 and name HG1) (resid 140 and name HA) 3.086 1.191 1.191 weight 1.000 ! spec=HCH, no=5543, id=8343, vol=1.480000e+07
assign (resid 140 and name HG1) (resid 140 and name HG2) 2.295 0.658 0.658 weight 1.000 ! spec=HCH, no=5546, id=8346, vol=8.770000e+07
assign (resid 141 and name HA2) (resid 127 and name HG21) 3.702 1.713 1.713 weight 1.000 ! spec=HCH, no=5547, id=8347, vol=4.980000e+06
or (resid 141 and name HA2) (resid 127 and name HG22)
or (resid 141 and name HA2) (resid 127 and name HG23)
assign (resid 141 and name HA2) (resid 140 and name HA) 3.572 1.594 1.594 weight 1.000 ! spec=HCH, no=5554, id=8354, vol=6.180000e+06
assign (resid 141 and name HA1) (resid 141 and name HA2) 2.248 0.631 0.631 weight 1.000 ! spec=HCH, no=5559, id=8358, vol=9.950000e+07
assign (resid 141 and name HA2) (resid 142 and name HA) 3.593 1.614 1.614 weight 1.000 ! spec=HCH, no=5562, id=8361, vol=5.960000e+06
assign (resid 142 and name HA) (resid 142 and name HB2) 2.250 0.633 0.633 weight 1.000 ! spec=HCH, no=5569, id=8367, vol=9.890000e+07
assign (resid 142 and name HD22) (resid 142 and name HB2) 2.781 0.967 0.967 weight 1.000 ! spec=HCH, no=5578, id=8376, vol=2.770000e+07
assign (resid 144 and name HN) (resid 142 and name HB2) 2.842 1.010 1.010 weight 1.000 ! spec=HCH, no=5581, id=8378, vol=2.430000e+07
assign (resid 143 and name HA) (resid 142 and name HD21) 2.904 1.054 1.054 weight 1.000 ! spec=HCH, no=5588, id=8385, vol=2.140000e+07
assign (resid 143 and name HN) (resid 143 and name HA) 2.645 0.875 0.875 weight 1.000 ! spec=HCH, no=5589, id=8386, vol=3.740000e+07
assign (resid 143 and name HA) (resid 143 and name HB2) 2.832 1.003 1.003 weight 1.000 ! spec=HCH, no=5591, id=8387, vol=2.490000e+07
assign (resid 143 and name HA) (resid 143 and name HB1) 2.653 0.880 0.880 weight 1.000 ! spec=HCH, no=5592, id=8388, vol=3.680000e+07
assign (resid 143 and name HB2) (resid 142 and name HA) 3.609 1.628 1.628 weight 1.000 ! spec=HCH, no=5600, id=8396, vol=5.800000e+06
assign (resid 143 and name HB1) (resid 142 and name HA) 3.787 1.793 1.793 weight 1.000 ! spec=HCH, no=5601, id=8397, vol=4.340000e+06
assign (resid 143 and name HB1) (resid 143 and name HB2) 2.162 0.585 0.585 weight 1.000 ! spec=HCH, no=5606, id=8402, vol=1.250000e+08
assign (resid 144 and name HN) (resid 143 and name HB2) 3.244 1.316 1.316 weight 1.000 ! spec=HCH, no=5608, id=8404, vol=1.100000e+07
assign (resid 144 and name HA) (resid 144 and name HB2) 2.455 0.753 0.753 weight 1.000 ! spec=HCH, no=5611, id=8407, vol=5.860000e+07
assign (resid 144 and name HA) (resid 144 and name HB1) 2.346 0.688 0.688 weight 1.000 ! spec=HCH, no=5612, id=8408, vol=7.700000e+07
assign (resid 144 and name HA) (resid 144 and name HG2) 2.448 0.749 0.749 weight 1.000 ! spec=HCH, no=5613, id=8409, vol=5.960000e+07
assign (resid 145 and name HN) (resid 144 and name HA) 2.138 0.571 0.571 weight 1.000 ! spec=HCH, no=5614, id=8410, vol=1.340000e+08
assign (resid 142 and name HB2) (resid 144 and name HB2) 3.747 1.755 1.755 weight 1.000 ! spec=HCH, no=5616, id=8412, vol=4.640000e+06
or (resid 144 and name HB2) (resid 142 and name HB1)
assign (resid 144 and name HB2) (resid 145 and name HG12) 3.751 1.758 1.758 weight 1.000 ! spec=HCH, no=5617, id=8413, vol=4.610000e+06
or (resid 144 and name HB2) (resid 145 and name HG11)
or (resid 144 and name HB2) (resid 145 and name HG13)
assign (resid 144 and name HB1) (resid 142 and name HB2) 3.936 1.937 1.937 weight 1.000 ! spec=HCH, no=5622, id=8417, vol=3.450000e+06
or (resid 144 and name HB1) (resid 142 and name HB1)
assign (resid 144 and name HB1) (resid 145 and name HG12) 3.616 1.634 1.634 weight 1.000 ! spec=HCH, no=5623, id=8418, vol=5.740000e+06
or (resid 144 and name HB1) (resid 145 and name HG11)
or (resid 144 and name HB1) (resid 145 and name HG13)
assign (resid 144 and name HB1) (resid 144 and name HN) 2.683 0.900 0.900 weight 1.000 ! spec=HCH, no=5625, id=8420, vol=3.440000e+07
assign (resid 144 and name HB2) (resid 144 and name HB1) 1.901 0.452 0.452 weight 1.000 ! spec=HCH, no=5628, id=8423, vol=2.720000e+08
assign (resid 144 and name HB2) (resid 144 and name HG2) 2.132 0.568 0.568 weight 1.000 ! spec=HCH, no=5630, id=8424, vol=1.370000e+08
assign (resid 145 and name HN) (resid 144 and name HB1) 3.345 1.398 1.398 weight 1.000 ! spec=HCH, no=5633, id=8427, vol=9.160000e+06
assign (resid 144 and name HG2) (resid 48 and name HA) 3.703 1.714 1.714 weight 1.000 ! spec=HCH, no=5635, id=8429, vol=4.970000e+06
assign (resid 144 and name HG2) (resid 142 and name HA) 3.948 1.948 1.948 weight 1.000 ! spec=HCH, no=5640, id=8434, vol=3.390000e+06
assign (resid 142 and name HD21) (resid 144 and name HG2) 3.763 1.770 1.770 weight 1.000 ! spec=HCH, no=5641, id=8435, vol=4.520000e+06
assign (resid 142 and name HD22) (resid 144 and name HG2) 3.585 1.607 1.607 weight 1.000 ! spec=HCH, no=5642, id=8436, vol=6.040000e+06
assign (resid 142 and name HB2) (resid 144 and name HG2) 2.861 1.023 1.023 weight 1.000 ! spec=HCH, no=5643, id=8437, vol=2.340000e+07
assign (resid 145 and name HA) (resid 145 and name HB) 2.279 0.649 0.649 weight 1.000 ! spec=HCH, no=5655, id=8448, vol=9.160000e+07
assign (resid 145 and name HA) (resid 145 and name HG12) 2.606 0.849 0.849 weight 1.000 ! spec=HCH, no=5656, id=8449, vol=4.090000e+07
or (resid 145 and name HA) (resid 145 and name HG11)
or (resid 145 and name HA) (resid 145 and name HG13)
assign (resid 145 and name HA) (resid 146 and name HA) 3.586 1.608 1.608 weight 1.000 ! spec=HCH, no=5659, id=8452, vol=6.030000e+06
assign (resid 145 and name HA) (resid 147 and name HB2) 4.037 2.037 2.037 weight 1.000 ! spec=HCH, no=5661, id=8454, vol=2.960000e+06
assign (resid 145 and name HB) (resid 145 and name HN) 3.048 1.162 1.162 weight 1.000 ! spec=HCH, no=5664, id=8457, vol=1.600000e+07
assign (resid 145 and name HB) (resid 146 and name HN) 3.291 1.354 1.354 weight 1.000 ! spec=HCH, no=5669, id=8461, vol=1.010000e+07
assign (resid 145 and name HG12) (resid 143 and name HA) 2.844 1.011 1.011 weight 1.000 ! spec=HCH, no=5674, id=8466, vol=2.420000e+07
or (resid 145 and name HG11) (resid 143 and name HA)
or (resid 145 and name HG13) (resid 143 and name HA)
assign (resid 144 and name HN) (resid 145 and name HG12) 2.850 1.015 1.015 weight 1.000 ! spec=HCH, no=5680, id=8472, vol=2.390000e+07
or (resid 144 and name HN) (resid 145 and name HG11)
or (resid 144 and name HN) (resid 145 and name HG13)
assign (resid 145 and name HN) (resid 145 and name HG12) 2.117 0.560 0.560 weight 1.000 ! spec=HCH, no=5681, id=8473, vol=1.420000e+08
or (resid 145 and name HN) (resid 145 and name HG11)
or (resid 145 and name HN) (resid 145 and name HG13)
assign (resid 145 and name HB) (resid 145 and name HG12) 2.073 0.537 0.537 weight 1.000 ! spec=HCH, no=5682, id=8474, vol=1.610000e+08
or (resid 145 and name HB) (resid 145 and name HG11)
or (resid 145 and name HB) (resid 145 and name HG13)
assign (resid 145 and name HG22) (resid 143 and name HN) 3.765 1.772 1.772 weight 1.000 ! spec=HCH, no=5700, id=8492, vol=4.500000e+06
or (resid 145 and name HG21) (resid 143 and name HN)
or (resid 145 and name HG23) (resid 143 and name HN)
assign (resid 145 and name HG22) (resid 143 and name HA) 2.945 1.084 1.084 weight 1.000 ! spec=HCH, no=5701, id=8493, vol=1.960000e+07
or (resid 145 and name HG21) (resid 143 and name HA)
or (resid 145 and name HG23) (resid 143 and name HA)
assign (resid 145 and name HG22) (resid 143 and name HB2) 3.217 1.294 1.294 weight 1.000 ! spec=HCH, no=5702, id=8494, vol=1.160000e+07
or (resid 145 and name HG21) (resid 143 and name HB2)
or (resid 145 and name HG23) (resid 143 and name HB2)
assign (resid 145 and name HG22) (resid 143 and name HB1) 3.210 1.288 1.288 weight 1.000 ! spec=HCH, no=5703, id=8495, vol=1.170000e+07
or (resid 145 and name HG21) (resid 143 and name HB1)
or (resid 145 and name HG23) (resid 143 and name HB1)
assign (resid 144 and name HN) (resid 145 and name HG22) 2.959 1.095 1.095 weight 1.000 ! spec=HCH, no=5704, id=8496, vol=1.910000e+07
or (resid 144 and name HN) (resid 145 and name HG21)
or (resid 144 and name HN) (resid 145 and name HG23)
assign (resid 145 and name HN) (resid 145 and name HG22) 2.367 0.701 0.701 weight 1.000 ! spec=HCH, no=5706, id=8498, vol=7.280000e+07
or (resid 145 and name HN) (resid 145 and name HG21)
or (resid 145 and name HN) (resid 145 and name HG23)
assign (resid 145 and name HB) (resid 145 and name HG22) 2.030 0.515 0.515 weight 1.000 ! spec=HCH, no=5708, id=8500, vol=1.830000e+08
or (resid 145 and name HB) (resid 145 and name HG21)
or (resid 145 and name HB) (resid 145 and name HG23)
assign (resid 145 and name HG12) (resid 145 and name HG22) 1.854 0.430 0.430 weight 1.000 ! spec=HCH, no=5709, id=8501, vol=3.160000e+08
or (resid 145 and name HG12) (resid 145 and name HG21)
or (resid 145 and name HG12) (resid 145 and name HG23)
or (resid 145 and name HG11) (resid 145 and name HG22)
or (resid 145 and name HG11) (resid 145 and name HG21)
or (resid 145 and name HG11) (resid 145 and name HG23)
or (resid 145 and name HG13) (resid 145 and name HG22)
or (resid 145 and name HG13) (resid 145 and name HG21)
or (resid 145 and name HG13) (resid 145 and name HG23)
assign (resid 145 and name HG22) (resid 145 and name HG21) 1.158 0.168 0.168 weight 1.000 ! spec=HCH, no=5710, id=8502, vol=5.320000e+09
or (resid 145 and name HG22) (resid 145 and name HG23)
or (resid 145 and name HG22) (resid 145 and name HG21)
or (resid 145 and name HG21) (resid 145 and name HG23)
or (resid 145 and name HG22) (resid 145 and name HG23)
or (resid 145 and name HG21) (resid 145 and name HG23)
assign (resid 145 and name HG22) (resid 147 and name HA) 3.070 1.178 1.178 weight 1.000 ! spec=HCH, no=5713, id=8505, vol=1.530000e+07
or (resid 145 and name HG21) (resid 147 and name HA)
or (resid 145 and name HG23) (resid 147 and name HA)
assign (resid 146 and name HA) (resid 46 and name HG12) 3.071 1.179 1.179 weight 1.000 ! spec=HCH, no=5715, id=8507, vol=1.530000e+07
or (resid 146 and name HA) (resid 46 and name HG11)
or (resid 146 and name HA) (resid 46 and name HG13)
assign (resid 146 and name HA) (resid 46 and name HG22) 2.915 1.062 1.062 weight 1.000 ! spec=HCH, no=5716, id=8508, vol=2.090000e+07
or (resid 146 and name HA) (resid 46 and name HG21)
or (resid 146 and name HA) (resid 46 and name HG23)
assign (resid 146 and name HA) (resid 146 and name HB2) 2.241 0.628 0.628 weight 1.000 ! spec=HCH, no=5723, id=8514, vol=1.010000e+08
assign (resid 146 and name HA) (resid 147 and name HN) 2.905 1.055 1.055 weight 1.000 ! spec=HCH, no=5724, id=8515, vol=2.130000e+07
assign (resid 146 and name HB2) (resid 147 and name HN) 3.236 1.309 1.309 weight 1.000 ! spec=HCH, no=5725, id=8516, vol=1.120000e+07
assign (resid 146 and name HB1) (resid 146 and name HA) 2.227 0.620 0.620 weight 1.000 ! spec=HCH, no=5732, id=8523, vol=1.050000e+08
assign (resid 148 and name HN) (resid 147 and name HA) 2.278 0.649 0.649 weight 1.000 ! spec=HCH, no=5740, id=8528, vol=9.180000e+07
assign (resid 147 and name HA) (resid 147 and name HN) 2.796 0.977 0.977 weight 1.000 ! spec=HCH, no=5742, id=8530, vol=2.690000e+07
assign (resid 147 and name HA) (resid 147 and name HB2) 2.262 0.639 0.639 weight 1.000 ! spec=HCH, no=5744, id=8531, vol=9.580000e+07
assign (resid 147 and name HB2) (resid 146 and name HN) 3.631 1.648 1.648 weight 1.000 ! spec=HCH, no=5745, id=8532, vol=5.590000e+06
assign (resid 147 and name HB2) (resid 147 and name HN) 2.551 0.814 0.814 weight 1.000 ! spec=HCH, no=5759, id=8546, vol=4.650000e+07
assign (resid 148 and name HA) (resid 150 and name HN) 3.127 1.222 1.222 weight 1.000 ! spec=HCH, no=5765, id=8552, vol=1.370000e+07
assign (resid 148 and name HA) (resid 148 and name HB) 2.431 0.739 0.739 weight 1.000 ! spec=HCH, no=5766, id=8553, vol=6.210000e+07
assign (resid 148 and name HA) (resid 148 and name HN) 2.781 0.966 0.966 weight 1.000 ! spec=HCH, no=5768, id=8555, vol=2.770000e+07
assign (resid 148 and name HA) (resid 149 and name HB2) 3.179 1.264 1.264 weight 1.000 ! spec=HCH, no=5772, id=8558, vol=1.240000e+07
assign (resid 148 and name HB) (resid 46 and name HG22) 2.833 1.003 1.003 weight 1.000 ! spec=HCH, no=5776, id=8562, vol=2.480000e+07
or (resid 148 and name HB) (resid 46 and name HG21)
or (resid 148 and name HB) (resid 46 and name HG23)
assign (resid 148 and name HG12) (resid 55 and name HE22) 3.673 1.686 1.686 weight 1.000 ! spec=HCH, no=5784, id=8569, vol=5.220000e+06
or (resid 148 and name HG11) (resid 55 and name HE22)
or (resid 148 and name HG13) (resid 55 and name HE22)
assign (resid 148 and name HB) (resid 148 and name HG12) 2.051 0.526 0.526 weight 1.000 ! spec=HCH, no=5791, id=8574, vol=1.720000e+08
or (resid 148 and name HB) (resid 148 and name HG11)
or (resid 148 and name HB) (resid 148 and name HG13)
assign (resid 148 and name HG12) (resid 148 and name HA) 2.332 0.680 0.680 weight 1.000 ! spec=HCH, no=5798, id=8579, vol=7.970000e+07
or (resid 148 and name HG11) (resid 148 and name HA)
or (resid 148 and name HG13) (resid 148 and name HA)
assign (resid 149 and name HN) (resid 148 and name HG12) 2.853 1.018 1.018 weight 1.000 ! spec=HCH, no=5799, id=8580, vol=2.380000e+07
or (resid 149 and name HN) (resid 148 and name HG11)
or (resid 149 and name HN) (resid 148 and name HG13)
assign (resid 148 and name HG12) (resid 150 and name HN) 2.835 1.004 1.004 weight 1.000 ! spec=HCH, no=5801, id=8582, vol=2.470000e+07
or (resid 148 and name HG11) (resid 150 and name HN)
or (resid 148 and name HG13) (resid 150 and name HN)
assign (resid 148 and name HG22) (resid 147 and name HN) 3.106 1.206 1.206 weight 1.000 ! spec=HCH, no=5802, id=8583, vol=1.430000e+07
or (resid 148 and name HG21) (resid 147 and name HN)
or (resid 148 and name HG23) (resid 147 and name HN)
assign (resid 148 and name HG22) (resid 148 and name HG21) 1.171 0.171 0.171 weight 1.000 ! spec=HCH, no=5803, id=8584, vol=4.980000e+09
or (resid 148 and name HG22) (resid 148 and name HG23)
or (resid 148 and name HG22) (resid 148 and name HG21)
or (resid 148 and name HG21) (resid 148 and name HG23)
or (resid 148 and name HG22) (resid 148 and name HG23)
or (resid 148 and name HG21) (resid 148 and name HG23)
assign (resid 148 and name HB) (resid 148 and name HG22) 1.999 0.500 0.500 weight 1.000 ! spec=HCH, no=5806, id=8587, vol=2.010000e+08
or (resid 148 and name HB) (resid 148 and name HG21)
or (resid 148 and name HB) (resid 148 and name HG23)
assign (resid 148 and name HG22) (resid 146 and name HA) 2.917 1.063 1.063 weight 1.000 ! spec=HCH, no=5811, id=8592, vol=2.080000e+07
or (resid 148 and name HG21) (resid 146 and name HA)
or (resid 148 and name HG23) (resid 146 and name HA)
assign (resid 148 and name HG22) (resid 147 and name HB2) 3.101 1.202 1.202 weight 1.000 ! spec=HCH, no=5813, id=8594, vol=1.440000e+07
or (resid 148 and name HG21) (resid 147 and name HB2)
or (resid 148 and name HG23) (resid 147 and name HB2)
assign (resid 148 and name HG22) (resid 148 and name HN) 2.613 0.853 0.853 weight 1.000 ! spec=HCH, no=5814, id=8595, vol=4.030000e+07
or (resid 148 and name HG21) (resid 148 and name HN)
or (resid 148 and name HG23) (resid 148 and name HN)
assign (resid 148 and name HA) (resid 148 and name HG22) 2.169 0.588 0.588 weight 1.000 ! spec=HCH, no=5815, id=8596, vol=1.230000e+08
or (resid 148 and name HA) (resid 148 and name HG21)
or (resid 148 and name HA) (resid 148 and name HG23)
assign (resid 149 and name HA) (resid 149 and name HB2) 2.628 0.863 0.863 weight 1.000 ! spec=HCH, no=5818, id=8599, vol=3.900000e+07
assign (resid 149 and name HA) (resid 43 and name HB2) 2.692 0.906 0.906 weight 1.000 ! spec=HCH, no=5821, id=8602, vol=3.370000e+07
or (resid 149 and name HA) (resid 43 and name HB1)
or (resid 149 and name HA) (resid 43 and name HB3)
assign (resid 149 and name HA) (resid 149 and name HB1) 2.369 0.701 0.701 weight 1.000 ! spec=HCH, no=5822, id=8603, vol=7.260000e+07
assign (resid 149 and name HA) (resid 44 and name HN) 3.274 1.340 1.340 weight 1.000 ! spec=HCH, no=5826, id=8607, vol=1.040000e+07
assign (resid 149 and name HA) (resid 149 and name HN) 2.674 0.894 0.894 weight 1.000 ! spec=HCH, no=5827, id=8608, vol=3.510000e+07
assign (resid 149 and name HA) (resid 149 and name HG1) 2.619 0.857 0.857 weight 1.000 ! spec=HCH, no=5829, id=8609, vol=3.970000e+07
assign (resid 149 and name HA) (resid 150 and name HA1) 3.325 1.382 1.382 weight 1.000 ! spec=HCH, no=5831, id=8611, vol=9.480000e+06
assign (resid 149 and name HB2) (resid 149 and name HB1) 1.871 0.438 0.438 weight 1.000 ! spec=HCH, no=5833, id=8613, vol=2.990000e+08
assign (resid 42 and name HN) (resid 149 and name HB1) 3.342 1.396 1.396 weight 1.000 ! spec=HCH, no=5838, id=8618, vol=9.200000e+06
assign (resid 149 and name HB1) (resid 43 and name HA) 3.285 1.349 1.349 weight 1.000 ! spec=HCH, no=5841, id=8621, vol=1.020000e+07
assign (resid 149 and name HB1) (resid 43 and name HB2) 3.080 1.186 1.186 weight 1.000 ! spec=HCH, no=5846, id=8626, vol=1.500000e+07
or (resid 149 and name HB1) (resid 43 and name HB1)
or (resid 149 and name HB1) (resid 43 and name HB3)
assign (resid 149 and name HG1) (resid 43 and name HA) 2.697 0.909 0.909 weight 1.000 ! spec=HCH, no=5851, id=8631, vol=3.330000e+07
assign (resid 149 and name HG1) (resid 147 and name HA) 3.583 1.605 1.605 weight 1.000 ! spec=HCH, no=5853, id=8633, vol=6.060000e+06
assign (resid 149 and name HG1) (resid 148 and name HN) 3.170 1.256 1.256 weight 1.000 ! spec=HCH, no=5854, id=8634, vol=1.260000e+07
assign (resid 148 and name HG12) (resid 149 and name HG1) 3.561 1.585 1.585 weight 1.000 ! spec=HCH, no=5855, id=8635, vol=6.290000e+06
or (resid 148 and name HG11) (resid 149 and name HG1)
or (resid 148 and name HG13) (resid 149 and name HG1)
assign (resid 149 and name HG2) (resid 149 and name HN) 3.096 1.198 1.198 weight 1.000 ! spec=HCH, no=5856, id=8636, vol=1.460000e+07
assign (resid 150 and name HA1) (resid 39 and name HZ) 2.914 1.062 1.062 weight 1.000 ! spec=HCH, no=5861, id=8641, vol=2.090000e+07
assign (resid 151 and name HA) (resid 151 and name HB) 3.046 1.160 1.160 weight 1.000 ! spec=HCH, no=5873, id=8651, vol=1.610000e+07
assign (resid 151 and name HA) (resid 151 and name HG21) 2.490 0.775 0.775 weight 1.000 ! spec=HCH, no=5874, id=8652, vol=5.380000e+07
or (resid 151 and name HA) (resid 151 and name HG22)
or (resid 151 and name HA) (resid 151 and name HG23)
assign (resid 152 and name HN) (resid 151 and name HA) 2.316 0.670 0.670 weight 1.000 ! spec=HCH, no=5875, id=8653, vol=8.320000e+07
assign (resid 151 and name HB) (resid 90 and name HB2) 2.826 0.998 0.998 weight 1.000 ! spec=HCH, no=5877, id=8655, vol=2.520000e+07
assign (resid 152 and name HN) (resid 151 and name HB) 3.170 1.256 1.256 weight 1.000 ! spec=HCH, no=5881, id=8659, vol=1.260000e+07
assign (resid 151 and name HB) (resid 90 and name HD22) 3.939 1.939 1.939 weight 1.000 ! spec=HCH, no=5888, id=8666, vol=3.430000e+06
or (resid 151 and name HB) (resid 90 and name HD21)
or (resid 151 and name HB) (resid 90 and name HD23)
assign (resid 151 and name HB) (resid 55 and name HB2) 3.725 1.734 1.734 weight 1.000 ! spec=HCH, no=5889, id=8667, vol=4.800000e+06
assign (resid 151 and name HG21) (resid 63 and name HG2) 2.770 0.959 0.959 weight 1.000 ! spec=HCH, no=5895, id=8672, vol=2.840000e+07
or (resid 151 and name HG22) (resid 63 and name HG2)
or (resid 151 and name HG23) (resid 63 and name HG2)
assign (resid 151 and name HG21) (resid 40 and name HD12) 3.276 1.342 1.342 weight 1.000 ! spec=HCH, no=5902, id=8679, vol=1.040000e+07
or (resid 151 and name HG21) (resid 40 and name HD11)
or (resid 151 and name HG21) (resid 40 and name HD13)
or (resid 151 and name HG22) (resid 40 and name HD12)
or (resid 151 and name HG22) (resid 40 and name HD11)
or (resid 151 and name HG22) (resid 40 and name HD13)
or (resid 151 and name HG23) (resid 40 and name HD12)
or (resid 151 and name HG23) (resid 40 and name HD11)
or (resid 151 and name HG23) (resid 40 and name HD13)
assign (resid 151 and name HG21) (resid 40 and name HD22) 2.575 0.829 0.829 weight 1.000 ! spec=HCH, no=5903, id=8680, vol=4.390000e+07
or (resid 151 and name HG21) (resid 40 and name HD21)
or (resid 151 and name HG21) (resid 40 and name HD23)
or (resid 151 and name HG22) (resid 40 and name HD22)
or (resid 151 and name HG22) (resid 40 and name HD21)
or (resid 151 and name HG22) (resid 40 and name HD23)
or (resid 151 and name HG23) (resid 40 and name HD22)
or (resid 151 and name HG23) (resid 40 and name HD21)
or (resid 151 and name HG23) (resid 40 and name HD23)
assign (resid 151 and name HG21) (resid 150 and name HA2) 3.142 1.234 1.234 weight 1.000 ! spec=HCH, no=5906, id=8683, vol=1.330000e+07
or (resid 151 and name HG22) (resid 150 and name HA2)
or (resid 151 and name HG23) (resid 150 and name HA2)
assign (resid 151 and name HG21) (resid 151 and name HN) 2.867 1.028 1.028 weight 1.000 ! spec=HCH, no=5907, id=8684, vol=2.310000e+07
or (resid 151 and name HG22) (resid 151 and name HN)
or (resid 151 and name HG23) (resid 151 and name HN)
assign (resid 151 and name HB) (resid 151 and name HG21) 2.220 0.616 0.616 weight 1.000 ! spec=HCH, no=5908, id=8685, vol=1.070000e+08
or (resid 151 and name HB) (resid 151 and name HG22)
or (resid 151 and name HB) (resid 151 and name HG23)
assign (resid 151 and name HG21) (resid 152 and name HA) 3.357 1.409 1.409 weight 1.000 ! spec=HCH, no=5910, id=8687, vol=8.960000e+06
or (resid 151 and name HG22) (resid 152 and name HA)
or (resid 151 and name HG23) (resid 152 and name HA)
assign (resid 151 and name HG21) (resid 153 and name HA) 3.742 1.751 1.751 weight 1.000 ! spec=HCH, no=5911, id=8688, vol=4.670000e+06
or (resid 151 and name HG22) (resid 153 and name HA)
or (resid 151 and name HG23) (resid 153 and name HA)
assign (resid 152 and name HA) (resid 152 and name HG) 3.106 1.206 1.206 weight 1.000 ! spec=HCH, no=5916, id=8693, vol=1.430000e+07
assign (resid 151 and name HA) (resid 152 and name HA) 3.423 1.464 1.464 weight 1.000 ! spec=HCH, no=5920, id=8697, vol=7.980000e+06
assign (resid 152 and name HA) (resid 152 and name HB2) 2.821 0.995 0.995 weight 1.000 ! spec=HCH, no=5922, id=8698, vol=2.540000e+07
assign (resid 152 and name HA) (resid 152 and name HB1) 2.992 1.119 1.119 weight 1.000 ! spec=HCH, no=5923, id=8699, vol=1.790000e+07
assign (resid 153 and name HN) (resid 152 and name HA) 2.326 0.676 0.676 weight 1.000 ! spec=HCH, no=5925, id=8701, vol=8.100000e+07
assign (resid 152 and name HA) (resid 153 and name HA) 3.587 1.609 1.609 weight 1.000 ! spec=HCH, no=5926, id=8702, vol=6.020000e+06
assign (resid 152 and name HB2) (resid 64 and name HG22) 2.810 0.987 0.987 weight 1.000 ! spec=HCH, no=5928, id=8704, vol=2.600000e+07
or (resid 152 and name HB2) (resid 64 and name HG21)
or (resid 152 and name HB2) (resid 64 and name HG23)
assign (resid 152 and name HB1) (resid 39 and name HD1) 3.787 1.793 1.793 weight 1.000 ! spec=HCH, no=5932, id=8708, vol=4.350000e+06
or (resid 152 and name HB1) (resid 39 and name HD2)
assign (resid 64 and name HG22) (resid 152 and name HB1) 2.707 0.916 0.916 weight 1.000 ! spec=HCH, no=5933, id=8709, vol=3.260000e+07
or (resid 64 and name HG21) (resid 152 and name HB1)
or (resid 64 and name HG23) (resid 152 and name HB1)
assign (resid 152 and name HB1) (resid 151 and name HA) 3.428 1.469 1.469 weight 1.000 ! spec=HCH, no=5936, id=8712, vol=7.900000e+06
assign (resid 152 and name HB1) (resid 64 and name HN) 3.854 1.857 1.857 weight 1.000 ! spec=HCH, no=5937, id=8713, vol=3.910000e+06
assign (resid 152 and name HB2) (resid 89 and name HA) 3.800 1.805 1.805 weight 1.000 ! spec=HCH, no=5941, id=8717, vol=4.260000e+06
assign (resid 152 and name HB1) (resid 152 and name HB2) 2.344 0.687 0.687 weight 1.000 ! spec=HCH, no=5944, id=8720, vol=7.730000e+07
assign (resid 152 and name HB2) (resid 153 and name HA) 4.127 2.129 2.129 weight 1.000 ! spec=HCH, no=5949, id=8724, vol=2.600000e+06
assign (resid 37 and name HB2) (resid 152 and name HD12) 2.873 1.032 1.032 weight 1.000 ! spec=HCH, no=5959, id=8734, vol=2.280000e+07
or (resid 37 and name HB2) (resid 152 and name HD11)
or (resid 37 and name HB2) (resid 152 and name HD13)
assign (resid 78 and name HG21) (resid 152 and name HD12) 3.155 1.244 1.244 weight 1.000 ! spec=HCH, no=5960, id=8735, vol=1.300000e+07
or (resid 78 and name HG21) (resid 152 and name HD11)
or (resid 78 and name HG21) (resid 152 and name HD13)
or (resid 78 and name HG22) (resid 152 and name HD12)
or (resid 78 and name HG22) (resid 152 and name HD11)
or (resid 78 and name HG22) (resid 152 and name HD13)
or (resid 78 and name HG23) (resid 152 and name HD12)
or (resid 78 and name HG23) (resid 152 and name HD11)
or (resid 78 and name HG23) (resid 152 and name HD13)
assign (resid 37 and name HB1) (resid 152 and name HD12) 3.060 1.171 1.171 weight 1.000 ! spec=HCH, no=5962, id=8737, vol=1.560000e+07
or (resid 37 and name HB1) (resid 152 and name HD11)
or (resid 37 and name HB1) (resid 152 and name HD13)
assign (resid 152 and name HD12) (resid 78 and name HN) 3.998 1.998 1.998 weight 1.000 ! spec=HCH, no=5963, id=8738, vol=3.140000e+06
or (resid 152 and name HD11) (resid 78 and name HN)
or (resid 152 and name HD13) (resid 78 and name HN)
assign (resid 38 and name HN) (resid 152 and name HD12) 3.049 1.162 1.162 weight 1.000 ! spec=HCH, no=5965, id=8740, vol=1.600000e+07
or (resid 38 and name HN) (resid 152 and name HD11)
or (resid 38 and name HN) (resid 152 and name HD13)
assign (resid 152 and name HD12) (resid 154 and name HN) 3.870 1.872 1.872 weight 1.000 ! spec=HCH, no=5969, id=8744, vol=3.820000e+06
or (resid 152 and name HD11) (resid 154 and name HN)
or (resid 152 and name HD13) (resid 154 and name HN)
assign (resid 152 and name HD12) (resid 154 and name HA) 3.599 1.619 1.619 weight 1.000 ! spec=HCH, no=5972, id=8747, vol=5.900000e+06
or (resid 152 and name HD11) (resid 154 and name HA)
or (resid 152 and name HD13) (resid 154 and name HA)
assign (resid 152 and name HD12) (resid 74 and name HE1) 3.991 1.991 1.991 weight 1.000 ! spec=HCH, no=5973, id=8748, vol=3.170000e+06
or (resid 152 and name HD11) (resid 74 and name HE1)
or (resid 152 and name HD13) (resid 74 and name HE1)
assign (resid 152 and name HD12) (resid 38 and name HA) 3.210 1.288 1.288 weight 1.000 ! spec=HCH, no=5976, id=8751, vol=1.170000e+07
or (resid 152 and name HD11) (resid 38 and name HA)
or (resid 152 and name HD13) (resid 38 and name HA)
assign (resid 152 and name HD12) (resid 39 and name HD1) 2.596 0.842 0.842 weight 1.000 ! spec=HCH, no=5978, id=8753, vol=4.190000e+07
or (resid 152 and name HD11) (resid 39 and name HD1)
or (resid 152 and name HD13) (resid 39 and name HD1)
assign (resid 152 and name HD12) (resid 79 and name HA) 3.615 1.634 1.634 weight 1.000 ! spec=HCH, no=5979, id=8754, vol=5.740000e+06
or (resid 152 and name HD11) (resid 79 and name HA)
or (resid 152 and name HD13) (resid 79 and name HA)
assign (resid 152 and name HD12) (resid 83 and name HE1) 4.054 2.054 2.054 weight 1.000 ! spec=HCH, no=5981, id=8756, vol=2.890000e+06
or (resid 152 and name HD11) (resid 83 and name HE1)
or (resid 152 and name HD13) (resid 83 and name HE1)
assign (resid 152 and name HA) (resid 152 and name HD12) 2.434 0.741 0.741 weight 1.000 ! spec=HCH, no=5984, id=8759, vol=6.160000e+07
or (resid 152 and name HA) (resid 152 and name HD11)
or (resid 152 and name HA) (resid 152 and name HD13)
assign (resid 152 and name HB2) (resid 152 and name HD12) 2.272 0.645 0.645 weight 1.000 ! spec=HCH, no=5985, id=8760, vol=9.320000e+07
or (resid 152 and name HB2) (resid 152 and name HD11)
or (resid 152 and name HB2) (resid 152 and name HD13)
assign (resid 152 and name HB1) (resid 152 and name HD12) 2.408 0.725 0.725 weight 1.000 ! spec=HCH, no=5986, id=8761, vol=6.580000e+07
or (resid 152 and name HB1) (resid 152 and name HD11)
or (resid 152 and name HB1) (resid 152 and name HD13)
assign (resid 152 and name HD12) (resid 152 and name HG) 2.229 0.621 0.621 weight 1.000 ! spec=HCH, no=5987, id=8762, vol=1.050000e+08
or (resid 152 and name HD11) (resid 152 and name HG)
or (resid 152 and name HD13) (resid 152 and name HG)
assign (resid 152 and name HD12) (resid 152 and name HD11) 1.215 0.184 0.184 weight 1.000 ! spec=HCH, no=5988, id=8763, vol=3.990000e+09
or (resid 152 and name HD12) (resid 152 and name HD13)
or (resid 152 and name HD12) (resid 152 and name HD11)
or (resid 152 and name HD11) (resid 152 and name HD13)
or (resid 152 and name HD12) (resid 152 and name HD13)
or (resid 152 and name HD11) (resid 152 and name HD13)
assign (resid 152 and name HD12) (resid 153 and name HB2) 3.316 1.375 1.375 weight 1.000 ! spec=HCH, no=5989, id=8764, vol=9.640000e+06
or (resid 152 and name HD11) (resid 153 and name HB2)
or (resid 152 and name HD13) (resid 153 and name HB2)
assign (resid 152 and name HD22) (resid 75 and name HB) 3.036 1.152 1.152 weight 1.000 ! spec=HCH, no=5991, id=8766, vol=1.640000e+07
or (resid 152 and name HD21) (resid 75 and name HB)
or (resid 152 and name HD23) (resid 75 and name HB)
assign (resid 152 and name HD22) (resid 64 and name HA) 3.542 1.568 1.568 weight 1.000 ! spec=HCH, no=5992, id=8767, vol=6.500000e+06
or (resid 152 and name HD21) (resid 64 and name HA)
or (resid 152 and name HD23) (resid 64 and name HA)
assign (resid 152 and name HD22) (resid 152 and name HG) 2.341 0.685 0.685 weight 1.000 ! spec=HCH, no=5994, id=8769, vol=7.800000e+07
or (resid 152 and name HD21) (resid 152 and name HG)
or (resid 152 and name HD23) (resid 152 and name HG)
assign (resid 152 and name HD22) (resid 75 and name HN) 3.852 1.855 1.855 weight 1.000 ! spec=HCH, no=6004, id=8779, vol=3.920000e+06
or (resid 152 and name HD21) (resid 75 and name HN)
or (resid 152 and name HD23) (resid 75 and name HN)
assign (resid 152 and name HD22) (resid 153 and name HB2) 3.588 1.609 1.609 weight 1.000 ! spec=HCH, no=6010, id=8783, vol=6.010000e+06
or (resid 152 and name HD21) (resid 153 and name HB2)
or (resid 152 and name HD23) (resid 153 and name HB2)
assign (resid 78 and name HG21) (resid 152 and name HD22) 3.270 1.336 1.336 weight 1.000 ! spec=HCH, no=6011, id=8784, vol=1.050000e+07
or (resid 78 and name HG21) (resid 152 and name HD21)
or (resid 78 and name HG21) (resid 152 and name HD23)
or (resid 78 and name HG22) (resid 152 and name HD22)
or (resid 78 and name HG22) (resid 152 and name HD21)
or (resid 78 and name HG22) (resid 152 and name HD23)
or (resid 78 and name HG23) (resid 152 and name HD22)
or (resid 78 and name HG23) (resid 152 and name HD21)
or (resid 78 and name HG23) (resid 152 and name HD23)
assign (resid 152 and name HD22) (resid 74 and name HE1) 3.647 1.662 1.662 weight 1.000 ! spec=HCH, no=6012, id=8785, vol=5.450000e+06
or (resid 152 and name HD21) (resid 74 and name HE1)
or (resid 152 and name HD23) (resid 74 and name HE1)
assign (resid 152 and name HD22) (resid 78 and name HB) 3.401 1.446 1.446 weight 1.000 ! spec=HCH, no=6016, id=8789, vol=8.280000e+06
or (resid 152 and name HD21) (resid 78 and name HB)
or (resid 152 and name HD23) (resid 78 and name HB)
assign (resid 152 and name HD22) (resid 79 and name HA) 3.565 1.588 1.588 weight 1.000 ! spec=HCH, no=6017, id=8790, vol=6.250000e+06
or (resid 152 and name HD21) (resid 79 and name HA)
or (resid 152 and name HD23) (resid 79 and name HA)
assign (resid 152 and name HD22) (resid 152 and name HA) 2.725 0.928 0.928 weight 1.000 ! spec=HCH, no=6021, id=8794, vol=3.130000e+07
or (resid 152 and name HD21) (resid 152 and name HA)
or (resid 152 and name HD23) (resid 152 and name HA)
assign (resid 152 and name HD22) (resid 152 and name HB2) 2.384 0.710 0.710 weight 1.000 ! spec=HCH, no=6022, id=8795, vol=6.990000e+07
or (resid 152 and name HD21) (resid 152 and name HB2)
or (resid 152 and name HD23) (resid 152 and name HB2)
assign (resid 152 and name HD22) (resid 152 and name HB1) 2.320 0.673 0.673 weight 1.000 ! spec=HCH, no=6023, id=8796, vol=8.210000e+07
or (resid 152 and name HD21) (resid 152 and name HB1)
or (resid 152 and name HD23) (resid 152 and name HB1)
assign (resid 152 and name HD22) (resid 152 and name HD21) 1.259 0.198 0.198 weight 1.000 ! spec=HCH, no=6024, id=8797, vol=3.220000e+09
or (resid 152 and name HD22) (resid 152 and name HD23)
or (resid 152 and name HD22) (resid 152 and name HD21)
or (resid 152 and name HD21) (resid 152 and name HD23)
or (resid 152 and name HD22) (resid 152 and name HD23)
or (resid 152 and name HD21) (resid 152 and name HD23)
assign (resid 152 and name HD22) (resid 153 and name HA) 3.742 1.750 1.750 weight 1.000 ! spec=HCH, no=6025, id=8798, vol=4.670000e+06
or (resid 152 and name HD21) (resid 153 and name HA)
or (resid 152 and name HD23) (resid 153 and name HA)
assign (resid 152 and name HG) (resid 39 and name HD1) 3.698 1.709 1.709 weight 1.000 ! spec=HCH, no=6026, id=8799, vol=5.020000e+06
or (resid 152 and name HG) (resid 39 and name HD2)
assign (resid 152 and name HG) (resid 64 and name HG22) 2.768 0.957 0.957 weight 1.000 ! spec=HCH, no=6027, id=8800, vol=2.850000e+07
or (resid 152 and name HG) (resid 64 and name HG21)
or (resid 152 and name HG) (resid 64 and name HG23)
assign (resid 152 and name HG) (resid 78 and name HG21) 4.027 2.027 2.027 weight 1.000 ! spec=HCH, no=6031, id=8804, vol=3.010000e+06
or (resid 152 and name HG) (resid 78 and name HG22)
or (resid 152 and name HG) (resid 78 and name HG23)
assign (resid 153 and name HN) (resid 152 and name HG) 3.165 1.252 1.252 weight 1.000 ! spec=HCH, no=6032, id=8805, vol=1.280000e+07
assign (resid 152 and name HG) (resid 64 and name HA) 3.876 1.878 1.878 weight 1.000 ! spec=HCH, no=6034, id=8807, vol=3.780000e+06
assign (resid 152 and name HG) (resid 152 and name HB2) 2.385 0.711 0.711 weight 1.000 ! spec=HCH, no=6039, id=8812, vol=6.960000e+07
assign (resid 38 and name HG22) (resid 153 and name HA) 3.592 1.613 1.613 weight 1.000 ! spec=HCH, no=6044, id=8816, vol=5.970000e+06
or (resid 38 and name HG21) (resid 153 and name HA)
or (resid 38 and name HG23) (resid 153 and name HA)
assign (resid 152 and name HD12) (resid 153 and name HA) 3.630 1.647 1.647 weight 1.000 ! spec=HCH, no=6045, id=8817, vol=5.600000e+06
or (resid 152 and name HD11) (resid 153 and name HA)
or (resid 152 and name HD13) (resid 153 and name HA)
assign (resid 153 and name HA) (resid 153 and name HB2) 2.913 1.061 1.061 weight 1.000 ! spec=HCH, no=6047, id=8819, vol=2.100000e+07
assign (resid 153 and name HA) (resid 40 and name HD22) 4.049 2.049 2.049 weight 1.000 ! spec=HCH, no=6050, id=8822, vol=2.910000e+06
or (resid 153 and name HA) (resid 40 and name HD21)
or (resid 153 and name HA) (resid 40 and name HD23)
assign (resid 56 and name HB2) (resid 153 and name HA) 3.514 1.544 1.544 weight 1.000 ! spec=HCH, no=6052, id=8824, vol=6.810000e+06
assign (resid 62 and name HN) (resid 153 and name HA) 3.440 1.479 1.479 weight 1.000 ! spec=HCH, no=6053, id=8825, vol=7.730000e+06
assign (resid 153 and name HA) (resid 64 and name HA) 3.742 1.750 1.750 weight 1.000 ! spec=HCH, no=6055, id=8827, vol=4.670000e+06
assign (resid 153 and name HA) (resid 63 and name HB1) 3.365 1.416 1.416 weight 1.000 ! spec=HCH, no=6058, id=8830, vol=8.830000e+06
assign (resid 153 and name HA) (resid 153 and name HB1) 2.704 0.914 0.914 weight 1.000 ! spec=HCH, no=6061, id=8832, vol=3.280000e+07
assign (resid 153 and name HB1) (resid 59 and name HN) 3.945 1.946 1.946 weight 1.000 ! spec=HCH, no=6066, id=8837, vol=3.400000e+06
assign (resid 153 and name HB1) (resid 29 and name HZ3) 3.892 1.894 1.894 weight 1.000 ! spec=HCH, no=6067, id=8838, vol=3.690000e+06
assign (resid 153 and name HB2) (resid 56 and name HB2) 3.501 1.532 1.532 weight 1.000 ! spec=HCH, no=6071, id=8842, vol=6.970000e+06
assign (resid 153 and name HB1) (resid 56 and name HB2) 3.449 1.487 1.487 weight 1.000 ! spec=HCH, no=6072, id=8843, vol=7.610000e+06
assign (resid 153 and name HB2) (resid 152 and name HA) 3.880 1.882 1.882 weight 1.000 ! spec=HCH, no=6074, id=8845, vol=3.760000e+06
assign (resid 153 and name HB1) (resid 152 and name HD12) 4.131 2.133 2.133 weight 1.000 ! spec=HCH, no=6075, id=8846, vol=2.580000e+06
or (resid 153 and name HB1) (resid 152 and name HD11)
or (resid 153 and name HB1) (resid 152 and name HD13)
assign (resid 153 and name HB1) (resid 153 and name HB2) 2.421 0.732 0.732 weight 1.000 ! spec=HCH, no=6081, id=8851, vol=6.370000e+07
assign (resid 153 and name HB1) (resid 154 and name HA) 3.986 1.986 1.986 weight 1.000 ! spec=HCH, no=6086, id=8856, vol=3.200000e+06
assign (resid 154 and name HA) (resid 64 and name HA) 3.746 1.754 1.754 weight 1.000 ! spec=HCH, no=6090, id=8860, vol=4.640000e+06
assign (resid 154 and name HA) (resid 154 and name HE2) 3.628 1.645 1.645 weight 1.000 ! spec=HCH, no=6091, id=8861, vol=5.620000e+06
or (resid 154 and name HA) (resid 154 and name HE1)
assign (resid 154 and name HA) (resid 37 and name HD1) 3.799 1.804 1.804 weight 1.000 ! spec=HCH, no=6094, id=8864, vol=4.270000e+06
assign (resid 154 and name HA) (resid 37 and name HE1) 3.942 1.942 1.942 weight 1.000 ! spec=HCH, no=6095, id=8865, vol=3.420000e+06
assign (resid 154 and name HA) (resid 154 and name HB1) 3.107 1.206 1.206 weight 1.000 ! spec=HCH, no=6098, id=8868, vol=1.430000e+07
assign (resid 154 and name HA) (resid 154 and name HG1) 3.205 1.284 1.284 weight 1.000 ! spec=HCH, no=6099, id=8869, vol=1.180000e+07
assign (resid 154 and name HA) (resid 155 and name HG21) 3.018 1.139 1.139 weight 1.000 ! spec=HCH, no=6101, id=8871, vol=1.700000e+07
or (resid 154 and name HA) (resid 155 and name HG22)
or (resid 154 and name HA) (resid 155 and name HG23)
assign (resid 154 and name HB2) (resid 154 and name HE2) 3.500 1.531 1.531 weight 1.000 ! spec=HCH, no=6102, id=8872, vol=6.980000e+06
or (resid 154 and name HB2) (resid 154 and name HE1)
assign (resid 154 and name HB2) (resid 37 and name HD1) 3.805 1.809 1.809 weight 1.000 ! spec=HCH, no=6103, id=8873, vol=4.230000e+06
or (resid 154 and name HB2) (resid 37 and name HD2)
assign (resid 154 and name HB1) (resid 37 and name HD1) 3.954 1.954 1.954 weight 1.000 ! spec=HCH, no=6104, id=8874, vol=3.360000e+06
or (resid 154 and name HB1) (resid 37 and name HD2)
assign (resid 154 and name HB2) (resid 37 and name HD1) 3.733 1.742 1.742 weight 1.000 ! spec=HCH, no=6105, id=8875, vol=4.740000e+06
assign (resid 154 and name HB2) (resid 37 and name HE1) 3.773 1.780 1.780 weight 1.000 ! spec=HCH, no=6107, id=8877, vol=4.440000e+06
assign (resid 154 and name HB2) (resid 62 and name HN) 4.065 2.065 2.065 weight 1.000 ! spec=HCH, no=6108, id=8878, vol=2.840000e+06
assign (resid 154 and name HB1) (resid 62 and name HN) 3.974 1.975 1.975 weight 1.000 ! spec=HCH, no=6109, id=8879, vol=3.250000e+06
assign (resid 154 and name HB2) (resid 64 and name HN) 3.872 1.874 1.874 weight 1.000 ! spec=HCH, no=6110, id=8880, vol=3.800000e+06
assign (resid 154 and name HB1) (resid 64 and name HA) 3.438 1.478 1.478 weight 1.000 ! spec=HCH, no=6112, id=8882, vol=7.760000e+06
assign (resid 154 and name HB1) (resid 65 and name HN) 3.842 1.845 1.845 weight 1.000 ! spec=HCH, no=6116, id=8886, vol=3.990000e+06
assign (resid 154 and name HB2) (resid 154 and name HN) 3.250 1.320 1.320 weight 1.000 ! spec=HCH, no=6117, id=8887, vol=1.090000e+07
assign (resid 154 and name HB2) (resid 154 and name HA) 3.059 1.170 1.170 weight 1.000 ! spec=HCH, no=6119, id=8889, vol=1.570000e+07
assign (resid 154 and name HB1) (resid 154 and name HB2) 2.345 0.687 0.687 weight 1.000 ! spec=HCH, no=6123, id=8892, vol=7.720000e+07
assign (resid 154 and name HB1) (resid 154 and name HG2) 3.146 1.237 1.237 weight 1.000 ! spec=HCH, no=6125, id=8893, vol=1.320000e+07
assign (resid 154 and name HB2) (resid 154 and name HG1) 2.751 0.946 0.946 weight 1.000 ! spec=HCH, no=6126, id=8894, vol=2.960000e+07
assign (resid 154 and name HB1) (resid 154 and name HG1) 2.869 1.029 1.029 weight 1.000 ! spec=HCH, no=6127, id=8895, vol=2.300000e+07
assign (resid 154 and name HB1) (resid 154 and name HE2) 3.753 1.761 1.761 weight 1.000 ! spec=HCH, no=6128, id=8896, vol=4.590000e+06
assign (resid 35 and name HB2) (resid 154 and name HD2) 3.593 1.614 1.614 weight 1.000 ! spec=HCH, no=6132, id=8900, vol=5.960000e+06
assign (resid 154 and name HD2) (resid 154 and name HA) 3.768 1.775 1.775 weight 1.000 ! spec=HCH, no=6134, id=8902, vol=4.480000e+06
assign (resid 154 and name HD2) (resid 64 and name HA) 2.949 1.087 1.087 weight 1.000 ! spec=HCH, no=6136, id=8904, vol=1.950000e+07
assign (resid 154 and name HD2) (resid 154 and name HG1) 2.402 0.721 0.721 weight 1.000 ! spec=HCH, no=6137, id=8905, vol=6.670000e+07
assign (resid 154 and name HD2) (resid 65 and name HN) 2.817 0.992 0.992 weight 1.000 ! spec=HCH, no=6139, id=8907, vol=2.560000e+07
assign (resid 154 and name HD2) (resid 154 and name HG2) 2.536 0.804 0.804 weight 1.000 ! spec=HCH, no=6141, id=8909, vol=4.820000e+07
assign (resid 154 and name HD2) (resid 154 and name HE2) 2.606 0.849 0.849 weight 1.000 ! spec=HCH, no=6143, id=8910, vol=4.090000e+07
assign (resid 154 and name HD2) (resid 155 and name HN) 3.687 1.699 1.699 weight 1.000 ! spec=HCH, no=6144, id=8911, vol=5.100000e+06
assign (resid 155 and name HN) (resid 154 and name HE2) 3.434 1.474 1.474 weight 1.000 ! spec=HCH, no=6154, id=8919, vol=7.820000e+06
assign (resid 154 and name HG1) (resid 74 and name HE1) 4.018 2.019 2.019 weight 1.000 ! spec=HCH, no=6161, id=8926, vol=3.050000e+06
assign (resid 64 and name HA) (resid 154 and name HG1) 3.599 1.619 1.619 weight 1.000 ! spec=HCH, no=6162, id=8927, vol=5.900000e+06
assign (resid 154 and name HN) (resid 154 and name HG1) 3.632 1.649 1.649 weight 1.000 ! spec=HCH, no=6163, id=8928, vol=5.590000e+06
assign (resid 154 and name HG2) (resid 154 and name HA) 3.362 1.413 1.413 weight 1.000 ! spec=HCH, no=6164, id=8929, vol=8.880000e+06
assign (resid 154 and name HG1) (resid 154 and name HG2) 2.459 0.756 0.756 weight 1.000 ! spec=HCH, no=6165, id=8930, vol=5.800000e+07
assign (resid 154 and name HG2) (resid 154 and name HE2) 2.935 1.077 1.077 weight 1.000 ! spec=HCH, no=6166, id=8931, vol=2.010000e+07
assign (resid 155 and name HA) (resid 155 and name HB) 2.494 0.777 0.777 weight 1.000 ! spec=HCH, no=6171, id=8936, vol=5.330000e+07
assign (resid 156 and name HN) (resid 155 and name HB) 3.202 1.282 1.282 weight 1.000 ! spec=HCH, no=6183, id=8948, vol=1.190000e+07
assign (resid 155 and name HB) (resid 29 and name HZ3) 3.529 1.557 1.557 weight 1.000 ! spec=HCH, no=6185, id=8950, vol=6.640000e+06
assign (resid 155 and name HB) (resid 154 and name HA) 3.875 1.877 1.877 weight 1.000 ! spec=HCH, no=6186, id=8951, vol=3.790000e+06
assign (resid 155 and name HN) (resid 155 and name HB) 3.207 1.286 1.286 weight 1.000 ! spec=HCH, no=6187, id=8952, vol=1.180000e+07
assign (resid 61 and name HB2) (resid 155 and name HG21) 2.490 0.775 0.775 weight 1.000 ! spec=HCH, no=6199, id=8963, vol=5.380000e+07
or (resid 61 and name HB2) (resid 155 and name HG22)
or (resid 61 and name HB2) (resid 155 and name HG23)
or (resid 61 and name HB1) (resid 155 and name HG21)
or (resid 61 and name HB1) (resid 155 and name HG22)
or (resid 61 and name HB1) (resid 155 and name HG23)
or (resid 61 and name HB3) (resid 155 and name HG21)
or (resid 61 and name HB3) (resid 155 and name HG22)
or (resid 61 and name HB3) (resid 155 and name HG23)
assign (resid 155 and name HG21) (resid 29 and name HE3) 3.167 1.253 1.253 weight 1.000 ! spec=HCH, no=6200, id=8964, vol=1.270000e+07
or (resid 155 and name HG22) (resid 29 and name HE3)
or (resid 155 and name HG23) (resid 29 and name HE3)
assign (resid 155 and name HG21) (resid 29 and name HZ3) 2.997 1.123 1.123 weight 1.000 ! spec=HCH, no=6201, id=8965, vol=1.770000e+07
or (resid 155 and name HG22) (resid 29 and name HZ3)
or (resid 155 and name HG23) (resid 29 and name HZ3)
assign (resid 155 and name HG21) (resid 35 and name HA) 3.698 1.710 1.710 weight 1.000 ! spec=HCH, no=6202, id=8966, vol=5.010000e+06
or (resid 155 and name HG22) (resid 35 and name HA)
or (resid 155 and name HG23) (resid 35 and name HA)
assign (resid 155 and name HG21) (resid 35 and name HB2) 3.521 1.550 1.550 weight 1.000 ! spec=HCH, no=6203, id=8967, vol=6.730000e+06
or (resid 155 and name HG22) (resid 35 and name HB2)
or (resid 155 and name HG23) (resid 35 and name HB2)
assign (resid 36 and name HB2) (resid 155 and name HG21) 2.551 0.813 0.813 weight 1.000 ! spec=HCH, no=6205, id=8969, vol=4.650000e+07
or (resid 36 and name HB2) (resid 155 and name HG22)
or (resid 36 and name HB2) (resid 155 and name HG23)
assign (resid 36 and name HB1) (resid 155 and name HG21) 2.642 0.873 0.873 weight 1.000 ! spec=HCH, no=6206, id=8970, vol=3.770000e+07
or (resid 36 and name HB1) (resid 155 and name HG22)
or (resid 36 and name HB1) (resid 155 and name HG23)
assign (resid 155 and name HG21) (resid 37 and name HN) 3.862 1.865 1.865 weight 1.000 ! spec=HCH, no=6207, id=8971, vol=3.860000e+06
or (resid 155 and name HG22) (resid 37 and name HN)
or (resid 155 and name HG23) (resid 37 and name HN)
assign (resid 155 and name HG21) (resid 38 and name HG22) 3.616 1.634 1.634 weight 1.000 ! spec=HCH, no=6208, id=8972, vol=5.740000e+06
or (resid 155 and name HG21) (resid 38 and name HG21)
or (resid 155 and name HG21) (resid 38 and name HG23)
or (resid 155 and name HG22) (resid 38 and name HG22)
or (resid 155 and name HG22) (resid 38 and name HG21)
or (resid 155 and name HG22) (resid 38 and name HG23)
or (resid 155 and name HG23) (resid 38 and name HG22)
or (resid 155 and name HG23) (resid 38 and name HG21)
or (resid 155 and name HG23) (resid 38 and name HG23)
assign (resid 155 and name HG21) (resid 155 and name HN) 2.630 0.865 0.865 weight 1.000 ! spec=HCH, no=6210, id=8974, vol=3.870000e+07
or (resid 155 and name HG22) (resid 155 and name HN)
or (resid 155 and name HG23) (resid 155 and name HN)
assign (resid 155 and name HG21) (resid 155 and name HA) 2.738 0.937 0.937 weight 1.000 ! spec=HCH, no=6211, id=8975, vol=3.040000e+07
or (resid 155 and name HG22) (resid 155 and name HA)
or (resid 155 and name HG23) (resid 155 and name HA)
assign (resid 155 and name HB) (resid 155 and name HG21) 2.320 0.673 0.673 weight 1.000 ! spec=HCH, no=6212, id=8976, vol=8.220000e+07
or (resid 155 and name HB) (resid 155 and name HG22)
or (resid 155 and name HB) (resid 155 and name HG23)
assign (resid 155 and name HG21) (resid 155 and name HG22) 1.274 0.203 0.203 weight 1.000 ! spec=HCH, no=6213, id=8977, vol=3.000000e+09
or (resid 155 and name HG21) (resid 155 and name HG23)
or (resid 155 and name HG21) (resid 155 and name HG22)
or (resid 155 and name HG22) (resid 155 and name HG23)
or (resid 155 and name HG21) (resid 155 and name HG23)
or (resid 155 and name HG22) (resid 155 and name HG23)
assign (resid 156 and name HA) (resid 157 and name HG22) 2.845 1.012 1.012 weight 1.000 ! spec=HCH, no=6219, id=8983, vol=2.420000e+07
or (resid 156 and name HA) (resid 157 and name HG21)
or (resid 156 and name HA) (resid 157 and name HG23)
assign (resid 156 and name HB2) (resid 154 and name HE2) 3.420 1.462 1.462 weight 1.000 ! spec=HCH, no=6220, id=8984, vol=8.010000e+06
or (resid 156 and name HB2) (resid 154 and name HE1)
or (resid 156 and name HB1) (resid 154 and name HE2)
or (resid 156 and name HB1) (resid 154 and name HE1)
or (resid 156 and name HB3) (resid 154 and name HE2)
or (resid 156 and name HB3) (resid 154 and name HE1)
assign (resid 156 and name HB2) (resid 35 and name HB2) 3.831 1.834 1.834 weight 1.000 ! spec=HCH, no=6225, id=8989, vol=4.060000e+06
or (resid 156 and name HB1) (resid 35 and name HB2)
or (resid 156 and name HB3) (resid 35 and name HB2)
assign (resid 156 and name HA) (resid 156 and name HB2) 2.120 0.562 0.562 weight 1.000 ! spec=HCH, no=6228, id=8992, vol=1.410000e+08
or (resid 156 and name HA) (resid 156 and name HB1)
or (resid 156 and name HA) (resid 156 and name HB3)
assign (resid 156 and name HB2) (resid 156 and name HB1) 1.205 0.181 0.181 weight 1.000 ! spec=HCH, no=6229, id=8993, vol=4.200000e+09
or (resid 156 and name HB2) (resid 156 and name HB3)
or (resid 156 and name HB2) (resid 156 and name HB1)
or (resid 156 and name HB1) (resid 156 and name HB3)
or (resid 156 and name HB2) (resid 156 and name HB3)
or (resid 156 and name HB1) (resid 156 and name HB3)
assign (resid 156 and name HB2) (resid 157 and name HA) 3.238 1.310 1.310 weight 1.000 ! spec=HCH, no=6231, id=8995, vol=1.110000e+07
or (resid 156 and name HB1) (resid 157 and name HA)
or (resid 156 and name HB3) (resid 157 and name HA)
assign (resid 157 and name HA) (resid 35 and name HA) 3.553 1.578 1.578 weight 1.000 ! spec=HCH, no=6237, id=9001, vol=6.370000e+06
assign (resid 157 and name HA) (resid 156 and name HA) 3.568 1.591 1.591 weight 1.000 ! spec=HCH, no=6238, id=9002, vol=6.220000e+06
assign (resid 157 and name HA) (resid 157 and name HB) 2.769 0.959 0.959 weight 1.000 ! spec=HCH, no=6241, id=9005, vol=2.840000e+07
assign (resid 157 and name HA) (resid 157 and name HG12) 2.946 1.085 1.085 weight 1.000 ! spec=HCH, no=6242, id=9006, vol=1.960000e+07
assign (resid 157 and name HA) (resid 158 and name HD1) 2.334 0.681 0.681 weight 1.000 ! spec=HCH, no=6245, id=9009, vol=7.940000e+07
assign (resid 157 and name HA) (resid 158 and name HG2) 3.044 1.158 1.158 weight 1.000 ! spec=HCH, no=6246, id=9010, vol=1.610000e+07
assign (resid 157 and name HB) (resid 35 and name HA) 3.820 1.824 1.824 weight 1.000 ! spec=HCH, no=6249, id=9013, vol=4.130000e+06
assign (resid 157 and name HN) (resid 157 and name HB) 2.656 0.882 0.882 weight 1.000 ! spec=HCH, no=6251, id=9015, vol=3.650000e+07
assign (resid 157 and name HB) (resid 157 and name HG11) 2.673 0.893 0.893 weight 1.000 ! spec=HCH, no=6254, id=9017, vol=3.520000e+07
assign (resid 31 and name HG1) (resid 157 and name HD12) 2.688 0.903 0.903 weight 1.000 ! spec=HCH, no=6258, id=9021, vol=3.400000e+07
or (resid 31 and name HG1) (resid 157 and name HD11)
or (resid 31 and name HG1) (resid 157 and name HD13)
assign (resid 35 and name HN) (resid 157 and name HD12) 2.986 1.115 1.115 weight 1.000 ! spec=HCH, no=6260, id=9023, vol=1.810000e+07
or (resid 35 and name HN) (resid 157 and name HD11)
or (resid 35 and name HN) (resid 157 and name HD13)
assign (resid 157 and name HD12) (resid 31 and name HA) 3.742 1.750 1.750 weight 1.000 ! spec=HCH, no=6264, id=9027, vol=4.670000e+06
or (resid 157 and name HD11) (resid 31 and name HA)
or (resid 157 and name HD13) (resid 31 and name HA)
assign (resid 157 and name HD12) (resid 34 and name HA) 2.491 0.775 0.775 weight 1.000 ! spec=HCH, no=6265, id=9028, vol=5.370000e+07
or (resid 157 and name HD11) (resid 34 and name HA)
or (resid 157 and name HD13) (resid 34 and name HA)
assign (resid 157 and name HB) (resid 157 and name HD12) 2.399 0.719 0.719 weight 1.000 ! spec=HCH, no=6269, id=9032, vol=6.730000e+07
or (resid 157 and name HB) (resid 157 and name HD11)
or (resid 157 and name HB) (resid 157 and name HD13)
assign (resid 157 and name HD12) (resid 158 and name HD1) 3.440 1.479 1.479 weight 1.000 ! spec=HCH, no=6270, id=9033, vol=7.740000e+06
or (resid 157 and name HD11) (resid 158 and name HD1)
or (resid 157 and name HD13) (resid 158 and name HD1)
assign (resid 34 and name HB2) (resid 157 and name HG11) 3.482 1.516 1.516 weight 1.000 ! spec=HCH, no=6278, id=9041, vol=7.190000e+06
or (resid 157 and name HG11) (resid 34 and name HB1)
assign (resid 157 and name HG12) (resid 23 and name HB2) 3.845 1.848 1.848 weight 1.000 ! spec=HCH, no=6280, id=9043, vol=3.970000e+06
assign (resid 157 and name HG12) (resid 23 and name HB1) 3.650 1.665 1.665 weight 1.000 ! spec=HCH, no=6281, id=9044, vol=5.420000e+06
assign (resid 157 and name HG12) (resid 34 and name HA) 3.498 1.529 1.529 weight 1.000 ! spec=HCH, no=6284, id=9047, vol=7.000000e+06
assign (resid 157 and name HG12) (resid 34 and name HB2) 3.498 1.529 1.529 weight 1.000 ! spec=HCH, no=6285, id=9048, vol=7.000000e+06
assign (resid 157 and name HG12) (resid 35 and name HA) 3.752 1.759 1.759 weight 1.000 ! spec=HCH, no=6286, id=9049, vol=4.600000e+06
assign (resid 157 and name HG11) (resid 157 and name HN) 2.892 1.045 1.045 weight 1.000 ! spec=HCH, no=6288, id=9051, vol=2.190000e+07
assign (resid 157 and name HG11) (resid 157 and name HA) 3.121 1.217 1.217 weight 1.000 ! spec=HCH, no=6289, id=9052, vol=1.390000e+07
assign (resid 157 and name HB) (resid 157 and name HG12) 2.839 1.008 1.008 weight 1.000 ! spec=HCH, no=6290, id=9053, vol=2.450000e+07
assign (resid 157 and name HG11) (resid 157 and name HG12) 2.153 0.579 0.579 weight 1.000 ! spec=HCH, no=6292, id=9054, vol=1.290000e+08
assign (resid 157 and name HG22) (resid 35 and name HA) 3.271 1.338 1.338 weight 1.000 ! spec=HCH, no=6297, id=9059, vol=1.050000e+07
or (resid 157 and name HG21) (resid 35 and name HA)
or (resid 157 and name HG23) (resid 35 and name HA)
assign (resid 157 and name HG22) (resid 35 and name HN) 3.614 1.632 1.632 weight 1.000 ! spec=HCH, no=6298, id=9060, vol=5.760000e+06
or (resid 157 and name HG21) (resid 35 and name HN)
or (resid 157 and name HG23) (resid 35 and name HN)
assign (resid 157 and name HG22) (resid 35 and name HB2) 3.682 1.694 1.694 weight 1.000 ! spec=HCH, no=6301, id=9062, vol=5.150000e+06
or (resid 157 and name HG21) (resid 35 and name HB2)
or (resid 157 and name HG23) (resid 35 and name HB2)
assign (resid 23 and name HB1) (resid 157 and name HG22) 2.672 0.892 0.892 weight 1.000 ! spec=HCH, no=6306, id=9067, vol=3.520000e+07
or (resid 23 and name HB1) (resid 157 and name HG21)
or (resid 23 and name HB1) (resid 157 and name HG23)
assign (resid 157 and name HG22) (resid 23 and name HB2) 2.861 1.023 1.023 weight 1.000 ! spec=HCH, no=6307, id=9068, vol=2.340000e+07
or (resid 157 and name HG21) (resid 23 and name HB2)
or (resid 157 and name HG23) (resid 23 and name HB2)
assign (resid 157 and name HG22) (resid 23 and name HA) 2.885 1.040 1.040 weight 1.000 ! spec=HCH, no=6308, id=9069, vol=2.230000e+07
or (resid 157 and name HG21) (resid 23 and name HA)
or (resid 157 and name HG23) (resid 23 and name HA)
assign (resid 157 and name HG22) (resid 36 and name HN) 3.882 1.884 1.884 weight 1.000 ! spec=HCH, no=6310, id=9071, vol=3.740000e+06
or (resid 157 and name HG21) (resid 36 and name HN)
or (resid 157 and name HG23) (resid 36 and name HN)
assign (resid 157 and name HG22) (resid 157 and name HN) 2.673 0.893 0.893 weight 1.000 ! spec=HCH, no=6311, id=9072, vol=3.520000e+07
or (resid 157 and name HG21) (resid 157 and name HN)
or (resid 157 and name HG23) (resid 157 and name HN)
assign (resid 157 and name HG22) (resid 157 and name HA) 2.329 0.678 0.678 weight 1.000 ! spec=HCH, no=6312, id=9073, vol=8.030000e+07
or (resid 157 and name HG21) (resid 157 and name HA)
or (resid 157 and name HG23) (resid 157 and name HA)
assign (resid 157 and name HB) (resid 157 and name HG22) 2.121 0.562 0.562 weight 1.000 ! spec=HCH, no=6313, id=9074, vol=1.410000e+08
or (resid 157 and name HB) (resid 157 and name HG21)
or (resid 157 and name HB) (resid 157 and name HG23)
assign (resid 157 and name HG22) (resid 157 and name HG11) 2.487 0.773 0.773 weight 1.000 ! spec=HCH, no=6314, id=9075, vol=5.410000e+07
or (resid 157 and name HG21) (resid 157 and name HG11)
or (resid 157 and name HG23) (resid 157 and name HG11)
assign (resid 157 and name HG22) (resid 157 and name HG21) 1.215 0.185 0.185 weight 1.000 ! spec=HCH, no=6315, id=9076, vol=3.980000e+09
or (resid 157 and name HG22) (resid 157 and name HG23)
or (resid 157 and name HG22) (resid 157 and name HG21)
or (resid 157 and name HG21) (resid 157 and name HG23)
or (resid 157 and name HG22) (resid 157 and name HG23)
or (resid 157 and name HG21) (resid 157 and name HG23)
assign (resid 157 and name HG22) (resid 158 and name HD1) 2.715 0.921 0.921 weight 1.000 ! spec=HCH, no=6317, id=9078, vol=3.210000e+07
or (resid 157 and name HG21) (resid 158 and name HD1)
or (resid 157 and name HG23) (resid 158 and name HD1)
assign (resid 156 and name HB2) (resid 158 and name HA) 3.503 1.534 1.534 weight 1.000 ! spec=HCH, no=6322, id=9083, vol=6.940000e+06
or (resid 156 and name HB1) (resid 158 and name HA)
or (resid 156 and name HB3) (resid 158 and name HA)
assign (resid 158 and name HA) (resid 158 and name HB2) 2.459 0.756 0.756 weight 1.000 ! spec=HCH, no=6325, id=9085, vol=5.800000e+07
assign (resid 158 and name HA) (resid 158 and name HB1) 2.335 0.682 0.682 weight 1.000 ! spec=HCH, no=6326, id=9086, vol=7.900000e+07
assign (resid 158 and name HA) (resid 158 and name HD2) 3.396 1.442 1.442 weight 1.000 ! spec=HCH, no=6327, id=9087, vol=8.350000e+06
assign (resid 158 and name HA) (resid 158 and name HD1) 3.414 1.457 1.457 weight 1.000 ! spec=HCH, no=6328, id=9088, vol=8.100000e+06
assign (resid 159 and name HN) (resid 158 and name HA) 2.320 0.673 0.673 weight 1.000 ! spec=HCH, no=6329, id=9089, vol=8.220000e+07
assign (resid 158 and name HB2) (resid 158 and name HD1) 3.104 1.204 1.204 weight 1.000 ! spec=HCH, no=6331, id=9091, vol=1.430000e+07
assign (resid 158 and name HB2) (resid 158 and name HB1) 2.036 0.518 0.518 weight 1.000 ! spec=HCH, no=6337, id=9097, vol=1.800000e+08
assign (resid 158 and name HB2) (resid 158 and name HD2) 3.125 1.221 1.221 weight 1.000 ! spec=HCH, no=6338, id=9098, vol=1.380000e+07
assign (resid 158 and name HB1) (resid 158 and name HD1) 3.098 1.200 1.200 weight 1.000 ! spec=HCH, no=6341, id=9101, vol=1.450000e+07
assign (resid 158 and name HB1) (resid 158 and name HD2) 3.004 1.128 1.128 weight 1.000 ! spec=HCH, no=6344, id=9104, vol=1.740000e+07
assign (resid 157 and name HG12) (resid 158 and name HD2) 3.657 1.671 1.671 weight 1.000 ! spec=HCH, no=6345, id=9105, vol=5.360000e+06
assign (resid 157 and name HA) (resid 158 and name HD2) 2.431 0.738 0.738 weight 1.000 ! spec=HCH, no=6346, id=9106, vol=6.220000e+07
assign (resid 157 and name HG12) (resid 158 and name HD1) 3.743 1.751 1.751 weight 1.000 ! spec=HCH, no=6347, id=9107, vol=4.670000e+06
assign (resid 156 and name HB2) (resid 158 and name HD2) 3.420 1.462 1.462 weight 1.000 ! spec=HCH, no=6353, id=9113, vol=8.010000e+06
or (resid 156 and name HB1) (resid 158 and name HD2)
or (resid 156 and name HB3) (resid 158 and name HD2)
assign (resid 158 and name HD1) (resid 157 and name HN) 3.765 1.772 1.772 weight 1.000 ! spec=HCH, no=6356, id=9116, vol=4.500000e+06
assign (resid 157 and name HB) (resid 158 and name HD2) 3.116 1.214 1.214 weight 1.000 ! spec=HCH, no=6357, id=9117, vol=1.400000e+07
assign (resid 157 and name HB) (resid 158 and name HD1) 3.302 1.363 1.363 weight 1.000 ! spec=HCH, no=6358, id=9118, vol=9.890000e+06
assign (resid 158 and name HD1) (resid 158 and name HD2) 2.043 0.522 0.522 weight 1.000 ! spec=HCH, no=6364, id=9123, vol=1.770000e+08
assign (resid 158 and name HD2) (resid 158 and name HG2) 2.452 0.751 0.751 weight 1.000 ! spec=HCH, no=6366, id=9124, vol=5.910000e+07
assign (resid 158 and name HD1) (resid 158 and name HG2) 2.492 0.777 0.777 weight 1.000 ! spec=HCH, no=6367, id=9125, vol=5.350000e+07
assign (resid 158 and name HG2) (resid 158 and name HA) 3.011 1.134 1.134 weight 1.000 ! spec=HCH, no=6370, id=9128, vol=1.720000e+07
assign (resid 158 and name HG2) (resid 158 and name HB1) 2.228 0.620 0.620 weight 1.000 ! spec=HCH, no=6371, id=9129, vol=1.050000e+08
assign (resid 158 and name HG2) (resid 159 and name HE1) 4.042 2.043 2.043 weight 1.000 ! spec=HCH, no=6375, id=9132, vol=2.940000e+06
assign (resid 160 and name HN) (resid 159 and name HA) 2.590 0.839 0.839 weight 1.000 ! spec=HCH, no=6379, id=9135, vol=4.250000e+07
assign (resid 159 and name HB2) (resid 157 and name HG22) 3.363 1.413 1.413 weight 1.000 ! spec=HCH, no=6382, id=9138, vol=8.870000e+06
or (resid 159 and name HB2) (resid 157 and name HG21)
or (resid 159 and name HB2) (resid 157 and name HG23)
assign (resid 159 and name HA) (resid 159 and name HB2) 2.327 0.677 0.677 weight 1.000 ! spec=HCH, no=6385, id=9141, vol=8.090000e+07
assign (resid 159 and name HB2) (resid 159 and name HD1) 2.477 0.767 0.767 weight 1.000 ! spec=HCH, no=6387, id=9142, vol=5.550000e+07
assign (resid 159 and name HB2) (resid 159 and name HE1) 3.623 1.641 1.641 weight 1.000 ! spec=HCH, no=6388, id=9143, vol=5.670000e+06
assign (resid 159 and name HB2) (resid 160 and name HG2) 3.843 1.846 1.846 weight 1.000 ! spec=HCH, no=6390, id=9145, vol=3.980000e+06
assign (resid 160 and name HA) (resid 160 and name HB2) 2.668 0.890 0.890 weight 1.000 ! spec=HCH, no=6394, id=9149, vol=3.550000e+07
assign (resid 160 and name HB1) (resid 160 and name HA) 2.782 0.968 0.968 weight 1.000 ! spec=HCH, no=6399, id=9154, vol=2.770000e+07
assign (resid 160 and name HB2) (resid 160 and name HG2) 2.262 0.639 0.639 weight 1.000 ! spec=HCH, no=6400, id=9155, vol=9.580000e+07
assign (resid 160 and name HB1) (resid 160 and name HG2) 2.485 0.772 0.772 weight 1.000 ! spec=HCH, no=6401, id=9156, vol=5.450000e+07
assign (resid 160 and name HG2) (resid 160 and name HA) 3.218 1.294 1.294 weight 1.000 ! spec=HCH, no=6413, id=9168, vol=1.160000e+07
assign (resid 161 and name HA) (resid 161 and name HB1) 2.852 1.017 1.017 weight 1.000 ! spec=HCH, no=6421, id=9173, vol=2.380000e+07
assign (resid 161 and name HN) (resid 161 and name HA) 2.900 1.051 1.051 weight 1.000 ! spec=HCH, no=6423, id=9175, vol=2.160000e+07
assign (resid 161 and name HB2) (resid 158 and name HB1) 3.120 1.217 1.217 weight 1.000 ! spec=HCH, no=6427, id=9178, vol=1.390000e+07
assign (resid 161 and name HN) (resid 161 and name HB1) 3.160 1.248 1.248 weight 1.000 ! spec=HCH, no=6429, id=9180, vol=1.290000e+07
assign (resid 161 and name HB2) (resid 161 and name HA) 3.393 1.439 1.439 weight 1.000 ! spec=HCH, no=6430, id=9181, vol=8.400000e+06
assign (resid 161 and name HB1) (resid 161 and name HB2) 1.796 0.403 0.403 weight 1.000 ! spec=HCH, no=6433, id=9183, vol=3.820000e+08
assign (resid 161 and name HB1) (resid 161 and name HG2) 1.971 0.486 0.486 weight 1.000 ! spec=HCH, no=6437, id=9186, vol=2.190000e+08
assign (resid 161 and name HD2) (resid 161 and name HB1) 3.496 1.527 1.527 weight 1.000 ! spec=HCH, no=6439, id=9188, vol=7.030000e+06
assign (resid 161 and name HD2) (resid 161 and name HA) 3.357 1.409 1.409 weight 1.000 ! spec=HCH, no=6452, id=9199, vol=8.960000e+06
assign (resid 161 and name HG2) (resid 161 and name HD2) 3.498 1.529 1.529 weight 1.000 ! spec=HCH, no=6457, id=9203, vol=7.000000e+06
assign (resid 29 and name HD1) (resid 26 and name HA) 3.298 1.359 1.359 weight 1.000 ! spec=HCHaro, no=3, id=9204, vol=5.290000e+06
assign (resid 29 and name HD1) (resid 25 and name HG2) 3.663 1.677 1.677 weight 1.000 ! spec=HCHaro, no=4, id=9205, vol=2.820000e+06
assign (resid 29 and name HD1) (resid 25 and name HD2) 3.655 1.670 1.670 weight 1.000 ! spec=HCHaro, no=5, id=9206, vol=2.850000e+06
assign (resid 29 and name HD1) (resid 28 and name HN) 3.685 1.697 1.697 weight 1.000 ! spec=HCHaro, no=6, id=9207, vol=2.720000e+06
assign (resid 29 and name HD1) (resid 25 and name HB1) 3.523 1.552 1.552 weight 1.000 ! spec=HCHaro, no=7, id=9208, vol=3.560000e+06
assign (resid 38 and name HD12) (resid 29 and name HD1) 3.040 1.155 1.155 weight 1.000 ! spec=HCHaro, no=8, id=9209, vol=8.630000e+06
or (resid 38 and name HD11) (resid 29 and name HD1)
or (resid 38 and name HD13) (resid 29 and name HD1)
assign (resid 29 and name HD1) (resid 25 and name HB2) 3.277 1.342 1.342 weight 1.000 ! spec=HCHaro, no=9, id=9210, vol=5.500000e+06
assign (resid 29 and name HD1) (resid 26 and name HB1) 3.336 1.391 1.391 weight 1.000 ! spec=HCHaro, no=11, id=9212, vol=4.940000e+06
assign (resid 28 and name HB) (resid 29 and name HD1) 2.882 1.038 1.038 weight 1.000 ! spec=HCHaro, no=12, id=9213, vol=1.190000e+07
assign (resid 28 and name HG21) (resid 29 and name HD1) 3.450 1.488 1.488 weight 1.000 ! spec=HCHaro, no=13, id=9214, vol=4.040000e+06
or (resid 28 and name HG22) (resid 29 and name HD1)
or (resid 28 and name HG23) (resid 29 and name HD1)
assign (resid 29 and name HN) (resid 29 and name HD1) 2.511 0.788 0.788 weight 1.000 ! spec=HCHaro, no=14, id=9215, vol=2.720000e+07
assign (resid 29 and name HD1) (resid 29 and name HA) 3.283 1.347 1.347 weight 1.000 ! spec=HCHaro, no=15, id=9216, vol=5.440000e+06
assign (resid 29 and name HE1) (resid 29 and name HD1) 2.434 0.740 0.740 weight 1.000 ! spec=HCHaro, no=17, id=9217, vol=3.280000e+07
assign (resid 29 and name HD1) (resid 29 and name HB2) 2.960 1.095 1.095 weight 1.000 ! spec=HCHaro, no=18, id=9218, vol=1.010000e+07
assign (resid 29 and name HE3) (resid 25 and name HD2) 3.518 1.547 1.547 weight 1.000 ! spec=HCHaro, no=25, id=9224, vol=3.590000e+06
assign (resid 29 and name HE3) (resid 29 and name HA) 3.433 1.473 1.473 weight 1.000 ! spec=HCHaro, no=26, id=9225, vol=4.160000e+06
assign (resid 29 and name HE3) (resid 29 and name HD1) 3.345 1.398 1.398 weight 1.000 ! spec=HCHaro, no=27, id=9226, vol=4.860000e+06
assign (resid 29 and name HE3) (resid 29 and name HZ2) 3.522 1.550 1.550 weight 1.000 ! spec=HCHaro, no=29, id=9227, vol=3.570000e+06
assign (resid 29 and name HB2) (resid 29 and name HE3) 2.785 0.970 0.970 weight 1.000 ! spec=HCHaro, no=31, id=9229, vol=1.460000e+07
assign (resid 29 and name HE3) (resid 36 and name HN) 3.609 1.628 1.628 weight 1.000 ! spec=HCHaro, no=32, id=9230, vol=3.080000e+06
assign (resid 29 and name HE3) (resid 36 and name HA) 3.310 1.370 1.370 weight 1.000 ! spec=HCHaro, no=33, id=9231, vol=5.170000e+06
assign (resid 36 and name HB2) (resid 29 and name HE3) 2.801 0.981 0.981 weight 1.000 ! spec=HCHaro, no=34, id=9232, vol=1.410000e+07
assign (resid 36 and name HB1) (resid 29 and name HE3) 2.786 0.970 0.970 weight 1.000 ! spec=HCHaro, no=35, id=9233, vol=1.460000e+07
assign (resid 29 and name HE3) (resid 38 and name HN) 3.610 1.629 1.629 weight 1.000 ! spec=HCHaro, no=36, id=9234, vol=3.080000e+06
assign (resid 38 and name HB) (resid 29 and name HE3) 3.388 1.435 1.435 weight 1.000 ! spec=HCHaro, no=37, id=9235, vol=4.500000e+06
assign (resid 29 and name HE3) (resid 38 and name HD12) 3.805 1.809 1.809 weight 1.000 ! spec=HCHaro, no=38, id=9236, vol=2.240000e+06
or (resid 29 and name HE3) (resid 38 and name HD11)
or (resid 29 and name HE3) (resid 38 and name HD13)
assign (resid 29 and name HZ2) (resid 25 and name HG2) 3.094 1.197 1.197 weight 1.000 ! spec=HCHaro, no=45, id=9242, vol=7.760000e+06
assign (resid 29 and name HZ2) (resid 25 and name HD1) 3.841 1.844 1.844 weight 1.000 ! spec=HCHaro, no=49, id=9246, vol=2.120000e+06
assign (resid 29 and name HE1) (resid 29 and name HZ2) 2.694 0.907 0.907 weight 1.000 ! spec=HCHaro, no=50, id=9247, vol=1.780000e+07
assign (resid 38 and name HG22) (resid 29 and name HZ2) 3.176 1.261 1.261 weight 1.000 ! spec=HCHaro, no=53, id=9249, vol=6.630000e+06
or (resid 38 and name HG21) (resid 29 and name HZ2)
or (resid 38 and name HG23) (resid 29 and name HZ2)
assign (resid 29 and name HZ2) (resid 59 and name HB2) 3.115 1.213 1.213 weight 1.000 ! spec=HCHaro, no=54, id=9250, vol=7.450000e+06
assign (resid 29 and name HZ2) (resid 59 and name HB1) 2.988 1.116 1.116 weight 1.000 ! spec=HCHaro, no=55, id=9251, vol=9.560000e+06
assign (resid 29 and name HZ2) (resid 153 and name HB2) 3.721 1.730 1.730 weight 1.000 ! spec=HCHaro, no=56, id=9252, vol=2.570000e+06
assign (resid 29 and name HZ3) (resid 153 and name HB2) 3.442 1.481 1.481 weight 1.000 ! spec=HCHaro, no=62, id=9258, vol=4.100000e+06
assign (resid 29 and name HE3) (resid 29 and name HZ3) 3.238 1.311 1.311 weight 1.000 ! spec=HCHaro, no=69, id=9265, vol=5.910000e+06
assign (resid 29 and name HZ3) (resid 38 and name HB) 3.779 1.785 1.785 weight 1.000 ! spec=HCHaro, no=72, id=9267, vol=2.340000e+06
assign (resid 38 and name HD12) (resid 29 and name HZ3) 3.537 1.564 1.564 weight 1.000 ! spec=HCHaro, no=73, id=9268, vol=3.470000e+06
or (resid 38 and name HD11) (resid 29 and name HZ3)
or (resid 38 and name HD13) (resid 29 and name HZ3)
assign (resid 38 and name HG22) (resid 29 and name HZ3) 3.006 1.130 1.130 weight 1.000 ! spec=HCHaro, no=74, id=9269, vol=9.220000e+06
or (resid 38 and name HG21) (resid 29 and name HZ3)
or (resid 38 and name HG23) (resid 29 and name HZ3)
assign (resid 29 and name HZ3) (resid 59 and name HB2) 3.258 1.327 1.327 weight 1.000 ! spec=HCHaro, no=75, id=9270, vol=5.690000e+06
assign (resid 29 and name HZ3) (resid 59 and name HB1) 3.430 1.471 1.471 weight 1.000 ! spec=HCHaro, no=76, id=9271, vol=4.180000e+06
assign (resid 61 and name HB2) (resid 29 and name HZ3) 2.432 0.739 0.739 weight 1.000 ! spec=HCHaro, no=77, id=9272, vol=3.290000e+07
or (resid 61 and name HB1) (resid 29 and name HZ3)
or (resid 61 and name HB3) (resid 29 and name HZ3)
assign (resid 32 and name HD1) (resid 71 and name HA) 2.831 1.002 1.002 weight 1.000 ! spec=HCHaro, no=81, id=9276, vol=1.320000e+07
assign (resid 32 and name HD1) (resid 33 and name HB2) 2.851 1.016 1.016 weight 1.000 ! spec=HCHaro, no=82, id=9277, vol=1.270000e+07
or (resid 32 and name HD1) (resid 33 and name HB1)
assign (resid 71 and name HG2) (resid 32 and name HD1) 2.625 0.861 0.861 weight 1.000 ! spec=HCHaro, no=83, id=9278, vol=2.080000e+07
assign (resid 32 and name HD1) (resid 33 and name HG1) 3.123 1.219 1.219 weight 1.000 ! spec=HCHaro, no=84, id=9279, vol=7.340000e+06
assign (resid 32 and name HD1) (resid 75 and name HD12) 3.457 1.494 1.494 weight 1.000 ! spec=HCHaro, no=86, id=9281, vol=3.980000e+06
or (resid 32 and name HD1) (resid 75 and name HD11)
or (resid 32 and name HD1) (resid 75 and name HD13)
assign (resid 32 and name HN) (resid 32 and name HD1) 3.207 1.286 1.286 weight 1.000 ! spec=HCHaro, no=87, id=9282, vol=6.250000e+06
assign (resid 32 and name HB1) (resid 32 and name HD1) 2.335 0.681 0.681 weight 1.000 ! spec=HCHaro, no=90, id=9285, vol=4.200000e+07
assign (resid 32 and name HD1) (resid 32 and name HE1) 1.972 0.486 0.486 weight 1.000 ! spec=HCHaro, no=92, id=9286, vol=1.160000e+08
assign (resid 32 and name HD1) (resid 74 and name HE1) 3.195 1.276 1.276 weight 1.000 ! spec=HCHaro, no=96, id=9290, vol=6.400000e+06
assign (resid 71 and name HA) (resid 32 and name HE1) 2.831 1.002 1.002 weight 1.000 ! spec=HCHaro, no=98, id=9292, vol=1.320000e+07
assign (resid 32 and name HE1) (resid 33 and name HG1) 3.180 1.264 1.264 weight 1.000 ! spec=HCHaro, no=100, id=9294, vol=6.580000e+06
assign (resid 32 and name HE1) (resid 70 and name HB1) 2.838 1.007 1.007 weight 1.000 ! spec=HCHaro, no=101, id=9295, vol=1.300000e+07
assign (resid 32 and name HE1) (resid 71 and name HN) 3.367 1.417 1.417 weight 1.000 ! spec=HCHaro, no=103, id=9297, vol=4.670000e+06
assign (resid 32 and name HE1) (resid 71 and name HB2) 2.869 1.029 1.029 weight 1.000 ! spec=HCHaro, no=104, id=9298, vol=1.220000e+07
or (resid 32 and name HE1) (resid 71 and name HB1)
assign (resid 32 and name HZ) (resid 70 and name HG1) 3.149 1.240 1.240 weight 1.000 ! spec=HCHaro, no=107, id=9301, vol=6.980000e+06
assign (resid 32 and name HZ) (resid 74 and name HA) 3.420 1.462 1.462 weight 1.000 ! spec=HCHaro, no=111, id=9305, vol=4.250000e+06
assign (resid 32 and name HZ) (resid 70 and name HN) 3.527 1.555 1.555 weight 1.000 ! spec=HCHaro, no=112, id=9306, vol=3.540000e+06
assign (resid 32 and name HZ) (resid 70 and name HB2) 2.890 1.044 1.044 weight 1.000 ! spec=HCHaro, no=114, id=9308, vol=1.170000e+07
assign (resid 70 and name HB1) (resid 32 and name HZ) 2.970 1.103 1.103 weight 1.000 ! spec=HCHaro, no=115, id=9309, vol=9.910000e+06
assign (resid 32 and name HZ) (resid 33 and name HG1) 3.174 1.259 1.259 weight 1.000 ! spec=HCHaro, no=116, id=9310, vol=6.660000e+06
assign (resid 31 and name HA) (resid 37 and name HD1) 3.083 1.188 1.188 weight 1.000 ! spec=HCHaro, no=117, id=9311, vol=7.930000e+06
assign (resid 35 and name HB1) (resid 37 and name HD1) 3.174 1.259 1.259 weight 1.000 ! spec=HCHaro, no=118, id=9312, vol=6.660000e+06
assign (resid 36 and name HA) (resid 37 and name HD1) 2.612 0.853 0.853 weight 1.000 ! spec=HCHaro, no=119, id=9313, vol=2.140000e+07
assign (resid 32 and name HB1) (resid 37 and name HD1) 2.940 1.081 1.081 weight 1.000 ! spec=HCHaro, no=124, id=9318, vol=1.050000e+07
assign (resid 37 and name HD1) (resid 35 and name HB2) 3.325 1.382 1.382 weight 1.000 ! spec=HCHaro, no=125, id=9319, vol=5.030000e+06
assign (resid 37 and name HD1) (resid 30 and name HN) 3.572 1.595 1.595 weight 1.000 ! spec=HCHaro, no=134, id=9328, vol=3.280000e+06
assign (resid 37 and name HD1) (resid 30 and name HB) 3.130 1.225 1.225 weight 1.000 ! spec=HCHaro, no=135, id=9329, vol=7.230000e+06
assign (resid 37 and name HN) (resid 37 and name HD1) 2.555 0.816 0.816 weight 1.000 ! spec=HCHaro, no=137, id=9331, vol=2.450000e+07
assign (resid 37 and name HB1) (resid 37 and name HD1) 2.451 0.751 0.751 weight 1.000 ! spec=HCHaro, no=139, id=9333, vol=3.140000e+07
assign (resid 37 and name HD1) (resid 74 and name HE1) 3.056 1.167 1.167 weight 1.000 ! spec=HCHaro, no=141, id=9335, vol=8.360000e+06
assign (resid 35 and name HB1) (resid 37 and name HE1) 2.726 0.929 0.929 weight 1.000 ! spec=HCHaro, no=147, id=9341, vol=1.660000e+07
assign (resid 32 and name HA) (resid 37 and name HE1) 3.207 1.285 1.285 weight 1.000 ! spec=HCHaro, no=148, id=9342, vol=6.260000e+06
assign (resid 35 and name HN) (resid 37 and name HE1) 3.423 1.465 1.465 weight 1.000 ! spec=HCHaro, no=150, id=9344, vol=4.230000e+06
assign (resid 37 and name HE1) (resid 74 and name HZ) 3.214 1.291 1.291 weight 1.000 ! spec=HCHaro, no=152, id=9346, vol=6.180000e+06
assign (resid 35 and name HB2) (resid 37 and name HE1) 3.010 1.133 1.133 weight 1.000 ! spec=HCHaro, no=155, id=9349, vol=9.150000e+06
assign (resid 37 and name HE1) (resid 31 and name HA) 3.178 1.262 1.262 weight 1.000 ! spec=HCHaro, no=160, id=9354, vol=6.610000e+06
assign (resid 32 and name HB2) (resid 37 and name HE1) 2.759 0.951 0.951 weight 1.000 ! spec=HCHaro, no=161, id=9355, vol=1.540000e+07
assign (resid 32 and name HB1) (resid 37 and name HE1) 2.501 0.782 0.782 weight 1.000 ! spec=HCHaro, no=162, id=9356, vol=2.780000e+07
assign (resid 37 and name HN) (resid 37 and name HE1) 3.286 1.350 1.350 weight 1.000 ! spec=HCHaro, no=164, id=9358, vol=5.400000e+06
assign (resid 37 and name HD1) (resid 37 and name HE1) 2.062 0.531 0.531 weight 1.000 ! spec=HCHaro, no=167, id=9361, vol=8.860000e+07
assign (resid 37 and name HE1) (resid 74 and name HE1) 3.113 1.212 1.212 weight 1.000 ! spec=HCHaro, no=169, id=9362, vol=7.470000e+06
assign (resid 37 and name HE1) (resid 154 and name HE2) 2.997 1.123 1.123 weight 1.000 ! spec=HCHaro, no=171, id=9364, vol=9.380000e+06
assign (resid 152 and name HB1) (resid 39 and name HD1) 3.206 1.285 1.285 weight 1.000 ! spec=HCHaro, no=174, id=9367, vol=6.270000e+06
assign (resid 152 and name HG) (resid 39 and name HD1) 3.325 1.382 1.382 weight 1.000 ! spec=HCHaro, no=175, id=9368, vol=5.040000e+06
assign (resid 152 and name HB2) (resid 39 and name HD1) 2.767 0.957 0.957 weight 1.000 ! spec=HCHaro, no=176, id=9369, vol=1.520000e+07
assign (resid 40 and name HN) (resid 39 and name HD1) 3.055 1.167 1.167 weight 1.000 ! spec=HCHaro, no=183, id=9375, vol=8.370000e+06
assign (resid 152 and name HA) (resid 39 and name HD1) 3.056 1.167 1.167 weight 1.000 ! spec=HCHaro, no=185, id=9377, vol=8.360000e+06
assign (resid 39 and name HZ) (resid 41 and name HG2) 3.031 1.149 1.149 weight 1.000 ! spec=HCHaro, no=189, id=9381, vol=8.770000e+06
assign (resid 39 and name HZ) (resid 79 and name HD12) 3.221 1.297 1.297 weight 1.000 ! spec=HCHaro, no=199, id=9391, vol=6.090000e+06
or (resid 39 and name HZ) (resid 79 and name HD11)
or (resid 39 and name HZ) (resid 79 and name HD13)
assign (resid 59 and name HD2) (resid 55 and name HA) 3.314 1.373 1.373 weight 1.000 ! spec=HCHaro, no=202, id=9394, vol=5.140000e+06
assign (resid 59 and name HD2) (resid 55 and name HB1) 3.430 1.471 1.471 weight 1.000 ! spec=HCHaro, no=204, id=9396, vol=4.180000e+06
assign (resid 59 and name HD2) (resid 40 and name HG) 3.544 1.570 1.570 weight 1.000 ! spec=HCHaro, no=205, id=9397, vol=3.430000e+06
assign (resid 59 and name HD2) (resid 38 and name HD12) 3.379 1.428 1.428 weight 1.000 ! spec=HCHaro, no=207, id=9399, vol=4.570000e+06
or (resid 59 and name HD2) (resid 38 and name HD11)
or (resid 59 and name HD2) (resid 38 and name HD13)
assign (resid 40 and name HD12) (resid 59 and name HD2) 2.913 1.061 1.061 weight 1.000 ! spec=HCHaro, no=208, id=9400, vol=1.110000e+07
or (resid 40 and name HD11) (resid 59 and name HD2)
or (resid 40 and name HD13) (resid 59 and name HD2)
assign (resid 40 and name HD22) (resid 59 and name HD2) 2.674 0.894 0.894 weight 1.000 ! spec=HCHaro, no=209, id=9401, vol=1.860000e+07
or (resid 40 and name HD21) (resid 59 and name HD2)
or (resid 40 and name HD23) (resid 59 and name HD2)
assign (resid 58 and name HB2) (resid 59 and name HD2) 3.203 1.282 1.282 weight 1.000 ! spec=HCHaro, no=210, id=9402, vol=6.310000e+06
assign (resid 59 and name HD2) (resid 58 and name HB1) 3.103 1.204 1.204 weight 1.000 ! spec=HCHaro, no=211, id=9403, vol=7.620000e+06
assign (resid 59 and name HD2) (resid 59 and name HB2) 2.852 1.017 1.017 weight 1.000 ! spec=HCHaro, no=212, id=9404, vol=1.270000e+07
assign (resid 59 and name HD2) (resid 59 and name HB1) 2.865 1.026 1.026 weight 1.000 ! spec=HCHaro, no=213, id=9405, vol=1.230000e+07
assign (resid 59 and name HE1) (resid 38 and name HD12) 3.653 1.668 1.668 weight 1.000 ! spec=HCHaro, no=222, id=9413, vol=2.870000e+06
or (resid 59 and name HE1) (resid 38 and name HD11)
or (resid 59 and name HE1) (resid 38 and name HD13)
assign (resid 67 and name HD2) (resid 104 and name HE1) 3.435 1.475 1.475 weight 1.000 ! spec=HCHaro, no=227, id=9417, vol=4.140000e+06
assign (resid 67 and name HB2) (resid 67 and name HD2) 3.227 1.302 1.302 weight 1.000 ! spec=HCHaro, no=230, id=9419, vol=6.020000e+06
assign (resid 67 and name HD2) (resid 65 and name HB2) 3.826 1.829 1.829 weight 1.000 ! spec=HCHaro, no=231, id=9420, vol=2.170000e+06
assign (resid 67 and name HD2) (resid 66 and name HG22) 3.504 1.534 1.534 weight 1.000 ! spec=HCHaro, no=232, id=9421, vol=3.680000e+06
or (resid 67 and name HD2) (resid 66 and name HG21)
or (resid 67 and name HD2) (resid 66 and name HG23)
assign (resid 67 and name HD2) (resid 66 and name HA) 3.792 1.797 1.797 weight 1.000 ! spec=HCHaro, no=234, id=9423, vol=2.290000e+06
assign (resid 67 and name HD2) (resid 67 and name HN) 3.503 1.534 1.534 weight 1.000 ! spec=HCHaro, no=235, id=9424, vol=3.680000e+06
assign (resid 67 and name HA) (resid 67 and name HD2) 3.164 1.251 1.251 weight 1.000 ! spec=HCHaro, no=236, id=9425, vol=6.780000e+06
assign (resid 67 and name HB1) (resid 67 and name HD2) 3.256 1.325 1.325 weight 1.000 ! spec=HCHaro, no=237, id=9426, vol=5.710000e+06
assign (resid 67 and name HE1) (resid 111 and name HG21) 3.529 1.557 1.557 weight 1.000 ! spec=HCHaro, no=239, id=9428, vol=3.530000e+06
or (resid 67 and name HE1) (resid 111 and name HG22)
or (resid 67 and name HE1) (resid 111 and name HG23)
assign (resid 67 and name HE1) (resid 104 and name HB2) 3.464 1.500 1.500 weight 1.000 ! spec=HCHaro, no=240, id=9429, vol=3.940000e+06
assign (resid 67 and name HE1) (resid 104 and name HD1) 3.112 1.211 1.211 weight 1.000 ! spec=HCHaro, no=244, id=9433, vol=7.490000e+06
assign (resid 104 and name HE1) (resid 67 and name HE1) 3.310 1.369 1.369 weight 1.000 ! spec=HCHaro, no=251, id=9439, vol=5.180000e+06
assign (resid 74 and name HD1) (resid 75 and name HA) 3.373 1.422 1.422 weight 1.000 ! spec=HCHaro, no=254, id=9442, vol=4.620000e+06
assign (resid 74 and name HD1) (resid 32 and name HB2) 3.524 1.552 1.552 weight 1.000 ! spec=HCHaro, no=255, id=9443, vol=3.560000e+06
assign (resid 74 and name HD1) (resid 32 and name HD1) 3.154 1.244 1.244 weight 1.000 ! spec=HCHaro, no=257, id=9445, vol=6.910000e+06
or (resid 74 and name HD1) (resid 32 and name HD2)
assign (resid 71 and name HA) (resid 74 and name HD1) 3.384 1.432 1.432 weight 1.000 ! spec=HCHaro, no=259, id=9447, vol=4.530000e+06
assign (resid 74 and name HB2) (resid 74 and name HD1) 2.562 0.820 0.820 weight 1.000 ! spec=HCHaro, no=264, id=9452, vol=2.410000e+07
assign (resid 74 and name HB1) (resid 74 and name HD1) 2.576 0.830 0.830 weight 1.000 ! spec=HCHaro, no=265, id=9453, vol=2.330000e+07
assign (resid 74 and name HD1) (resid 74 and name HE1) 2.423 0.734 0.734 weight 1.000 ! spec=HCHaro, no=266, id=9454, vol=3.370000e+07
assign (resid 75 and name HG12) (resid 74 and name HD1) 3.103 1.204 1.204 weight 1.000 ! spec=HCHaro, no=268, id=9455, vol=7.620000e+06
assign (resid 75 and name HG11) (resid 74 and name HD1) 3.012 1.134 1.134 weight 1.000 ! spec=HCHaro, no=269, id=9456, vol=9.110000e+06
assign (resid 74 and name HE1) (resid 74 and name HB2) 3.163 1.250 1.250 weight 1.000 ! spec=HCHaro, no=270, id=9457, vol=6.800000e+06
assign (resid 74 and name HE1) (resid 78 and name HB) 3.626 1.644 1.644 weight 1.000 ! spec=HCHaro, no=274, id=9461, vol=2.990000e+06
assign (resid 74 and name HE1) (resid 37 and name HB2) 3.587 1.608 1.608 weight 1.000 ! spec=HCHaro, no=276, id=9463, vol=3.200000e+06
assign (resid 74 and name HE1) (resid 75 and name HA) 3.731 1.740 1.740 weight 1.000 ! spec=HCHaro, no=277, id=9464, vol=2.520000e+06
assign (resid 74 and name HE1) (resid 64 and name HG11) 3.670 1.684 1.684 weight 1.000 ! spec=HCHaro, no=278, id=9465, vol=2.790000e+06
assign (resid 74 and name HE2) (resid 30 and name HB) 3.596 1.617 1.617 weight 1.000 ! spec=HCHaro, no=279, id=9466, vol=3.150000e+06
assign (resid 32 and name HB2) (resid 74 and name HE1) 3.548 1.573 1.573 weight 1.000 ! spec=HCHaro, no=287, id=9474, vol=3.410000e+06
assign (resid 74 and name HE2) (resid 32 and name HB2) 3.398 1.444 1.444 weight 1.000 ! spec=HCHaro, no=288, id=9475, vol=4.420000e+06
assign (resid 74 and name HE2) (resid 74 and name HZ) 2.602 0.846 0.846 weight 1.000 ! spec=HCHaro, no=302, id=9487, vol=2.190000e+07
assign (resid 74 and name HZ) (resid 37 and name HB1) 3.173 1.258 1.258 weight 1.000 ! spec=HCHaro, no=306, id=9491, vol=6.670000e+06
assign (resid 74 and name HZ) (resid 37 and name HD1) 3.201 1.281 1.281 weight 1.000 ! spec=HCHaro, no=307, id=9492, vol=6.330000e+06
or (resid 74 and name HZ) (resid 37 and name HD2)
assign (resid 74 and name HZ) (resid 30 and name HB) 2.936 1.078 1.078 weight 1.000 ! spec=HCHaro, no=309, id=9494, vol=1.060000e+07
assign (resid 74 and name HZ) (resid 37 and name HB2) 3.661 1.676 1.676 weight 1.000 ! spec=HCHaro, no=310, id=9495, vol=2.830000e+06
assign (resid 74 and name HZ) (resid 30 and name HD12) 2.929 1.072 1.072 weight 1.000 ! spec=HCHaro, no=312, id=9497, vol=1.080000e+07
or (resid 74 and name HZ) (resid 30 and name HD11)
or (resid 74 and name HZ) (resid 30 and name HD13)
assign (resid 30 and name HG22) (resid 74 and name HZ) 2.481 0.769 0.769 weight 1.000 ! spec=HCHaro, no=313, id=9498, vol=2.920000e+07
or (resid 30 and name HG21) (resid 74 and name HZ)
or (resid 30 and name HG23) (resid 74 and name HZ)
assign (resid 32 and name HB2) (resid 74 and name HZ) 3.217 1.293 1.293 weight 1.000 ! spec=HCHaro, no=314, id=9499, vol=6.140000e+06
assign (resid 74 and name HZ) (resid 32 and name HB1) 3.285 1.349 1.349 weight 1.000 ! spec=HCHaro, no=315, id=9500, vol=5.410000e+06
assign (resid 74 and name HE1) (resid 74 and name HZ) 2.070 0.536 0.536 weight 1.000 ! spec=HCHaro, no=317, id=9502, vol=8.650000e+07
assign (resid 83 and name HD1) (resid 82 and name HG2) 3.286 1.350 1.350 weight 1.000 ! spec=HCHaro, no=329, id=9513, vol=5.400000e+06
assign (resid 83 and name HE3) (resid 78 and name HG21) 3.726 1.735 1.735 weight 1.000 ! spec=HCHaro, no=338, id=9520, vol=2.540000e+06
or (resid 83 and name HE3) (resid 78 and name HG22)
or (resid 83 and name HE3) (resid 78 and name HG23)
assign (resid 83 and name HE3) (resid 83 and name HZ3) 2.780 0.966 0.966 weight 1.000 ! spec=HCHaro, no=341, id=9522, vol=1.470000e+07
assign (resid 83 and name HE3) (resid 83 and name HB2) 2.951 1.088 1.088 weight 1.000 ! spec=HCHaro, no=342, id=9523, vol=1.030000e+07
assign (resid 83 and name HH2) (resid 37 and name HD1) 2.865 1.026 1.026 weight 1.000 ! spec=HCHaro, no=350, id=9531, vol=1.230000e+07
or (resid 83 and name HH2) (resid 37 and name HD2)
assign (resid 83 and name HH2) (resid 79 and name HD12) 3.505 1.536 1.536 weight 1.000 ! spec=HCHaro, no=351, id=9532, vol=3.670000e+06
or (resid 83 and name HH2) (resid 79 and name HD11)
or (resid 83 and name HH2) (resid 79 and name HD13)
assign (resid 38 and name HD12) (resid 83 and name HZ2) 3.661 1.675 1.675 weight 1.000 ! spec=HCHaro, no=369, id=9549, vol=2.830000e+06
or (resid 38 and name HD11) (resid 83 and name HZ2)
or (resid 38 and name HD13) (resid 83 and name HZ2)
assign (resid 38 and name HA) (resid 83 and name HZ2) 3.053 1.165 1.165 weight 1.000 ! spec=HCHaro, no=370, id=9550, vol=8.410000e+06
assign (resid 30 and name HN) (resid 83 and name HZ2) 3.632 1.649 1.649 weight 1.000 ! spec=HCHaro, no=371, id=9551, vol=2.960000e+06
assign (resid 40 and name HD12) (resid 83 and name HZ2) 3.712 1.722 1.722 weight 1.000 ! spec=HCHaro, no=376, id=9556, vol=2.600000e+06
or (resid 40 and name HD11) (resid 83 and name HZ2)
or (resid 40 and name HD13) (resid 83 and name HZ2)
assign (resid 83 and name HZ2) (resid 29 and name HA) 3.478 1.512 1.512 weight 1.000 ! spec=HCHaro, no=379, id=9559, vol=3.840000e+06
assign (resid 83 and name HZ2) (resid 30 and name HG12) 3.060 1.171 1.171 weight 1.000 ! spec=HCHaro, no=381, id=9561, vol=8.290000e+06
assign (resid 30 and name HG11) (resid 83 and name HZ2) 3.037 1.153 1.153 weight 1.000 ! spec=HCHaro, no=382, id=9562, vol=8.680000e+06
assign (resid 30 and name HD12) (resid 83 and name HZ2) 2.701 0.912 0.912 weight 1.000 ! spec=HCHaro, no=383, id=9563, vol=1.750000e+07
or (resid 30 and name HD11) (resid 83 and name HZ2)
or (resid 30 and name HD13) (resid 83 and name HZ2)
assign (resid 83 and name HZ2) (resid 37 and name HB2) 3.328 1.384 1.384 weight 1.000 ! spec=HCHaro, no=385, id=9565, vol=5.010000e+06
assign (resid 83 and name HZ2) (resid 37 and name HB1) 3.207 1.285 1.285 weight 1.000 ! spec=HCHaro, no=386, id=9566, vol=6.260000e+06
assign (resid 83 and name HZ2) (resid 38 and name HG11) 3.291 1.353 1.353 weight 1.000 ! spec=HCHaro, no=387, id=9567, vol=5.360000e+06
assign (resid 83 and name HZ2) (resid 78 and name HG21) 3.322 1.379 1.379 weight 1.000 ! spec=HCHaro, no=388, id=9568, vol=5.070000e+06
or (resid 83 and name HZ2) (resid 78 and name HG22)
or (resid 83 and name HZ2) (resid 78 and name HG23)
assign (resid 83 and name HE1) (resid 83 and name HZ2) 2.562 0.820 0.820 weight 1.000 ! spec=HCHaro, no=390, id=9570, vol=2.410000e+07
assign (resid 83 and name HZ3) (resid 79 and name HD12) 3.679 1.691 1.691 weight 1.000 ! spec=HCHaro, no=394, id=9573, vol=2.750000e+06
or (resid 83 and name HZ3) (resid 79 and name HD11)
or (resid 83 and name HZ3) (resid 79 and name HD13)
assign (resid 83 and name HZ3) (resid 30 and name HD12) 3.082 1.187 1.187 weight 1.000 ! spec=HCHaro, no=395, id=9574, vol=7.950000e+06
or (resid 83 and name HZ3) (resid 30 and name HD11)
or (resid 83 and name HZ3) (resid 30 and name HD13)
assign (resid 83 and name HZ2) (resid 83 and name HZ3) 3.439 1.478 1.478 weight 1.000 ! spec=HCHaro, no=396, id=9575, vol=4.120000e+06
assign (resid 93 and name HN) (resid 94 and name HD1) 3.425 1.466 1.466 weight 1.000 ! spec=HCHaro, no=399, id=9578, vol=4.220000e+06
assign (resid 94 and name HD1) (resid 103 and name HA) 3.718 1.728 1.728 weight 1.000 ! spec=HCHaro, no=405, id=9583, vol=2.580000e+06
assign (resid 94 and name HD1) (resid 105 and name HA) 2.645 0.875 0.875 weight 1.000 ! spec=HCHaro, no=410, id=9588, vol=1.990000e+07
assign (resid 94 and name HD1) (resid 105 and name HB1) 3.566 1.590 1.590 weight 1.000 ! spec=HCHaro, no=413, id=9591, vol=3.310000e+06
assign (resid 94 and name HN) (resid 94 and name HD1) 2.497 0.779 0.779 weight 1.000 ! spec=HCHaro, no=415, id=9593, vol=2.810000e+07
assign (resid 94 and name HB2) (resid 94 and name HD1) 2.336 0.682 0.682 weight 1.000 ! spec=HCHaro, no=417, id=9595, vol=4.190000e+07
assign (resid 94 and name HD1) (resid 94 and name HE1) 2.060 0.530 0.530 weight 1.000 ! spec=HCHaro, no=420, id=9597, vol=8.920000e+07
assign (resid 94 and name HD1) (resid 103 and name HN) 3.492 1.524 1.524 weight 1.000 ! spec=HCHaro, no=423, id=9600, vol=3.760000e+06
assign (resid 103 and name HB2) (resid 94 and name HD1) 3.335 1.391 1.391 weight 1.000 ! spec=HCHaro, no=424, id=9601, vol=4.940000e+06
assign (resid 103 and name HB2) (resid 94 and name HE1) 3.252 1.322 1.322 weight 1.000 ! spec=HCHaro, no=427, id=9604, vol=5.760000e+06
assign (resid 94 and name HE1) (resid 105 and name HA) 2.719 0.924 0.924 weight 1.000 ! spec=HCHaro, no=431, id=9608, vol=1.680000e+07
assign (resid 94 and name HE1) (resid 94 and name HZ) 2.141 0.573 0.573 weight 1.000 ! spec=HCHaro, no=432, id=9609, vol=7.070000e+07
assign (resid 94 and name HZ) (resid 96 and name HB2) 3.383 1.431 1.431 weight 1.000 ! spec=HCHaro, no=435, id=9612, vol=4.540000e+06
assign (resid 103 and name HB2) (resid 94 and name HZ) 3.415 1.458 1.458 weight 1.000 ! spec=HCHaro, no=439, id=9615, vol=4.290000e+06
assign (resid 94 and name HD1) (resid 94 and name HZ) 2.887 1.042 1.042 weight 1.000 ! spec=HCHaro, no=441, id=9616, vol=1.180000e+07
assign (resid 103 and name HD2) (resid 94 and name HZ) 2.925 1.069 1.069 weight 1.000 ! spec=HCHaro, no=442, id=9617, vol=1.090000e+07
assign (resid 94 and name HZ) (resid 105 and name HA) 3.127 1.222 1.222 weight 1.000 ! spec=HCHaro, no=444, id=9619, vol=7.280000e+06
assign (resid 124 and name HD22) (resid 95 and name HD1) 3.229 1.304 1.304 weight 1.000 ! spec=HCHaro, no=449, id=9623, vol=6.000000e+06
or (resid 124 and name HD21) (resid 95 and name HD1)
or (resid 124 and name HD23) (resid 95 and name HD1)
assign (resid 102 and name HA) (resid 95 and name HD1) 2.897 1.049 1.049 weight 1.000 ! spec=HCHaro, no=456, id=9630, vol=1.150000e+07
assign (resid 95 and name HA) (resid 95 and name HD1) 2.297 0.659 0.659 weight 1.000 ! spec=HCHaro, no=457, id=9631, vol=4.640000e+07
assign (resid 102 and name HN) (resid 95 and name HD1) 3.001 1.126 1.126 weight 1.000 ! spec=HCHaro, no=461, id=9635, vol=9.310000e+06
assign (resid 95 and name HB2) (resid 95 and name HD1) 2.353 0.692 0.692 weight 1.000 ! spec=HCHaro, no=468, id=9640, vol=4.010000e+07
assign (resid 96 and name HN) (resid 95 and name HD1) 2.906 1.055 1.055 weight 1.000 ! spec=HCHaro, no=472, id=9643, vol=1.130000e+07
assign (resid 95 and name HD1) (resid 102 and name HZ) 3.342 1.396 1.396 weight 1.000 ! spec=HCHaro, no=474, id=9645, vol=4.890000e+06
assign (resid 95 and name HD1) (resid 102 and name HD1) 2.661 0.885 0.885 weight 1.000 ! spec=HCHaro, no=475, id=9646, vol=1.920000e+07
assign (resid 100 and name HN) (resid 95 and name HE1) 3.286 1.350 1.350 weight 1.000 ! spec=HCHaro, no=481, id=9652, vol=5.410000e+06
assign (resid 101 and name HN) (resid 95 and name HE1) 2.787 0.971 0.971 weight 1.000 ! spec=HCHaro, no=486, id=9656, vol=1.450000e+07
assign (resid 95 and name HE1) (resid 102 and name HZ) 3.381 1.429 1.429 weight 1.000 ! spec=HCHaro, no=487, id=9657, vol=4.550000e+06
assign (resid 100 and name HA) (resid 95 and name HE1) 2.819 0.993 0.993 weight 1.000 ! spec=HCHaro, no=488, id=9658, vol=1.360000e+07
assign (resid 95 and name HD1) (resid 95 and name HE1) 1.947 0.474 0.474 weight 1.000 ! spec=HCHaro, no=498, id=9668, vol=1.250000e+08
assign (resid 96 and name HN) (resid 95 and name HE1) 3.508 1.538 1.538 weight 1.000 ! spec=HCHaro, no=500, id=9669, vol=3.660000e+06
assign (resid 95 and name HE1) (resid 102 and name HN) 3.122 1.218 1.218 weight 1.000 ! spec=HCHaro, no=503, id=9672, vol=7.350000e+06
assign (resid 124 and name HD22) (resid 95 and name HE1) 2.800 0.980 0.980 weight 1.000 ! spec=HCHaro, no=505, id=9674, vol=1.410000e+07
or (resid 124 and name HD21) (resid 95 and name HE1)
or (resid 124 and name HD23) (resid 95 and name HE1)
assign (resid 95 and name HA) (resid 102 and name HD1) 3.092 1.195 1.195 weight 1.000 ! spec=HCHaro, no=509, id=9678, vol=7.790000e+06
assign (resid 102 and name HD1) (resid 95 and name HB2) 3.175 1.260 1.260 weight 1.000 ! spec=HCHaro, no=515, id=9684, vol=6.640000e+06
assign (resid 102 and name HB2) (resid 102 and name HD1) 2.596 0.843 0.843 weight 1.000 ! spec=HCHaro, no=520, id=9689, vol=2.220000e+07
assign (resid 102 and name HB1) (resid 102 and name HD1) 2.635 0.868 0.868 weight 1.000 ! spec=HCHaro, no=521, id=9690, vol=2.030000e+07
assign (resid 102 and name HD1) (resid 124 and name HD22) 3.465 1.500 1.500 weight 1.000 ! spec=HCHaro, no=524, id=9692, vol=3.940000e+06
or (resid 102 and name HD1) (resid 124 and name HD21)
or (resid 102 and name HD1) (resid 124 and name HD23)
assign (resid 95 and name HB2) (resid 102 and name HE1) 3.084 1.189 1.189 weight 1.000 ! spec=HCHaro, no=525, id=9693, vol=7.910000e+06
assign (resid 124 and name HD22) (resid 102 and name HE1) 2.751 0.946 0.946 weight 1.000 ! spec=HCHaro, no=529, id=9697, vol=1.570000e+07
or (resid 124 and name HD21) (resid 102 and name HE1)
or (resid 124 and name HD23) (resid 102 and name HE1)
assign (resid 102 and name HE1) (resid 95 and name HD1) 3.240 1.313 1.313 weight 1.000 ! spec=HCHaro, no=535, id=9703, vol=5.880000e+06
assign (resid 102 and name HE1) (resid 102 and name HA) 3.301 1.362 1.362 weight 1.000 ! spec=HCHaro, no=537, id=9705, vol=5.260000e+06
assign (resid 124 and name HD22) (resid 102 and name HZ) 2.851 1.016 1.016 weight 1.000 ! spec=HCHaro, no=542, id=9709, vol=1.270000e+07
or (resid 124 and name HD21) (resid 102 and name HZ)
or (resid 124 and name HD23) (resid 102 and name HZ)
assign (resid 102 and name HZ) (resid 95 and name HB2) 3.421 1.463 1.463 weight 1.000 ! spec=HCHaro, no=547, id=9714, vol=4.240000e+06
assign (resid 102 and name HZ) (resid 140 and name HE2) 3.257 1.326 1.326 weight 1.000 ! spec=HCHaro, no=551, id=9717, vol=5.700000e+06
assign (resid 140 and name HD2) (resid 102 and name HZ) 2.907 1.056 1.056 weight 1.000 ! spec=HCHaro, no=553, id=9719, vol=1.130000e+07
assign (resid 110 and name HG1) (resid 104 and name HD1) 3.282 1.346 1.346 weight 1.000 ! spec=HCHaro, no=554, id=9720, vol=5.450000e+06
assign (resid 110 and name HA) (resid 104 and name HD1) 2.881 1.037 1.037 weight 1.000 ! spec=HCHaro, no=558, id=9724, vol=1.190000e+07
assign (resid 104 and name HN) (resid 104 and name HD1) 2.728 0.930 0.930 weight 1.000 ! spec=HCHaro, no=562, id=9728, vol=1.650000e+07
assign (resid 104 and name HA) (resid 104 and name HD1) 3.428 1.469 1.469 weight 1.000 ! spec=HCHaro, no=563, id=9729, vol=4.190000e+06
assign (resid 104 and name HB2) (resid 104 and name HD1) 2.638 0.870 0.870 weight 1.000 ! spec=HCHaro, no=564, id=9730, vol=2.020000e+07
assign (resid 104 and name HB1) (resid 104 and name HD1) 2.913 1.061 1.061 weight 1.000 ! spec=HCHaro, no=565, id=9731, vol=1.110000e+07
assign (resid 104 and name HE1) (resid 104 and name HD1) 2.435 0.741 0.741 weight 1.000 ! spec=HCHaro, no=567, id=9732, vol=3.260000e+07
assign (resid 104 and name HD1) (resid 110 and name HB2) 3.030 1.147 1.147 weight 1.000 ! spec=HCHaro, no=568, id=9733, vol=8.800000e+06
assign (resid 104 and name HD1) (resid 110 and name HB1) 3.372 1.422 1.422 weight 1.000 ! spec=HCHaro, no=569, id=9734, vol=4.630000e+06
assign (resid 104 and name HE3) (resid 65 and name HA) 3.469 1.504 1.504 weight 1.000 ! spec=HCHaro, no=570, id=9735, vol=3.910000e+06
assign (resid 93 and name HB2) (resid 104 and name HE3) 3.581 1.603 1.603 weight 1.000 ! spec=HCHaro, no=571, id=9736, vol=3.230000e+06
assign (resid 104 and name HE3) (resid 91 and name HD12) 3.756 1.763 1.763 weight 1.000 ! spec=HCHaro, no=574, id=9739, vol=2.420000e+06
or (resid 104 and name HE3) (resid 91 and name HD11)
or (resid 104 and name HE3) (resid 91 and name HD13)
assign (resid 104 and name HE3) (resid 64 and name HG22) 3.422 1.464 1.464 weight 1.000 ! spec=HCHaro, no=576, id=9741, vol=4.240000e+06
or (resid 104 and name HE3) (resid 64 and name HG21)
or (resid 104 and name HE3) (resid 64 and name HG23)
assign (resid 104 and name HA) (resid 104 and name HE3) 2.859 1.022 1.022 weight 1.000 ! spec=HCHaro, no=577, id=9742, vol=1.250000e+07
assign (resid 104 and name HB2) (resid 104 and name HE3) 3.534 1.561 1.561 weight 1.000 ! spec=HCHaro, no=578, id=9743, vol=3.500000e+06
assign (resid 104 and name HB1) (resid 104 and name HE3) 3.601 1.621 1.621 weight 1.000 ! spec=HCHaro, no=579, id=9744, vol=3.120000e+06
assign (resid 92 and name HN) (resid 104 and name HH2) 3.636 1.653 1.653 weight 1.000 ! spec=HCHaro, no=583, id=9747, vol=2.940000e+06
assign (resid 66 and name HG22) (resid 104 and name HH2) 3.564 1.588 1.588 weight 1.000 ! spec=HCHaro, no=584, id=9748, vol=3.320000e+06
or (resid 66 and name HG21) (resid 104 and name HH2)
or (resid 66 and name HG23) (resid 104 and name HH2)
assign (resid 104 and name HH2) (resid 65 and name HA) 3.639 1.656 1.656 weight 1.000 ! spec=HCHaro, no=586, id=9750, vol=2.930000e+06
assign (resid 66 and name HG11) (resid 104 and name HH2) 3.169 1.255 1.255 weight 1.000 ! spec=HCHaro, no=588, id=9752, vol=6.720000e+06
assign (resid 104 and name HH2) (resid 104 and name HZ3) 3.029 1.147 1.147 weight 1.000 ! spec=HCHaro, no=594, id=9757, vol=8.820000e+06
assign (resid 104 and name HZ2) (resid 138 and name HE3) 3.534 1.561 1.561 weight 1.000 ! spec=HCHaro, no=600, id=9763, vol=3.490000e+06
assign (resid 66 and name HG11) (resid 104 and name HZ2) 3.103 1.203 1.203 weight 1.000 ! spec=HCHaro, no=601, id=9764, vol=7.630000e+06
assign (resid 66 and name HB) (resid 104 and name HZ2) 3.058 1.169 1.169 weight 1.000 ! spec=HCHaro, no=604, id=9767, vol=8.320000e+06
assign (resid 113 and name HA) (resid 104 and name HZ2) 3.507 1.538 1.538 weight 1.000 ! spec=HCHaro, no=606, id=9769, vol=3.660000e+06
assign (resid 66 and name HN) (resid 104 and name HZ2) 2.729 0.931 0.931 weight 1.000 ! spec=HCHaro, no=607, id=9770, vol=1.650000e+07
assign (resid 104 and name HZ2) (resid 66 and name HG22) 3.398 1.443 1.443 weight 1.000 ! spec=HCHaro, no=608, id=9771, vol=4.420000e+06
or (resid 104 and name HZ2) (resid 66 and name HG21)
or (resid 104 and name HZ2) (resid 66 and name HG23)
assign (resid 91 and name HD22) (resid 104 and name HZ2) 3.485 1.518 1.518 weight 1.000 ! spec=HCHaro, no=609, id=9772, vol=3.800000e+06
or (resid 91 and name HD21) (resid 104 and name HZ2)
or (resid 91 and name HD23) (resid 104 and name HZ2)
assign (resid 104 and name HE1) (resid 104 and name HZ2) 2.949 1.087 1.087 weight 1.000 ! spec=HCHaro, no=610, id=9773, vol=1.030000e+07
assign (resid 104 and name HH2) (resid 104 and name HZ2) 2.571 0.826 0.826 weight 1.000 ! spec=HCHaro, no=611, id=9774, vol=2.360000e+07
assign (resid 104 and name HZ2) (resid 104 and name HZ3) 3.401 1.446 1.446 weight 1.000 ! spec=HCHaro, no=613, id=9775, vol=4.400000e+06
assign (resid 104 and name HZ2) (resid 138 and name HH2) 2.580 0.832 0.832 weight 1.000 ! spec=HCHaro, no=615, id=9777, vol=2.310000e+07
assign (resid 104 and name HZ2) (resid 138 and name HZ2) 3.075 1.182 1.182 weight 1.000 ! spec=HCHaro, no=616, id=9778, vol=8.050000e+06
assign (resid 104 and name HZ2) (resid 138 and name HZ3) 3.020 1.140 1.140 weight 1.000 ! spec=HCHaro, no=617, id=9779, vol=8.960000e+06
assign (resid 91 and name HB2) (resid 104 and name HZ3) 3.089 1.193 1.193 weight 1.000 ! spec=HCHaro, no=620, id=9782, vol=7.840000e+06
assign (resid 93 and name HN) (resid 104 and name HZ3) 3.504 1.534 1.534 weight 1.000 ! spec=HCHaro, no=623, id=9785, vol=3.680000e+06
assign (resid 105 and name HD1) (resid 104 and name HA) 3.455 1.492 1.492 weight 1.000 ! spec=HCHaro, no=627, id=9789, vol=4.000000e+06
assign (resid 105 and name HD1) (resid 49 and name HG11) 3.427 1.468 1.468 weight 1.000 ! spec=HCHaro, no=628, id=9790, vol=4.200000e+06
assign (resid 63 and name HB2) (resid 105 and name HD1) 3.160 1.248 1.248 weight 1.000 ! spec=HCHaro, no=629, id=9791, vol=6.830000e+06
assign (resid 92 and name HA2) (resid 105 and name HD1) 3.044 1.158 1.158 weight 1.000 ! spec=HCHaro, no=633, id=9795, vol=8.560000e+06
assign (resid 105 and name HD1) (resid 63 and name HN) 3.822 1.826 1.826 weight 1.000 ! spec=HCHaro, no=634, id=9796, vol=2.180000e+06
assign (resid 105 and name HD1) (resid 49 and name HD12) 3.003 1.127 1.127 weight 1.000 ! spec=HCHaro, no=635, id=9797, vol=9.290000e+06
or (resid 105 and name HD1) (resid 49 and name HD11)
or (resid 105 and name HD1) (resid 49 and name HD13)
assign (resid 92 and name HA1) (resid 105 and name HD1) 2.964 1.098 1.098 weight 1.000 ! spec=HCHaro, no=638, id=9800, vol=1.000000e+07
assign (resid 93 and name HN) (resid 105 and name HD1) 3.162 1.250 1.250 weight 1.000 ! spec=HCHaro, no=639, id=9801, vol=6.810000e+06
assign (resid 105 and name HD1) (resid 94 and name HD1) 3.282 1.346 1.346 weight 1.000 ! spec=HCHaro, no=641, id=9803, vol=5.450000e+06
assign (resid 105 and name HB2) (resid 105 and name HD1) 2.731 0.932 0.932 weight 1.000 ! spec=HCHaro, no=643, id=9805, vol=1.640000e+07
assign (resid 105 and name HB1) (resid 105 and name HD1) 2.833 1.004 1.004 weight 1.000 ! spec=HCHaro, no=644, id=9806, vol=1.320000e+07
assign (resid 105 and name HD1) (resid 105 and name HE1) 2.045 0.523 0.523 weight 1.000 ! spec=HCHaro, no=646, id=9807, vol=9.300000e+07
assign (resid 105 and name HE1) (resid 49 and name HG22) 2.691 0.905 0.905 weight 1.000 ! spec=HCHaro, no=648, id=9809, vol=1.790000e+07
or (resid 105 and name HE1) (resid 49 and name HG21)
or (resid 105 and name HE1) (resid 49 and name HG23)
assign (resid 105 and name HE1) (resid 63 and name HE2) 3.300 1.361 1.361 weight 1.000 ! spec=HCHaro, no=649, id=9810, vol=5.270000e+06
or (resid 105 and name HE1) (resid 63 and name HE1)
or (resid 105 and name HE1) (resid 63 and name HE3)
assign (resid 105 and name HE1) (resid 94 and name HB2) 3.151 1.241 1.241 weight 1.000 ! spec=HCHaro, no=650, id=9811, vol=6.950000e+06
assign (resid 105 and name HE1) (resid 94 and name HD1) 3.632 1.649 1.649 weight 1.000 ! spec=HCHaro, no=651, id=9812, vol=2.970000e+06
assign (resid 49 and name HB) (resid 105 and name HZ) 3.575 1.598 1.598 weight 1.000 ! spec=HCHaro, no=653, id=9813, vol=3.260000e+06
assign (resid 105 and name HZ) (resid 94 and name HA) 3.682 1.695 1.695 weight 1.000 ! spec=HCHaro, no=657, id=9817, vol=2.730000e+06
assign (resid 105 and name HZ) (resid 94 and name HB2) 3.017 1.137 1.137 weight 1.000 ! spec=HCHaro, no=658, id=9818, vol=9.030000e+06
assign (resid 94 and name HB1) (resid 105 and name HZ) 3.170 1.256 1.256 weight 1.000 ! spec=HCHaro, no=659, id=9819, vol=6.710000e+06
assign (resid 69 and name HN) (resid 112 and name HD1) 3.271 1.337 1.337 weight 1.000 ! spec=HCHaro, no=665, id=9824, vol=5.560000e+06
assign (resid 72 and name HB2) (resid 112 and name HD1) 3.092 1.195 1.195 weight 1.000 ! spec=HCHaro, no=667, id=9826, vol=7.790000e+06
assign (resid 112 and name HD1) (resid 112 and name HA) 2.881 1.038 1.038 weight 1.000 ! spec=HCHaro, no=678, id=9837, vol=1.190000e+07
assign (resid 112 and name HB1) (resid 112 and name HD1) 3.094 1.196 1.196 weight 1.000 ! spec=HCHaro, no=679, id=9838, vol=7.760000e+06
assign (resid 72 and name HN) (resid 112 and name HE1) 3.396 1.441 1.441 weight 1.000 ! spec=HCHaro, no=692, id=9850, vol=4.440000e+06
assign (resid 115 and name HD1) (resid 113 and name HB2) 2.670 0.891 0.891 weight 1.000 ! spec=HCHaro, no=694, id=9852, vol=1.880000e+07
assign (resid 113 and name HB1) (resid 115 and name HD1) 2.739 0.938 0.938 weight 1.000 ! spec=HCHaro, no=695, id=9853, vol=1.610000e+07
assign (resid 115 and name HN) (resid 115 and name HD1) 2.630 0.864 0.864 weight 1.000 ! spec=HCHaro, no=698, id=9856, vol=2.060000e+07
assign (resid 115 and name HA) (resid 115 and name HD1) 3.215 1.292 1.292 weight 1.000 ! spec=HCHaro, no=699, id=9857, vol=6.160000e+06
assign (resid 115 and name HB2) (resid 115 and name HD1) 2.362 0.697 0.697 weight 1.000 ! spec=HCHaro, no=700, id=9858, vol=3.920000e+07
assign (resid 115 and name HB1) (resid 115 and name HD1) 2.534 0.803 0.803 weight 1.000 ! spec=HCHaro, no=701, id=9859, vol=2.570000e+07
assign (resid 115 and name HE1) (resid 115 and name HD1) 2.121 0.562 0.562 weight 1.000 ! spec=HCHaro, no=703, id=9860, vol=7.470000e+07
assign (resid 115 and name HE3) (resid 115 and name HZ3) 2.763 0.954 0.954 weight 1.000 ! spec=HCHaro, no=713, id=9870, vol=1.530000e+07
assign (resid 115 and name HE3) (resid 140 and name HG2) 3.760 1.767 1.767 weight 1.000 ! spec=HCHaro, no=715, id=9872, vol=2.410000e+06
assign (resid 140 and name HG1) (resid 115 and name HE3) 3.515 1.544 1.544 weight 1.000 ! spec=HCHaro, no=716, id=9873, vol=3.610000e+06
assign (resid 115 and name HE3) (resid 115 and name HH2) 3.280 1.345 1.345 weight 1.000 ! spec=HCHaro, no=719, id=9876, vol=5.470000e+06
assign (resid 115 and name HH2) (resid 110 and name HE2) 3.710 1.721 1.721 weight 1.000 ! spec=HCHaro, no=721, id=9878, vol=2.610000e+06
or (resid 115 and name HH2) (resid 110 and name HE1)
or (resid 115 and name HH2) (resid 110 and name HE3)
assign (resid 129 and name HB2) (resid 115 and name HH2) 2.262 0.639 0.639 weight 1.000 ! spec=HCHaro, no=725, id=9882, vol=5.090000e+07
or (resid 129 and name HB1) (resid 115 and name HH2)
or (resid 129 and name HB3) (resid 115 and name HH2)
assign (resid 140 and name HN) (resid 115 and name HH2) 3.703 1.714 1.714 weight 1.000 ! spec=HCHaro, no=726, id=9883, vol=2.640000e+06
assign (resid 91 and name HD22) (resid 115 and name HH2) 3.419 1.461 1.461 weight 1.000 ! spec=HCHaro, no=728, id=9885, vol=4.260000e+06
or (resid 91 and name HD21) (resid 115 and name HH2)
or (resid 91 and name HD23) (resid 115 and name HH2)
assign (resid 115 and name HH2) (resid 93 and name HG2) 3.420 1.462 1.462 weight 1.000 ! spec=HCHaro, no=729, id=9886, vol=4.250000e+06
assign (resid 115 and name HH2) (resid 102 and name HB2) 3.720 1.730 1.730 weight 1.000 ! spec=HCHaro, no=730, id=9887, vol=2.570000e+06
assign (resid 115 and name HH2) (resid 102 and name HB1) 3.675 1.688 1.688 weight 1.000 ! spec=HCHaro, no=731, id=9888, vol=2.770000e+06
assign (resid 115 and name HH2) (resid 102 and name HE1) 3.118 1.215 1.215 weight 1.000 ! spec=HCHaro, no=732, id=9889, vol=7.410000e+06
assign (resid 115 and name HE1) (resid 115 and name HH2) 3.661 1.675 1.675 weight 1.000 ! spec=HCHaro, no=733, id=9890, vol=2.830000e+06
assign (resid 140 and name HG2) (resid 115 and name HH2) 3.066 1.175 1.175 weight 1.000 ! spec=HCHaro, no=736, id=9892, vol=8.190000e+06
assign (resid 115 and name HZ2) (resid 110 and name HE2) 3.721 1.731 1.731 weight 1.000 ! spec=HCHaro, no=737, id=9893, vol=2.560000e+06
or (resid 115 and name HZ2) (resid 110 and name HE1)
or (resid 115 and name HZ2) (resid 110 and name HE3)
assign (resid 115 and name HZ2) (resid 140 and name HG2) 3.116 1.214 1.214 weight 1.000 ! spec=HCHaro, no=741, id=9897, vol=7.430000e+06
assign (resid 115 and name HZ2) (resid 113 and name HB1) 3.611 1.630 1.630 weight 1.000 ! spec=HCHaro, no=742, id=9898, vol=3.070000e+06
assign (resid 102 and name HB2) (resid 115 and name HZ2) 3.110 1.209 1.209 weight 1.000 ! spec=HCHaro, no=743, id=9899, vol=7.520000e+06
assign (resid 102 and name HB1) (resid 115 and name HZ2) 3.283 1.347 1.347 weight 1.000 ! spec=HCHaro, no=744, id=9900, vol=5.440000e+06
assign (resid 115 and name HZ2) (resid 93 and name HE2) 3.302 1.363 1.363 weight 1.000 ! spec=HCHaro, no=745, id=9901, vol=5.260000e+06
or (resid 115 and name HZ2) (resid 93 and name HE1)
or (resid 115 and name HZ2) (resid 93 and name HE3)
assign (resid 115 and name HZ2) (resid 93 and name HG2) 3.507 1.538 1.538 weight 1.000 ! spec=HCHaro, no=746, id=9902, vol=3.660000e+06
assign (resid 115 and name HE1) (resid 115 and name HZ2) 2.532 0.801 0.801 weight 1.000 ! spec=HCHaro, no=748, id=9904, vol=2.580000e+07
assign (resid 115 and name HZ2) (resid 115 and name HE3) 3.690 1.702 1.702 weight 1.000 ! spec=HCHaro, no=749, id=9905, vol=2.700000e+06
assign (resid 115 and name HH2) (resid 115 and name HZ2) 2.114 0.559 0.559 weight 1.000 ! spec=HCHaro, no=750, id=9906, vol=7.630000e+07
assign (resid 115 and name HZ2) (resid 138 and name HE3) 3.416 1.459 1.459 weight 1.000 ! spec=HCHaro, no=752, id=9907, vol=4.280000e+06
assign (resid 140 and name HA) (resid 115 and name HZ3) 3.631 1.648 1.648 weight 1.000 ! spec=HCHaro, no=759, id=9914, vol=2.970000e+06
assign (resid 129 and name HB2) (resid 115 and name HZ3) 3.051 1.164 1.164 weight 1.000 ! spec=HCHaro, no=761, id=9916, vol=8.440000e+06
or (resid 129 and name HB1) (resid 115 and name HZ3)
or (resid 129 and name HB3) (resid 115 and name HZ3)
assign (resid 115 and name HH2) (resid 115 and name HZ3) 2.798 0.979 0.979 weight 1.000 ! spec=HCHaro, no=768, id=9923, vol=1.420000e+07
assign (resid 115 and name HZ3) (resid 139 and name HA) 3.477 1.511 1.511 weight 1.000 ! spec=HCHaro, no=770, id=9924, vol=3.850000e+06
assign (resid 130 and name HD1) (resid 130 and name HE1) 2.058 0.529 0.529 weight 1.000 ! spec=HCHaro, no=773, id=9927, vol=8.970000e+07
or (resid 130 and name HD1) (resid 130 and name HE2)
assign (resid 130 and name HA) (resid 130 and name HD1) 3.160 1.248 1.248 weight 1.000 ! spec=HCHaro, no=778, id=9932, vol=6.840000e+06
assign (resid 90 and name HD12) (resid 130 and name HD1) 3.420 1.462 1.462 weight 1.000 ! spec=HCHaro, no=779, id=9933, vol=4.250000e+06
or (resid 90 and name HD11) (resid 130 and name HD1)
or (resid 90 and name HD13) (resid 130 and name HD1)
assign (resid 130 and name HD1) (resid 130 and name HN) 2.866 1.027 1.027 weight 1.000 ! spec=HCHaro, no=781, id=9935, vol=1.230000e+07
assign (resid 130 and name HD1) (resid 130 and name HE1) 2.316 0.671 0.671 weight 1.000 ! spec=HCHaro, no=799, id=9952, vol=4.410000e+07
assign (resid 145 and name HG22) (resid 130 and name HZ) 3.037 1.153 1.153 weight 1.000 ! spec=HCHaro, no=803, id=9956, vol=8.670000e+06
or (resid 145 and name HG21) (resid 130 and name HZ)
or (resid 145 and name HG23) (resid 130 and name HZ)
assign (resid 128 and name HB2) (resid 130 and name HZ) 3.161 1.249 1.249 weight 1.000 ! spec=HCHaro, no=804, id=9957, vol=6.830000e+06
or (resid 130 and name HZ) (resid 128 and name HB1)
assign (resid 130 and name HZ) (resid 130 and name HD1) 3.110 1.209 1.209 weight 1.000 ! spec=HCHaro, no=807, id=9960, vol=7.520000e+06
assign (resid 130 and name HZ) (resid 130 and name HE1) 2.406 0.724 0.724 weight 1.000 ! spec=HCHaro, no=808, id=9961, vol=3.510000e+07
assign (resid 132 and name HD2) (resid 87 and name HB2) 3.543 1.569 1.569 weight 1.000 ! spec=HCHaro, no=810, id=9963, vol=3.440000e+06
or (resid 132 and name HD2) (resid 87 and name HB1)
assign (resid 135 and name HN) (resid 132 and name HD2) 2.820 0.994 0.994 weight 1.000 ! spec=HCHaro, no=811, id=9964, vol=1.350000e+07
assign (resid 132 and name HD2) (resid 136 and name HN) 3.601 1.621 1.621 weight 1.000 ! spec=HCHaro, no=813, id=9966, vol=3.120000e+06
assign (resid 132 and name HD2) (resid 133 and name HN) 3.476 1.510 1.510 weight 1.000 ! spec=HCHaro, no=815, id=9968, vol=3.860000e+06
assign (resid 132 and name HD2) (resid 132 and name HN) 3.657 1.672 1.672 weight 1.000 ! spec=HCHaro, no=818, id=9971, vol=2.840000e+06
assign (resid 132 and name HA) (resid 132 and name HD2) 3.547 1.573 1.573 weight 1.000 ! spec=HCHaro, no=819, id=9972, vol=3.420000e+06
assign (resid 132 and name HB2) (resid 132 and name HD2) 3.134 1.228 1.228 weight 1.000 ! spec=HCHaro, no=820, id=9973, vol=7.180000e+06
assign (resid 132 and name HB1) (resid 132 and name HD2) 2.963 1.097 1.097 weight 1.000 ! spec=HCHaro, no=821, id=9974, vol=1.010000e+07
assign (resid 132 and name HD2) (resid 134 and name HA) 3.538 1.565 1.565 weight 1.000 ! spec=HCHaro, no=823, id=9975, vol=3.470000e+06
assign (resid 134 and name HB2) (resid 132 and name HD2) 2.918 1.064 1.064 weight 1.000 ! spec=HCHaro, no=824, id=9976, vol=1.100000e+07
assign (resid 135 and name HG21) (resid 132 and name HE1) 2.871 1.031 1.031 weight 1.000 ! spec=HCHaro, no=830, id=9982, vol=1.210000e+07
or (resid 135 and name HG22) (resid 132 and name HE1)
or (resid 135 and name HG23) (resid 132 and name HE1)
assign (resid 132 and name HE1) (resid 134 and name HB2) 2.563 0.821 0.821 weight 1.000 ! spec=HCHaro, no=834, id=9986, vol=2.400000e+07
or (resid 132 and name HE1) (resid 134 and name HB1)
assign (resid 132 and name HE1) (resid 132 and name HD2) 3.590 1.611 1.611 weight 1.000 ! spec=HCHaro, no=839, id=9991, vol=3.180000e+06
assign (resid 132 and name HE1) (resid 134 and name HE2) 3.512 1.542 1.542 weight 1.000 ! spec=HCHaro, no=841, id=9992, vol=3.630000e+06
assign (resid 138 and name HB1) (resid 138 and name HD1) 3.020 1.140 1.140 weight 1.000 ! spec=HCHaro, no=843, id=9994, vol=8.970000e+06
assign (resid 131 and name HG) (resid 138 and name HD1) 2.951 1.089 1.089 weight 1.000 ! spec=HCHaro, no=844, id=9995, vol=1.030000e+07
assign (resid 138 and name HD1) (resid 136 and name HA2) 3.651 1.667 1.667 weight 1.000 ! spec=HCHaro, no=846, id=9997, vol=2.870000e+06
assign (resid 91 and name HD12) (resid 138 and name HD1) 3.507 1.538 1.538 weight 1.000 ! spec=HCHaro, no=847, id=9998, vol=3.660000e+06
or (resid 91 and name HD11) (resid 138 and name HD1)
or (resid 91 and name HD13) (resid 138 and name HD1)
assign (resid 91 and name HD22) (resid 138 and name HD1) 3.058 1.169 1.169 weight 1.000 ! spec=HCHaro, no=852, id=10002, vol=8.320000e+06
or (resid 91 and name HD21) (resid 138 and name HD1)
or (resid 91 and name HD23) (resid 138 and name HD1)
assign (resid 131 and name HD22) (resid 138 and name HD1) 3.025 1.144 1.144 weight 1.000 ! spec=HCHaro, no=854, id=10004, vol=8.890000e+06
or (resid 131 and name HD21) (resid 138 and name HD1)
or (resid 131 and name HD23) (resid 138 and name HD1)
assign (resid 138 and name HD1) (resid 136 and name HA1) 3.672 1.686 1.686 weight 1.000 ! spec=HCHaro, no=856, id=10006, vol=2.770000e+06
assign (resid 138 and name HD1) (resid 131 and name HA) 2.689 0.904 0.904 weight 1.000 ! spec=HCHaro, no=859, id=10009, vol=1.800000e+07
assign (resid 131 and name HB2) (resid 138 and name HD1) 2.877 1.035 1.035 weight 1.000 ! spec=HCHaro, no=860, id=10010, vol=1.200000e+07
assign (resid 138 and name HD1) (resid 131 and name HB1) 3.356 1.408 1.408 weight 1.000 ! spec=HCHaro, no=861, id=10011, vol=4.760000e+06
assign (resid 132 and name HN) (resid 138 and name HD1) 3.048 1.162 1.162 weight 1.000 ! spec=HCHaro, no=862, id=10012, vol=8.480000e+06
assign (resid 138 and name HD1) (resid 137 and name HA) 2.893 1.046 1.046 weight 1.000 ! spec=HCHaro, no=864, id=10014, vol=1.160000e+07
assign (resid 138 and name HN) (resid 138 and name HD1) 2.806 0.984 0.984 weight 1.000 ! spec=HCHaro, no=865, id=10015, vol=1.390000e+07
assign (resid 138 and name HA) (resid 138 and name HD1) 2.538 0.805 0.805 weight 1.000 ! spec=HCHaro, no=866, id=10016, vol=2.550000e+07
assign (resid 138 and name HE1) (resid 138 and name HD1) 2.262 0.640 0.640 weight 1.000 ! spec=HCHaro, no=868, id=10017, vol=5.080000e+07
assign (resid 139 and name HN) (resid 138 and name HD1) 3.168 1.254 1.254 weight 1.000 ! spec=HCHaro, no=869, id=10018, vol=6.730000e+06
assign (resid 114 and name HN) (resid 138 and name HE3) 2.842 1.010 1.010 weight 1.000 ! spec=HCHaro, no=870, id=10019, vol=1.290000e+07
assign (resid 113 and name HB2) (resid 138 and name HE3) 2.967 1.101 1.101 weight 1.000 ! spec=HCHaro, no=871, id=10020, vol=9.970000e+06
assign (resid 113 and name HA) (resid 138 and name HE3) 3.171 1.257 1.257 weight 1.000 ! spec=HCHaro, no=873, id=10022, vol=6.700000e+06
assign (resid 138 and name HE3) (resid 138 and name HZ3) 2.403 0.722 0.722 weight 1.000 ! spec=HCHaro, no=875, id=10024, vol=3.530000e+07
assign (resid 138 and name HB2) (resid 138 and name HE3) 2.507 0.785 0.785 weight 1.000 ! spec=HCHaro, no=877, id=10026, vol=2.740000e+07
assign (resid 138 and name HE3) (resid 115 and name HA) 3.269 1.335 1.335 weight 1.000 ! spec=HCHaro, no=880, id=10029, vol=5.580000e+06
assign (resid 138 and name HE3) (resid 115 and name HD1) 3.565 1.589 1.589 weight 1.000 ! spec=HCHaro, no=881, id=10030, vol=3.310000e+06
assign (resid 138 and name HE3) (resid 115 and name HE3) 3.449 1.487 1.487 weight 1.000 ! spec=HCHaro, no=882, id=10031, vol=4.040000e+06
assign (resid 138 and name HE3) (resid 138 and name HA) 3.468 1.503 1.503 weight 1.000 ! spec=HCHaro, no=883, id=10032, vol=3.910000e+06
assign (resid 138 and name HE3) (resid 138 and name HD1) 3.596 1.616 1.616 weight 1.000 ! spec=HCHaro, no=884, id=10033, vol=3.150000e+06
assign (resid 113 and name HA) (resid 138 and name HH2) 2.799 0.979 0.979 weight 1.000 ! spec=HCHaro, no=887, id=10035, vol=1.420000e+07
assign (resid 138 and name HH2) (resid 66 and name HG11) 3.295 1.357 1.357 weight 1.000 ! spec=HCHaro, no=889, id=10037, vol=5.320000e+06
assign (resid 66 and name HN) (resid 138 and name HH2) 3.494 1.526 1.526 weight 1.000 ! spec=HCHaro, no=892, id=10040, vol=3.740000e+06
assign (resid 66 and name HB) (resid 138 and name HH2) 2.855 1.019 1.019 weight 1.000 ! spec=HCHaro, no=893, id=10041, vol=1.260000e+07
assign (resid 113 and name HB1) (resid 138 and name HH2) 3.460 1.496 1.496 weight 1.000 ! spec=HCHaro, no=894, id=10042, vol=3.970000e+06
assign (resid 138 and name HH2) (resid 72 and name HB2) 3.606 1.625 1.625 weight 1.000 ! spec=HCHaro, no=895, id=10043, vol=3.100000e+06
assign (resid 104 and name HH2) (resid 138 and name HH2) 3.153 1.243 1.243 weight 1.000 ! spec=HCHaro, no=896, id=10044, vol=6.920000e+06
assign (resid 138 and name HH2) (resid 112 and name HD1) 2.770 0.959 0.959 weight 1.000 ! spec=HCHaro, no=899, id=10047, vol=1.510000e+07
assign (resid 138 and name HE1) (resid 138 and name HH2) 3.507 1.537 1.537 weight 1.000 ! spec=HCHaro, no=900, id=10048, vol=3.660000e+06
assign (resid 138 and name HE3) (resid 138 and name HH2) 3.312 1.371 1.371 weight 1.000 ! spec=HCHaro, no=901, id=10049, vol=5.160000e+06
assign (resid 138 and name HH2) (resid 138 and name HZ2) 2.515 0.791 0.791 weight 1.000 ! spec=HCHaro, no=903, id=10050, vol=2.690000e+07
assign (resid 138 and name HH2) (resid 138 and name HZ3) 2.527 0.798 0.798 weight 1.000 ! spec=HCHaro, no=904, id=10051, vol=2.610000e+07
assign (resid 66 and name HG11) (resid 138 and name HZ2) 3.094 1.197 1.197 weight 1.000 ! spec=HCHaro, no=906, id=10053, vol=7.750000e+06
assign (resid 66 and name HD12) (resid 138 and name HZ2) 2.664 0.887 0.887 weight 1.000 ! spec=HCHaro, no=907, id=10054, vol=1.900000e+07
or (resid 66 and name HD11) (resid 138 and name HZ2)
or (resid 66 and name HD13) (resid 138 and name HZ2)
assign (resid 66 and name HG12) (resid 138 and name HZ2) 3.124 1.220 1.220 weight 1.000 ! spec=HCHaro, no=908, id=10055, vol=7.330000e+06
assign (resid 113 and name HA) (resid 138 and name HZ2) 3.322 1.379 1.379 weight 1.000 ! spec=HCHaro, no=912, id=10059, vol=5.060000e+06
assign (resid 72 and name HA) (resid 138 and name HZ2) 3.498 1.530 1.530 weight 1.000 ! spec=HCHaro, no=913, id=10060, vol=3.710000e+06
assign (resid 66 and name HB) (resid 138 and name HZ2) 2.459 0.756 0.756 weight 1.000 ! spec=HCHaro, no=917, id=10063, vol=3.080000e+07
assign (resid 138 and name HZ2) (resid 66 and name HA) 3.482 1.516 1.516 weight 1.000 ! spec=HCHaro, no=918, id=10064, vol=3.820000e+06
assign (resid 138 and name HZ2) (resid 72 and name HB2) 3.692 1.704 1.704 weight 1.000 ! spec=HCHaro, no=919, id=10065, vol=2.690000e+06
assign (resid 138 and name HZ2) (resid 114 and name HN) 3.576 1.598 1.598 weight 1.000 ! spec=HCHaro, no=924, id=10070, vol=3.260000e+06
assign (resid 138 and name HE1) (resid 138 and name HZ2) 2.723 0.927 0.927 weight 1.000 ! spec=HCHaro, no=925, id=10071, vol=1.670000e+07
assign (resid 113 and name HB2) (resid 138 and name HZ3) 2.892 1.046 1.046 weight 1.000 ! spec=HCHaro, no=927, id=10072, vol=1.160000e+07
assign (resid 138 and name HZ3) (resid 113 and name HN) 3.430 1.471 1.471 weight 1.000 ! spec=HCHaro, no=928, id=10073, vol=4.180000e+06
assign (resid 138 and name HZ2) (resid 138 and name HZ3) 3.245 1.316 1.316 weight 1.000 ! spec=HCHaro, no=930, id=10075, vol=5.830000e+06
assign (resid 113 and name HB1) (resid 138 and name HZ3) 2.848 1.014 1.014 weight 1.000 ! spec=HCHaro, no=931, id=10076, vol=1.280000e+07
assign (resid 138 and name HZ3) (resid 115 and name HD1) 3.504 1.535 1.535 weight 1.000 ! spec=HCHaro, no=935, id=10080, vol=3.680000e+06
assign (resid 114 and name HN) (resid 138 and name HZ3) 3.029 1.147 1.147 weight 1.000 ! spec=HCHaro, no=936, id=10081, vol=8.820000e+06
assign (resid 113 and name HA) (resid 138 and name HZ3) 2.779 0.965 0.965 weight 1.000 ! spec=HCHaro, no=937, id=10082, vol=1.480000e+07
assign (resid 104 and name HH2) (resid 138 and name HZ3) 3.432 1.472 1.472 weight 1.000 ! spec=HCHaro, no=938, id=10083, vol=4.170000e+06
assign (resid 138 and name HZ3) (resid 66 and name HB) 3.648 1.663 1.663 weight 1.000 ! spec=HCHaro, no=939, id=10084, vol=2.890000e+06
assign (resid 138 and name HZ3) (resid 112 and name HD1) 3.521 1.550 1.550 weight 1.000 ! spec=HCHaro, no=940, id=10085, vol=3.570000e+06
assign (resid 159 and name HD1) (resid 157 and name HB) 3.422 1.464 1.464 weight 1.000 ! spec=HCHaro, no=955, id=10097, vol=4.240000e+06
assign (resid 159 and name HB2) (resid 159 and name HD1) 2.191 0.600 0.600 weight 1.000 ! spec=HCHaro, no=956, id=10098, vol=6.160000e+07
or (resid 159 and name HD1) (resid 159 and name HB1)
assign (resid 159 and name HD1) (resid 158 and name HB1) 3.702 1.714 1.714 weight 1.000 ! spec=HCHaro, no=958, id=10099, vol=2.640000e+06
assign (resid 157 and name HG22) (resid 159 and name HD1) 3.128 1.223 1.223 weight 1.000 ! spec=HCHaro, no=960, id=10101, vol=7.260000e+06
or (resid 157 and name HG21) (resid 159 and name HD1)
or (resid 157 and name HG23) (resid 159 and name HD1)
assign (resid 159 and name HN) (resid 159 and name HD1) 2.849 1.015 1.015 weight 1.000 ! spec=HCHaro, no=961, id=10102, vol=1.270000e+07
assign (resid 159 and name HD1) (resid 159 and name HA) 2.667 0.889 0.889 weight 1.000 ! spec=HCHaro, no=962, id=10103, vol=1.890000e+07
assign (resid 160 and name HN) (resid 159 and name HD1) 3.221 1.296 1.296 weight 1.000 ! spec=HCHaro, no=965, id=10105, vol=6.100000e+06
assign (resid 159 and name HE1) (resid 157 and name HB) 3.331 1.387 1.387 weight 1.000 ! spec=HCHaro, no=967, id=10107, vol=4.980000e+06
assign (resid 157 and name HG22) (resid 159 and name HE1) 3.271 1.337 1.337 weight 1.000 ! spec=HCHaro, no=968, id=10108, vol=5.560000e+06
or (resid 157 and name HG21) (resid 159 and name HE1)
or (resid 157 and name HG23) (resid 159 and name HE1)
assign (resid 159 and name HB2) (resid 159 and name HE1) 2.992 1.119 1.119 weight 1.000 ! spec=HCHaro, no=969, id=10109, vol=9.480000e+06
or (resid 159 and name HE1) (resid 159 and name HB1)
assign (resid 24 and name HN) (resid 26 and name HN) 3.826 1.830 1.830 weight 1.000 ! spec=HNH, no=5, id=2, vol=6.900000e+06
assign (resid 24 and name HN) (resid 23 and name HA) 2.516 0.791 0.791 weight 1.000 ! spec=HNH, no=8, id=5, vol=8.540000e+07
assign (resid 24 and name HN) (resid 23 and name HB1) 3.042 1.157 1.157 weight 1.000 ! spec=HNH, no=9, id=6, vol=2.730000e+07
assign (resid 24 and name HN) (resid 24 and name HA) 3.007 1.130 1.130 weight 1.000 ! spec=HNH, no=11, id=7, vol=2.930000e+07
assign (resid 24 and name HN) (resid 24 and name HB1) 2.624 0.861 0.861 weight 1.000 ! spec=HNH, no=12, id=8, vol=6.640000e+07
assign (resid 24 and name HN) (resid 25 and name HD1) 3.549 1.574 1.574 weight 1.000 ! spec=HNH, no=13, id=9, vol=1.080000e+07
assign (resid 24 and name HN) (resid 29 and name HB2) 3.754 1.762 1.762 weight 1.000 ! spec=HNH, no=14, id=10, vol=7.740000e+06
assign (resid 24 and name HN) (resid 31 and name HB2) 3.636 1.653 1.653 weight 1.000 ! spec=HNH, no=15, id=11, vol=9.370000e+06
assign (resid 24 and name HN) (resid 157 and name HD12) 3.646 1.662 1.662 weight 1.000 ! spec=HNH, no=20, id=16, vol=9.220000e+06
or (resid 24 and name HN) (resid 157 and name HD11)
or (resid 24 and name HN) (resid 157 and name HD13)
assign (resid 26 and name HN) (resid 24 and name HA) 3.733 1.741 1.741 weight 1.000 ! spec=HNH, no=23, id=19, vol=8.010000e+06
assign (resid 26 and name HN) (resid 26 and name HB1) 3.599 1.619 1.619 weight 1.000 ! spec=HNH, no=25, id=21, vol=9.970000e+06
assign (resid 26 and name HN) (resid 24 and name HB1) 3.036 1.152 1.152 weight 1.000 ! spec=HNH, no=26, id=22, vol=2.760000e+07
assign (resid 26 and name HN) (resid 25 and name HA) 3.318 1.376 1.376 weight 1.000 ! spec=HNH, no=28, id=24, vol=1.620000e+07
assign (resid 26 and name HN) (resid 25 and name HB2) 3.134 1.228 1.228 weight 1.000 ! spec=HNH, no=29, id=25, vol=2.290000e+07
assign (resid 26 and name HN) (resid 25 and name HB1) 3.423 1.464 1.464 weight 1.000 ! spec=HNH, no=30, id=26, vol=1.350000e+07
assign (resid 26 and name HN) (resid 25 and name HD2) 3.303 1.364 1.364 weight 1.000 ! spec=HNH, no=31, id=27, vol=1.670000e+07
assign (resid 26 and name HN) (resid 25 and name HD1) 3.380 1.428 1.428 weight 1.000 ! spec=HNH, no=32, id=28, vol=1.450000e+07
assign (resid 26 and name HN) (resid 25 and name HG2) 3.663 1.678 1.678 weight 1.000 ! spec=HNH, no=33, id=29, vol=8.960000e+06
assign (resid 26 and name HN) (resid 26 and name HA) 2.896 1.048 1.048 weight 1.000 ! spec=HNH, no=35, id=30, vol=3.670000e+07
assign (resid 26 and name HN) (resid 26 and name HB2) 3.361 1.412 1.412 weight 1.000 ! spec=HNH, no=36, id=31, vol=1.500000e+07
assign (resid 26 and name HN) (resid 29 and name HN) 3.427 1.468 1.468 weight 1.000 ! spec=HNH, no=37, id=32, vol=1.340000e+07
assign (resid 26 and name HN) (resid 29 and name HD1) 2.746 0.943 0.943 weight 1.000 ! spec=HNH, no=38, id=33, vol=5.050000e+07
assign (resid 26 and name HN) (resid 29 and name HB2) 3.211 1.289 1.289 weight 1.000 ! spec=HNH, no=40, id=35, vol=1.980000e+07
assign (resid 28 and name HN) (resid 27 and name HA) 3.809 1.813 1.813 weight 1.000 ! spec=HNH, no=43, id=38, vol=7.090000e+06
assign (resid 28 and name HN) (resid 28 and name HA) 3.364 1.415 1.415 weight 1.000 ! spec=HNH, no=45, id=40, vol=1.490000e+07
assign (resid 28 and name HN) (resid 28 and name HG21) 3.744 1.752 1.752 weight 1.000 ! spec=HNH, no=47, id=42, vol=7.860000e+06
or (resid 28 and name HN) (resid 28 and name HG22)
or (resid 28 and name HN) (resid 28 and name HG23)
assign (resid 28 and name HN) (resid 28 and name HB) 3.307 1.367 1.367 weight 1.000 ! spec=HNH, no=48, id=43, vol=1.660000e+07
assign (resid 28 and name HN) (resid 29 and name HN) 3.441 1.480 1.480 weight 1.000 ! spec=HNH, no=49, id=44, vol=1.310000e+07
assign (resid 29 and name HN) (resid 29 and name HE3) 3.838 1.842 1.842 weight 1.000 ! spec=HNH, no=54, id=49, vol=6.770000e+06
assign (resid 29 and name HN) (resid 27 and name HA) 3.442 1.481 1.481 weight 1.000 ! spec=HNH, no=57, id=52, vol=1.300000e+07
assign (resid 29 and name HN) (resid 24 and name HB2) 3.418 1.460 1.460 weight 1.000 ! spec=HNH, no=62, id=57, vol=1.360000e+07
assign (resid 29 and name HN) (resid 24 and name HB1) 3.374 1.423 1.423 weight 1.000 ! spec=HNH, no=63, id=58, vol=1.470000e+07
assign (resid 29 and name HN) (resid 29 and name HA) 3.028 1.146 1.146 weight 1.000 ! spec=HNH, no=68, id=62, vol=2.810000e+07
assign (resid 29 and name HN) (resid 29 and name HE1) 3.830 1.834 1.834 weight 1.000 ! spec=HNH, no=69, id=63, vol=6.860000e+06
assign (resid 29 and name HN) (resid 29 and name HB2) 2.680 0.898 0.898 weight 1.000 ! spec=HNH, no=70, id=64, vol=5.850000e+07
assign (resid 29 and name HN) (resid 30 and name HN) 3.681 1.694 1.694 weight 1.000 ! spec=HNH, no=71, id=65, vol=8.710000e+06
assign (resid 29 and name HN) (resid 37 and name HN) 4.226 2.232 2.232 weight 1.000 ! spec=HNH, no=73, id=67, vol=3.800000e+06
assign (resid 29 and name HN) (resid 38 and name HD12) 3.697 1.708 1.708 weight 1.000 ! spec=HNH, no=75, id=69, vol=8.490000e+06
or (resid 29 and name HN) (resid 38 and name HD11)
or (resid 29 and name HN) (resid 38 and name HD13)
assign (resid 29 and name HE1) (resid 26 and name HB1) 4.127 2.129 2.129 weight 1.000 ! spec=HNH, no=80, id=74, vol=4.390000e+06
assign (resid 29 and name HE1) (resid 29 and name HE3) 4.308 2.320 2.320 weight 1.000 ! spec=HNH, no=84, id=78, vol=3.390000e+06
assign (resid 29 and name HE1) (resid 26 and name HA) 3.853 1.856 1.856 weight 1.000 ! spec=HNH, no=85, id=79, vol=6.620000e+06
assign (resid 29 and name HE1) (resid 25 and name HD2) 3.849 1.852 1.852 weight 1.000 ! spec=HNH, no=86, id=80, vol=6.660000e+06
assign (resid 29 and name HE1) (resid 25 and name HB2) 3.045 1.159 1.159 weight 1.000 ! spec=HNH, no=87, id=81, vol=2.720000e+07
assign (resid 29 and name HE1) (resid 25 and name HB1) 3.341 1.395 1.395 weight 1.000 ! spec=HNH, no=88, id=82, vol=1.560000e+07
assign (resid 29 and name HE1) (resid 25 and name HD1) 4.306 2.318 2.318 weight 1.000 ! spec=HNH, no=89, id=83, vol=3.400000e+06
assign (resid 29 and name HE1) (resid 25 and name HG2) 3.469 1.504 1.504 weight 1.000 ! spec=HNH, no=90, id=84, vol=1.240000e+07
assign (resid 26 and name HN) (resid 29 and name HE1) 3.556 1.580 1.580 weight 1.000 ! spec=HNH, no=92, id=86, vol=1.070000e+07
assign (resid 29 and name HE1) (resid 29 and name HZ3) 3.953 1.953 1.953 weight 1.000 ! spec=HNH, no=96, id=89, vol=5.680000e+06
assign (resid 29 and name HE1) (resid 29 and name HB2) 4.007 2.007 2.007 weight 1.000 ! spec=HNH, no=97, id=90, vol=5.240000e+06
assign (resid 29 and name HE1) (resid 38 and name HG12) 4.106 2.107 2.107 weight 1.000 ! spec=HNH, no=98, id=91, vol=4.520000e+06
assign (resid 29 and name HE1) (resid 38 and name HD12) 2.956 1.092 1.092 weight 1.000 ! spec=HNH, no=99, id=92, vol=3.250000e+07
or (resid 29 and name HE1) (resid 38 and name HD11)
or (resid 29 and name HE1) (resid 38 and name HD13)
assign (resid 29 and name HE1) (resid 38 and name HG22) 3.790 1.795 1.795 weight 1.000 ! spec=HNH, no=100, id=93, vol=7.310000e+06
or (resid 29 and name HE1) (resid 38 and name HG21)
or (resid 29 and name HE1) (resid 38 and name HG23)
assign (resid 29 and name HE1) (resid 40 and name HD12) 4.235 2.242 2.242 weight 1.000 ! spec=HNH, no=101, id=94, vol=3.750000e+06
or (resid 29 and name HE1) (resid 40 and name HD11)
or (resid 29 and name HE1) (resid 40 and name HD13)
assign (resid 29 and name HE1) (resid 59 and name HB2) 4.094 2.095 2.095 weight 1.000 ! spec=HNH, no=102, id=95, vol=4.600000e+06
assign (resid 30 and name HN) (resid 37 and name HB2) 3.667 1.680 1.680 weight 1.000 ! spec=HNH, no=103, id=96, vol=8.920000e+06
assign (resid 30 and name HN) (resid 152 and name HD12) 3.660 1.675 1.675 weight 1.000 ! spec=HNH, no=104, id=97, vol=9.010000e+06
or (resid 30 and name HN) (resid 152 and name HD11)
or (resid 30 and name HN) (resid 152 and name HD13)
assign (resid 30 and name HN) (resid 30 and name HG12) 3.387 1.434 1.434 weight 1.000 ! spec=HNH, no=105, id=98, vol=1.440000e+07
assign (resid 30 and name HN) (resid 30 and name HB) 2.897 1.049 1.049 weight 1.000 ! spec=HNH, no=108, id=101, vol=3.660000e+07
assign (resid 30 and name HN) (resid 29 and name HB2) 2.941 1.082 1.082 weight 1.000 ! spec=HNH, no=112, id=105, vol=3.340000e+07
or (resid 30 and name HN) (resid 29 and name HB1)
assign (resid 30 and name HN) (resid 24 and name HB1) 3.941 1.941 1.941 weight 1.000 ! spec=HNH, no=117, id=110, vol=5.780000e+06
assign (resid 30 and name HN) (resid 29 and name HD1) 4.266 2.274 2.274 weight 1.000 ! spec=HNH, no=118, id=111, vol=3.600000e+06
assign (resid 30 and name HN) (resid 29 and name HE3) 3.736 1.744 1.744 weight 1.000 ! spec=HNH, no=119, id=112, vol=7.970000e+06
assign (resid 30 and name HN) (resid 30 and name HA) 3.215 1.292 1.292 weight 1.000 ! spec=HNH, no=121, id=113, vol=1.960000e+07
assign (resid 30 and name HN) (resid 36 and name HA) 3.856 1.858 1.858 weight 1.000 ! spec=HNH, no=124, id=116, vol=6.590000e+06
assign (resid 30 and name HN) (resid 37 and name HN) 3.038 1.154 1.154 weight 1.000 ! spec=HNH, no=125, id=117, vol=2.760000e+07
assign (resid 30 and name HN) (resid 38 and name HA) 3.783 1.789 1.789 weight 1.000 ! spec=HNH, no=126, id=118, vol=7.390000e+06
assign (resid 30 and name HN) (resid 38 and name HB) 3.937 1.937 1.937 weight 1.000 ! spec=HNH, no=127, id=119, vol=5.820000e+06
assign (resid 30 and name HN) (resid 38 and name HG22) 4.297 2.308 2.308 weight 1.000 ! spec=HNH, no=129, id=121, vol=3.440000e+06
or (resid 30 and name HN) (resid 38 and name HG21)
or (resid 30 and name HN) (resid 38 and name HG23)
assign (resid 30 and name HN) (resid 78 and name HG21) 4.145 2.148 2.148 weight 1.000 ! spec=HNH, no=130, id=122, vol=4.270000e+06
or (resid 30 and name HN) (resid 78 and name HG22)
or (resid 30 and name HN) (resid 78 and name HG23)
assign (resid 31 and name HN) (resid 30 and name HG11) 3.527 1.555 1.555 weight 1.000 ! spec=HNH, no=141, id=132, vol=1.130000e+07
assign (resid 30 and name HN) (resid 31 and name HN) 3.524 1.553 1.553 weight 1.000 ! spec=HNH, no=145, id=136, vol=1.130000e+07
assign (resid 31 and name HN) (resid 30 and name HA) 2.250 0.633 0.633 weight 1.000 ! spec=HNH, no=146, id=137, vol=1.670000e+08
assign (resid 31 and name HN) (resid 30 and name HG12) 3.370 1.420 1.420 weight 1.000 ! spec=HNH, no=147, id=138, vol=1.480000e+07
assign (resid 31 and name HN) (resid 31 and name HA) 2.950 1.088 1.088 weight 1.000 ! spec=HNH, no=151, id=141, vol=3.290000e+07
assign (resid 31 and name HN) (resid 31 and name HB2) 2.362 0.697 0.697 weight 1.000 ! spec=HNH, no=152, id=142, vol=1.250000e+08
assign (resid 31 and name HN) (resid 32 and name HN) 3.182 1.266 1.266 weight 1.000 ! spec=HNH, no=153, id=143, vol=2.090000e+07
assign (resid 31 and name HN) (resid 36 and name HA) 4.108 2.109 2.109 weight 1.000 ! spec=HNH, no=154, id=144, vol=4.510000e+06
assign (resid 31 and name HN) (resid 37 and name HD1) 4.222 2.228 2.228 weight 1.000 ! spec=HNH, no=156, id=146, vol=3.830000e+06
assign (resid 31 and name HE21) (resid 33 and name HN) 4.084 2.085 2.085 weight 1.000 ! spec=HNH, no=158, id=148, vol=4.670000e+06
assign (resid 31 and name HE21) (resid 32 and name HN) 4.038 2.038 2.038 weight 1.000 ! spec=HNH, no=159, id=149, vol=5.000000e+06
assign (resid 31 and name HE21) (resid 34 and name HA) 3.312 1.371 1.371 weight 1.000 ! spec=HNH, no=161, id=151, vol=1.640000e+07
assign (resid 31 and name HE22) (resid 35 and name HN) 4.323 2.336 2.336 weight 1.000 ! spec=HNH, no=172, id=161, vol=3.320000e+06
assign (resid 31 and name HE22) (resid 23 and name HB1) 3.714 1.724 1.724 weight 1.000 ! spec=HNH, no=173, id=162, vol=8.260000e+06
assign (resid 31 and name HN) (resid 31 and name HE21) 4.234 2.241 2.241 weight 1.000 ! spec=HNH, no=174, id=163, vol=3.760000e+06
assign (resid 31 and name HE21) (resid 31 and name HA) 4.049 2.049 2.049 weight 1.000 ! spec=HNH, no=175, id=164, vol=4.920000e+06
assign (resid 31 and name HE22) (resid 31 and name HA) 4.589 2.632 2.632 weight 1.000 ! spec=HNH, no=176, id=165, vol=2.320000e+06
assign (resid 31 and name HE21) (resid 31 and name HG2) 2.792 0.974 0.974 weight 1.000 ! spec=HNH, no=179, id=166, vol=4.580000e+07
assign (resid 31 and name HE22) (resid 31 and name HG2) 3.105 1.205 1.205 weight 1.000 ! spec=HNH, no=180, id=167, vol=2.420000e+07
assign (resid 31 and name HE21) (resid 31 and name HG1) 2.942 1.082 1.082 weight 1.000 ! spec=HNH, no=181, id=168, vol=3.340000e+07
assign (resid 31 and name HE22) (resid 31 and name HG1) 3.055 1.167 1.167 weight 1.000 ! spec=HNH, no=182, id=169, vol=2.670000e+07
assign (resid 31 and name HE21) (resid 31 and name HB2) 2.967 1.100 1.100 weight 1.000 ! spec=HNH, no=183, id=170, vol=3.180000e+07
assign (resid 31 and name HE22) (resid 31 and name HB2) 3.432 1.472 1.472 weight 1.000 ! spec=HNH, no=184, id=171, vol=1.330000e+07
assign (resid 31 and name HE21) (resid 157 and name HG12) 3.907 1.908 1.908 weight 1.000 ! spec=HNH, no=186, id=173, vol=6.090000e+06
assign (resid 31 and name HE22) (resid 157 and name HG12) 4.108 2.109 2.109 weight 1.000 ! spec=HNH, no=187, id=174, vol=4.510000e+06
assign (resid 31 and name HE21) (resid 157 and name HD12) 2.800 0.980 0.980 weight 1.000 ! spec=HNH, no=188, id=175, vol=4.490000e+07
or (resid 31 and name HE21) (resid 157 and name HD11)
or (resid 31 and name HE21) (resid 157 and name HD13)
assign (resid 31 and name HE22) (resid 157 and name HD12) 3.055 1.167 1.167 weight 1.000 ! spec=HNH, no=189, id=176, vol=2.660000e+07
or (resid 31 and name HE22) (resid 157 and name HD11)
or (resid 31 and name HE22) (resid 157 and name HD13)
assign (resid 32 and name HN) (resid 74 and name HZ) 4.231 2.237 2.237 weight 1.000 ! spec=HNH, no=190, id=177, vol=3.780000e+06
assign (resid 32 and name HN) (resid 35 and name HB1) 3.897 1.898 1.898 weight 1.000 ! spec=HNH, no=193, id=178, vol=6.190000e+06
assign (resid 32 and name HN) (resid 32 and name HD1) 3.654 1.669 1.669 weight 1.000 ! spec=HNH, no=198, id=183, vol=9.100000e+06
or (resid 32 and name HN) (resid 32 and name HD2)
assign (resid 32 and name HN) (resid 33 and name HB2) 3.814 1.818 1.818 weight 1.000 ! spec=HNH, no=203, id=186, vol=7.040000e+06
or (resid 32 and name HN) (resid 33 and name HB1)
assign (resid 32 and name HN) (resid 33 and name HG1) 4.229 2.236 2.236 weight 1.000 ! spec=HNH, no=204, id=187, vol=3.790000e+06
assign (resid 32 and name HN) (resid 35 and name HA) 3.724 1.733 1.733 weight 1.000 ! spec=HNH, no=212, id=194, vol=8.120000e+06
assign (resid 32 and name HN) (resid 31 and name HA) 2.343 0.686 0.686 weight 1.000 ! spec=HNH, no=218, id=200, vol=1.310000e+08
assign (resid 32 and name HN) (resid 31 and name HG1) 2.883 1.039 1.039 weight 1.000 ! spec=HNH, no=219, id=201, vol=3.770000e+07
assign (resid 32 and name HN) (resid 32 and name HB2) 3.207 1.286 1.286 weight 1.000 ! spec=HNH, no=222, id=203, vol=1.990000e+07
assign (resid 32 and name HN) (resid 32 and name HB1) 2.673 0.893 0.893 weight 1.000 ! spec=HNH, no=223, id=204, vol=5.930000e+07
assign (resid 32 and name HN) (resid 36 and name HA) 3.210 1.288 1.288 weight 1.000 ! spec=HNH, no=226, id=207, vol=1.980000e+07
assign (resid 32 and name HN) (resid 37 and name HN) 3.792 1.798 1.798 weight 1.000 ! spec=HNH, no=227, id=208, vol=7.280000e+06
assign (resid 32 and name HN) (resid 37 and name HD1) 3.163 1.251 1.251 weight 1.000 ! spec=HNH, no=228, id=209, vol=2.160000e+07
assign (resid 32 and name HN) (resid 37 and name HE1) 2.937 1.078 1.078 weight 1.000 ! spec=HNH, no=229, id=210, vol=3.370000e+07
assign (resid 33 and name HN) (resid 32 and name HB2) 3.174 1.259 1.259 weight 1.000 ! spec=HNH, no=234, id=215, vol=2.120000e+07
assign (resid 32 and name HN) (resid 33 and name HN) 3.467 1.503 1.503 weight 1.000 ! spec=HNH, no=236, id=217, vol=1.250000e+07
assign (resid 33 and name HN) (resid 33 and name HB2) 2.884 1.039 1.039 weight 1.000 ! spec=HNH, no=240, id=221, vol=3.770000e+07
or (resid 33 and name HN) (resid 33 and name HB1)
assign (resid 33 and name HN) (resid 33 and name HE22) 4.224 2.230 2.230 weight 1.000 ! spec=HNH, no=245, id=226, vol=3.810000e+06
assign (resid 33 and name HN) (resid 32 and name HA) 2.378 0.707 0.707 weight 1.000 ! spec=HNH, no=246, id=227, vol=1.200000e+08
assign (resid 33 and name HN) (resid 33 and name HA) 2.317 0.671 0.671 weight 1.000 ! spec=HNH, no=249, id=229, vol=1.400000e+08
assign (resid 33 and name HN) (resid 33 and name HG2) 2.882 1.038 1.038 weight 1.000 ! spec=HNH, no=251, id=231, vol=3.780000e+07
assign (resid 33 and name HN) (resid 33 and name HG1) 2.927 1.071 1.071 weight 1.000 ! spec=HNH, no=252, id=232, vol=3.440000e+07
assign (resid 33 and name HE21) (resid 71 and name HN) 4.042 2.042 2.042 weight 1.000 ! spec=HNH, no=254, id=234, vol=4.970000e+06
assign (resid 33 and name HE21) (resid 70 and name HB1) 3.274 1.340 1.340 weight 1.000 ! spec=HNH, no=259, id=239, vol=1.760000e+07
assign (resid 33 and name HE21) (resid 70 and name HG1) 3.783 1.789 1.789 weight 1.000 ! spec=HNH, no=260, id=240, vol=7.390000e+06
assign (resid 33 and name HE21) (resid 33 and name HB2) 3.229 1.303 1.303 weight 1.000 ! spec=HNH, no=264, id=244, vol=1.910000e+07
or (resid 33 and name HE21) (resid 33 and name HB1)
assign (resid 33 and name HE22) (resid 70 and name HG1) 3.648 1.664 1.664 weight 1.000 ! spec=HNH, no=266, id=246, vol=9.190000e+06
assign (resid 33 and name HE22) (resid 70 and name HB1) 3.184 1.267 1.267 weight 1.000 ! spec=HNH, no=267, id=247, vol=2.080000e+07
assign (resid 33 and name HE22) (resid 70 and name HB2) 3.407 1.451 1.451 weight 1.000 ! spec=HNH, no=268, id=248, vol=1.380000e+07
assign (resid 33 and name HE22) (resid 33 and name HB2) 3.489 1.522 1.522 weight 1.000 ! spec=HNH, no=270, id=250, vol=1.200000e+07
or (resid 33 and name HE22) (resid 33 and name HB1)
assign (resid 33 and name HE22) (resid 71 and name HN) 3.657 1.672 1.672 weight 1.000 ! spec=HNH, no=272, id=252, vol=9.050000e+06
assign (resid 33 and name HE22) (resid 70 and name HN) 3.768 1.775 1.775 weight 1.000 ! spec=HNH, no=273, id=253, vol=7.570000e+06
assign (resid 33 and name HN) (resid 33 and name HE21) 3.735 1.744 1.744 weight 1.000 ! spec=HNH, no=276, id=256, vol=7.980000e+06
assign (resid 33 and name HE21) (resid 33 and name HE22) 1.739 0.378 0.378 weight 1.000 ! spec=HNH, no=278, id=257, vol=7.820000e+08
assign (resid 33 and name HE21) (resid 33 and name HG2) 2.845 1.012 1.012 weight 1.000 ! spec=HNH, no=280, id=258, vol=4.080000e+07
assign (resid 33 and name HE22) (resid 33 and name HG2) 3.131 1.225 1.225 weight 1.000 ! spec=HNH, no=281, id=259, vol=2.300000e+07
assign (resid 33 and name HE21) (resid 33 and name HG1) 2.791 0.973 0.973 weight 1.000 ! spec=HNH, no=282, id=260, vol=4.590000e+07
assign (resid 33 and name HE22) (resid 33 and name HG1) 3.075 1.182 1.182 weight 1.000 ! spec=HNH, no=283, id=261, vol=2.560000e+07
assign (resid 33 and name HE21) (resid 71 and name HA) 4.253 2.261 2.261 weight 1.000 ! spec=HNH, no=284, id=262, vol=3.660000e+06
assign (resid 33 and name HE22) (resid 71 and name HA) 4.399 2.419 2.419 weight 1.000 ! spec=HNH, no=285, id=263, vol=2.990000e+06
assign (resid 35 and name HN) (resid 33 and name HN) 3.832 1.836 1.836 weight 1.000 ! spec=HNH, no=289, id=267, vol=6.840000e+06
assign (resid 35 and name HN) (resid 157 and name HN) 3.750 1.758 1.758 weight 1.000 ! spec=HNH, no=291, id=269, vol=7.790000e+06
assign (resid 35 and name HN) (resid 32 and name HA) 3.788 1.794 1.794 weight 1.000 ! spec=HNH, no=295, id=273, vol=7.330000e+06
assign (resid 35 and name HN) (resid 37 and name HE1) 3.446 1.485 1.485 weight 1.000 ! spec=HNH, no=297, id=275, vol=1.290000e+07
or (resid 35 and name HN) (resid 37 and name HE2)
assign (resid 35 and name HN) (resid 32 and name HB1) 3.744 1.752 1.752 weight 1.000 ! spec=HNH, no=298, id=276, vol=7.870000e+06
assign (resid 35 and name HN) (resid 32 and name HD1) 4.049 2.049 2.049 weight 1.000 ! spec=HNH, no=300, id=278, vol=4.920000e+06
or (resid 35 and name HN) (resid 32 and name HD2)
assign (resid 35 and name HN) (resid 33 and name HB2) 3.108 1.208 1.208 weight 1.000 ! spec=HNH, no=302, id=280, vol=2.400000e+07
or (resid 35 and name HN) (resid 33 and name HB1)
assign (resid 31 and name HE21) (resid 35 and name HN) 3.642 1.658 1.658 weight 1.000 ! spec=HNH, no=304, id=282, vol=9.290000e+06
assign (resid 35 and name HN) (resid 31 and name HA) 3.817 1.821 1.821 weight 1.000 ! spec=HNH, no=306, id=284, vol=7.010000e+06
assign (resid 32 and name HN) (resid 35 and name HN) 2.995 1.121 1.121 weight 1.000 ! spec=HNH, no=307, id=285, vol=3.000000e+07
assign (resid 35 and name HN) (resid 34 and name HA) 2.783 0.968 0.968 weight 1.000 ! spec=HNH, no=308, id=286, vol=4.660000e+07
assign (resid 35 and name HN) (resid 34 and name HB2) 3.264 1.332 1.332 weight 1.000 ! spec=HNH, no=309, id=287, vol=1.790000e+07
assign (resid 35 and name HN) (resid 35 and name HA) 2.970 1.102 1.102 weight 1.000 ! spec=HNH, no=311, id=288, vol=3.160000e+07
assign (resid 35 and name HN) (resid 35 and name HB1) 2.886 1.041 1.041 weight 1.000 ! spec=HNH, no=313, id=290, vol=3.750000e+07
assign (resid 35 and name HN) (resid 36 and name HA) 4.451 2.476 2.476 weight 1.000 ! spec=HNH, no=315, id=292, vol=2.790000e+06
assign (resid 35 and name HN) (resid 154 and name HG1) 4.100 2.102 2.102 weight 1.000 ! spec=HNH, no=317, id=294, vol=4.560000e+06
assign (resid 35 and name HN) (resid 157 and name HG12) 4.020 2.020 2.020 weight 1.000 ! spec=HNH, no=318, id=295, vol=5.130000e+06
assign (resid 35 and name HN) (resid 157 and name HG11) 3.686 1.698 1.698 weight 1.000 ! spec=HNH, no=319, id=296, vol=8.640000e+06
assign (resid 35 and name HN) (resid 36 and name HN) 3.969 1.969 1.969 weight 1.000 ! spec=HNH, no=322, id=299, vol=5.540000e+06
assign (resid 36 and name HN) (resid 154 and name HG1) 3.745 1.753 1.753 weight 1.000 ! spec=HNH, no=325, id=302, vol=7.850000e+06
assign (resid 36 and name HN) (resid 31 and name HG1) 4.237 2.244 2.244 weight 1.000 ! spec=HNH, no=337, id=314, vol=3.750000e+06
assign (resid 36 and name HN) (resid 31 and name HB2) 4.233 2.240 2.240 weight 1.000 ! spec=HNH, no=338, id=315, vol=3.770000e+06
assign (resid 36 and name HN) (resid 35 and name HA) 2.555 0.816 0.816 weight 1.000 ! spec=HNH, no=339, id=316, vol=7.790000e+07
assign (resid 36 and name HN) (resid 35 and name HB1) 3.160 1.248 1.248 weight 1.000 ! spec=HNH, no=341, id=318, vol=2.180000e+07
assign (resid 36 and name HN) (resid 36 and name HB2) 2.929 1.073 1.073 weight 1.000 ! spec=HNH, no=344, id=320, vol=3.430000e+07
assign (resid 36 and name HN) (resid 36 and name HB1) 3.084 1.189 1.189 weight 1.000 ! spec=HNH, no=345, id=321, vol=2.520000e+07
assign (resid 36 and name HN) (resid 37 and name HA) 3.976 1.976 1.976 weight 1.000 ! spec=HNH, no=347, id=323, vol=5.480000e+06
assign (resid 36 and name HN) (resid 37 and name HD1) 4.352 2.367 2.367 weight 1.000 ! spec=HNH, no=348, id=324, vol=3.190000e+06
assign (resid 36 and name HN) (resid 155 and name HG21) 2.995 1.121 1.121 weight 1.000 ! spec=HNH, no=350, id=326, vol=3.000000e+07
or (resid 36 and name HN) (resid 155 and name HG22)
or (resid 36 and name HN) (resid 155 and name HG23)
assign (resid 36 and name HN) (resid 156 and name HN) 4.112 2.114 2.114 weight 1.000 ! spec=HNH, no=351, id=327, vol=4.480000e+06
assign (resid 36 and name HN) (resid 156 and name HA) 3.248 1.319 1.319 weight 1.000 ! spec=HNH, no=352, id=328, vol=1.840000e+07
assign (resid 37 and name HN) (resid 37 and name HB2) 3.139 1.231 1.231 weight 1.000 ! spec=HNH, no=356, id=331, vol=2.270000e+07
assign (resid 31 and name HN) (resid 37 and name HN) 4.228 2.235 2.235 weight 1.000 ! spec=HNH, no=362, id=335, vol=3.790000e+06
assign (resid 37 and name HN) (resid 38 and name HA) 4.344 2.359 2.359 weight 1.000 ! spec=HNH, no=367, id=339, vol=3.220000e+06
assign (resid 37 and name HN) (resid 38 and name HB) 4.211 2.217 2.217 weight 1.000 ! spec=HNH, no=368, id=340, vol=3.880000e+06
assign (resid 37 and name HN) (resid 29 and name HE3) 3.340 1.394 1.394 weight 1.000 ! spec=HNH, no=372, id=344, vol=1.560000e+07
assign (resid 37 and name HN) (resid 30 and name HA) 4.222 2.228 2.228 weight 1.000 ! spec=HNH, no=374, id=346, vol=3.830000e+06
assign (resid 37 and name HN) (resid 30 and name HB) 3.645 1.661 1.661 weight 1.000 ! spec=HNH, no=375, id=347, vol=9.230000e+06
assign (resid 37 and name HN) (resid 30 and name HG12) 4.104 2.106 2.106 weight 1.000 ! spec=HNH, no=376, id=348, vol=4.530000e+06
assign (resid 37 and name HN) (resid 30 and name HD12) 3.656 1.671 1.671 weight 1.000 ! spec=HNH, no=377, id=349, vol=9.070000e+06
or (resid 37 and name HN) (resid 30 and name HD11)
or (resid 37 and name HN) (resid 30 and name HD13)
assign (resid 37 and name HN) (resid 31 and name HA) 3.487 1.520 1.520 weight 1.000 ! spec=HNH, no=379, id=351, vol=1.210000e+07
assign (resid 36 and name HN) (resid 37 and name HN) 3.715 1.726 1.726 weight 1.000 ! spec=HNH, no=380, id=352, vol=8.230000e+06
assign (resid 37 and name HN) (resid 36 and name HA) 2.595 0.842 0.842 weight 1.000 ! spec=HNH, no=381, id=353, vol=7.100000e+07
assign (resid 37 and name HN) (resid 36 and name HB2) 3.458 1.495 1.495 weight 1.000 ! spec=HNH, no=382, id=354, vol=1.270000e+07
assign (resid 37 and name HN) (resid 37 and name HB1) 2.959 1.094 1.094 weight 1.000 ! spec=HNH, no=384, id=355, vol=3.230000e+07
assign (resid 37 and name HN) (resid 154 and name HB2) 4.413 2.435 2.435 weight 1.000 ! spec=HNH, no=389, id=360, vol=2.930000e+06
assign (resid 38 and name HN) (resid 37 and name HD1) 3.413 1.456 1.456 weight 1.000 ! spec=HNH, no=391, id=362, vol=1.370000e+07
or (resid 38 and name HN) (resid 37 and name HD2)
assign (resid 38 and name HN) (resid 40 and name HD12) 3.845 1.848 1.848 weight 1.000 ! spec=HNH, no=397, id=368, vol=6.700000e+06
or (resid 38 and name HN) (resid 40 and name HD11)
or (resid 38 and name HN) (resid 40 and name HD13)
assign (resid 38 and name HN) (resid 29 and name HZ3) 3.818 1.822 1.822 weight 1.000 ! spec=HNH, no=398, id=369, vol=7.000000e+06
assign (resid 37 and name HN) (resid 38 and name HN) 3.863 1.866 1.866 weight 1.000 ! spec=HNH, no=399, id=370, vol=6.520000e+06
assign (resid 38 and name HN) (resid 37 and name HA) 2.466 0.760 0.760 weight 1.000 ! spec=HNH, no=400, id=371, vol=9.630000e+07
assign (resid 38 and name HN) (resid 37 and name HB2) 3.080 1.186 1.186 weight 1.000 ! spec=HNH, no=401, id=372, vol=2.540000e+07
assign (resid 38 and name HN) (resid 37 and name HB1) 3.274 1.340 1.340 weight 1.000 ! spec=HNH, no=402, id=373, vol=1.760000e+07
assign (resid 38 and name HN) (resid 38 and name HB) 3.205 1.284 1.284 weight 1.000 ! spec=HNH, no=404, id=374, vol=2.000000e+07
assign (resid 38 and name HN) (resid 38 and name HG22) 2.655 0.881 0.881 weight 1.000 ! spec=HNH, no=405, id=375, vol=6.190000e+07
or (resid 38 and name HN) (resid 38 and name HG21)
or (resid 38 and name HN) (resid 38 and name HG23)
assign (resid 38 and name HN) (resid 152 and name HA) 3.560 1.584 1.584 weight 1.000 ! spec=HNH, no=406, id=376, vol=1.060000e+07
assign (resid 38 and name HN) (resid 153 and name HN) 2.795 0.977 0.977 weight 1.000 ! spec=HNH, no=409, id=379, vol=4.540000e+07
assign (resid 38 and name HN) (resid 153 and name HB2) 3.432 1.472 1.472 weight 1.000 ! spec=HNH, no=410, id=380, vol=1.330000e+07
assign (resid 38 and name HN) (resid 154 and name HA) 3.207 1.286 1.286 weight 1.000 ! spec=HNH, no=411, id=381, vol=1.990000e+07
assign (resid 39 and name HN) (resid 152 and name HB2) 4.065 2.066 2.066 weight 1.000 ! spec=HNH, no=422, id=391, vol=4.800000e+06
assign (resid 40 and name HN) (resid 38 and name HG22) 3.668 1.682 1.682 weight 1.000 ! spec=HNH, no=427, id=395, vol=8.890000e+06
or (resid 40 and name HN) (resid 38 and name HG21)
or (resid 40 and name HN) (resid 38 and name HG23)
assign (resid 40 and name HN) (resid 40 and name HA) 2.917 1.064 1.064 weight 1.000 ! spec=HNH, no=435, id=402, vol=3.510000e+07
assign (resid 40 and name HN) (resid 152 and name HA) 2.923 1.068 1.068 weight 1.000 ! spec=HNH, no=441, id=408, vol=3.470000e+07
assign (resid 41 and name HN) (resid 39 and name HB2) 3.584 1.606 1.606 weight 1.000 ! spec=HNH, no=443, id=410, vol=1.020000e+07
assign (resid 41 and name HN) (resid 41 and name HE22) 4.083 2.084 2.084 weight 1.000 ! spec=HNH, no=445, id=412, vol=4.670000e+06
assign (resid 41 and name HN) (resid 40 and name HN) 3.363 1.414 1.414 weight 1.000 ! spec=HNH, no=446, id=413, vol=1.500000e+07
assign (resid 41 and name HN) (resid 40 and name HA) 2.296 0.659 0.659 weight 1.000 ! spec=HNH, no=447, id=414, vol=1.480000e+08
assign (resid 41 and name HN) (resid 40 and name HB1) 3.307 1.367 1.367 weight 1.000 ! spec=HNH, no=449, id=416, vol=1.660000e+07
assign (resid 41 and name HN) (resid 40 and name HD22) 3.666 1.680 1.680 weight 1.000 ! spec=HNH, no=451, id=418, vol=8.920000e+06
or (resid 41 and name HN) (resid 40 and name HD21)
or (resid 41 and name HN) (resid 40 and name HD23)
assign (resid 41 and name HN) (resid 41 and name HB2) 2.723 0.927 0.927 weight 1.000 ! spec=HNH, no=452, id=419, vol=5.310000e+07
assign (resid 41 and name HN) (resid 41 and name HB1) 2.738 0.937 0.937 weight 1.000 ! spec=HNH, no=453, id=420, vol=5.140000e+07
assign (resid 41 and name HN) (resid 41 and name HG2) 2.894 1.047 1.047 weight 1.000 ! spec=HNH, no=454, id=421, vol=3.690000e+07
assign (resid 41 and name HN) (resid 41 and name HG1) 2.738 0.937 0.937 weight 1.000 ! spec=HNH, no=455, id=422, vol=5.140000e+07
assign (resid 41 and name HN) (resid 42 and name HN) 2.957 1.093 1.093 weight 1.000 ! spec=HNH, no=456, id=423, vol=3.240000e+07
assign (resid 41 and name HN) (resid 150 and name HA2) 3.656 1.671 1.671 weight 1.000 ! spec=HNH, no=457, id=424, vol=9.070000e+06
assign (resid 41 and name HE21) (resid 85 and name HA1) 4.285 2.295 2.295 weight 1.000 ! spec=HNH, no=459, id=426, vol=3.500000e+06
assign (resid 41 and name HE22) (resid 84 and name HG2) 4.023 2.023 2.023 weight 1.000 ! spec=HNH, no=471, id=438, vol=5.110000e+06
or (resid 41 and name HE22) (resid 84 and name HG1)
assign (resid 41 and name HE22) (resid 89 and name HG22) 4.310 2.322 2.322 weight 1.000 ! spec=HNH, no=475, id=442, vol=3.380000e+06
or (resid 41 and name HE22) (resid 89 and name HG21)
or (resid 41 and name HE22) (resid 89 and name HG23)
assign (resid 41 and name HE22) (resid 41 and name HA) 3.880 1.882 1.882 weight 1.000 ! spec=HNH, no=477, id=444, vol=6.350000e+06
assign (resid 41 and name HE21) (resid 40 and name HN) 4.219 2.225 2.225 weight 1.000 ! spec=HNH, no=478, id=445, vol=3.840000e+06
assign (resid 41 and name HE21) (resid 41 and name HN) 4.131 2.134 2.134 weight 1.000 ! spec=HNH, no=479, id=446, vol=4.360000e+06
assign (resid 41 and name HE21) (resid 41 and name HA) 3.837 1.841 1.841 weight 1.000 ! spec=HNH, no=480, id=447, vol=6.790000e+06
assign (resid 41 and name HE21) (resid 41 and name HB2) 3.288 1.352 1.352 weight 1.000 ! spec=HNH, no=481, id=448, vol=1.710000e+07
assign (resid 41 and name HE22) (resid 41 and name HB2) 3.374 1.423 1.423 weight 1.000 ! spec=HNH, no=482, id=449, vol=1.470000e+07
assign (resid 41 and name HE21) (resid 41 and name HG2) 2.755 0.949 0.949 weight 1.000 ! spec=HNH, no=487, id=452, vol=4.960000e+07
assign (resid 41 and name HE22) (resid 41 and name HG2) 3.182 1.266 1.266 weight 1.000 ! spec=HNH, no=488, id=453, vol=2.090000e+07
assign (resid 41 and name HE21) (resid 150 and name HA2) 4.055 2.055 2.055 weight 1.000 ! spec=HNH, no=490, id=455, vol=4.870000e+06
assign (resid 42 and name HN) (resid 42 and name HB1) 2.770 0.959 0.959 weight 1.000 ! spec=HNH, no=491, id=456, vol=4.800000e+07
assign (resid 42 and name HN) (resid 41 and name HA) 2.197 0.603 0.603 weight 1.000 ! spec=HNH, no=495, id=460, vol=1.930000e+08
assign (resid 42 and name HN) (resid 40 and name HD22) 3.930 1.931 1.931 weight 1.000 ! spec=HNH, no=500, id=465, vol=5.880000e+06
or (resid 42 and name HN) (resid 40 and name HD21)
or (resid 42 and name HN) (resid 40 and name HD23)
assign (resid 42 and name HN) (resid 42 and name HB2) 2.408 0.725 0.725 weight 1.000 ! spec=HNH, no=504, id=468, vol=1.110000e+08
assign (resid 42 and name HN) (resid 43 and name HN) 3.086 1.190 1.190 weight 1.000 ! spec=HNH, no=505, id=469, vol=2.510000e+07
assign (resid 42 and name HN) (resid 43 and name HA) 3.810 1.815 1.815 weight 1.000 ! spec=HNH, no=506, id=470, vol=7.080000e+06
assign (resid 42 and name HN) (resid 150 and name HA2) 3.065 1.174 1.174 weight 1.000 ! spec=HNH, no=508, id=472, vol=2.610000e+07
assign (resid 42 and name HN) (resid 150 and name HA1) 3.047 1.161 1.161 weight 1.000 ! spec=HNH, no=509, id=473, vol=2.710000e+07
assign (resid 43 and name HN) (resid 42 and name HB2) 3.046 1.160 1.160 weight 1.000 ! spec=HNH, no=510, id=474, vol=2.710000e+07
assign (resid 43 and name HN) (resid 42 and name HB1) 2.894 1.047 1.047 weight 1.000 ! spec=HNH, no=515, id=479, vol=3.690000e+07
assign (resid 43 and name HN) (resid 42 and name HA) 2.128 0.566 0.566 weight 1.000 ! spec=HNH, no=517, id=481, vol=2.330000e+08
assign (resid 43 and name HN) (resid 43 and name HA) 2.771 0.960 0.960 weight 1.000 ! spec=HNH, no=519, id=482, vol=4.780000e+07
assign (resid 43 and name HN) (resid 44 and name HN) 3.172 1.258 1.258 weight 1.000 ! spec=HNH, no=521, id=484, vol=2.130000e+07
assign (resid 43 and name HN) (resid 44 and name HG22) 3.503 1.534 1.534 weight 1.000 ! spec=HNH, no=522, id=485, vol=1.170000e+07
or (resid 43 and name HN) (resid 44 and name HG21)
or (resid 43 and name HN) (resid 44 and name HG23)
assign (resid 44 and name HN) (resid 149 and name HB1) 3.466 1.502 1.502 weight 1.000 ! spec=HNH, no=525, id=488, vol=1.250000e+07
assign (resid 44 and name HN) (resid 55 and name HE21) 3.804 1.809 1.809 weight 1.000 ! spec=HNH, no=530, id=493, vol=7.150000e+06
assign (resid 44 and name HN) (resid 43 and name HB2) 2.471 0.764 0.764 weight 1.000 ! spec=HNH, no=533, id=496, vol=9.510000e+07
or (resid 44 and name HN) (resid 43 and name HB1)
or (resid 44 and name HN) (resid 43 and name HB3)
assign (resid 44 and name HN) (resid 44 and name HA) 2.599 0.844 0.844 weight 1.000 ! spec=HNH, no=535, id=497, vol=7.030000e+07
assign (resid 44 and name HN) (resid 44 and name HG12) 2.515 0.791 0.791 weight 1.000 ! spec=HNH, no=537, id=499, vol=8.550000e+07
assign (resid 44 and name HN) (resid 44 and name HG11) 2.488 0.774 0.774 weight 1.000 ! spec=HNH, no=538, id=500, vol=9.140000e+07
assign (resid 45 and name HN) (resid 45 and name HE2) 4.169 2.173 2.173 weight 1.000 ! spec=HNH, no=547, id=509, vol=4.130000e+06
or (resid 45 and name HN) (resid 45 and name HE1)
assign (resid 45 and name HN) (resid 44 and name HN) 3.128 1.223 1.223 weight 1.000 ! spec=HNH, no=552, id=514, vol=2.310000e+07
assign (resid 45 and name HN) (resid 44 and name HA) 2.012 0.506 0.506 weight 1.000 ! spec=HNH, no=553, id=515, vol=3.270000e+08
assign (resid 45 and name HN) (resid 44 and name HB) 2.090 0.546 0.546 weight 1.000 ! spec=HNH, no=555, id=517, vol=2.600000e+08
assign (resid 45 and name HN) (resid 44 and name HG11) 2.865 1.026 1.026 weight 1.000 ! spec=HNH, no=557, id=519, vol=3.920000e+07
assign (resid 45 and name HN) (resid 45 and name HA) 2.161 0.584 0.584 weight 1.000 ! spec=HNH, no=561, id=522, vol=2.130000e+08
assign (resid 45 and name HN) (resid 45 and name HB2) 2.205 0.608 0.608 weight 1.000 ! spec=HNH, no=562, id=523, vol=1.890000e+08
assign (resid 45 and name HN) (resid 45 and name HB1) 2.090 0.546 0.546 weight 1.000 ! spec=HNH, no=563, id=524, vol=2.600000e+08
assign (resid 46 and name HN) (resid 51 and name HB2) 3.635 1.651 1.651 weight 1.000 ! spec=HNH, no=568, id=529, vol=9.400000e+06
assign (resid 46 and name HN) (resid 45 and name HG1) 3.247 1.318 1.318 weight 1.000 ! spec=HNH, no=575, id=536, vol=1.850000e+07
assign (resid 46 and name HN) (resid 45 and name HD2) 2.904 1.054 1.054 weight 1.000 ! spec=HNH, no=576, id=537, vol=3.610000e+07
assign (resid 46 and name HN) (resid 45 and name HE2) 3.764 1.771 1.771 weight 1.000 ! spec=HNH, no=577, id=538, vol=7.610000e+06
assign (resid 46 and name HN) (resid 46 and name HB) 2.726 0.929 0.929 weight 1.000 ! spec=HNH, no=580, id=540, vol=5.280000e+07
assign (resid 46 and name HN) (resid 47 and name HN) 3.624 1.641 1.641 weight 1.000 ! spec=HNH, no=582, id=542, vol=9.570000e+06
assign (resid 47 and name HN) (resid 51 and name HB1) 3.040 1.155 1.155 weight 1.000 ! spec=HNH, no=585, id=545, vol=2.750000e+07
assign (resid 47 and name HN) (resid 51 and name HB2) 3.126 1.222 1.222 weight 1.000 ! spec=HNH, no=591, id=551, vol=2.320000e+07
assign (resid 47 and name HN) (resid 45 and name HB1) 4.120 2.122 2.122 weight 1.000 ! spec=HNH, no=593, id=553, vol=4.430000e+06
assign (resid 47 and name HN) (resid 47 and name HA) 2.901 1.052 1.052 weight 1.000 ! spec=HNH, no=598, id=557, vol=3.640000e+07
assign (resid 47 and name HN) (resid 47 and name HB1) 2.614 0.854 0.854 weight 1.000 ! spec=HNH, no=600, id=559, vol=6.800000e+07
assign (resid 47 and name HN) (resid 48 and name HA) 3.683 1.696 1.696 weight 1.000 ! spec=HNH, no=602, id=561, vol=8.670000e+06
assign (resid 47 and name HN) (resid 48 and name HB2) 3.955 1.955 1.955 weight 1.000 ! spec=HNH, no=603, id=562, vol=5.660000e+06
assign (resid 48 and name HN) (resid 47 and name HA) 2.940 1.080 1.080 weight 1.000 ! spec=HNH, no=616, id=575, vol=3.360000e+07
assign (resid 48 and name HN) (resid 46 and name HA) 2.626 0.862 0.862 weight 1.000 ! spec=HNH, no=622, id=581, vol=6.610000e+07
assign (resid 47 and name HN) (resid 48 and name HN) 2.145 0.575 0.575 weight 1.000 ! spec=HNH, no=624, id=583, vol=2.220000e+08
assign (resid 48 and name HN) (resid 47 and name HB1) 2.682 0.899 0.899 weight 1.000 ! spec=HNH, no=626, id=585, vol=5.820000e+07
assign (resid 48 and name HN) (resid 48 and name HB2) 3.046 1.159 1.159 weight 1.000 ! spec=HNH, no=629, id=587, vol=2.710000e+07
assign (resid 48 and name HN) (resid 48 and name HB1) 3.136 1.229 1.229 weight 1.000 ! spec=HNH, no=630, id=588, vol=2.280000e+07
assign (resid 48 and name HN) (resid 51 and name HB1) 2.677 0.896 0.896 weight 1.000 ! spec=HNH, no=635, id=593, vol=5.890000e+07
assign (resid 49 and name HN) (resid 143 and name HN) 3.734 1.743 1.743 weight 1.000 ! spec=HNH, no=637, id=595, vol=8.000000e+06
assign (resid 49 and name HN) (resid 144 and name HG2) 2.605 0.848 0.848 weight 1.000 ! spec=HNH, no=639, id=597, vol=6.930000e+07
or (resid 49 and name HN) (resid 144 and name HG1)
assign (resid 49 and name HN) (resid 46 and name HG12) 3.062 1.172 1.172 weight 1.000 ! spec=HNH, no=641, id=599, vol=2.630000e+07
or (resid 49 and name HN) (resid 46 and name HG11)
or (resid 49 and name HN) (resid 46 and name HG13)
assign (resid 49 and name HN) (resid 105 and name HZ) 3.412 1.455 1.455 weight 1.000 ! spec=HNH, no=647, id=604, vol=1.370000e+07
assign (resid 49 and name HN) (resid 48 and name HN) 3.286 1.349 1.349 weight 1.000 ! spec=HNH, no=648, id=605, vol=1.720000e+07
assign (resid 49 and name HN) (resid 48 and name HA) 2.324 0.675 0.675 weight 1.000 ! spec=HNH, no=649, id=606, vol=1.370000e+08
assign (resid 49 and name HN) (resid 48 and name HB2) 2.752 0.947 0.947 weight 1.000 ! spec=HNH, no=650, id=607, vol=4.990000e+07
assign (resid 49 and name HN) (resid 49 and name HA) 2.584 0.835 0.835 weight 1.000 ! spec=HNH, no=652, id=608, vol=7.270000e+07
assign (resid 49 and name HN) (resid 49 and name HB) 2.328 0.677 0.677 weight 1.000 ! spec=HNH, no=653, id=609, vol=1.360000e+08
assign (resid 49 and name HN) (resid 52 and name HG12) 3.038 1.153 1.153 weight 1.000 ! spec=HNH, no=660, id=616, vol=2.760000e+07
or (resid 49 and name HN) (resid 52 and name HG11)
or (resid 49 and name HN) (resid 52 and name HG13)
assign (resid 50 and name HN) (resid 49 and name HG11) 3.169 1.255 1.255 weight 1.000 ! spec=HNH, no=661, id=617, vol=2.140000e+07
assign (resid 50 and name HN) (resid 52 and name HG12) 3.399 1.444 1.444 weight 1.000 ! spec=HNH, no=663, id=619, vol=1.400000e+07
or (resid 50 and name HN) (resid 52 and name HG11)
or (resid 50 and name HN) (resid 52 and name HG13)
assign (resid 50 and name HN) (resid 46 and name HG12) 3.718 1.728 1.728 weight 1.000 ! spec=HNH, no=665, id=621, vol=8.210000e+06
or (resid 50 and name HN) (resid 46 and name HG11)
or (resid 50 and name HN) (resid 46 and name HG13)
assign (resid 50 and name HN) (resid 48 and name HA) 3.215 1.292 1.292 weight 1.000 ! spec=HNH, no=666, id=622, vol=1.960000e+07
assign (resid 50 and name HN) (resid 48 and name HB2) 3.008 1.131 1.131 weight 1.000 ! spec=HNH, no=667, id=623, vol=2.930000e+07
assign (resid 50 and name HN) (resid 48 and name HB1) 2.731 0.932 0.932 weight 1.000 ! spec=HNH, no=668, id=624, vol=5.230000e+07
assign (resid 49 and name HN) (resid 50 and name HN) 2.646 0.875 0.875 weight 1.000 ! spec=HNH, no=669, id=625, vol=6.320000e+07
assign (resid 50 and name HN) (resid 49 and name HA) 2.918 1.064 1.064 weight 1.000 ! spec=HNH, no=670, id=626, vol=3.510000e+07
assign (resid 50 and name HN) (resid 50 and name HA) 2.464 0.759 0.759 weight 1.000 ! spec=HNH, no=673, id=628, vol=9.680000e+07
assign (resid 50 and name HN) (resid 50 and name HG2) 2.677 0.896 0.896 weight 1.000 ! spec=HNH, no=674, id=629, vol=5.880000e+07
assign (resid 50 and name HN) (resid 50 and name HB2) 2.140 0.572 0.572 weight 1.000 ! spec=HNH, no=675, id=630, vol=2.260000e+08
assign (resid 50 and name HN) (resid 52 and name HN) 3.185 1.268 1.268 weight 1.000 ! spec=HNH, no=677, id=632, vol=2.080000e+07
assign (resid 51 and name HN) (resid 51 and name HA) 2.391 0.715 0.715 weight 1.000 ! spec=HNH, no=685, id=640, vol=1.160000e+08
assign (resid 47 and name HN) (resid 51 and name HN) 3.445 1.483 1.483 weight 1.000 ! spec=HNH, no=686, id=641, vol=1.300000e+07
assign (resid 48 and name HN) (resid 51 and name HN) 2.872 1.031 1.031 weight 1.000 ! spec=HNH, no=687, id=642, vol=3.860000e+07
assign (resid 51 and name HN) (resid 48 and name HA) 3.537 1.564 1.564 weight 1.000 ! spec=HNH, no=688, id=643, vol=1.110000e+07
assign (resid 51 and name HN) (resid 48 and name HB1) 3.188 1.270 1.270 weight 1.000 ! spec=HNH, no=689, id=644, vol=2.060000e+07
assign (resid 49 and name HN) (resid 51 and name HN) 3.684 1.697 1.697 weight 1.000 ! spec=HNH, no=690, id=645, vol=8.660000e+06
assign (resid 51 and name HN) (resid 49 and name HG22) 3.168 1.255 1.255 weight 1.000 ! spec=HNH, no=691, id=646, vol=2.140000e+07
or (resid 51 and name HN) (resid 49 and name HG21)
or (resid 51 and name HN) (resid 49 and name HG23)
assign (resid 50 and name HN) (resid 51 and name HN) 2.271 0.644 0.644 weight 1.000 ! spec=HNH, no=692, id=647, vol=1.580000e+08
assign (resid 51 and name HN) (resid 50 and name HA) 3.054 1.166 1.166 weight 1.000 ! spec=HNH, no=693, id=648, vol=2.670000e+07
assign (resid 51 and name HN) (resid 50 and name HB2) 2.528 0.799 0.799 weight 1.000 ! spec=HNH, no=694, id=649, vol=8.310000e+07
assign (resid 51 and name HN) (resid 51 and name HB1) 2.500 0.781 0.781 weight 1.000 ! spec=HNH, no=697, id=651, vol=8.870000e+07
assign (resid 51 and name HN) (resid 52 and name HN) 2.457 0.755 0.755 weight 1.000 ! spec=HNH, no=698, id=652, vol=9.850000e+07
assign (resid 51 and name HN) (resid 52 and name HG12) 2.998 1.123 1.123 weight 1.000 ! spec=HNH, no=699, id=653, vol=2.990000e+07
or (resid 51 and name HN) (resid 52 and name HG11)
or (resid 51 and name HN) (resid 52 and name HG13)
assign (resid 52 and name HN) (resid 55 and name HE22) 3.961 1.961 1.961 weight 1.000 ! spec=HNH, no=702, id=656, vol=5.610000e+06
assign (resid 52 and name HN) (resid 49 and name HN) 4.207 2.212 2.212 weight 1.000 ! spec=HNH, no=705, id=659, vol=3.910000e+06
assign (resid 48 and name HN) (resid 52 and name HN) 3.303 1.363 1.363 weight 1.000 ! spec=HNH, no=708, id=662, vol=1.670000e+07
assign (resid 47 and name HN) (resid 52 and name HN) 4.024 2.024 2.024 weight 1.000 ! spec=HNH, no=712, id=666, vol=5.100000e+06
assign (resid 52 and name HN) (resid 46 and name HG12) 2.902 1.053 1.053 weight 1.000 ! spec=HNH, no=714, id=668, vol=3.620000e+07
or (resid 52 and name HN) (resid 46 and name HG11)
or (resid 52 and name HN) (resid 46 and name HG13)
assign (resid 52 and name HN) (resid 46 and name HG22) 3.020 1.140 1.140 weight 1.000 ! spec=HNH, no=715, id=669, vol=2.850000e+07
or (resid 52 and name HN) (resid 46 and name HG21)
or (resid 52 and name HN) (resid 46 and name HG23)
assign (resid 52 and name HN) (resid 50 and name HB2) 3.566 1.589 1.589 weight 1.000 ! spec=HNH, no=719, id=673, vol=1.050000e+07
assign (resid 52 and name HN) (resid 51 and name HA) 3.031 1.148 1.148 weight 1.000 ! spec=HNH, no=721, id=675, vol=2.800000e+07
assign (resid 52 and name HN) (resid 51 and name HB2) 2.976 1.107 1.107 weight 1.000 ! spec=HNH, no=722, id=676, vol=3.120000e+07
assign (resid 52 and name HN) (resid 51 and name HB1) 2.879 1.036 1.036 weight 1.000 ! spec=HNH, no=723, id=677, vol=3.800000e+07
assign (resid 52 and name HN) (resid 52 and name HA) 2.707 0.916 0.916 weight 1.000 ! spec=HNH, no=725, id=678, vol=5.500000e+07
assign (resid 52 and name HN) (resid 52 and name HB) 2.434 0.740 0.740 weight 1.000 ! spec=HNH, no=726, id=679, vol=1.040000e+08
assign (resid 52 and name HN) (resid 53 and name HG1) 3.371 1.421 1.421 weight 1.000 ! spec=HNH, no=729, id=682, vol=1.480000e+07
assign (resid 53 and name HN) (resid 46 and name HG12) 3.301 1.362 1.362 weight 1.000 ! spec=HNH, no=735, id=687, vol=1.680000e+07
or (resid 53 and name HN) (resid 46 and name HG11)
or (resid 53 and name HN) (resid 46 and name HG13)
assign (resid 53 and name HN) (resid 51 and name HN) 3.162 1.250 1.250 weight 1.000 ! spec=HNH, no=736, id=688, vol=2.170000e+07
assign (resid 52 and name HN) (resid 53 and name HN) 2.428 0.737 0.737 weight 1.000 ! spec=HNH, no=739, id=691, vol=1.060000e+08
assign (resid 53 and name HN) (resid 52 and name HA) 2.872 1.031 1.031 weight 1.000 ! spec=HNH, no=740, id=692, vol=3.860000e+07
assign (resid 53 and name HN) (resid 53 and name HG2) 2.760 0.952 0.952 weight 1.000 ! spec=HNH, no=745, id=696, vol=4.900000e+07
assign (resid 53 and name HN) (resid 53 and name HG1) 2.430 0.738 0.738 weight 1.000 ! spec=HNH, no=746, id=697, vol=1.050000e+08
assign (resid 53 and name HN) (resid 53 and name HB2) 2.553 0.815 0.815 weight 1.000 ! spec=HNH, no=747, id=698, vol=7.820000e+07
assign (resid 53 and name HE) (resid 63 and name HB2) 4.164 2.168 2.168 weight 1.000 ! spec=HNH, no=748, id=699, vol=4.150000e+06
assign (resid 53 and name HE) (resid 57 and name HG21) 3.162 1.249 1.249 weight 1.000 ! spec=HNH, no=753, id=703, vol=2.170000e+07
or (resid 53 and name HE) (resid 57 and name HG22)
or (resid 53 and name HE) (resid 57 and name HG23)
assign (resid 53 and name HE) (resid 62 and name HA) 3.893 1.894 1.894 weight 1.000 ! spec=HNH, no=756, id=706, vol=6.220000e+06
assign (resid 53 and name HE) (resid 50 and name HA) 4.095 2.096 2.096 weight 1.000 ! spec=HNH, no=760, id=710, vol=4.600000e+06
assign (resid 53 and name HE) (resid 53 and name HN) 3.864 1.866 1.866 weight 1.000 ! spec=HNH, no=762, id=712, vol=6.510000e+06
assign (resid 53 and name HE) (resid 53 and name HD2) 2.967 1.100 1.100 weight 1.000 ! spec=HNH, no=763, id=713, vol=3.170000e+07
assign (resid 53 and name HE) (resid 53 and name HG2) 2.859 1.022 1.022 weight 1.000 ! spec=HNH, no=765, id=714, vol=3.960000e+07
assign (resid 53 and name HE) (resid 63 and name HN) 3.470 1.505 1.505 weight 1.000 ! spec=HNH, no=767, id=716, vol=1.240000e+07
assign (resid 53 and name HE) (resid 105 and name HB2) 3.327 1.384 1.384 weight 1.000 ! spec=HNH, no=768, id=717, vol=1.600000e+07
assign (resid 53 and name HE) (resid 105 and name HB1) 3.103 1.203 1.203 weight 1.000 ! spec=HNH, no=769, id=718, vol=2.430000e+07
assign (resid 53 and name HE) (resid 105 and name HD1) 3.476 1.511 1.511 weight 1.000 ! spec=HNH, no=770, id=719, vol=1.230000e+07
assign (resid 54 and name HN) (resid 57 and name HN) 3.598 1.619 1.619 weight 1.000 ! spec=HNH, no=774, id=723, vol=9.980000e+06
assign (resid 54 and name HN) (resid 52 and name HG22) 3.187 1.270 1.270 weight 1.000 ! spec=HNH, no=784, id=732, vol=2.070000e+07
or (resid 54 and name HN) (resid 52 and name HG21)
or (resid 54 and name HN) (resid 52 and name HG23)
assign (resid 52 and name HN) (resid 54 and name HN) 3.291 1.354 1.354 weight 1.000 ! spec=HNH, no=786, id=734, vol=1.710000e+07
assign (resid 54 and name HN) (resid 53 and name HD1) 3.041 1.156 1.156 weight 1.000 ! spec=HNH, no=787, id=735, vol=2.740000e+07
assign (resid 54 and name HN) (resid 53 and name HG1) 2.670 0.891 0.891 weight 1.000 ! spec=HNH, no=788, id=736, vol=5.970000e+07
assign (resid 54 and name HN) (resid 54 and name HA) 2.382 0.709 0.709 weight 1.000 ! spec=HNH, no=791, id=738, vol=1.190000e+08
assign (resid 54 and name HN) (resid 54 and name HD22) 3.633 1.650 1.650 weight 1.000 ! spec=HNH, no=792, id=739, vol=9.430000e+06
assign (resid 54 and name HN) (resid 54 and name HB2) 2.161 0.584 0.584 weight 1.000 ! spec=HNH, no=793, id=740, vol=2.130000e+08
assign (resid 54 and name HD21) (resid 51 and name HB1) 3.988 1.988 1.988 weight 1.000 ! spec=HNH, no=796, id=743, vol=5.390000e+06
assign (resid 54 and name HD22) (resid 50 and name HB2) 3.680 1.693 1.693 weight 1.000 ! spec=HNH, no=801, id=748, vol=8.720000e+06
assign (resid 54 and name HD21) (resid 51 and name HA) 3.102 1.203 1.203 weight 1.000 ! spec=HNH, no=802, id=749, vol=2.430000e+07
assign (resid 54 and name HD22) (resid 51 and name HA) 3.159 1.248 1.248 weight 1.000 ! spec=HNH, no=803, id=750, vol=2.180000e+07
assign (resid 54 and name HD21) (resid 54 and name HN) 3.626 1.643 1.643 weight 1.000 ! spec=HNH, no=804, id=751, vol=9.530000e+06
assign (resid 54 and name HD21) (resid 54 and name HA) 3.996 1.996 1.996 weight 1.000 ! spec=HNH, no=806, id=753, vol=5.320000e+06
assign (resid 54 and name HD22) (resid 54 and name HA) 4.048 2.048 2.048 weight 1.000 ! spec=HNH, no=807, id=754, vol=4.920000e+06
assign (resid 54 and name HD22) (resid 54 and name HD21) 1.779 0.396 0.396 weight 1.000 ! spec=HNH, no=810, id=756, vol=6.840000e+08
assign (resid 54 and name HD22) (resid 54 and name HB2) 2.599 0.844 0.844 weight 1.000 ! spec=HNH, no=813, id=758, vol=7.030000e+07
assign (resid 55 and name HN) (resid 52 and name HA) 2.973 1.105 1.105 weight 1.000 ! spec=HNH, no=814, id=759, vol=3.140000e+07
assign (resid 55 and name HN) (resid 58 and name HN) 3.783 1.789 1.789 weight 1.000 ! spec=HNH, no=815, id=760, vol=7.390000e+06
assign (resid 55 and name HN) (resid 53 and name HD2) 3.511 1.541 1.541 weight 1.000 ! spec=HNH, no=817, id=762, vol=1.160000e+07
assign (resid 55 and name HN) (resid 151 and name HG21) 3.135 1.229 1.229 weight 1.000 ! spec=HNH, no=820, id=765, vol=2.280000e+07
or (resid 55 and name HN) (resid 151 and name HG22)
or (resid 55 and name HN) (resid 151 and name HG23)
assign (resid 55 and name HN) (resid 40 and name HD22) 3.614 1.633 1.633 weight 1.000 ! spec=HNH, no=823, id=768, vol=9.720000e+06
or (resid 55 and name HN) (resid 40 and name HD21)
or (resid 55 and name HN) (resid 40 and name HD23)
assign (resid 54 and name HN) (resid 55 and name HN) 2.554 0.815 0.815 weight 1.000 ! spec=HNH, no=824, id=769, vol=7.810000e+07
assign (resid 55 and name HN) (resid 54 and name HA) 3.100 1.201 1.201 weight 1.000 ! spec=HNH, no=825, id=770, vol=2.440000e+07
assign (resid 55 and name HN) (resid 54 and name HB2) 2.611 0.852 0.852 weight 1.000 ! spec=HNH, no=826, id=771, vol=6.840000e+07
assign (resid 55 and name HN) (resid 55 and name HA) 2.418 0.731 0.731 weight 1.000 ! spec=HNH, no=828, id=772, vol=1.080000e+08
assign (resid 55 and name HN) (resid 55 and name HB2) 2.425 0.735 0.735 weight 1.000 ! spec=HNH, no=829, id=773, vol=1.060000e+08
assign (resid 55 and name HN) (resid 55 and name HE22) 3.803 1.807 1.807 weight 1.000 ! spec=HNH, no=831, id=775, vol=7.170000e+06
assign (resid 55 and name HN) (resid 55 and name HG2) 2.415 0.729 0.729 weight 1.000 ! spec=HNH, no=832, id=776, vol=1.090000e+08
assign (resid 55 and name HE21) (resid 150 and name HA2) 4.319 2.331 2.331 weight 1.000 ! spec=HNH, no=838, id=782, vol=3.340000e+06
assign (resid 55 and name HE21) (resid 51 and name HB1) 4.501 2.533 2.533 weight 1.000 ! spec=HNH, no=840, id=784, vol=2.600000e+06
assign (resid 55 and name HE21) (resid 42 and name HB1) 3.515 1.544 1.544 weight 1.000 ! spec=HNH, no=843, id=787, vol=1.150000e+07
assign (resid 55 and name HE21) (resid 44 and name HG22) 2.814 0.990 0.990 weight 1.000 ! spec=HNH, no=845, id=789, vol=4.360000e+07
or (resid 55 and name HE21) (resid 44 and name HG21)
or (resid 55 and name HE21) (resid 44 and name HG23)
assign (resid 55 and name HE21) (resid 42 and name HB2) 3.166 1.253 1.253 weight 1.000 ! spec=HNH, no=846, id=790, vol=2.150000e+07
assign (resid 55 and name HE21) (resid 52 and name HA) 3.132 1.226 1.226 weight 1.000 ! spec=HNH, no=847, id=791, vol=2.300000e+07
assign (resid 55 and name HE21) (resid 52 and name HG22) 3.039 1.155 1.155 weight 1.000 ! spec=HNH, no=848, id=792, vol=2.750000e+07
or (resid 55 and name HE21) (resid 52 and name HG21)
or (resid 55 and name HE21) (resid 52 and name HG23)
assign (resid 55 and name HE21) (resid 44 and name HG11) 3.780 1.786 1.786 weight 1.000 ! spec=HNH, no=849, id=793, vol=7.420000e+06
assign (resid 55 and name HE22) (resid 44 and name HN) 3.879 1.880 1.880 weight 1.000 ! spec=HNH, no=852, id=796, vol=6.360000e+06
assign (resid 55 and name HE22) (resid 42 and name HB1) 3.701 1.713 1.713 weight 1.000 ! spec=HNH, no=853, id=797, vol=8.420000e+06
assign (resid 55 and name HE22) (resid 42 and name HB2) 3.208 1.286 1.286 weight 1.000 ! spec=HNH, no=854, id=798, vol=1.990000e+07
assign (resid 55 and name HE22) (resid 44 and name HG11) 3.696 1.708 1.708 weight 1.000 ! spec=HNH, no=856, id=800, vol=8.500000e+06
assign (resid 55 and name HE22) (resid 43 and name HN) 4.226 2.232 2.232 weight 1.000 ! spec=HNH, no=857, id=801, vol=3.800000e+06
assign (resid 55 and name HE22) (resid 40 and name HD22) 3.673 1.686 1.686 weight 1.000 ! spec=HNH, no=864, id=808, vol=8.830000e+06
or (resid 55 and name HE22) (resid 40 and name HD21)
or (resid 55 and name HE22) (resid 40 and name HD23)
assign (resid 55 and name HE22) (resid 52 and name HA) 3.338 1.392 1.392 weight 1.000 ! spec=HNH, no=865, id=809, vol=1.570000e+07
assign (resid 55 and name HE22) (resid 52 and name HG22) 3.099 1.200 1.200 weight 1.000 ! spec=HNH, no=866, id=810, vol=2.450000e+07
or (resid 55 and name HE22) (resid 52 and name HG21)
or (resid 55 and name HE22) (resid 52 and name HG23)
assign (resid 55 and name HE21) (resid 54 and name HB2) 3.781 1.787 1.787 weight 1.000 ! spec=HNH, no=867, id=811, vol=7.410000e+06
assign (resid 55 and name HE21) (resid 55 and name HA) 3.663 1.678 1.678 weight 1.000 ! spec=HNH, no=869, id=813, vol=8.960000e+06
assign (resid 55 and name HE21) (resid 55 and name HB2) 2.977 1.108 1.108 weight 1.000 ! spec=HNH, no=871, id=815, vol=3.110000e+07
assign (resid 55 and name HE22) (resid 55 and name HE21) 1.772 0.393 0.393 weight 1.000 ! spec=HNH, no=874, id=817, vol=6.990000e+08
assign (resid 55 and name HE21) (resid 55 and name HG2) 2.699 0.910 0.910 weight 1.000 ! spec=HNH, no=876, id=818, vol=5.610000e+07
assign (resid 55 and name HE22) (resid 55 and name HG2) 2.994 1.121 1.121 weight 1.000 ! spec=HNH, no=877, id=819, vol=3.010000e+07
assign (resid 55 and name HE21) (resid 55 and name HG1) 2.797 0.978 0.978 weight 1.000 ! spec=HNH, no=878, id=820, vol=4.530000e+07
assign (resid 55 and name HE22) (resid 55 and name HG1) 3.114 1.212 1.212 weight 1.000 ! spec=HNH, no=879, id=821, vol=2.380000e+07
assign (resid 55 and name HE22) (resid 148 and name HN) 4.265 2.273 2.273 weight 1.000 ! spec=HNH, no=882, id=824, vol=3.600000e+06
assign (resid 55 and name HE22) (resid 148 and name HA) 3.984 1.984 1.984 weight 1.000 ! spec=HNH, no=884, id=826, vol=5.420000e+06
assign (resid 55 and name HE21) (resid 151 and name HG21) 3.040 1.155 1.155 weight 1.000 ! spec=HNH, no=886, id=828, vol=2.750000e+07
or (resid 55 and name HE21) (resid 151 and name HG22)
or (resid 55 and name HE21) (resid 151 and name HG23)
assign (resid 55 and name HE22) (resid 151 and name HG21) 3.038 1.154 1.154 weight 1.000 ! spec=HNH, no=887, id=829, vol=2.750000e+07
or (resid 55 and name HE22) (resid 151 and name HG22)
or (resid 55 and name HE22) (resid 151 and name HG23)
assign (resid 56 and name HN) (resid 54 and name HN) 3.416 1.459 1.459 weight 1.000 ! spec=HNH, no=888, id=830, vol=1.360000e+07
assign (resid 56 and name HN) (resid 151 and name HG21) 3.296 1.358 1.358 weight 1.000 ! spec=HNH, no=897, id=839, vol=1.690000e+07
or (resid 56 and name HN) (resid 151 and name HG22)
or (resid 56 and name HN) (resid 151 and name HG23)
assign (resid 56 and name HN) (resid 58 and name HB1) 3.498 1.529 1.529 weight 1.000 ! spec=HNH, no=901, id=843, vol=1.180000e+07
assign (resid 56 and name HN) (resid 40 and name HD12) 4.362 2.379 2.379 weight 1.000 ! spec=HNH, no=905, id=847, vol=3.140000e+06
or (resid 56 and name HN) (resid 40 and name HD11)
or (resid 56 and name HN) (resid 40 and name HD13)
assign (resid 56 and name HN) (resid 40 and name HD22) 3.501 1.532 1.532 weight 1.000 ! spec=HNH, no=906, id=848, vol=1.180000e+07
or (resid 56 and name HN) (resid 40 and name HD21)
or (resid 56 and name HN) (resid 40 and name HD23)
assign (resid 56 and name HN) (resid 55 and name HN) 2.408 0.725 0.725 weight 1.000 ! spec=HNH, no=907, id=849, vol=1.110000e+08
assign (resid 56 and name HN) (resid 55 and name HB2) 2.707 0.916 0.916 weight 1.000 ! spec=HNH, no=909, id=851, vol=5.500000e+07
assign (resid 56 and name HN) (resid 56 and name HA) 2.728 0.930 0.930 weight 1.000 ! spec=HNH, no=912, id=853, vol=5.260000e+07
assign (resid 56 and name HN) (resid 56 and name HB2) 2.648 0.876 0.876 weight 1.000 ! spec=HNH, no=913, id=854, vol=6.290000e+07
assign (resid 56 and name HN) (resid 56 and name HB1) 2.575 0.829 0.829 weight 1.000 ! spec=HNH, no=914, id=855, vol=7.440000e+07
assign (resid 56 and name HN) (resid 57 and name HN) 2.527 0.798 0.798 weight 1.000 ! spec=HNH, no=915, id=856, vol=8.320000e+07
assign (resid 56 and name HN) (resid 63 and name HG1) 3.172 1.258 1.258 weight 1.000 ! spec=HNH, no=919, id=860, vol=2.130000e+07
assign (resid 57 and name HN) (resid 63 and name HG1) 3.829 1.833 1.833 weight 1.000 ! spec=HNH, no=923, id=864, vol=6.880000e+06
assign (resid 57 and name HN) (resid 55 and name HB2) 3.858 1.860 1.860 weight 1.000 ! spec=HNH, no=924, id=865, vol=6.570000e+06
assign (resid 57 and name HN) (resid 54 and name HA) 2.790 0.973 0.973 weight 1.000 ! spec=HNH, no=925, id=866, vol=4.590000e+07
assign (resid 55 and name HN) (resid 57 and name HN) 3.185 1.268 1.268 weight 1.000 ! spec=HNH, no=926, id=867, vol=2.080000e+07
assign (resid 57 and name HN) (resid 55 and name HA) 3.792 1.798 1.798 weight 1.000 ! spec=HNH, no=927, id=868, vol=7.280000e+06
assign (resid 57 and name HN) (resid 56 and name HB2) 3.015 1.136 1.136 weight 1.000 ! spec=HNH, no=929, id=870, vol=2.890000e+07
assign (resid 57 and name HN) (resid 56 and name HB1) 2.698 0.910 0.910 weight 1.000 ! spec=HNH, no=930, id=871, vol=5.610000e+07
assign (resid 57 and name HN) (resid 57 and name HA) 2.739 0.938 0.938 weight 1.000 ! spec=HNH, no=932, id=872, vol=5.130000e+07
assign (resid 57 and name HN) (resid 57 and name HB) 2.974 1.106 1.106 weight 1.000 ! spec=HNH, no=933, id=873, vol=3.130000e+07
assign (resid 56 and name HN) (resid 58 and name HN) 3.370 1.420 1.420 weight 1.000 ! spec=HNH, no=942, id=882, vol=1.480000e+07
assign (resid 58 and name HN) (resid 56 and name HB1) 3.446 1.485 1.485 weight 1.000 ! spec=HNH, no=943, id=883, vol=1.290000e+07
assign (resid 57 and name HN) (resid 58 and name HN) 2.701 0.912 0.912 weight 1.000 ! spec=HNH, no=944, id=884, vol=5.580000e+07
assign (resid 58 and name HN) (resid 58 and name HA) 2.522 0.795 0.795 weight 1.000 ! spec=HNH, no=947, id=886, vol=8.410000e+07
assign (resid 58 and name HN) (resid 58 and name HB2) 2.586 0.836 0.836 weight 1.000 ! spec=HNH, no=948, id=887, vol=7.250000e+07
assign (resid 58 and name HN) (resid 58 and name HB1) 2.344 0.687 0.687 weight 1.000 ! spec=HNH, no=949, id=888, vol=1.310000e+08
assign (resid 58 and name HN) (resid 59 and name HN) 2.627 0.863 0.863 weight 1.000 ! spec=HNH, no=950, id=889, vol=6.590000e+07
assign (resid 58 and name HN) (resid 60 and name HN) 3.470 1.505 1.505 weight 1.000 ! spec=HNH, no=952, id=891, vol=1.240000e+07
assign (resid 59 and name HN) (resid 61 and name HA) 4.048 2.048 2.048 weight 1.000 ! spec=HNH, no=955, id=894, vol=4.920000e+06
assign (resid 59 and name HN) (resid 57 and name HN) 3.338 1.393 1.393 weight 1.000 ! spec=HNH, no=957, id=896, vol=1.570000e+07
assign (resid 59 and name HN) (resid 57 and name HA) 2.861 1.023 1.023 weight 1.000 ! spec=HNH, no=958, id=897, vol=3.950000e+07
assign (resid 59 and name HN) (resid 58 and name HB2) 3.061 1.171 1.171 weight 1.000 ! spec=HNH, no=960, id=899, vol=2.630000e+07
assign (resid 59 and name HN) (resid 58 and name HB1) 2.799 0.979 0.979 weight 1.000 ! spec=HNH, no=961, id=900, vol=4.510000e+07
assign (resid 59 and name HN) (resid 59 and name HA) 2.617 0.856 0.856 weight 1.000 ! spec=HNH, no=963, id=901, vol=6.740000e+07
assign (resid 59 and name HN) (resid 59 and name HB2) 2.587 0.836 0.836 weight 1.000 ! spec=HNH, no=964, id=902, vol=7.230000e+07
assign (resid 59 and name HN) (resid 59 and name HB1) 2.800 0.980 0.980 weight 1.000 ! spec=HNH, no=965, id=903, vol=4.490000e+07
assign (resid 59 and name HN) (resid 60 and name HA2) 3.274 1.340 1.340 weight 1.000 ! spec=HNH, no=967, id=905, vol=1.760000e+07
assign (resid 59 and name HN) (resid 60 and name HA1) 3.339 1.394 1.394 weight 1.000 ! spec=HNH, no=968, id=906, vol=1.560000e+07
assign (resid 60 and name HN) (resid 57 and name HN) 4.311 2.323 2.323 weight 1.000 ! spec=HNH, no=973, id=910, vol=3.370000e+06
assign (resid 60 and name HN) (resid 57 and name HA) 2.910 1.058 1.058 weight 1.000 ! spec=HNH, no=974, id=911, vol=3.570000e+07
assign (resid 60 and name HN) (resid 57 and name HB) 3.701 1.712 1.712 weight 1.000 ! spec=HNH, no=975, id=912, vol=8.430000e+06
assign (resid 60 and name HN) (resid 57 and name HG21) 3.792 1.797 1.797 weight 1.000 ! spec=HNH, no=976, id=913, vol=7.290000e+06
or (resid 60 and name HN) (resid 57 and name HG22)
or (resid 60 and name HN) (resid 57 and name HG23)
assign (resid 60 and name HN) (resid 58 and name HB2) 3.983 1.983 1.983 weight 1.000 ! spec=HNH, no=978, id=915, vol=5.420000e+06
assign (resid 60 and name HN) (resid 58 and name HB1) 3.993 1.993 1.993 weight 1.000 ! spec=HNH, no=979, id=916, vol=5.340000e+06
assign (resid 59 and name HN) (resid 60 and name HN) 2.511 0.788 0.788 weight 1.000 ! spec=HNH, no=980, id=917, vol=8.650000e+07
assign (resid 60 and name HN) (resid 59 and name HA) 2.936 1.078 1.078 weight 1.000 ! spec=HNH, no=981, id=918, vol=3.380000e+07
assign (resid 60 and name HN) (resid 59 and name HB2) 3.426 1.467 1.467 weight 1.000 ! spec=HNH, no=982, id=919, vol=1.340000e+07
assign (resid 60 and name HN) (resid 59 and name HB1) 3.420 1.462 1.462 weight 1.000 ! spec=HNH, no=983, id=920, vol=1.350000e+07
assign (resid 60 and name HN) (resid 60 and name HA2) 2.400 0.720 0.720 weight 1.000 ! spec=HNH, no=985, id=921, vol=1.130000e+08
assign (resid 60 and name HN) (resid 60 and name HA1) 2.465 0.760 0.760 weight 1.000 ! spec=HNH, no=986, id=922, vol=9.650000e+07
assign (resid 60 and name HN) (resid 61 and name HN) 2.557 0.817 0.817 weight 1.000 ! spec=HNH, no=987, id=923, vol=7.750000e+07
assign (resid 60 and name HN) (resid 61 and name HA) 3.898 1.899 1.899 weight 1.000 ! spec=HNH, no=988, id=924, vol=6.180000e+06
assign (resid 60 and name HN) (resid 61 and name HB2) 3.460 1.496 1.496 weight 1.000 ! spec=HNH, no=989, id=925, vol=1.260000e+07
or (resid 60 and name HN) (resid 61 and name HB1)
or (resid 60 and name HN) (resid 61 and name HB3)
assign (resid 61 and name HN) (resid 57 and name HB) 3.357 1.409 1.409 weight 1.000 ! spec=HNH, no=993, id=929, vol=1.510000e+07
assign (resid 61 and name HN) (resid 59 and name HA) 3.133 1.227 1.227 weight 1.000 ! spec=HNH, no=994, id=930, vol=2.290000e+07
assign (resid 61 and name HN) (resid 29 and name HZ3) 3.782 1.788 1.788 weight 1.000 ! spec=HNH, no=996, id=932, vol=7.400000e+06
assign (resid 61 and name HN) (resid 56 and name HB2) 3.589 1.610 1.610 weight 1.000 ! spec=HNH, no=997, id=933, vol=1.010000e+07
assign (resid 57 and name HN) (resid 61 and name HN) 3.768 1.774 1.774 weight 1.000 ! spec=HNH, no=998, id=934, vol=7.570000e+06
assign (resid 61 and name HN) (resid 57 and name HA) 2.588 0.837 0.837 weight 1.000 ! spec=HNH, no=999, id=935, vol=7.210000e+07
assign (resid 59 and name HN) (resid 61 and name HN) 2.869 1.029 1.029 weight 1.000 ! spec=HNH, no=1000, id=936, vol=3.880000e+07
assign (resid 61 and name HN) (resid 59 and name HB2) 3.207 1.285 1.285 weight 1.000 ! spec=HNH, no=1001, id=937, vol=1.990000e+07
assign (resid 61 and name HN) (resid 59 and name HB1) 3.510 1.540 1.540 weight 1.000 ! spec=HNH, no=1002, id=938, vol=1.160000e+07
assign (resid 61 and name HN) (resid 60 and name HA2) 2.817 0.992 0.992 weight 1.000 ! spec=HNH, no=1004, id=940, vol=4.330000e+07
assign (resid 61 and name HN) (resid 60 and name HA1) 2.793 0.975 0.975 weight 1.000 ! spec=HNH, no=1005, id=941, vol=4.560000e+07
assign (resid 61 and name HN) (resid 61 and name HA) 2.778 0.965 0.965 weight 1.000 ! spec=HNH, no=1007, id=942, vol=4.710000e+07
assign (resid 61 and name HN) (resid 61 and name HB2) 2.427 0.737 0.737 weight 1.000 ! spec=HNH, no=1008, id=943, vol=1.060000e+08
or (resid 61 and name HN) (resid 61 and name HB1)
or (resid 61 and name HN) (resid 61 and name HB3)
assign (resid 61 and name HN) (resid 62 and name HN) 3.338 1.393 1.393 weight 1.000 ! spec=HNH, no=1009, id=944, vol=1.570000e+07
assign (resid 61 and name HN) (resid 155 and name HG21) 4.027 2.027 2.027 weight 1.000 ! spec=HNH, no=1010, id=945, vol=5.080000e+06
or (resid 61 and name HN) (resid 155 and name HG22)
or (resid 61 and name HN) (resid 155 and name HG23)
assign (resid 62 and name HN) (resid 29 and name HZ3) 3.912 1.913 1.913 weight 1.000 ! spec=HNH, no=1015, id=950, vol=6.040000e+06
assign (resid 62 and name HN) (resid 61 and name HA) 2.618 0.857 0.857 weight 1.000 ! spec=HNH, no=1017, id=952, vol=6.730000e+07
assign (resid 62 and name HN) (resid 62 and name HB2) 2.890 1.044 1.044 weight 1.000 ! spec=HNH, no=1021, id=955, vol=3.720000e+07
assign (resid 62 and name HN) (resid 62 and name HB1) 3.136 1.229 1.229 weight 1.000 ! spec=HNH, no=1022, id=956, vol=2.280000e+07
assign (resid 62 and name HN) (resid 153 and name HB2) 3.569 1.592 1.592 weight 1.000 ! spec=HNH, no=1025, id=959, vol=1.050000e+07
assign (resid 62 and name HN) (resid 153 and name HB1) 3.153 1.243 1.243 weight 1.000 ! spec=HNH, no=1026, id=960, vol=2.200000e+07
assign (resid 62 and name HN) (resid 154 and name HA) 4.295 2.306 2.306 weight 1.000 ! spec=HNH, no=1028, id=962, vol=3.450000e+06
assign (resid 62 and name HN) (resid 155 and name HA) 3.542 1.568 1.568 weight 1.000 ! spec=HNH, no=1031, id=965, vol=1.100000e+07
assign (resid 62 and name HN) (resid 155 and name HB) 3.387 1.434 1.434 weight 1.000 ! spec=HNH, no=1032, id=966, vol=1.440000e+07
assign (resid 62 and name HN) (resid 155 and name HG21) 3.594 1.615 1.615 weight 1.000 ! spec=HNH, no=1033, id=967, vol=1.000000e+07
or (resid 62 and name HN) (resid 155 and name HG22)
or (resid 62 and name HN) (resid 155 and name HG23)
assign (resid 62 and name HN) (resid 63 and name HN) 3.408 1.452 1.452 weight 1.000 ! spec=HNH, no=1040, id=973, vol=1.380000e+07
assign (resid 63 and name HN) (resid 62 and name HA) 2.524 0.796 0.796 weight 1.000 ! spec=HNH, no=1041, id=974, vol=8.380000e+07
assign (resid 63 and name HN) (resid 62 and name HB1) 2.984 1.113 1.113 weight 1.000 ! spec=HNH, no=1042, id=975, vol=3.070000e+07
assign (resid 63 and name HN) (resid 63 and name HB2) 2.723 0.927 0.927 weight 1.000 ! spec=HNH, no=1044, id=976, vol=5.320000e+07
assign (resid 63 and name HN) (resid 63 and name HG1) 3.531 1.559 1.559 weight 1.000 ! spec=HNH, no=1046, id=978, vol=1.120000e+07
assign (resid 63 and name HN) (resid 63 and name HE2) 3.507 1.538 1.538 weight 1.000 ! spec=HNH, no=1047, id=979, vol=1.160000e+07
or (resid 63 and name HN) (resid 63 and name HE1)
or (resid 63 and name HN) (resid 63 and name HE3)
assign (resid 63 and name HN) (resid 64 and name HN) 3.345 1.399 1.399 weight 1.000 ! spec=HNH, no=1048, id=980, vol=1.550000e+07
assign (resid 63 and name HN) (resid 64 and name HA) 4.024 2.024 2.024 weight 1.000 ! spec=HNH, no=1049, id=981, vol=5.100000e+06
assign (resid 63 and name HN) (resid 105 and name HN) 4.309 2.321 2.321 weight 1.000 ! spec=HNH, no=1051, id=983, vol=3.390000e+06
assign (resid 63 and name HN) (resid 151 and name HG21) 3.788 1.793 1.793 weight 1.000 ! spec=HNH, no=1052, id=984, vol=7.340000e+06
or (resid 63 and name HN) (resid 151 and name HG22)
or (resid 63 and name HN) (resid 151 and name HG23)
assign (resid 63 and name HN) (resid 153 and name HA) 3.979 1.979 1.979 weight 1.000 ! spec=HNH, no=1053, id=985, vol=5.460000e+06
assign (resid 64 and name HN) (resid 152 and name HG) 3.173 1.259 1.259 weight 1.000 ! spec=HNH, no=1057, id=989, vol=2.120000e+07
assign (resid 64 and name HN) (resid 63 and name HA) 2.513 0.789 0.789 weight 1.000 ! spec=HNH, no=1059, id=991, vol=8.600000e+07
assign (resid 64 and name HN) (resid 63 and name HB2) 3.067 1.176 1.176 weight 1.000 ! spec=HNH, no=1060, id=992, vol=2.600000e+07
assign (resid 64 and name HN) (resid 63 and name HB1) 2.691 0.905 0.905 weight 1.000 ! spec=HNH, no=1061, id=993, vol=5.700000e+07
assign (resid 64 and name HN) (resid 63 and name HE2) 3.356 1.408 1.408 weight 1.000 ! spec=HNH, no=1063, id=995, vol=1.520000e+07
or (resid 64 and name HN) (resid 63 and name HE1)
or (resid 64 and name HN) (resid 63 and name HE3)
assign (resid 64 and name HN) (resid 64 and name HA) 2.943 1.083 1.083 weight 1.000 ! spec=HNH, no=1065, id=996, vol=3.330000e+07
assign (resid 64 and name HN) (resid 64 and name HB) 2.463 0.758 0.758 weight 1.000 ! spec=HNH, no=1066, id=997, vol=9.710000e+07
assign (resid 64 and name HN) (resid 65 and name HN) 3.698 1.709 1.709 weight 1.000 ! spec=HNH, no=1069, id=1000, vol=8.480000e+06
assign (resid 64 and name HN) (resid 153 and name HA) 3.154 1.244 1.244 weight 1.000 ! spec=HNH, no=1070, id=1001, vol=2.200000e+07
assign (resid 65 and name HN) (resid 75 and name HD12) 3.579 1.601 1.601 weight 1.000 ! spec=HNH, no=1072, id=1003, vol=1.030000e+07
or (resid 65 and name HN) (resid 75 and name HD11)
or (resid 65 and name HN) (resid 75 and name HD13)
assign (resid 65 and name HN) (resid 154 and name HE2) 3.284 1.348 1.348 weight 1.000 ! spec=HNH, no=1076, id=1007, vol=1.730000e+07
or (resid 65 and name HN) (resid 154 and name HE1)
assign (resid 65 and name HN) (resid 64 and name HA) 2.369 0.701 0.701 weight 1.000 ! spec=HNH, no=1081, id=1012, vol=1.230000e+08
assign (resid 65 and name HN) (resid 65 and name HB2) 3.660 1.674 1.674 weight 1.000 ! spec=HNH, no=1085, id=1015, vol=9.010000e+06
assign (resid 65 and name HN) (resid 91 and name HD12) 4.351 2.366 2.366 weight 1.000 ! spec=HNH, no=1088, id=1018, vol=3.190000e+06
or (resid 65 and name HN) (resid 91 and name HD11)
or (resid 65 and name HN) (resid 91 and name HD13)
assign (resid 65 and name HN) (resid 91 and name HD22) 4.493 2.523 2.523 weight 1.000 ! spec=HNH, no=1089, id=1019, vol=2.630000e+06
or (resid 65 and name HN) (resid 91 and name HD21)
or (resid 65 and name HN) (resid 91 and name HD23)
assign (resid 65 and name HN) (resid 92 and name HN) 3.530 1.558 1.558 weight 1.000 ! spec=HNH, no=1090, id=1020, vol=1.120000e+07
assign (resid 65 and name HN) (resid 154 and name HB2) 3.341 1.395 1.395 weight 1.000 ! spec=HNH, no=1092, id=1022, vol=1.560000e+07
assign (resid 65 and name HN) (resid 154 and name HG2) 3.489 1.522 1.522 weight 1.000 ! spec=HNH, no=1093, id=1023, vol=1.200000e+07
assign (resid 65 and name HN) (resid 66 and name HN) 3.687 1.699 1.699 weight 1.000 ! spec=HNH, no=1102, id=1031, vol=8.620000e+06
assign (resid 66 and name HN) (resid 65 and name HA) 2.651 0.878 0.878 weight 1.000 ! spec=HNH, no=1103, id=1032, vol=6.250000e+07
assign (resid 66 and name HN) (resid 65 and name HB2) 3.461 1.497 1.497 weight 1.000 ! spec=HNH, no=1104, id=1033, vol=1.260000e+07
assign (resid 66 and name HN) (resid 66 and name HA) 3.082 1.187 1.187 weight 1.000 ! spec=HNH, no=1106, id=1034, vol=2.530000e+07
assign (resid 66 and name HN) (resid 66 and name HB) 2.831 1.002 1.002 weight 1.000 ! spec=HNH, no=1107, id=1035, vol=4.210000e+07
assign (resid 66 and name HN) (resid 66 and name HG12) 3.268 1.335 1.335 weight 1.000 ! spec=HNH, no=1108, id=1036, vol=1.780000e+07
assign (resid 66 and name HN) (resid 66 and name HG11) 2.807 0.985 0.985 weight 1.000 ! spec=HNH, no=1109, id=1037, vol=4.430000e+07
assign (resid 66 and name HN) (resid 66 and name HD12) 3.160 1.248 1.248 weight 1.000 ! spec=HNH, no=1110, id=1038, vol=2.180000e+07
or (resid 66 and name HN) (resid 66 and name HD11)
or (resid 66 and name HN) (resid 66 and name HD13)
assign (resid 66 and name HN) (resid 66 and name HG22) 3.132 1.226 1.226 weight 1.000 ! spec=HNH, no=1111, id=1039, vol=2.290000e+07
or (resid 66 and name HN) (resid 66 and name HG21)
or (resid 66 and name HN) (resid 66 and name HG23)
assign (resid 66 and name HN) (resid 67 and name HN) 3.797 1.803 1.803 weight 1.000 ! spec=HNH, no=1112, id=1040, vol=7.220000e+06
assign (resid 66 and name HN) (resid 104 and name HH2) 2.997 1.122 1.122 weight 1.000 ! spec=HNH, no=1113, id=1041, vol=2.990000e+07
assign (resid 66 and name HN) (resid 138 and name HZ2) 3.493 1.525 1.525 weight 1.000 ! spec=HNH, no=1116, id=1044, vol=1.190000e+07
assign (resid 67 and name HN) (resid 66 and name HA) 2.372 0.703 0.703 weight 1.000 ! spec=HNH, no=1118, id=1046, vol=1.220000e+08
assign (resid 67 and name HN) (resid 66 and name HG12) 3.465 1.501 1.501 weight 1.000 ! spec=HNH, no=1121, id=1049, vol=1.250000e+07
assign (resid 67 and name HN) (resid 67 and name HA) 2.994 1.121 1.121 weight 1.000 ! spec=HNH, no=1122, id=1050, vol=3.010000e+07
assign (resid 67 and name HN) (resid 67 and name HB1) 3.120 1.217 1.217 weight 1.000 ! spec=HNH, no=1123, id=1051, vol=2.350000e+07
assign (resid 67 and name HN) (resid 68 and name HD21) 3.749 1.757 1.757 weight 1.000 ! spec=HNH, no=1125, id=1053, vol=7.800000e+06
assign (resid 68 and name HN) (resid 71 and name HA) 3.759 1.766 1.766 weight 1.000 ! spec=HNH, no=1128, id=1056, vol=7.680000e+06
assign (resid 68 and name HN) (resid 72 and name HA) 3.799 1.804 1.804 weight 1.000 ! spec=HNH, no=1129, id=1057, vol=7.210000e+06
assign (resid 68 and name HN) (resid 112 and name HN) 4.023 2.023 2.023 weight 1.000 ! spec=HNH, no=1133, id=1060, vol=5.110000e+06
assign (resid 68 and name HN) (resid 66 and name HA) 3.035 1.151 1.151 weight 1.000 ! spec=HNH, no=1136, id=1063, vol=2.770000e+07
assign (resid 68 and name HN) (resid 66 and name HB) 3.555 1.580 1.580 weight 1.000 ! spec=HNH, no=1137, id=1064, vol=1.070000e+07
assign (resid 68 and name HN) (resid 66 and name HG12) 3.640 1.656 1.656 weight 1.000 ! spec=HNH, no=1138, id=1065, vol=9.320000e+06
assign (resid 68 and name HN) (resid 66 and name HD12) 3.616 1.635 1.635 weight 1.000 ! spec=HNH, no=1139, id=1066, vol=9.680000e+06
or (resid 68 and name HN) (resid 66 and name HD11)
or (resid 68 and name HN) (resid 66 and name HD13)
assign (resid 68 and name HN) (resid 66 and name HG22) 2.372 0.704 0.704 weight 1.000 ! spec=HNH, no=1140, id=1067, vol=1.210000e+08
or (resid 68 and name HN) (resid 66 and name HG21)
or (resid 68 and name HN) (resid 66 and name HG23)
assign (resid 67 and name HN) (resid 68 and name HN) 2.461 0.757 0.757 weight 1.000 ! spec=HNH, no=1141, id=1068, vol=9.760000e+07
assign (resid 68 and name HN) (resid 67 and name HB2) 3.290 1.353 1.353 weight 1.000 ! spec=HNH, no=1143, id=1070, vol=1.710000e+07
assign (resid 68 and name HN) (resid 68 and name HA) 2.730 0.931 0.931 weight 1.000 ! spec=HNH, no=1145, id=1071, vol=5.240000e+07
assign (resid 68 and name HN) (resid 68 and name HB2) 3.194 1.276 1.276 weight 1.000 ! spec=HNH, no=1146, id=1072, vol=2.040000e+07
assign (resid 68 and name HN) (resid 68 and name HB1) 3.099 1.200 1.200 weight 1.000 ! spec=HNH, no=1147, id=1073, vol=2.450000e+07
assign (resid 68 and name HN) (resid 68 and name HD21) 3.462 1.498 1.498 weight 1.000 ! spec=HNH, no=1148, id=1074, vol=1.260000e+07
assign (resid 68 and name HN) (resid 69 and name HN) 3.217 1.293 1.293 weight 1.000 ! spec=HNH, no=1149, id=1075, vol=1.960000e+07
assign (resid 68 and name HN) (resid 71 and name HN) 3.169 1.255 1.255 weight 1.000 ! spec=HNH, no=1151, id=1077, vol=2.140000e+07
assign (resid 68 and name HN) (resid 71 and name HB2) 2.534 0.803 0.803 weight 1.000 ! spec=HNH, no=1152, id=1078, vol=8.180000e+07
assign (resid 68 and name HN) (resid 72 and name HB2) 3.203 1.282 1.282 weight 1.000 ! spec=HNH, no=1153, id=1079, vol=2.010000e+07
assign (resid 68 and name HN) (resid 112 and name HB2) 3.633 1.650 1.650 weight 1.000 ! spec=HNH, no=1154, id=1080, vol=9.420000e+06
assign (resid 68 and name HD21) (resid 33 and name HE22) 3.661 1.676 1.676 weight 1.000 ! spec=HNH, no=1157, id=1083, vol=8.990000e+06
assign (resid 68 and name HD22) (resid 33 and name HE22) 3.540 1.567 1.567 weight 1.000 ! spec=HNH, no=1162, id=1088, vol=1.100000e+07
assign (resid 68 and name HD21) (resid 67 and name HB1) 3.677 1.690 1.690 weight 1.000 ! spec=HNH, no=1163, id=1089, vol=8.760000e+06
assign (resid 68 and name HD22) (resid 67 and name HB1) 4.056 2.056 2.056 weight 1.000 ! spec=HNH, no=1164, id=1090, vol=4.870000e+06
assign (resid 68 and name HD22) (resid 68 and name HA) 3.753 1.761 1.761 weight 1.000 ! spec=HNH, no=1165, id=1091, vol=7.750000e+06
assign (resid 68 and name HD21) (resid 68 and name HB2) 2.914 1.061 1.061 weight 1.000 ! spec=HNH, no=1166, id=1092, vol=3.540000e+07
assign (resid 68 and name HD22) (resid 68 and name HB2) 3.231 1.305 1.305 weight 1.000 ! spec=HNH, no=1167, id=1093, vol=1.900000e+07
assign (resid 68 and name HD21) (resid 68 and name HB1) 2.704 0.914 0.914 weight 1.000 ! spec=HNH, no=1168, id=1094, vol=5.550000e+07
assign (resid 68 and name HD22) (resid 68 and name HD21) 2.058 0.529 0.529 weight 1.000 ! spec=HNH, no=1172, id=1097, vol=2.850000e+08
assign (resid 68 and name HD22) (resid 70 and name HN) 3.931 1.932 1.932 weight 1.000 ! spec=HNH, no=1174, id=1098, vol=5.870000e+06
assign (resid 68 and name HD22) (resid 70 and name HB1) 3.669 1.683 1.683 weight 1.000 ! spec=HNH, no=1175, id=1099, vol=8.880000e+06
assign (resid 68 and name HD21) (resid 71 and name HN) 3.952 1.952 1.952 weight 1.000 ! spec=HNH, no=1176, id=1100, vol=5.680000e+06
assign (resid 68 and name HD22) (resid 71 and name HN) 3.955 1.955 1.955 weight 1.000 ! spec=HNH, no=1177, id=1101, vol=5.660000e+06
assign (resid 68 and name HD21) (resid 71 and name HB2) 3.481 1.514 1.514 weight 1.000 ! spec=HNH, no=1178, id=1102, vol=1.220000e+07
assign (resid 68 and name HD22) (resid 71 and name HB2) 3.513 1.543 1.543 weight 1.000 ! spec=HNH, no=1179, id=1103, vol=1.150000e+07
assign (resid 69 and name HN) (resid 68 and name HA) 2.438 0.743 0.743 weight 1.000 ! spec=HNH, no=1180, id=1104, vol=1.030000e+08
assign (resid 69 and name HN) (resid 112 and name HE1) 3.163 1.251 1.251 weight 1.000 ! spec=HNH, no=1185, id=1109, vol=2.160000e+07
assign (resid 70 and name HN) (resid 68 and name HB1) 2.494 0.777 0.777 weight 1.000 ! spec=HNH, no=1186, id=1110, vol=9.010000e+07
assign (resid 70 and name HN) (resid 69 and name HA) 2.826 0.998 0.998 weight 1.000 ! spec=HNH, no=1187, id=1111, vol=4.260000e+07
assign (resid 70 and name HN) (resid 69 and name HG2) 2.332 0.680 0.680 weight 1.000 ! spec=HNH, no=1188, id=1112, vol=1.350000e+08
assign (resid 70 and name HN) (resid 69 and name HG1) 2.582 0.833 0.833 weight 1.000 ! spec=HNH, no=1189, id=1113, vol=7.310000e+07
assign (resid 70 and name HN) (resid 70 and name HA) 2.524 0.796 0.796 weight 1.000 ! spec=HNH, no=1191, id=1114, vol=8.390000e+07
assign (resid 70 and name HN) (resid 70 and name HB1) 2.266 0.642 0.642 weight 1.000 ! spec=HNH, no=1193, id=1116, vol=1.600000e+08
assign (resid 70 and name HN) (resid 71 and name HN) 2.434 0.740 0.740 weight 1.000 ! spec=HNH, no=1194, id=1117, vol=1.040000e+08
assign (resid 70 and name HN) (resid 72 and name HN) 3.491 1.524 1.524 weight 1.000 ! spec=HNH, no=1196, id=1119, vol=1.200000e+07
assign (resid 71 and name HN) (resid 32 and name HZ) 3.291 1.354 1.354 weight 1.000 ! spec=HNH, no=1201, id=1124, vol=1.710000e+07
assign (resid 71 and name HN) (resid 74 and name HN) 3.701 1.712 1.712 weight 1.000 ! spec=HNH, no=1203, id=1126, vol=8.430000e+06
assign (resid 71 and name HN) (resid 67 and name HN) 3.685 1.697 1.697 weight 1.000 ! spec=HNH, no=1204, id=1127, vol=8.660000e+06
assign (resid 71 and name HN) (resid 66 and name HG12) 3.987 1.987 1.987 weight 1.000 ! spec=HNH, no=1209, id=1132, vol=5.400000e+06
assign (resid 71 and name HN) (resid 66 and name HD12) 4.002 2.002 2.002 weight 1.000 ! spec=HNH, no=1211, id=1134, vol=5.280000e+06
or (resid 71 and name HN) (resid 66 and name HD11)
or (resid 71 and name HN) (resid 66 and name HD13)
assign (resid 71 and name HN) (resid 66 and name HG22) 3.252 1.322 1.322 weight 1.000 ! spec=HNH, no=1212, id=1135, vol=1.830000e+07
or (resid 71 and name HN) (resid 66 and name HG21)
or (resid 71 and name HN) (resid 66 and name HG23)
assign (resid 71 and name HN) (resid 68 and name HA) 3.825 1.829 1.829 weight 1.000 ! spec=HNH, no=1213, id=1136, vol=6.920000e+06
assign (resid 71 and name HN) (resid 68 and name HB2) 3.669 1.683 1.683 weight 1.000 ! spec=HNH, no=1214, id=1137, vol=8.870000e+06
assign (resid 71 and name HN) (resid 68 and name HB1) 3.753 1.761 1.761 weight 1.000 ! spec=HNH, no=1215, id=1138, vol=7.750000e+06
assign (resid 71 and name HN) (resid 70 and name HA) 2.950 1.088 1.088 weight 1.000 ! spec=HNH, no=1218, id=1141, vol=3.290000e+07
assign (resid 71 and name HN) (resid 70 and name HB1) 2.330 0.679 0.679 weight 1.000 ! spec=HNH, no=1219, id=1142, vol=1.350000e+08
assign (resid 71 and name HN) (resid 71 and name HA) 2.805 0.984 0.984 weight 1.000 ! spec=HNH, no=1222, id=1144, vol=4.440000e+07
assign (resid 71 and name HN) (resid 71 and name HB2) 2.303 0.663 0.663 weight 1.000 ! spec=HNH, no=1223, id=1145, vol=1.450000e+08
assign (resid 71 and name HN) (resid 72 and name HN) 2.650 0.878 0.878 weight 1.000 ! spec=HNH, no=1224, id=1146, vol=6.260000e+07
assign (resid 71 and name HN) (resid 72 and name HB1) 3.518 1.547 1.547 weight 1.000 ! spec=HNH, no=1225, id=1147, vol=1.140000e+07
assign (resid 72 and name HN) (resid 73 and name HB2) 3.118 1.215 1.215 weight 1.000 ! spec=HNH, no=1228, id=1150, vol=2.360000e+07
or (resid 72 and name HN) (resid 73 and name HB1)
or (resid 72 and name HN) (resid 73 and name HB3)
assign (resid 72 and name HN) (resid 138 and name HZ2) 3.751 1.759 1.759 weight 1.000 ! spec=HNH, no=1232, id=1153, vol=7.770000e+06
assign (resid 72 and name HN) (resid 69 and name HA) 3.021 1.141 1.141 weight 1.000 ! spec=HNH, no=1234, id=1155, vol=2.850000e+07
assign (resid 72 and name HN) (resid 66 and name HG12) 3.554 1.579 1.579 weight 1.000 ! spec=HNH, no=1236, id=1157, vol=1.080000e+07
assign (resid 72 and name HN) (resid 66 and name HD12) 3.527 1.555 1.555 weight 1.000 ! spec=HNH, no=1238, id=1159, vol=1.130000e+07
or (resid 72 and name HN) (resid 66 and name HD11)
or (resid 72 and name HN) (resid 66 and name HD13)
assign (resid 68 and name HN) (resid 72 and name HN) 3.098 1.200 1.200 weight 1.000 ! spec=HNH, no=1240, id=1161, vol=2.450000e+07
assign (resid 72 and name HN) (resid 71 and name HA) 3.225 1.300 1.300 weight 1.000 ! spec=HNH, no=1242, id=1163, vol=1.930000e+07
assign (resid 72 and name HN) (resid 71 and name HB2) 2.673 0.893 0.893 weight 1.000 ! spec=HNH, no=1243, id=1164, vol=5.940000e+07
assign (resid 72 and name HN) (resid 72 and name HA) 2.638 0.870 0.870 weight 1.000 ! spec=HNH, no=1245, id=1165, vol=6.420000e+07
assign (resid 72 and name HN) (resid 72 and name HB2) 2.408 0.725 0.725 weight 1.000 ! spec=HNH, no=1246, id=1166, vol=1.110000e+08
assign (resid 72 and name HN) (resid 72 and name HB1) 2.572 0.827 0.827 weight 1.000 ! spec=HNH, no=1247, id=1167, vol=7.480000e+07
assign (resid 72 and name HN) (resid 72 and name HD21) 3.143 1.235 1.235 weight 1.000 ! spec=HNH, no=1248, id=1168, vol=2.250000e+07
assign (resid 72 and name HN) (resid 73 and name HN) 2.624 0.861 0.861 weight 1.000 ! spec=HNH, no=1250, id=1170, vol=6.640000e+07
assign (resid 72 and name HD21) (resid 69 and name HB1) 3.922 1.923 1.923 weight 1.000 ! spec=HNH, no=1256, id=1176, vol=5.950000e+06
assign (resid 72 and name HD21) (resid 76 and name HG) 3.925 1.926 1.926 weight 1.000 ! spec=HNH, no=1258, id=1178, vol=5.920000e+06
assign (resid 72 and name HD22) (resid 76 and name HB1) 3.903 1.904 1.904 weight 1.000 ! spec=HNH, no=1260, id=1180, vol=6.130000e+06
assign (resid 72 and name HD21) (resid 66 and name HG22) 3.684 1.697 1.697 weight 1.000 ! spec=HNH, no=1268, id=1188, vol=8.660000e+06
or (resid 72 and name HD21) (resid 66 and name HG21)
or (resid 72 and name HD21) (resid 66 and name HG23)
assign (resid 72 and name HD22) (resid 66 and name HG22) 3.812 1.816 1.816 weight 1.000 ! spec=HNH, no=1269, id=1189, vol=7.060000e+06
or (resid 72 and name HD22) (resid 66 and name HG21)
or (resid 72 and name HD22) (resid 66 and name HG23)
assign (resid 72 and name HD21) (resid 69 and name HA) 3.693 1.704 1.704 weight 1.000 ! spec=HNH, no=1270, id=1190, vol=8.540000e+06
assign (resid 72 and name HD21) (resid 72 and name HA) 3.287 1.351 1.351 weight 1.000 ! spec=HNH, no=1272, id=1192, vol=1.720000e+07
assign (resid 72 and name HD21) (resid 72 and name HB1) 2.773 0.961 0.961 weight 1.000 ! spec=HNH, no=1276, id=1196, vol=4.760000e+07
assign (resid 72 and name HD22) (resid 72 and name HB1) 3.078 1.184 1.184 weight 1.000 ! spec=HNH, no=1277, id=1197, vol=2.550000e+07
assign (resid 72 and name HD22) (resid 72 and name HD21) 2.194 0.602 0.602 weight 1.000 ! spec=HNH, no=1280, id=1199, vol=1.940000e+08
assign (resid 72 and name HD21) (resid 73 and name HN) 3.465 1.501 1.501 weight 1.000 ! spec=HNH, no=1282, id=1200, vol=1.250000e+07
assign (resid 72 and name HD21) (resid 73 and name HA) 3.420 1.462 1.462 weight 1.000 ! spec=HNH, no=1284, id=1202, vol=1.350000e+07
assign (resid 72 and name HD21) (resid 73 and name HB2) 3.139 1.232 1.232 weight 1.000 ! spec=HNH, no=1285, id=1203, vol=2.260000e+07
or (resid 72 and name HD21) (resid 73 and name HB1)
or (resid 72 and name HD21) (resid 73 and name HB3)
assign (resid 72 and name HD22) (resid 114 and name HB2) 4.088 2.089 2.089 weight 1.000 ! spec=HNH, no=1287, id=1205, vol=4.640000e+06
assign (resid 72 and name HD21) (resid 114 and name HE1) 3.273 1.339 1.339 weight 1.000 ! spec=HNH, no=1290, id=1208, vol=1.760000e+07
assign (resid 72 and name HD22) (resid 114 and name HE1) 3.378 1.427 1.427 weight 1.000 ! spec=HNH, no=1291, id=1209, vol=1.460000e+07
assign (resid 72 and name HD21) (resid 114 and name HG1) 3.472 1.507 1.507 weight 1.000 ! spec=HNH, no=1292, id=1210, vol=1.240000e+07
assign (resid 72 and name HD22) (resid 114 and name HG1) 3.438 1.478 1.478 weight 1.000 ! spec=HNH, no=1293, id=1211, vol=1.310000e+07
assign (resid 72 and name HD21) (resid 131 and name HD12) 2.799 0.980 0.980 weight 1.000 ! spec=HNH, no=1294, id=1212, vol=4.500000e+07
or (resid 72 and name HD21) (resid 131 and name HD11)
or (resid 72 and name HD21) (resid 131 and name HD13)
assign (resid 72 and name HD22) (resid 136 and name HN) 4.334 2.348 2.348 weight 1.000 ! spec=HNH, no=1297, id=1215, vol=3.270000e+06
assign (resid 72 and name HD21) (resid 136 and name HA2) 3.716 1.726 1.726 weight 1.000 ! spec=HNH, no=1298, id=1216, vol=8.230000e+06
assign (resid 72 and name HD21) (resid 136 and name HA1) 3.465 1.501 1.501 weight 1.000 ! spec=HNH, no=1300, id=1218, vol=1.250000e+07
assign (resid 72 and name HD22) (resid 138 and name HE1) 3.453 1.490 1.490 weight 1.000 ! spec=HNH, no=1304, id=1222, vol=1.280000e+07
assign (resid 73 and name HN) (resid 69 and name HA) 3.199 1.279 1.279 weight 1.000 ! spec=HNH, no=1309, id=1227, vol=2.020000e+07
assign (resid 73 and name HN) (resid 131 and name HD22) 3.869 1.871 1.871 weight 1.000 ! spec=HNH, no=1310, id=1228, vol=6.460000e+06
or (resid 73 and name HN) (resid 131 and name HD21)
or (resid 73 and name HN) (resid 131 and name HD23)
assign (resid 73 and name HN) (resid 76 and name HD12) 3.339 1.394 1.394 weight 1.000 ! spec=HNH, no=1317, id=1235, vol=1.560000e+07
or (resid 73 and name HN) (resid 76 and name HD11)
or (resid 73 and name HN) (resid 76 and name HD13)
assign (resid 73 and name HN) (resid 76 and name HN) 3.433 1.473 1.473 weight 1.000 ! spec=HNH, no=1320, id=1238, vol=1.320000e+07
assign (resid 73 and name HN) (resid 66 and name HG22) 3.297 1.359 1.359 weight 1.000 ! spec=HNH, no=1321, id=1239, vol=1.690000e+07
or (resid 73 and name HN) (resid 66 and name HG21)
or (resid 73 and name HN) (resid 66 and name HG23)
assign (resid 73 and name HN) (resid 72 and name HB2) 2.711 0.919 0.919 weight 1.000 ! spec=HNH, no=1326, id=1244, vol=5.450000e+07
assign (resid 73 and name HN) (resid 72 and name HB1) 2.566 0.823 0.823 weight 1.000 ! spec=HNH, no=1327, id=1245, vol=7.580000e+07
assign (resid 72 and name HD22) (resid 73 and name HN) 3.567 1.591 1.591 weight 1.000 ! spec=HNH, no=1328, id=1246, vol=1.050000e+07
assign (resid 73 and name HN) (resid 73 and name HA) 2.410 0.726 0.726 weight 1.000 ! spec=HNH, no=1330, id=1247, vol=1.110000e+08
assign (resid 73 and name HN) (resid 74 and name HN) 2.552 0.814 0.814 weight 1.000 ! spec=HNH, no=1332, id=1249, vol=7.850000e+07
assign (resid 73 and name HN) (resid 74 and name HD1) 4.159 2.162 2.162 weight 1.000 ! spec=HNH, no=1334, id=1251, vol=4.180000e+06
assign (resid 73 and name HN) (resid 112 and name HE1) 3.769 1.776 1.776 weight 1.000 ! spec=HNH, no=1335, id=1252, vol=7.550000e+06
assign (resid 74 and name HN) (resid 71 and name HA) 2.928 1.071 1.071 weight 1.000 ! spec=HNH, no=1348, id=1264, vol=3.440000e+07
assign (resid 74 and name HN) (resid 72 and name HN) 3.354 1.406 1.406 weight 1.000 ! spec=HNH, no=1350, id=1266, vol=1.520000e+07
assign (resid 74 and name HN) (resid 72 and name HB1) 3.666 1.680 1.680 weight 1.000 ! spec=HNH, no=1351, id=1267, vol=8.930000e+06
assign (resid 74 and name HN) (resid 74 and name HA) 2.421 0.733 0.733 weight 1.000 ! spec=HNH, no=1355, id=1270, vol=1.080000e+08
assign (resid 74 and name HN) (resid 74 and name HB2) 2.235 0.624 0.624 weight 1.000 ! spec=HNH, no=1356, id=1271, vol=1.740000e+08
assign (resid 74 and name HN) (resid 74 and name HB1) 2.264 0.641 0.641 weight 1.000 ! spec=HNH, no=1357, id=1272, vol=1.610000e+08
assign (resid 74 and name HN) (resid 75 and name HG12) 3.546 1.572 1.572 weight 1.000 ! spec=HNH, no=1361, id=1276, vol=1.090000e+07
assign (resid 74 and name HN) (resid 76 and name HB1) 3.472 1.507 1.507 weight 1.000 ! spec=HNH, no=1363, id=1278, vol=1.240000e+07
assign (resid 75 and name HN) (resid 76 and name HB1) 3.159 1.248 1.248 weight 1.000 ! spec=HNH, no=1365, id=1280, vol=2.180000e+07
assign (resid 75 and name HN) (resid 73 and name HN) 3.722 1.732 1.732 weight 1.000 ! spec=HNH, no=1366, id=1281, vol=8.150000e+06
assign (resid 75 and name HN) (resid 32 and name HD1) 4.039 2.039 2.039 weight 1.000 ! spec=HNH, no=1372, id=1287, vol=4.990000e+06
or (resid 75 and name HN) (resid 32 and name HD2)
assign (resid 75 and name HN) (resid 71 and name HA) 3.473 1.508 1.508 weight 1.000 ! spec=HNH, no=1376, id=1291, vol=1.230000e+07
assign (resid 75 and name HN) (resid 74 and name HB1) 2.770 0.959 0.959 weight 1.000 ! spec=HNH, no=1379, id=1294, vol=4.800000e+07
assign (resid 75 and name HN) (resid 74 and name HE1) 3.787 1.792 1.792 weight 1.000 ! spec=HNH, no=1380, id=1295, vol=7.350000e+06
assign (resid 75 and name HN) (resid 74 and name HD1) 2.949 1.087 1.087 weight 1.000 ! spec=HNH, no=1381, id=1296, vol=3.290000e+07
assign (resid 75 and name HN) (resid 75 and name HA) 2.782 0.967 0.967 weight 1.000 ! spec=HNH, no=1383, id=1297, vol=4.680000e+07
assign (resid 75 and name HN) (resid 75 and name HB) 2.375 0.705 0.705 weight 1.000 ! spec=HNH, no=1384, id=1298, vol=1.210000e+08
assign (resid 75 and name HN) (resid 75 and name HG12) 2.752 0.946 0.946 weight 1.000 ! spec=HNH, no=1385, id=1299, vol=4.990000e+07
assign (resid 75 and name HN) (resid 75 and name HG11) 2.574 0.828 0.828 weight 1.000 ! spec=HNH, no=1386, id=1300, vol=7.440000e+07
assign (resid 75 and name HN) (resid 76 and name HA) 3.837 1.841 1.841 weight 1.000 ! spec=HNH, no=1390, id=1304, vol=6.790000e+06
assign (resid 76 and name HN) (resid 74 and name HD1) 4.205 2.210 2.210 weight 1.000 ! spec=HNH, no=1397, id=1310, vol=3.920000e+06
or (resid 76 and name HN) (resid 74 and name HD2)
assign (resid 76 and name HN) (resid 73 and name HA) 2.778 0.965 0.965 weight 1.000 ! spec=HNH, no=1401, id=1314, vol=4.710000e+07
assign (resid 76 and name HN) (resid 74 and name HB1) 3.458 1.494 1.494 weight 1.000 ! spec=HNH, no=1404, id=1317, vol=1.270000e+07
assign (resid 75 and name HN) (resid 76 and name HN) 2.439 0.744 0.744 weight 1.000 ! spec=HNH, no=1405, id=1318, vol=1.030000e+08
assign (resid 76 and name HN) (resid 75 and name HA) 3.106 1.206 1.206 weight 1.000 ! spec=HNH, no=1406, id=1319, vol=2.410000e+07
assign (resid 76 and name HN) (resid 75 and name HB) 2.566 0.823 0.823 weight 1.000 ! spec=HNH, no=1407, id=1320, vol=7.600000e+07
assign (resid 76 and name HN) (resid 75 and name HG12) 3.343 1.397 1.397 weight 1.000 ! spec=HNH, no=1408, id=1321, vol=1.550000e+07
assign (resid 76 and name HN) (resid 76 and name HA) 2.629 0.864 0.864 weight 1.000 ! spec=HNH, no=1410, id=1322, vol=6.550000e+07
assign (resid 76 and name HN) (resid 76 and name HB1) 2.242 0.628 0.628 weight 1.000 ! spec=HNH, no=1412, id=1324, vol=1.710000e+08
assign (resid 76 and name HN) (resid 77 and name HN) 2.445 0.747 0.747 weight 1.000 ! spec=HNH, no=1414, id=1326, vol=1.010000e+08
assign (resid 76 and name HN) (resid 77 and name HB1) 3.552 1.577 1.577 weight 1.000 ! spec=HNH, no=1415, id=1327, vol=1.080000e+07
assign (resid 76 and name HN) (resid 78 and name HB) 3.823 1.827 1.827 weight 1.000 ! spec=HNH, no=1416, id=1328, vol=6.940000e+06
assign (resid 76 and name HN) (resid 131 and name HD22) 2.629 0.864 0.864 weight 1.000 ! spec=HNH, no=1418, id=1330, vol=6.560000e+07
or (resid 76 and name HN) (resid 131 and name HD21)
or (resid 76 and name HN) (resid 131 and name HD23)
assign (resid 77 and name HN) (resid 78 and name HG21) 4.030 2.030 2.030 weight 1.000 ! spec=HNH, no=1419, id=1331, vol=5.060000e+06
or (resid 77 and name HN) (resid 78 and name HG22)
or (resid 77 and name HN) (resid 78 and name HG23)
assign (resid 77 and name HN) (resid 75 and name HG12) 4.092 2.093 2.093 weight 1.000 ! spec=HNH, no=1423, id=1334, vol=4.610000e+06
assign (resid 77 and name HN) (resid 74 and name HA) 2.827 0.999 0.999 weight 1.000 ! spec=HNH, no=1428, id=1339, vol=4.250000e+07
assign (resid 77 and name HN) (resid 75 and name HA) 3.443 1.482 1.482 weight 1.000 ! spec=HNH, no=1429, id=1340, vol=1.300000e+07
assign (resid 77 and name HN) (resid 76 and name HA) 3.051 1.163 1.163 weight 1.000 ! spec=HNH, no=1431, id=1342, vol=2.690000e+07
assign (resid 77 and name HN) (resid 76 and name HB2) 2.592 0.840 0.840 weight 1.000 ! spec=HNH, no=1432, id=1343, vol=7.150000e+07
assign (resid 77 and name HN) (resid 76 and name HB1) 2.532 0.802 0.802 weight 1.000 ! spec=HNH, no=1433, id=1344, vol=8.210000e+07
assign (resid 77 and name HN) (resid 76 and name HD12) 3.116 1.214 1.214 weight 1.000 ! spec=HNH, no=1434, id=1345, vol=2.370000e+07
or (resid 77 and name HN) (resid 76 and name HD11)
or (resid 77 and name HN) (resid 76 and name HD13)
assign (resid 77 and name HN) (resid 77 and name HA) 2.514 0.790 0.790 weight 1.000 ! spec=HNH, no=1436, id=1346, vol=8.570000e+07
assign (resid 77 and name HN) (resid 77 and name HB1) 2.251 0.633 0.633 weight 1.000 ! spec=HNH, no=1438, id=1348, vol=1.670000e+08
assign (resid 77 and name HN) (resid 78 and name HA) 3.652 1.668 1.668 weight 1.000 ! spec=HNH, no=1440, id=1350, vol=9.120000e+06
assign (resid 77 and name HN) (resid 78 and name HB) 3.249 1.320 1.320 weight 1.000 ! spec=HNH, no=1441, id=1351, vol=1.840000e+07
assign (resid 78 and name HN) (resid 76 and name HN) 3.121 1.218 1.218 weight 1.000 ! spec=HNH, no=1443, id=1353, vol=2.340000e+07
assign (resid 78 and name HN) (resid 76 and name HD22) 4.005 2.005 2.005 weight 1.000 ! spec=HNH, no=1444, id=1354, vol=5.250000e+06
or (resid 78 and name HN) (resid 76 and name HD21)
or (resid 78 and name HN) (resid 76 and name HD23)
assign (resid 78 and name HN) (resid 76 and name HB1) 3.090 1.194 1.194 weight 1.000 ! spec=HNH, no=1450, id=1360, vol=2.490000e+07
assign (resid 78 and name HN) (resid 75 and name HA) 3.057 1.168 1.168 weight 1.000 ! spec=HNH, no=1452, id=1362, vol=2.660000e+07
assign (resid 77 and name HN) (resid 78 and name HN) 2.530 0.800 0.800 weight 1.000 ! spec=HNH, no=1454, id=1364, vol=8.250000e+07
assign (resid 78 and name HN) (resid 77 and name HB1) 2.805 0.984 0.984 weight 1.000 ! spec=HNH, no=1457, id=1367, vol=4.440000e+07
assign (resid 78 and name HN) (resid 78 and name HA) 2.590 0.839 0.839 weight 1.000 ! spec=HNH, no=1459, id=1368, vol=7.170000e+07
assign (resid 78 and name HN) (resid 78 and name HB) 2.264 0.641 0.641 weight 1.000 ! spec=HNH, no=1460, id=1369, vol=1.610000e+08
assign (resid 78 and name HN) (resid 78 and name HG21) 2.893 1.046 1.046 weight 1.000 ! spec=HNH, no=1461, id=1370, vol=3.700000e+07
or (resid 78 and name HN) (resid 78 and name HG22)
or (resid 78 and name HN) (resid 78 and name HG23)
assign (resid 78 and name HN) (resid 79 and name HB1) 3.235 1.308 1.308 weight 1.000 ! spec=HNH, no=1465, id=1374, vol=1.890000e+07
assign (resid 78 and name HN) (resid 79 and name HD22) 3.362 1.413 1.413 weight 1.000 ! spec=HNH, no=1466, id=1375, vol=1.500000e+07
or (resid 78 and name HN) (resid 79 and name HD21)
or (resid 78 and name HN) (resid 79 and name HD23)
assign (resid 79 and name HN) (resid 79 and name HB2) 2.599 0.844 0.844 weight 1.000 ! spec=HNH, no=1467, id=1376, vol=7.030000e+07
assign (resid 79 and name HN) (resid 81 and name HN) 3.305 1.365 1.365 weight 1.000 ! spec=HNH, no=1469, id=1378, vol=1.660000e+07
assign (resid 79 and name HN) (resid 83 and name HZ3) 3.694 1.706 1.706 weight 1.000 ! spec=HNH, no=1471, id=1380, vol=8.520000e+06
assign (resid 78 and name HN) (resid 79 and name HN) 2.360 0.696 0.696 weight 1.000 ! spec=HNH, no=1474, id=1383, vol=1.250000e+08
assign (resid 79 and name HN) (resid 78 and name HA) 2.994 1.121 1.121 weight 1.000 ! spec=HNH, no=1475, id=1384, vol=3.010000e+07
assign (resid 79 and name HN) (resid 78 and name HB) 2.572 0.827 0.827 weight 1.000 ! spec=HNH, no=1476, id=1385, vol=7.480000e+07
assign (resid 79 and name HN) (resid 78 and name HG21) 3.109 1.208 1.208 weight 1.000 ! spec=HNH, no=1477, id=1386, vol=2.400000e+07
or (resid 79 and name HN) (resid 78 and name HG22)
or (resid 79 and name HN) (resid 78 and name HG23)
assign (resid 79 and name HN) (resid 79 and name HA) 2.747 0.943 0.943 weight 1.000 ! spec=HNH, no=1478, id=1387, vol=5.040000e+07
assign (resid 79 and name HN) (resid 79 and name HB1) 2.378 0.707 0.707 weight 1.000 ! spec=HNH, no=1479, id=1388, vol=1.200000e+08
assign (resid 79 and name HN) (resid 79 and name HD22) 2.705 0.915 0.915 weight 1.000 ! spec=HNH, no=1481, id=1390, vol=5.530000e+07
or (resid 79 and name HN) (resid 79 and name HD21)
or (resid 79 and name HN) (resid 79 and name HD23)
assign (resid 79 and name HN) (resid 80 and name HN) 2.379 0.707 0.707 weight 1.000 ! spec=HNH, no=1482, id=1391, vol=1.200000e+08
assign (resid 80 and name HN) (resid 76 and name HA) 3.707 1.718 1.718 weight 1.000 ! spec=HNH, no=1488, id=1397, vol=8.350000e+06
assign (resid 80 and name HN) (resid 79 and name HD12) 3.848 1.851 1.851 weight 1.000 ! spec=HNH, no=1492, id=1401, vol=6.670000e+06
or (resid 80 and name HN) (resid 79 and name HD11)
or (resid 80 and name HN) (resid 79 and name HD13)
assign (resid 80 and name HN) (resid 80 and name HB2) 2.465 0.760 0.760 weight 1.000 ! spec=HNH, no=1496, id=1404, vol=9.650000e+07
assign (resid 80 and name HN) (resid 80 and name HG2) 2.873 1.032 1.032 weight 1.000 ! spec=HNH, no=1497, id=1405, vol=3.850000e+07
assign (resid 80 and name HN) (resid 82 and name HN) 3.456 1.493 1.493 weight 1.000 ! spec=HNH, no=1501, id=1409, vol=1.270000e+07
assign (resid 80 and name HN) (resid 133 and name HD12) 3.355 1.407 1.407 weight 1.000 ! spec=HNH, no=1502, id=1410, vol=1.520000e+07
or (resid 80 and name HN) (resid 133 and name HD11)
or (resid 80 and name HN) (resid 133 and name HD13)
assign (resid 81 and name HN) (resid 78 and name HA) 3.174 1.260 1.260 weight 1.000 ! spec=HNH, no=1506, id=1414, vol=2.120000e+07
assign (resid 80 and name HN) (resid 81 and name HN) 2.385 0.711 0.711 weight 1.000 ! spec=HNH, no=1508, id=1416, vol=1.180000e+08
assign (resid 81 and name HN) (resid 81 and name HA) 2.454 0.753 0.753 weight 1.000 ! spec=HNH, no=1511, id=1418, vol=9.920000e+07
assign (resid 81 and name HN) (resid 81 and name HB2) 2.332 0.680 0.680 weight 1.000 ! spec=HNH, no=1512, id=1419, vol=1.350000e+08
assign (resid 81 and name HN) (resid 81 and name HB1) 2.260 0.639 0.639 weight 1.000 ! spec=HNH, no=1513, id=1420, vol=1.620000e+08
assign (resid 81 and name HN) (resid 82 and name HN) 2.563 0.821 0.821 weight 1.000 ! spec=HNH, no=1515, id=1422, vol=7.640000e+07
assign (resid 82 and name HN) (resid 78 and name HG21) 3.523 1.551 1.551 weight 1.000 ! spec=HNH, no=1517, id=1424, vol=1.130000e+07
or (resid 82 and name HN) (resid 78 and name HG22)
or (resid 82 and name HN) (resid 78 and name HG23)
assign (resid 82 and name HN) (resid 30 and name HD12) 3.713 1.723 1.723 weight 1.000 ! spec=HNH, no=1518, id=1425, vol=8.270000e+06
or (resid 82 and name HN) (resid 30 and name HD11)
or (resid 82 and name HN) (resid 30 and name HD13)
assign (resid 82 and name HN) (resid 78 and name HB) 4.072 2.073 2.073 weight 1.000 ! spec=HNH, no=1520, id=1427, vol=4.750000e+06
assign (resid 82 and name HN) (resid 81 and name HA) 2.870 1.030 1.030 weight 1.000 ! spec=HNH, no=1526, id=1433, vol=3.870000e+07
assign (resid 82 and name HN) (resid 82 and name HB2) 2.594 0.841 0.841 weight 1.000 ! spec=HNH, no=1528, id=1434, vol=7.100000e+07
assign (resid 82 and name HN) (resid 83 and name HB2) 3.476 1.510 1.510 weight 1.000 ! spec=HNH, no=1532, id=1438, vol=1.230000e+07
assign (resid 82 and name HE21) (resid 28 and name HA) 3.971 1.971 1.971 weight 1.000 ! spec=HNH, no=1533, id=1439, vol=5.530000e+06
assign (resid 82 and name HE21) (resid 82 and name HB2) 3.611 1.630 1.630 weight 1.000 ! spec=HNH, no=1536, id=1442, vol=9.770000e+06
assign (resid 82 and name HE22) (resid 82 and name HA) 4.013 2.013 2.013 weight 1.000 ! spec=HNH, no=1539, id=1445, vol=5.180000e+06
assign (resid 82 and name HE22) (resid 82 and name HB2) 3.799 1.805 1.805 weight 1.000 ! spec=HNH, no=1545, id=1450, vol=7.200000e+06
assign (resid 82 and name HE21) (resid 30 and name HG12) 3.663 1.677 1.677 weight 1.000 ! spec=HNH, no=1546, id=1451, vol=8.970000e+06
assign (resid 82 and name HE21) (resid 30 and name HG11) 3.255 1.324 1.324 weight 1.000 ! spec=HNH, no=1548, id=1453, vol=1.820000e+07
assign (resid 82 and name HE22) (resid 30 and name HG11) 3.526 1.554 1.554 weight 1.000 ! spec=HNH, no=1549, id=1454, vol=1.130000e+07
assign (resid 82 and name HE21) (resid 30 and name HG22) 3.825 1.829 1.829 weight 1.000 ! spec=HNH, no=1550, id=1455, vol=6.910000e+06
or (resid 82 and name HE21) (resid 30 and name HG21)
or (resid 82 and name HE21) (resid 30 and name HG23)
assign (resid 82 and name HE22) (resid 30 and name HG22) 3.890 1.891 1.891 weight 1.000 ! spec=HNH, no=1551, id=1456, vol=6.250000e+06
or (resid 82 and name HE22) (resid 30 and name HG21)
or (resid 82 and name HE22) (resid 30 and name HG23)
assign (resid 82 and name HE21) (resid 78 and name HA) 4.327 2.341 2.341 weight 1.000 ! spec=HNH, no=1552, id=1457, vol=3.300000e+06
assign (resid 82 and name HE21) (resid 78 and name HG21) 3.331 1.387 1.387 weight 1.000 ! spec=HNH, no=1553, id=1458, vol=1.590000e+07
or (resid 82 and name HE21) (resid 78 and name HG22)
or (resid 82 and name HE21) (resid 78 and name HG23)
assign (resid 82 and name HE22) (resid 81 and name HE2) 4.253 2.261 2.261 weight 1.000 ! spec=HNH, no=1556, id=1461, vol=3.660000e+06
assign (resid 82 and name HE22) (resid 82 and name HE21) 1.595 0.318 0.318 weight 1.000 ! spec=HNH, no=1561, id=1465, vol=1.320000e+09
assign (resid 82 and name HE21) (resid 82 and name HG2) 2.858 1.021 1.021 weight 1.000 ! spec=HNH, no=1563, id=1466, vol=3.980000e+07
assign (resid 82 and name HE22) (resid 82 and name HG2) 3.084 1.189 1.189 weight 1.000 ! spec=HNH, no=1564, id=1467, vol=2.520000e+07
assign (resid 82 and name HE21) (resid 82 and name HG1) 2.716 0.922 0.922 weight 1.000 ! spec=HNH, no=1565, id=1468, vol=5.390000e+07
assign (resid 82 and name HE22) (resid 82 and name HG1) 3.060 1.170 1.170 weight 1.000 ! spec=HNH, no=1566, id=1469, vol=2.640000e+07
assign (resid 82 and name HE21) (resid 83 and name HE1) 4.192 2.196 2.196 weight 1.000 ! spec=HNH, no=1567, id=1470, vol=3.990000e+06
assign (resid 82 and name HE22) (resid 83 and name HE1) 4.295 2.306 2.306 weight 1.000 ! spec=HNH, no=1568, id=1471, vol=3.450000e+06
assign (resid 83 and name HN) (resid 78 and name HA) 4.192 2.196 2.196 weight 1.000 ! spec=HNH, no=1581, id=1483, vol=3.990000e+06
assign (resid 83 and name HN) (resid 78 and name HG21) 3.597 1.618 1.618 weight 1.000 ! spec=HNH, no=1582, id=1484, vol=9.990000e+06
or (resid 83 and name HN) (resid 78 and name HG22)
or (resid 83 and name HN) (resid 78 and name HG23)
assign (resid 83 and name HN) (resid 83 and name HA) 3.084 1.189 1.189 weight 1.000 ! spec=HNH, no=1588, id=1489, vol=2.520000e+07
assign (resid 83 and name HN) (resid 83 and name HB2) 2.593 0.840 0.840 weight 1.000 ! spec=HNH, no=1589, id=1490, vol=7.130000e+07
assign (resid 83 and name HE1) (resid 30 and name HD12) 2.867 1.027 1.027 weight 1.000 ! spec=HNH, no=1591, id=1492, vol=3.900000e+07
or (resid 83 and name HE1) (resid 30 and name HD11)
or (resid 83 and name HE1) (resid 30 and name HD13)
assign (resid 83 and name HE1) (resid 79 and name HD12) 4.272 2.281 2.281 weight 1.000 ! spec=HNH, no=1607, id=1505, vol=3.560000e+06
or (resid 83 and name HE1) (resid 79 and name HD11)
or (resid 83 and name HE1) (resid 79 and name HD13)
assign (resid 83 and name HE1) (resid 38 and name HG11) 3.913 1.914 1.914 weight 1.000 ! spec=HNH, no=1608, id=1506, vol=6.040000e+06
assign (resid 83 and name HE1) (resid 83 and name HD1) 3.405 1.450 1.450 weight 1.000 ! spec=HNH, no=1618, id=1513, vol=1.390000e+07
assign (resid 83 and name HE1) (resid 83 and name HB2) 3.724 1.734 1.734 weight 1.000 ! spec=HNH, no=1628, id=1521, vol=8.120000e+06
or (resid 83 and name HE1) (resid 83 and name HB1)
assign (resid 83 and name HE1) (resid 30 and name HG11) 3.360 1.411 1.411 weight 1.000 ! spec=HNH, no=1630, id=1523, vol=1.500000e+07
assign (resid 83 and name HE1) (resid 37 and name HB1) 4.320 2.333 2.333 weight 1.000 ! spec=HNH, no=1631, id=1524, vol=3.330000e+06
assign (resid 83 and name HE1) (resid 38 and name HA) 3.625 1.643 1.643 weight 1.000 ! spec=HNH, no=1632, id=1525, vol=9.550000e+06
assign (resid 83 and name HE1) (resid 78 and name HG21) 3.871 1.873 1.873 weight 1.000 ! spec=HNH, no=1633, id=1526, vol=6.430000e+06
or (resid 83 and name HE1) (resid 78 and name HG22)
or (resid 83 and name HE1) (resid 78 and name HG23)
assign (resid 83 and name HE1) (resid 82 and name HG2) 3.210 1.288 1.288 weight 1.000 ! spec=HNH, no=1635, id=1528, vol=1.980000e+07
assign (resid 83 and name HE1) (resid 83 and name HN) 4.013 2.013 2.013 weight 1.000 ! spec=HNH, no=1636, id=1529, vol=5.180000e+06
assign (resid 84 and name HN) (resid 83 and name HB2) 3.229 1.304 1.304 weight 1.000 ! spec=HNH, no=1642, id=1534, vol=1.910000e+07
or (resid 84 and name HN) (resid 83 and name HB1)
assign (resid 84 and name HN) (resid 83 and name HD1) 3.873 1.875 1.875 weight 1.000 ! spec=HNH, no=1644, id=1536, vol=6.420000e+06
assign (resid 84 and name HN) (resid 84 and name HB1) 2.711 0.919 0.919 weight 1.000 ! spec=HNH, no=1648, id=1539, vol=5.460000e+07
assign (resid 84 and name HN) (resid 84 and name HG2) 2.976 1.107 1.107 weight 1.000 ! spec=HNH, no=1649, id=1540, vol=3.120000e+07
assign (resid 84 and name HN) (resid 85 and name HA2) 3.943 1.943 1.943 weight 1.000 ! spec=HNH, no=1650, id=1541, vol=5.770000e+06
assign (resid 85 and name HN) (resid 83 and name HA) 4.478 2.507 2.507 weight 1.000 ! spec=HNH, no=1651, id=1542, vol=2.690000e+06
assign (resid 85 and name HN) (resid 83 and name HE3) 4.392 2.411 2.411 weight 1.000 ! spec=HNH, no=1652, id=1543, vol=3.020000e+06
assign (resid 85 and name HN) (resid 79 and name HD12) 4.275 2.284 2.284 weight 1.000 ! spec=HNH, no=1654, id=1545, vol=3.550000e+06
or (resid 85 and name HN) (resid 79 and name HD11)
or (resid 85 and name HN) (resid 79 and name HD13)
assign (resid 85 and name HN) (resid 79 and name HD22) 4.474 2.502 2.502 weight 1.000 ! spec=HNH, no=1655, id=1546, vol=2.700000e+06
or (resid 85 and name HN) (resid 79 and name HD21)
or (resid 85 and name HN) (resid 79 and name HD23)
assign (resid 85 and name HN) (resid 83 and name HB2) 4.286 2.297 2.297 weight 1.000 ! spec=HNH, no=1656, id=1547, vol=3.490000e+06
assign (resid 85 and name HN) (resid 84 and name HN) 3.406 1.450 1.450 weight 1.000 ! spec=HNH, no=1657, id=1548, vol=1.390000e+07
assign (resid 85 and name HN) (resid 84 and name HB1) 3.821 1.825 1.825 weight 1.000 ! spec=HNH, no=1659, id=1550, vol=6.960000e+06
assign (resid 87 and name HN) (resid 86 and name HA) 2.210 0.610 0.610 weight 1.000 ! spec=HNH, no=1673, id=1562, vol=1.860000e+08
assign (resid 87 and name HN) (resid 86 and name HB2) 2.524 0.797 0.797 weight 1.000 ! spec=HNH, no=1674, id=1563, vol=8.370000e+07
assign (resid 87 and name HN) (resid 86 and name HB1) 2.636 0.869 0.869 weight 1.000 ! spec=HNH, no=1675, id=1564, vol=6.450000e+07
assign (resid 87 and name HN) (resid 86 and name HG2) 3.094 1.197 1.197 weight 1.000 ! spec=HNH, no=1676, id=1565, vol=2.470000e+07
assign (resid 87 and name HN) (resid 87 and name HA) 2.506 0.785 0.785 weight 1.000 ! spec=HNH, no=1678, id=1566, vol=8.750000e+07
assign (resid 87 and name HN) (resid 87 and name HB2) 2.230 0.622 0.622 weight 1.000 ! spec=HNH, no=1679, id=1567, vol=1.760000e+08
assign (resid 87 and name HN) (resid 88 and name HN) 2.459 0.756 0.756 weight 1.000 ! spec=HNH, no=1680, id=1568, vol=9.800000e+07
assign (resid 87 and name HN) (resid 88 and name HA) 3.931 1.932 1.932 weight 1.000 ! spec=HNH, no=1681, id=1569, vol=5.870000e+06
assign (resid 88 and name HN) (resid 86 and name HB2) 2.589 0.838 0.838 weight 1.000 ! spec=HNH, no=1691, id=1579, vol=7.190000e+07
assign (resid 88 and name HN) (resid 87 and name HB2) 2.569 0.825 0.825 weight 1.000 ! spec=HNH, no=1693, id=1581, vol=7.540000e+07
assign (resid 88 and name HN) (resid 88 and name HA) 2.806 0.984 0.984 weight 1.000 ! spec=HNH, no=1695, id=1582, vol=4.440000e+07
assign (resid 88 and name HN) (resid 89 and name HN) 3.339 1.394 1.394 weight 1.000 ! spec=HNH, no=1697, id=1584, vol=1.560000e+07
assign (resid 88 and name HN) (resid 132 and name HA) 3.771 1.777 1.777 weight 1.000 ! spec=HNH, no=1698, id=1585, vol=7.540000e+06
assign (resid 89 and name HN) (resid 86 and name HG2) 3.869 1.871 1.871 weight 1.000 ! spec=HNH, no=1702, id=1589, vol=6.460000e+06
assign (resid 89 and name HN) (resid 86 and name HD2) 4.058 2.058 2.058 weight 1.000 ! spec=HNH, no=1704, id=1591, vol=4.850000e+06
assign (resid 89 and name HN) (resid 88 and name HA) 2.420 0.732 0.732 weight 1.000 ! spec=HNH, no=1706, id=1593, vol=1.080000e+08
assign (resid 89 and name HN) (resid 88 and name HB2) 2.760 0.952 0.952 weight 1.000 ! spec=HNH, no=1707, id=1594, vol=4.900000e+07
assign (resid 89 and name HN) (resid 89 and name HA) 3.175 1.260 1.260 weight 1.000 ! spec=HNH, no=1709, id=1595, vol=2.120000e+07
assign (resid 89 and name HN) (resid 89 and name HG12) 2.975 1.107 1.107 weight 1.000 ! spec=HNH, no=1711, id=1597, vol=3.120000e+07
assign (resid 89 and name HN) (resid 91 and name HD12) 4.158 2.161 2.161 weight 1.000 ! spec=HNH, no=1713, id=1599, vol=4.190000e+06
or (resid 89 and name HN) (resid 91 and name HD11)
or (resid 89 and name HN) (resid 91 and name HD13)
assign (resid 89 and name HN) (resid 130 and name HA) 3.462 1.498 1.498 weight 1.000 ! spec=HNH, no=1714, id=1600, vol=1.260000e+07
assign (resid 89 and name HN) (resid 130 and name HB2) 3.212 1.290 1.290 weight 1.000 ! spec=HNH, no=1715, id=1601, vol=1.970000e+07
assign (resid 89 and name HN) (resid 131 and name HA) 3.768 1.775 1.775 weight 1.000 ! spec=HNH, no=1718, id=1604, vol=7.560000e+06
assign (resid 89 and name HN) (resid 131 and name HB1) 3.254 1.324 1.324 weight 1.000 ! spec=HNH, no=1719, id=1605, vol=1.820000e+07
assign (resid 89 and name HN) (resid 132 and name HA) 3.363 1.414 1.414 weight 1.000 ! spec=HNH, no=1720, id=1606, vol=1.500000e+07
assign (resid 89 and name HN) (resid 133 and name HA) 4.079 2.080 2.080 weight 1.000 ! spec=HNH, no=1721, id=1607, vol=4.700000e+06
assign (resid 89 and name HN) (resid 133 and name HG11) 3.318 1.376 1.376 weight 1.000 ! spec=HNH, no=1722, id=1608, vol=1.620000e+07
assign (resid 89 and name HN) (resid 133 and name HD12) 2.927 1.071 1.071 weight 1.000 ! spec=HNH, no=1723, id=1609, vol=3.440000e+07
or (resid 89 and name HN) (resid 133 and name HD11)
or (resid 89 and name HN) (resid 133 and name HD13)
assign (resid 90 and name HN) (resid 90 and name HB2) 2.388 0.713 0.713 weight 1.000 ! spec=HNH, no=1726, id=1612, vol=1.170000e+08
assign (resid 90 and name HN) (resid 90 and name HB1) 2.295 0.658 0.658 weight 1.000 ! spec=HNH, no=1737, id=1623, vol=1.480000e+08
assign (resid 90 and name HN) (resid 89 and name HA) 2.191 0.600 0.600 weight 1.000 ! spec=HNH, no=1738, id=1624, vol=1.960000e+08
assign (resid 90 and name HN) (resid 89 and name HB) 2.849 1.015 1.015 weight 1.000 ! spec=HNH, no=1739, id=1625, vol=4.050000e+07
assign (resid 90 and name HN) (resid 90 and name HA) 2.830 1.001 1.001 weight 1.000 ! spec=HNH, no=1743, id=1628, vol=4.220000e+07
assign (resid 90 and name HN) (resid 130 and name HB2) 4.193 2.197 2.197 weight 1.000 ! spec=HNH, no=1744, id=1629, vol=3.990000e+06
assign (resid 90 and name HN) (resid 131 and name HN) 3.865 1.867 1.867 weight 1.000 ! spec=HNH, no=1747, id=1632, vol=6.500000e+06
assign (resid 90 and name HN) (resid 151 and name HA) 3.096 1.198 1.198 weight 1.000 ! spec=HNH, no=1748, id=1633, vol=2.460000e+07
assign (resid 91 and name HN) (resid 104 and name HZ3) 3.944 1.944 1.944 weight 1.000 ! spec=HNH, no=1750, id=1635, vol=5.760000e+06
assign (resid 91 and name HN) (resid 130 and name HB2) 3.450 1.488 1.488 weight 1.000 ! spec=HNH, no=1751, id=1636, vol=1.280000e+07
or (resid 91 and name HN) (resid 130 and name HB1)
assign (resid 91 and name HN) (resid 90 and name HA) 2.355 0.693 0.693 weight 1.000 ! spec=HNH, no=1755, id=1640, vol=1.270000e+08
assign (resid 91 and name HN) (resid 91 and name HA) 3.059 1.170 1.170 weight 1.000 ! spec=HNH, no=1759, id=1643, vol=2.640000e+07
assign (resid 91 and name HN) (resid 91 and name HB2) 2.829 1.000 1.000 weight 1.000 ! spec=HNH, no=1760, id=1644, vol=4.230000e+07
assign (resid 91 and name HN) (resid 91 and name HB1) 2.672 0.892 0.892 weight 1.000 ! spec=HNH, no=1761, id=1645, vol=5.960000e+07
assign (resid 91 and name HN) (resid 130 and name HA) 2.843 1.011 1.011 weight 1.000 ! spec=HNH, no=1765, id=1649, vol=4.100000e+07
assign (resid 91 and name HN) (resid 130 and name HD1) 3.606 1.626 1.626 weight 1.000 ! spec=HNH, no=1766, id=1650, vol=9.850000e+06
assign (resid 92 and name HN) (resid 64 and name HB) 3.543 1.569 1.569 weight 1.000 ! spec=HNH, no=1778, id=1661, vol=1.090000e+07
assign (resid 92 and name HN) (resid 64 and name HG12) 3.158 1.247 1.247 weight 1.000 ! spec=HNH, no=1779, id=1662, vol=2.180000e+07
assign (resid 92 and name HN) (resid 131 and name HD22) 3.971 1.971 1.971 weight 1.000 ! spec=HNH, no=1782, id=1665, vol=5.530000e+06
or (resid 92 and name HN) (resid 131 and name HD21)
or (resid 92 and name HN) (resid 131 and name HD23)
assign (resid 92 and name HN) (resid 63 and name HB2) 3.472 1.506 1.506 weight 1.000 ! spec=HNH, no=1786, id=1668, vol=1.240000e+07
assign (resid 92 and name HN) (resid 63 and name HE2) 3.405 1.449 1.449 weight 1.000 ! spec=HNH, no=1788, id=1670, vol=1.390000e+07
or (resid 92 and name HN) (resid 63 and name HE1)
or (resid 92 and name HN) (resid 63 and name HE3)
assign (resid 92 and name HN) (resid 65 and name HA) 3.929 1.929 1.929 weight 1.000 ! spec=HNH, no=1789, id=1671, vol=5.890000e+06
assign (resid 92 and name HN) (resid 91 and name HN) 3.729 1.738 1.738 weight 1.000 ! spec=HNH, no=1790, id=1672, vol=8.050000e+06
assign (resid 92 and name HN) (resid 91 and name HA) 2.637 0.869 0.869 weight 1.000 ! spec=HNH, no=1791, id=1673, vol=6.440000e+07
assign (resid 92 and name HN) (resid 91 and name HB2) 2.526 0.797 0.797 weight 1.000 ! spec=HNH, no=1792, id=1674, vol=8.340000e+07
assign (resid 92 and name HN) (resid 91 and name HB1) 3.193 1.274 1.274 weight 1.000 ! spec=HNH, no=1793, id=1675, vol=2.040000e+07
assign (resid 92 and name HN) (resid 93 and name HA) 4.249 2.256 2.256 weight 1.000 ! spec=HNH, no=1799, id=1680, vol=3.680000e+06
assign (resid 92 and name HN) (resid 104 and name HE3) 3.660 1.675 1.675 weight 1.000 ! spec=HNH, no=1800, id=1681, vol=9.010000e+06
assign (resid 92 and name HN) (resid 104 and name HZ3) 3.244 1.316 1.316 weight 1.000 ! spec=HNH, no=1802, id=1683, vol=1.860000e+07
assign (resid 92 and name HN) (resid 105 and name HD1) 3.947 1.947 1.947 weight 1.000 ! spec=HNH, no=1803, id=1684, vol=5.730000e+06
assign (resid 93 and name HN) (resid 63 and name HB2) 3.579 1.601 1.601 weight 1.000 ! spec=HNH, no=1805, id=1685, vol=1.030000e+07
assign (resid 93 and name HN) (resid 102 and name HB1) 4.190 2.195 2.195 weight 1.000 ! spec=HNH, no=1807, id=1687, vol=4.000000e+06
assign (resid 93 and name HN) (resid 93 and name HG2) 2.693 0.906 0.906 weight 1.000 ! spec=HNH, no=1810, id=1690, vol=5.680000e+07
or (resid 93 and name HN) (resid 93 and name HG1)
assign (resid 93 and name HN) (resid 90 and name HD22) 3.883 1.885 1.885 weight 1.000 ! spec=HNH, no=1812, id=1692, vol=6.320000e+06
or (resid 93 and name HN) (resid 90 and name HD21)
or (resid 93 and name HN) (resid 90 and name HD23)
assign (resid 93 and name HN) (resid 102 and name HD1) 4.091 2.092 2.092 weight 1.000 ! spec=HNH, no=1820, id=1700, vol=4.620000e+06
or (resid 93 and name HN) (resid 102 and name HD2)
assign (resid 93 and name HN) (resid 63 and name HB1) 3.574 1.597 1.597 weight 1.000 ! spec=HNH, no=1824, id=1704, vol=1.040000e+07
assign (resid 93 and name HN) (resid 63 and name HE2) 3.410 1.454 1.454 weight 1.000 ! spec=HNH, no=1826, id=1706, vol=1.380000e+07
or (resid 93 and name HN) (resid 63 and name HE1)
or (resid 93 and name HN) (resid 63 and name HE3)
assign (resid 93 and name HN) (resid 91 and name HD22) 4.129 2.131 2.131 weight 1.000 ! spec=HNH, no=1827, id=1707, vol=4.370000e+06
or (resid 93 and name HN) (resid 91 and name HD21)
or (resid 93 and name HN) (resid 91 and name HD23)
assign (resid 93 and name HN) (resid 92 and name HA2) 3.046 1.160 1.160 weight 1.000 ! spec=HNH, no=1828, id=1708, vol=2.710000e+07
assign (resid 93 and name HN) (resid 92 and name HA1) 2.747 0.943 0.943 weight 1.000 ! spec=HNH, no=1829, id=1709, vol=5.040000e+07
assign (resid 93 and name HN) (resid 93 and name HA) 2.949 1.087 1.087 weight 1.000 ! spec=HNH, no=1831, id=1710, vol=3.290000e+07
assign (resid 93 and name HN) (resid 94 and name HN) 3.605 1.625 1.625 weight 1.000 ! spec=HNH, no=1833, id=1712, vol=9.870000e+06
assign (resid 93 and name HN) (resid 94 and name HB2) 3.998 1.998 1.998 weight 1.000 ! spec=HNH, no=1834, id=1713, vol=5.310000e+06
assign (resid 94 and name HN) (resid 93 and name HA) 2.324 0.675 0.675 weight 1.000 ! spec=HNH, no=1853, id=1731, vol=1.380000e+08
assign (resid 94 and name HN) (resid 93 and name HB2) 2.820 0.994 0.994 weight 1.000 ! spec=HNH, no=1854, id=1732, vol=4.310000e+07
assign (resid 94 and name HN) (resid 93 and name HB1) 3.035 1.152 1.152 weight 1.000 ! spec=HNH, no=1855, id=1733, vol=2.770000e+07
assign (resid 94 and name HN) (resid 93 and name HG2) 2.825 0.998 0.998 weight 1.000 ! spec=HNH, no=1856, id=1734, vol=4.260000e+07
assign (resid 94 and name HN) (resid 94 and name HA) 2.631 0.866 0.866 weight 1.000 ! spec=HNH, no=1858, id=1735, vol=6.530000e+07
assign (resid 94 and name HN) (resid 94 and name HB2) 3.192 1.273 1.273 weight 1.000 ! spec=HNH, no=1859, id=1736, vol=2.050000e+07
assign (resid 94 and name HN) (resid 94 and name HB1) 3.200 1.280 1.280 weight 1.000 ! spec=HNH, no=1860, id=1737, vol=2.020000e+07
assign (resid 94 and name HN) (resid 95 and name HN) 3.384 1.431 1.431 weight 1.000 ! spec=HNH, no=1862, id=1739, vol=1.440000e+07
assign (resid 94 and name HN) (resid 102 and name HA) 3.544 1.570 1.570 weight 1.000 ! spec=HNH, no=1864, id=1741, vol=1.090000e+07
assign (resid 94 and name HN) (resid 102 and name HD1) 3.369 1.419 1.419 weight 1.000 ! spec=HNH, no=1865, id=1742, vol=1.480000e+07
assign (resid 94 and name HN) (resid 103 and name HA) 4.095 2.096 2.096 weight 1.000 ! spec=HNH, no=1867, id=1744, vol=4.600000e+06
assign (resid 94 and name HN) (resid 103 and name HB2) 3.685 1.697 1.697 weight 1.000 ! spec=HNH, no=1868, id=1745, vol=8.650000e+06
assign (resid 94 and name HN) (resid 103 and name HG2) 3.580 1.602 1.602 weight 1.000 ! spec=HNH, no=1870, id=1747, vol=1.030000e+07
assign (resid 94 and name HN) (resid 105 and name HN) 3.325 1.382 1.382 weight 1.000 ! spec=HNH, no=1872, id=1749, vol=1.600000e+07
assign (resid 94 and name HN) (resid 105 and name HA) 3.750 1.758 1.758 weight 1.000 ! spec=HNH, no=1873, id=1750, vol=7.790000e+06
assign (resid 95 and name HN) (resid 142 and name HA) 3.052 1.164 1.164 weight 1.000 ! spec=HNH, no=1877, id=1753, vol=2.680000e+07
assign (resid 95 and name HN) (resid 94 and name HB1) 2.667 0.889 0.889 weight 1.000 ! spec=HNH, no=1881, id=1757, vol=6.020000e+07
assign (resid 95 and name HN) (resid 95 and name HA) 2.799 0.979 0.979 weight 1.000 ! spec=HNH, no=1884, id=1759, vol=4.510000e+07
assign (resid 95 and name HN) (resid 95 and name HB1) 2.485 0.772 0.772 weight 1.000 ! spec=HNH, no=1885, id=1760, vol=9.190000e+07
assign (resid 95 and name HN) (resid 102 and name HD1) 3.268 1.335 1.335 weight 1.000 ! spec=HNH, no=1888, id=1763, vol=1.780000e+07
assign (resid 96 and name HN) (resid 97 and name HN) 3.096 1.198 1.198 weight 1.000 ! spec=HNH, no=1889, id=1764, vol=2.460000e+07
assign (resid 96 and name HN) (resid 103 and name HD1) 3.890 1.891 1.891 weight 1.000 ! spec=HNH, no=1890, id=1765, vol=6.250000e+06
assign (resid 96 and name HN) (resid 95 and name HB2) 3.241 1.313 1.313 weight 1.000 ! spec=HNH, no=1893, id=1768, vol=1.870000e+07
assign (resid 96 and name HN) (resid 99 and name HN) 3.895 1.897 1.897 weight 1.000 ! spec=HNH, no=1897, id=1772, vol=6.200000e+06
assign (resid 96 and name HN) (resid 94 and name HA) 3.925 1.926 1.926 weight 1.000 ! spec=HNH, no=1901, id=1776, vol=5.920000e+06
assign (resid 96 and name HN) (resid 95 and name HN) 3.650 1.665 1.665 weight 1.000 ! spec=HNH, no=1903, id=1778, vol=9.160000e+06
assign (resid 96 and name HN) (resid 95 and name HA) 2.311 0.668 0.668 weight 1.000 ! spec=HNH, no=1904, id=1779, vol=1.420000e+08
assign (resid 96 and name HN) (resid 96 and name HA) 2.870 1.029 1.029 weight 1.000 ! spec=HNH, no=1908, id=1782, vol=3.880000e+07
assign (resid 96 and name HN) (resid 96 and name HB2) 2.650 0.878 0.878 weight 1.000 ! spec=HNH, no=1909, id=1783, vol=6.260000e+07
assign (resid 96 and name HN) (resid 96 and name HB1) 2.546 0.810 0.810 weight 1.000 ! spec=HNH, no=1910, id=1784, vol=7.950000e+07
assign (resid 96 and name HN) (resid 101 and name HN) 2.837 1.006 1.006 weight 1.000 ! spec=HNH, no=1913, id=1787, vol=4.160000e+07
assign (resid 96 and name HN) (resid 101 and name HB1) 3.753 1.761 1.761 weight 1.000 ! spec=HNH, no=1914, id=1788, vol=7.750000e+06
assign (resid 96 and name HN) (resid 102 and name HA) 2.934 1.076 1.076 weight 1.000 ! spec=HNH, no=1915, id=1789, vol=3.390000e+07
assign (resid 96 and name HN) (resid 103 and name HG2) 3.259 1.328 1.328 weight 1.000 ! spec=HNH, no=1918, id=1792, vol=1.810000e+07
assign (resid 97 and name HN) (resid 100 and name HN) 3.427 1.468 1.468 weight 1.000 ! spec=HNH, no=1919, id=1793, vol=1.340000e+07
assign (resid 97 and name HN) (resid 96 and name HA) 2.057 0.529 0.529 weight 1.000 ! spec=HNH, no=1926, id=1799, vol=2.860000e+08
assign (resid 97 and name HN) (resid 96 and name HB1) 3.207 1.286 1.286 weight 1.000 ! spec=HNH, no=1928, id=1801, vol=1.990000e+07
assign (resid 97 and name HN) (resid 97 and name HA) 2.582 0.834 0.834 weight 1.000 ! spec=HNH, no=1930, id=1802, vol=7.300000e+07
assign (resid 97 and name HN) (resid 99 and name HN) 3.337 1.392 1.392 weight 1.000 ! spec=HNH, no=1933, id=1805, vol=1.570000e+07
assign (resid 98 and name HN) (resid 96 and name HB2) 3.411 1.454 1.454 weight 1.000 ! spec=HNH, no=1934, id=1806, vol=1.380000e+07
assign (resid 98 and name HN) (resid 101 and name HN) 3.817 1.821 1.821 weight 1.000 ! spec=HNH, no=1935, id=1807, vol=7.010000e+06
assign (resid 98 and name HN) (resid 96 and name HA) 2.774 0.962 0.962 weight 1.000 ! spec=HNH, no=1937, id=1809, vol=4.760000e+07
assign (resid 98 and name HN) (resid 96 and name HB1) 3.164 1.252 1.252 weight 1.000 ! spec=HNH, no=1938, id=1810, vol=2.160000e+07
assign (resid 98 and name HN) (resid 97 and name HA) 2.806 0.984 0.984 weight 1.000 ! spec=HNH, no=1939, id=1811, vol=4.440000e+07
assign (resid 98 and name HN) (resid 98 and name HB1) 2.239 0.627 0.627 weight 1.000 ! spec=HNH, no=1942, id=1813, vol=1.720000e+08
assign (resid 98 and name HN) (resid 99 and name HN) 2.314 0.669 0.669 weight 1.000 ! spec=HNH, no=1943, id=1814, vol=1.410000e+08
assign (resid 98 and name HN) (resid 100 and name HN) 2.979 1.109 1.109 weight 1.000 ! spec=HNH, no=1946, id=1817, vol=3.100000e+07
assign (resid 99 and name HN) (resid 96 and name HB2) 3.496 1.528 1.528 weight 1.000 ! spec=HNH, no=1952, id=1823, vol=1.190000e+07
assign (resid 99 and name HN) (resid 96 and name HB1) 3.104 1.204 1.204 weight 1.000 ! spec=HNH, no=1953, id=1824, vol=2.420000e+07
assign (resid 99 and name HN) (resid 97 and name HA) 3.431 1.472 1.472 weight 1.000 ! spec=HNH, no=1954, id=1825, vol=1.330000e+07
assign (resid 99 and name HN) (resid 98 and name HA) 2.923 1.068 1.068 weight 1.000 ! spec=HNH, no=1956, id=1827, vol=3.480000e+07
assign (resid 99 and name HN) (resid 98 and name HB2) 2.764 0.955 0.955 weight 1.000 ! spec=HNH, no=1957, id=1828, vol=4.860000e+07
assign (resid 99 and name HN) (resid 99 and name HA) 2.719 0.924 0.924 weight 1.000 ! spec=HNH, no=1960, id=1830, vol=5.370000e+07
assign (resid 99 and name HN) (resid 99 and name HB2) 2.378 0.707 0.707 weight 1.000 ! spec=HNH, no=1961, id=1831, vol=1.200000e+08
assign (resid 99 and name HN) (resid 100 and name HA) 2.996 1.122 1.122 weight 1.000 ! spec=HNH, no=1963, id=1833, vol=3.000000e+07
assign (resid 100 and name HN) (resid 95 and name HD1) 4.071 2.072 2.072 weight 1.000 ! spec=HNH, no=1966, id=1836, vol=4.760000e+06
assign (resid 100 and name HN) (resid 96 and name HB2) 3.863 1.866 1.866 weight 1.000 ! spec=HNH, no=1968, id=1838, vol=6.510000e+06
assign (resid 100 and name HN) (resid 97 and name HA) 2.770 0.959 0.959 weight 1.000 ! spec=HNH, no=1969, id=1839, vol=4.800000e+07
assign (resid 100 and name HN) (resid 98 and name HB2) 3.481 1.515 1.515 weight 1.000 ! spec=HNH, no=1971, id=1841, vol=1.220000e+07
assign (resid 99 and name HN) (resid 100 and name HN) 2.249 0.632 0.632 weight 1.000 ! spec=HNH, no=1972, id=1842, vol=1.670000e+08
assign (resid 100 and name HN) (resid 99 and name HA) 2.976 1.107 1.107 weight 1.000 ! spec=HNH, no=1973, id=1843, vol=3.120000e+07
assign (resid 100 and name HN) (resid 99 and name HB2) 2.926 1.070 1.070 weight 1.000 ! spec=HNH, no=1974, id=1844, vol=3.450000e+07
assign (resid 100 and name HN) (resid 100 and name HA) 2.174 0.591 0.591 weight 1.000 ! spec=HNH, no=1976, id=1845, vol=2.050000e+08
assign (resid 101 and name HN) (resid 99 and name HB1) 3.966 1.966 1.966 weight 1.000 ! spec=HNH, no=1981, id=1850, vol=5.570000e+06
assign (resid 101 and name HN) (resid 95 and name HA) 3.470 1.505 1.505 weight 1.000 ! spec=HNH, no=1985, id=1854, vol=1.240000e+07
assign (resid 101 and name HN) (resid 95 and name HD1) 3.652 1.667 1.667 weight 1.000 ! spec=HNH, no=1990, id=1859, vol=9.140000e+06
assign (resid 101 and name HN) (resid 96 and name HB1) 2.830 1.001 1.001 weight 1.000 ! spec=HNH, no=1994, id=1863, vol=4.220000e+07
assign (resid 101 and name HN) (resid 97 and name HA) 3.155 1.244 1.244 weight 1.000 ! spec=HNH, no=1995, id=1864, vol=2.200000e+07
assign (resid 99 and name HN) (resid 101 and name HN) 2.979 1.109 1.109 weight 1.000 ! spec=HNH, no=1996, id=1865, vol=3.100000e+07
assign (resid 101 and name HN) (resid 99 and name HB2) 3.097 1.199 1.199 weight 1.000 ! spec=HNH, no=1997, id=1866, vol=2.460000e+07
assign (resid 100 and name HN) (resid 101 and name HN) 2.474 0.765 0.765 weight 1.000 ! spec=HNH, no=1998, id=1867, vol=9.440000e+07
assign (resid 101 and name HN) (resid 100 and name HA) 2.247 0.631 0.631 weight 1.000 ! spec=HNH, no=1999, id=1868, vol=1.680000e+08
assign (resid 101 and name HN) (resid 102 and name HN) 3.267 1.334 1.334 weight 1.000 ! spec=HNH, no=2003, id=1871, vol=1.780000e+07
assign (resid 101 and name HN) (resid 103 and name HD1) 3.972 1.972 1.972 weight 1.000 ! spec=HNH, no=2005, id=1873, vol=5.510000e+06
assign (resid 101 and name HN) (resid 103 and name HE2) 3.367 1.417 1.417 weight 1.000 ! spec=HNH, no=2006, id=1874, vol=1.490000e+07
assign (resid 101 and name HN) (resid 103 and name HG2) 3.407 1.451 1.451 weight 1.000 ! spec=HNH, no=2007, id=1875, vol=1.390000e+07
assign (resid 102 and name HN) (resid 101 and name HB2) 2.540 0.806 0.806 weight 1.000 ! spec=HNH, no=2012, id=1880, vol=8.070000e+07
assign (resid 102 and name HN) (resid 102 and name HB2) 2.443 0.746 0.746 weight 1.000 ! spec=HNH, no=2016, id=1883, vol=1.020000e+08
assign (resid 102 and name HN) (resid 102 and name HB1) 2.649 0.877 0.877 weight 1.000 ! spec=HNH, no=2017, id=1884, vol=6.260000e+07
assign (resid 102 and name HN) (resid 103 and name HG2) 3.222 1.297 1.297 weight 1.000 ! spec=HNH, no=2019, id=1886, vol=1.940000e+07
assign (resid 103 and name HN) (resid 93 and name HA) 3.531 1.559 1.559 weight 1.000 ! spec=HNH, no=2024, id=1891, vol=1.120000e+07
assign (resid 103 and name HN) (resid 93 and name HB2) 2.870 1.029 1.029 weight 1.000 ! spec=HNH, no=2025, id=1892, vol=3.880000e+07
assign (resid 94 and name HN) (resid 103 and name HN) 2.761 0.953 0.953 weight 1.000 ! spec=HNH, no=2026, id=1893, vol=4.890000e+07
assign (resid 103 and name HN) (resid 95 and name HA) 3.036 1.152 1.152 weight 1.000 ! spec=HNH, no=2027, id=1894, vol=2.760000e+07
assign (resid 96 and name HN) (resid 103 and name HN) 3.527 1.555 1.555 weight 1.000 ! spec=HNH, no=2028, id=1895, vol=1.130000e+07
assign (resid 103 and name HN) (resid 102 and name HB2) 3.074 1.181 1.181 weight 1.000 ! spec=HNH, no=2030, id=1897, vol=2.570000e+07
assign (resid 103 and name HN) (resid 102 and name HB1) 2.894 1.047 1.047 weight 1.000 ! spec=HNH, no=2031, id=1898, vol=3.690000e+07
assign (resid 103 and name HN) (resid 102 and name HD1) 3.030 1.148 1.148 weight 1.000 ! spec=HNH, no=2032, id=1899, vol=2.800000e+07
assign (resid 103 and name HN) (resid 103 and name HA) 2.933 1.075 1.075 weight 1.000 ! spec=HNH, no=2034, id=1900, vol=3.410000e+07
assign (resid 103 and name HN) (resid 103 and name HB2) 2.859 1.022 1.022 weight 1.000 ! spec=HNH, no=2035, id=1901, vol=3.970000e+07
assign (resid 103 and name HN) (resid 103 and name HG2) 2.791 0.974 0.974 weight 1.000 ! spec=HNH, no=2036, id=1902, vol=4.580000e+07
assign (resid 103 and name HN) (resid 104 and name HA) 3.477 1.511 1.511 weight 1.000 ! spec=HNH, no=2037, id=1903, vol=1.230000e+07
assign (resid 103 and name HN) (resid 110 and name HE2) 3.894 1.895 1.895 weight 1.000 ! spec=HNH, no=2038, id=1904, vol=6.210000e+06
or (resid 103 and name HN) (resid 110 and name HE1)
or (resid 103 and name HN) (resid 110 and name HE3)
assign (resid 104 and name HN) (resid 94 and name HD1) 4.053 2.054 2.054 weight 1.000 ! spec=HNH, no=2039, id=1905, vol=4.880000e+06
or (resid 104 and name HN) (resid 94 and name HD2)
assign (resid 104 and name HN) (resid 103 and name HA) 2.240 0.627 0.627 weight 1.000 ! spec=HNH, no=2042, id=1908, vol=1.710000e+08
assign (resid 104 and name HN) (resid 103 and name HB2) 2.992 1.119 1.119 weight 1.000 ! spec=HNH, no=2043, id=1909, vol=3.020000e+07
assign (resid 104 and name HN) (resid 103 and name HB1) 2.630 0.865 0.865 weight 1.000 ! spec=HNH, no=2044, id=1910, vol=6.540000e+07
assign (resid 104 and name HN) (resid 104 and name HA) 2.966 1.100 1.100 weight 1.000 ! spec=HNH, no=2048, id=1913, vol=3.180000e+07
assign (resid 104 and name HN) (resid 104 and name HB2) 2.536 0.804 0.804 weight 1.000 ! spec=HNH, no=2049, id=1914, vol=8.150000e+07
assign (resid 104 and name HN) (resid 104 and name HB1) 2.624 0.861 0.861 weight 1.000 ! spec=HNH, no=2050, id=1915, vol=6.640000e+07
assign (resid 104 and name HN) (resid 104 and name HE3) 3.807 1.812 1.812 weight 1.000 ! spec=HNH, no=2052, id=1917, vol=7.110000e+06
assign (resid 104 and name HN) (resid 107 and name HN) 3.678 1.691 1.691 weight 1.000 ! spec=HNH, no=2054, id=1919, vol=8.750000e+06
assign (resid 104 and name HN) (resid 107 and name HA) 3.459 1.496 1.496 weight 1.000 ! spec=HNH, no=2055, id=1920, vol=1.260000e+07
assign (resid 104 and name HE1) (resid 110 and name HB1) 3.568 1.591 1.591 weight 1.000 ! spec=HNH, no=2060, id=1924, vol=1.050000e+07
assign (resid 104 and name HE1) (resid 66 and name HN) 3.811 1.815 1.815 weight 1.000 ! spec=HNH, no=2061, id=1925, vol=7.070000e+06
assign (resid 104 and name HE1) (resid 110 and name HG2) 3.259 1.328 1.328 weight 1.000 ! spec=HNH, no=2063, id=1927, vol=1.810000e+07
assign (resid 104 and name HE1) (resid 66 and name HG22) 4.235 2.241 2.241 weight 1.000 ! spec=HNH, no=2065, id=1929, vol=3.760000e+06
or (resid 104 and name HE1) (resid 66 and name HG21)
or (resid 104 and name HE1) (resid 66 and name HG23)
assign (resid 104 and name HE1) (resid 103 and name HA) 4.302 2.313 2.313 weight 1.000 ! spec=HNH, no=2067, id=1931, vol=3.420000e+06
assign (resid 104 and name HE1) (resid 104 and name HB2) 3.867 1.869 1.869 weight 1.000 ! spec=HNH, no=2068, id=1932, vol=6.480000e+06
assign (resid 104 and name HE1) (resid 104 and name HB1) 4.127 2.129 2.129 weight 1.000 ! spec=HNH, no=2069, id=1933, vol=4.380000e+06
assign (resid 104 and name HE1) (resid 104 and name HH2) 4.196 2.201 2.201 weight 1.000 ! spec=HNH, no=2072, id=1935, vol=3.970000e+06
assign (resid 104 and name HE1) (resid 110 and name HA) 2.579 0.831 0.831 weight 1.000 ! spec=HNH, no=2075, id=1938, vol=7.360000e+07
assign (resid 104 and name HE1) (resid 110 and name HB2) 3.357 1.409 1.409 weight 1.000 ! spec=HNH, no=2076, id=1939, vol=1.510000e+07
assign (resid 104 and name HE1) (resid 110 and name HG1) 3.474 1.509 1.509 weight 1.000 ! spec=HNH, no=2079, id=1942, vol=1.230000e+07
assign (resid 104 and name HE1) (resid 138 and name HH2) 3.651 1.666 1.666 weight 1.000 ! spec=HNH, no=2082, id=1945, vol=9.150000e+06
assign (resid 104 and name HE1) (resid 138 and name HZ3) 4.521 2.555 2.555 weight 1.000 ! spec=HNH, no=2083, id=1946, vol=2.540000e+06
assign (resid 105 and name HN) (resid 93 and name HB2) 3.570 1.593 1.593 weight 1.000 ! spec=HNH, no=2085, id=1948, vol=1.050000e+07
assign (resid 105 and name HN) (resid 106 and name HA) 3.841 1.844 1.844 weight 1.000 ! spec=HNH, no=2087, id=1950, vol=6.750000e+06
assign (resid 105 and name HN) (resid 93 and name HN) 3.615 1.633 1.633 weight 1.000 ! spec=HNH, no=2088, id=1951, vol=9.710000e+06
assign (resid 105 and name HN) (resid 94 and name HD1) 3.533 1.561 1.561 weight 1.000 ! spec=HNH, no=2090, id=1953, vol=1.110000e+07
assign (resid 104 and name HN) (resid 105 and name HN) 3.544 1.570 1.570 weight 1.000 ! spec=HNH, no=2091, id=1954, vol=1.090000e+07
assign (resid 105 and name HN) (resid 104 and name HA) 2.377 0.706 0.706 weight 1.000 ! spec=HNH, no=2092, id=1955, vol=1.200000e+08
assign (resid 105 and name HN) (resid 104 and name HB2) 3.274 1.340 1.340 weight 1.000 ! spec=HNH, no=2093, id=1956, vol=1.760000e+07
assign (resid 105 and name HN) (resid 104 and name HE3) 3.259 1.328 1.328 weight 1.000 ! spec=HNH, no=2094, id=1957, vol=1.810000e+07
assign (resid 105 and name HN) (resid 105 and name HA) 2.894 1.047 1.047 weight 1.000 ! spec=HNH, no=2096, id=1958, vol=3.680000e+07
assign (resid 105 and name HN) (resid 105 and name HB2) 2.795 0.976 0.976 weight 1.000 ! spec=HNH, no=2097, id=1959, vol=4.540000e+07
assign (resid 105 and name HN) (resid 105 and name HB1) 2.941 1.081 1.081 weight 1.000 ! spec=HNH, no=2098, id=1960, vol=3.350000e+07
assign (resid 105 and name HN) (resid 105 and name HD1) 3.056 1.168 1.168 weight 1.000 ! spec=HNH, no=2099, id=1961, vol=2.660000e+07
assign (resid 105 and name HN) (resid 105 and name HE1) 3.567 1.591 1.591 weight 1.000 ! spec=HNH, no=2100, id=1962, vol=1.050000e+07
assign (resid 106 and name HN) (resid 104 and name HD1) 4.127 2.129 2.129 weight 1.000 ! spec=HNH, no=2102, id=1964, vol=4.390000e+06
assign (resid 106 and name HN) (resid 105 and name HD1) 3.750 1.757 1.757 weight 1.000 ! spec=HNH, no=2103, id=1965, vol=7.790000e+06
or (resid 106 and name HN) (resid 105 and name HD2)
assign (resid 106 and name HN) (resid 104 and name HA) 3.315 1.373 1.373 weight 1.000 ! spec=HNH, no=2108, id=1970, vol=1.630000e+07
assign (resid 106 and name HN) (resid 104 and name HB2) 2.652 0.879 0.879 weight 1.000 ! spec=HNH, no=2109, id=1971, vol=6.220000e+07
assign (resid 106 and name HN) (resid 104 and name HB1) 2.917 1.063 1.063 weight 1.000 ! spec=HNH, no=2110, id=1972, vol=3.520000e+07
assign (resid 105 and name HN) (resid 106 and name HN) 2.955 1.091 1.091 weight 1.000 ! spec=HNH, no=2111, id=1973, vol=3.260000e+07
assign (resid 106 and name HN) (resid 105 and name HA) 3.167 1.254 1.254 weight 1.000 ! spec=HNH, no=2112, id=1974, vol=2.140000e+07
assign (resid 106 and name HN) (resid 105 and name HB2) 2.942 1.082 1.082 weight 1.000 ! spec=HNH, no=2113, id=1975, vol=3.340000e+07
assign (resid 106 and name HN) (resid 106 and name HA) 2.742 0.940 0.940 weight 1.000 ! spec=HNH, no=2115, id=1976, vol=5.100000e+07
assign (resid 106 and name HN) (resid 106 and name HB2) 2.712 0.919 0.919 weight 1.000 ! spec=HNH, no=2116, id=1977, vol=5.450000e+07
assign (resid 106 and name HN) (resid 107 and name HN) 2.843 1.011 1.011 weight 1.000 ! spec=HNH, no=2117, id=1978, vol=4.100000e+07
assign (resid 106 and name HN) (resid 107 and name HA) 3.546 1.572 1.572 weight 1.000 ! spec=HNH, no=2118, id=1979, vol=1.090000e+07
assign (resid 107 and name HN) (resid 105 and name HA) 3.170 1.256 1.256 weight 1.000 ! spec=HNH, no=2122, id=1983, vol=2.140000e+07
assign (resid 107 and name HN) (resid 104 and name HD1) 3.960 1.961 1.961 weight 1.000 ! spec=HNH, no=2124, id=1985, vol=5.610000e+06
assign (resid 107 and name HN) (resid 94 and name HE1) 3.845 1.848 1.848 weight 1.000 ! spec=HNH, no=2125, id=1986, vol=6.700000e+06
or (resid 107 and name HN) (resid 94 and name HE2)
assign (resid 107 and name HN) (resid 104 and name HA) 3.786 1.791 1.791 weight 1.000 ! spec=HNH, no=2126, id=1987, vol=7.360000e+06
assign (resid 107 and name HN) (resid 104 and name HB1) 3.320 1.378 1.378 weight 1.000 ! spec=HNH, no=2127, id=1988, vol=1.620000e+07
assign (resid 107 and name HN) (resid 105 and name HN) 4.036 2.036 2.036 weight 1.000 ! spec=HNH, no=2128, id=1989, vol=5.010000e+06
assign (resid 107 and name HN) (resid 105 and name HB1) 3.932 1.933 1.933 weight 1.000 ! spec=HNH, no=2129, id=1990, vol=5.860000e+06
assign (resid 107 and name HN) (resid 106 and name HB2) 3.624 1.642 1.642 weight 1.000 ! spec=HNH, no=2131, id=1992, vol=9.560000e+06
assign (resid 107 and name HN) (resid 107 and name HA) 2.184 0.596 0.596 weight 1.000 ! spec=HNH, no=2133, id=1993, vol=2.000000e+08
assign (resid 107 and name HN) (resid 107 and name HB2) 2.800 0.980 0.980 weight 1.000 ! spec=HNH, no=2134, id=1994, vol=4.500000e+07
assign (resid 107 and name HD22) (resid 105 and name HA) 3.724 1.733 1.733 weight 1.000 ! spec=HNH, no=2142, id=2001, vol=8.130000e+06
assign (resid 107 and name HD21) (resid 107 and name HN) 3.725 1.734 1.734 weight 1.000 ! spec=HNH, no=2143, id=2002, vol=8.110000e+06
assign (resid 107 and name HD22) (resid 107 and name HN) 3.780 1.786 1.786 weight 1.000 ! spec=HNH, no=2144, id=2003, vol=7.430000e+06
assign (resid 107 and name HD21) (resid 107 and name HA) 3.512 1.541 1.541 weight 1.000 ! spec=HNH, no=2145, id=2004, vol=1.160000e+07
assign (resid 107 and name HD22) (resid 107 and name HA) 3.400 1.445 1.445 weight 1.000 ! spec=HNH, no=2146, id=2005, vol=1.400000e+07
assign (resid 107 and name HD21) (resid 107 and name HB2) 2.815 0.990 0.990 weight 1.000 ! spec=HNH, no=2147, id=2006, vol=4.350000e+07
assign (resid 107 and name HD22) (resid 107 and name HB2) 3.002 1.127 1.127 weight 1.000 ! spec=HNH, no=2148, id=2007, vol=2.960000e+07
assign (resid 107 and name HD21) (resid 107 and name HB1) 3.074 1.181 1.181 weight 1.000 ! spec=HNH, no=2149, id=2008, vol=2.570000e+07
assign (resid 107 and name HD22) (resid 107 and name HD21) 1.505 0.283 0.283 weight 1.000 ! spec=HNH, no=2153, id=2011, vol=1.870000e+09
assign (resid 108 and name HN) (resid 104 and name HA) 3.935 1.936 1.936 weight 1.000 ! spec=HNH, no=2155, id=2012, vol=5.840000e+06
assign (resid 108 and name HN) (resid 104 and name HD1) 3.753 1.760 1.760 weight 1.000 ! spec=HNH, no=2156, id=2013, vol=7.760000e+06
assign (resid 108 and name HN) (resid 104 and name HB1) 3.232 1.305 1.305 weight 1.000 ! spec=HNH, no=2157, id=2014, vol=1.900000e+07
assign (resid 108 and name HN) (resid 106 and name HB2) 4.054 2.055 2.055 weight 1.000 ! spec=HNH, no=2159, id=2016, vol=4.880000e+06
assign (resid 107 and name HN) (resid 108 and name HN) 2.704 0.914 0.914 weight 1.000 ! spec=HNH, no=2160, id=2017, vol=5.540000e+07
assign (resid 108 and name HN) (resid 107 and name HA) 2.810 0.987 0.987 weight 1.000 ! spec=HNH, no=2161, id=2018, vol=4.400000e+07
assign (resid 108 and name HN) (resid 107 and name HB2) 3.134 1.228 1.228 weight 1.000 ! spec=HNH, no=2162, id=2019, vol=2.290000e+07
assign (resid 108 and name HN) (resid 108 and name HA) 2.803 0.982 0.982 weight 1.000 ! spec=HNH, no=2165, id=2021, vol=4.470000e+07
assign (resid 108 and name HN) (resid 108 and name HB2) 2.948 1.087 1.087 weight 1.000 ! spec=HNH, no=2166, id=2022, vol=3.300000e+07
assign (resid 109 and name HN) (resid 108 and name HB2) 3.032 1.149 1.149 weight 1.000 ! spec=HNH, no=2170, id=2026, vol=2.790000e+07
assign (resid 109 and name HN) (resid 108 and name HB1) 2.812 0.988 0.988 weight 1.000 ! spec=HNH, no=2171, id=2027, vol=4.380000e+07
assign (resid 109 and name HN) (resid 109 and name HB2) 2.402 0.721 0.721 weight 1.000 ! spec=HNH, no=2174, id=2029, vol=1.130000e+08
assign (resid 109 and name HN) (resid 110 and name HN) 3.684 1.696 1.696 weight 1.000 ! spec=HNH, no=2175, id=2030, vol=8.670000e+06
assign (resid 109 and name HD21) (resid 111 and name HA) 2.798 0.979 0.979 weight 1.000 ! spec=HNH, no=2177, id=2032, vol=4.510000e+07
assign (resid 109 and name HD21) (resid 111 and name HG21) 3.559 1.583 1.583 weight 1.000 ! spec=HNH, no=2178, id=2033, vol=1.070000e+07
or (resid 109 and name HD21) (resid 111 and name HG22)
or (resid 109 and name HD21) (resid 111 and name HG23)
assign (resid 109 and name HD21) (resid 109 and name HN) 4.043 2.043 2.043 weight 1.000 ! spec=HNH, no=2180, id=2035, vol=4.960000e+06
assign (resid 109 and name HD22) (resid 109 and name HA) 3.590 1.611 1.611 weight 1.000 ! spec=HNH, no=2181, id=2036, vol=1.010000e+07
assign (resid 109 and name HD21) (resid 109 and name HD22) 2.081 0.541 0.541 weight 1.000 ! spec=HNH, no=2182, id=2037, vol=2.670000e+08
assign (resid 109 and name HD21) (resid 109 and name HB2) 2.853 1.017 1.017 weight 1.000 ! spec=HNH, no=2183, id=2038, vol=4.020000e+07
assign (resid 109 and name HD22) (resid 109 and name HB2) 2.562 0.820 0.820 weight 1.000 ! spec=HNH, no=2184, id=2039, vol=7.670000e+07
assign (resid 109 and name HD21) (resid 110 and name HN) 4.316 2.328 2.328 weight 1.000 ! spec=HNH, no=2185, id=2040, vol=3.350000e+06
assign (resid 109 and name HD22) (resid 111 and name HA) 2.708 0.917 0.917 weight 1.000 ! spec=HNH, no=2186, id=2041, vol=5.490000e+07
assign (resid 109 and name HD22) (resid 111 and name HG21) 3.642 1.658 1.658 weight 1.000 ! spec=HNH, no=2187, id=2042, vol=9.280000e+06
or (resid 109 and name HD22) (resid 111 and name HG22)
or (resid 109 and name HD22) (resid 111 and name HG23)
assign (resid 110 and name HN) (resid 103 and name HG2) 3.794 1.799 1.799 weight 1.000 ! spec=HNH, no=2189, id=2043, vol=7.270000e+06
or (resid 110 and name HN) (resid 103 and name HG1)
assign (resid 104 and name HE1) (resid 110 and name HN) 4.172 2.176 2.176 weight 1.000 ! spec=HNH, no=2192, id=2046, vol=4.110000e+06
assign (resid 110 and name HN) (resid 109 and name HA) 2.562 0.821 0.821 weight 1.000 ! spec=HNH, no=2194, id=2048, vol=7.660000e+07
assign (resid 110 and name HN) (resid 110 and name HA) 3.288 1.352 1.352 weight 1.000 ! spec=HNH, no=2197, id=2050, vol=1.710000e+07
assign (resid 110 and name HN) (resid 110 and name HB2) 2.885 1.041 1.041 weight 1.000 ! spec=HNH, no=2198, id=2051, vol=3.760000e+07
assign (resid 110 and name HN) (resid 110 and name HB1) 2.827 0.999 0.999 weight 1.000 ! spec=HNH, no=2199, id=2052, vol=4.240000e+07
assign (resid 110 and name HN) (resid 110 and name HG2) 3.472 1.507 1.507 weight 1.000 ! spec=HNH, no=2200, id=2053, vol=1.240000e+07
assign (resid 110 and name HN) (resid 110 and name HG1) 3.450 1.488 1.488 weight 1.000 ! spec=HNH, no=2201, id=2054, vol=1.280000e+07
assign (resid 112 and name HN) (resid 110 and name HA) 3.483 1.516 1.516 weight 1.000 ! spec=HNH, no=2207, id=2060, vol=1.210000e+07
assign (resid 112 and name HN) (resid 104 and name HE1) 4.129 2.131 2.131 weight 1.000 ! spec=HNH, no=2212, id=2065, vol=4.370000e+06
assign (resid 112 and name HN) (resid 111 and name HB) 3.249 1.319 1.319 weight 1.000 ! spec=HNH, no=2213, id=2066, vol=1.840000e+07
assign (resid 112 and name HN) (resid 111 and name HG21) 3.515 1.545 1.545 weight 1.000 ! spec=HNH, no=2214, id=2067, vol=1.150000e+07
or (resid 112 and name HN) (resid 111 and name HG22)
or (resid 112 and name HN) (resid 111 and name HG23)
assign (resid 112 and name HN) (resid 112 and name HA) 2.606 0.849 0.849 weight 1.000 ! spec=HNH, no=2216, id=2068, vol=6.920000e+07
assign (resid 112 and name HN) (resid 112 and name HB2) 2.870 1.029 1.029 weight 1.000 ! spec=HNH, no=2217, id=2069, vol=3.880000e+07
assign (resid 112 and name HN) (resid 112 and name HB1) 2.978 1.109 1.109 weight 1.000 ! spec=HNH, no=2218, id=2070, vol=3.110000e+07
assign (resid 112 and name HN) (resid 112 and name HD1) 3.376 1.424 1.424 weight 1.000 ! spec=HNH, no=2219, id=2071, vol=1.460000e+07
assign (resid 112 and name HN) (resid 113 and name HN) 3.577 1.599 1.599 weight 1.000 ! spec=HNH, no=2220, id=2072, vol=1.030000e+07
assign (resid 113 and name HN) (resid 68 and name HA) 4.171 2.175 2.175 weight 1.000 ! spec=HNH, no=2221, id=2073, vol=4.110000e+06
assign (resid 113 and name HN) (resid 112 and name HA) 2.166 0.587 0.587 weight 1.000 ! spec=HNH, no=2223, id=2075, vol=2.100000e+08
assign (resid 113 and name HN) (resid 112 and name HB2) 3.081 1.187 1.187 weight 1.000 ! spec=HNH, no=2224, id=2076, vol=2.530000e+07
assign (resid 113 and name HN) (resid 112 and name HD1) 2.740 0.939 0.939 weight 1.000 ! spec=HNH, no=2226, id=2078, vol=5.110000e+07
assign (resid 113 and name HN) (resid 113 and name HB2) 3.215 1.292 1.292 weight 1.000 ! spec=HNH, no=2228, id=2079, vol=1.960000e+07
assign (resid 113 and name HN) (resid 113 and name HB1) 3.126 1.221 1.221 weight 1.000 ! spec=HNH, no=2229, id=2080, vol=2.320000e+07
assign (resid 113 and name HN) (resid 114 and name HN) 3.113 1.211 1.211 weight 1.000 ! spec=HNH, no=2230, id=2081, vol=2.380000e+07
assign (resid 113 and name HN) (resid 114 and name HA) 3.869 1.871 1.871 weight 1.000 ! spec=HNH, no=2231, id=2082, vol=6.460000e+06
assign (resid 113 and name HN) (resid 114 and name HG2) 3.980 1.980 1.980 weight 1.000 ! spec=HNH, no=2232, id=2083, vol=5.450000e+06
assign (resid 113 and name HN) (resid 114 and name HG1) 3.965 1.965 1.965 weight 1.000 ! spec=HNH, no=2233, id=2084, vol=5.580000e+06
assign (resid 113 and name HN) (resid 138 and name HH2) 3.705 1.716 1.716 weight 1.000 ! spec=HNH, no=2234, id=2085, vol=8.370000e+06
assign (resid 114 and name HN) (resid 112 and name HA) 4.445 2.470 2.470 weight 1.000 ! spec=HNH, no=2238, id=2089, vol=2.810000e+06
assign (resid 114 and name HN) (resid 104 and name HZ2) 3.971 1.971 1.971 weight 1.000 ! spec=HNH, no=2239, id=2090, vol=5.520000e+06
assign (resid 114 and name HN) (resid 112 and name HD1) 3.592 1.613 1.613 weight 1.000 ! spec=HNH, no=2241, id=2092, vol=1.010000e+07
assign (resid 114 and name HN) (resid 113 and name HA) 2.423 0.734 0.734 weight 1.000 ! spec=HNH, no=2243, id=2094, vol=1.070000e+08
assign (resid 114 and name HN) (resid 113 and name HB2) 2.606 0.849 0.849 weight 1.000 ! spec=HNH, no=2244, id=2095, vol=6.920000e+07
assign (resid 114 and name HN) (resid 114 and name HA) 2.777 0.964 0.964 weight 1.000 ! spec=HNH, no=2246, id=2096, vol=4.720000e+07
assign (resid 114 and name HN) (resid 114 and name HB2) 2.872 1.031 1.031 weight 1.000 ! spec=HNH, no=2247, id=2097, vol=3.860000e+07
assign (resid 114 and name HN) (resid 114 and name HD1) 3.754 1.762 1.762 weight 1.000 ! spec=HNH, no=2249, id=2099, vol=7.730000e+06
assign (resid 114 and name HN) (resid 115 and name HA) 3.707 1.718 1.718 weight 1.000 ! spec=HNH, no=2251, id=2101, vol=8.350000e+06
assign (resid 114 and name HN) (resid 115 and name HD1) 3.449 1.487 1.487 weight 1.000 ! spec=HNH, no=2252, id=2102, vol=1.290000e+07
assign (resid 114 and name HN) (resid 115 and name HE1) 4.077 2.077 2.077 weight 1.000 ! spec=HNH, no=2253, id=2103, vol=4.720000e+06
assign (resid 114 and name HN) (resid 115 and name HE3) 4.102 2.103 2.103 weight 1.000 ! spec=HNH, no=2254, id=2104, vol=4.550000e+06
assign (resid 114 and name HN) (resid 137 and name HA) 4.091 2.092 2.092 weight 1.000 ! spec=HNH, no=2255, id=2105, vol=4.620000e+06
assign (resid 114 and name HN) (resid 138 and name HN) 3.787 1.793 1.793 weight 1.000 ! spec=HNH, no=2256, id=2106, vol=7.340000e+06
assign (resid 114 and name HN) (resid 138 and name HH2) 3.522 1.551 1.551 weight 1.000 ! spec=HNH, no=2259, id=2109, vol=1.130000e+07
assign (resid 115 and name HN) (resid 113 and name HB2) 2.657 0.883 0.883 weight 1.000 ! spec=HNH, no=2262, id=2112, vol=6.150000e+07
assign (resid 114 and name HN) (resid 115 and name HN) 2.461 0.757 0.757 weight 1.000 ! spec=HNH, no=2263, id=2113, vol=9.750000e+07
assign (resid 115 and name HN) (resid 114 and name HA) 2.379 0.707 0.707 weight 1.000 ! spec=HNH, no=2264, id=2114, vol=1.200000e+08
assign (resid 115 and name HN) (resid 114 and name HB2) 3.503 1.534 1.534 weight 1.000 ! spec=HNH, no=2265, id=2115, vol=1.170000e+07
assign (resid 115 and name HN) (resid 115 and name HA) 2.749 0.944 0.944 weight 1.000 ! spec=HNH, no=2267, id=2116, vol=5.020000e+07
assign (resid 115 and name HN) (resid 115 and name HB2) 2.386 0.711 0.711 weight 1.000 ! spec=HNH, no=2268, id=2117, vol=1.180000e+08
assign (resid 115 and name HN) (resid 115 and name HE1) 3.681 1.694 1.694 weight 1.000 ! spec=HNH, no=2271, id=2120, vol=8.710000e+06
assign (resid 115 and name HN) (resid 138 and name HE3) 3.554 1.579 1.579 weight 1.000 ! spec=HNH, no=2273, id=2122, vol=1.070000e+07
assign (resid 115 and name HE1) (resid 93 and name HE2) 4.174 2.178 2.178 weight 1.000 ! spec=HNH, no=2280, id=2129, vol=4.090000e+06
or (resid 115 and name HE1) (resid 93 and name HE1)
or (resid 115 and name HE1) (resid 93 and name HE3)
assign (resid 115 and name HE1) (resid 113 and name HB2) 3.018 1.139 1.139 weight 1.000 ! spec=HNH, no=2281, id=2130, vol=2.860000e+07
assign (resid 115 and name HE1) (resid 113 and name HB1) 3.069 1.177 1.177 weight 1.000 ! spec=HNH, no=2282, id=2131, vol=2.590000e+07
assign (resid 115 and name HE1) (resid 115 and name HB2) 3.488 1.521 1.521 weight 1.000 ! spec=HNH, no=2285, id=2134, vol=1.200000e+07
assign (resid 115 and name HE1) (resid 115 and name HE3) 4.188 2.192 2.192 weight 1.000 ! spec=HNH, no=2288, id=2136, vol=4.020000e+06
assign (resid 115 and name HE1) (resid 138 and name HE3) 3.777 1.783 1.783 weight 1.000 ! spec=HNH, no=2291, id=2139, vol=7.470000e+06
assign (resid 115 and name HE1) (resid 140 and name HE2) 4.336 2.350 2.350 weight 1.000 ! spec=HNH, no=2292, id=2140, vol=3.260000e+06
assign (resid 116 and name HN) (resid 115 and name HD1) 4.019 2.019 2.019 weight 1.000 ! spec=HNH, no=2293, id=2141, vol=5.140000e+06
assign (resid 116 and name HN) (resid 138 and name HB2) 3.098 1.199 1.199 weight 1.000 ! spec=HNH, no=2295, id=2143, vol=2.450000e+07
assign (resid 116 and name HN) (resid 140 and name HG2) 4.250 2.258 2.258 weight 1.000 ! spec=HNH, no=2299, id=2147, vol=3.680000e+06
assign (resid 116 and name HN) (resid 139 and name HG1) 3.880 1.881 1.881 weight 1.000 ! spec=HNH, no=2300, id=2148, vol=6.350000e+06
assign (resid 116 and name HN) (resid 115 and name HZ3) 3.968 1.968 1.968 weight 1.000 ! spec=HNH, no=2301, id=2149, vol=5.550000e+06
assign (resid 116 and name HN) (resid 115 and name HA) 2.295 0.658 0.658 weight 1.000 ! spec=HNH, no=2302, id=2150, vol=1.480000e+08
assign (resid 116 and name HN) (resid 115 and name HB2) 3.094 1.197 1.197 weight 1.000 ! spec=HNH, no=2303, id=2151, vol=2.470000e+07
assign (resid 116 and name HN) (resid 115 and name HB1) 2.857 1.020 1.020 weight 1.000 ! spec=HNH, no=2304, id=2152, vol=3.990000e+07
assign (resid 116 and name HN) (resid 115 and name HE3) 2.990 1.118 1.118 weight 1.000 ! spec=HNH, no=2305, id=2153, vol=3.030000e+07
assign (resid 116 and name HN) (resid 116 and name HB) 2.649 0.877 0.877 weight 1.000 ! spec=HNH, no=2308, id=2155, vol=6.260000e+07
assign (resid 116 and name HN) (resid 137 and name HB1) 3.618 1.636 1.636 weight 1.000 ! spec=HNH, no=2310, id=2157, vol=9.660000e+06
assign (resid 116 and name HN) (resid 138 and name HN) 2.878 1.035 1.035 weight 1.000 ! spec=HNH, no=2311, id=2158, vol=3.810000e+07
assign (resid 116 and name HN) (resid 138 and name HA) 4.185 2.189 2.189 weight 1.000 ! spec=HNH, no=2312, id=2159, vol=4.030000e+06
assign (resid 116 and name HN) (resid 139 and name HN) 4.106 2.107 2.107 weight 1.000 ! spec=HNH, no=2313, id=2160, vol=4.520000e+06
assign (resid 116 and name HN) (resid 139 and name HA) 3.287 1.350 1.350 weight 1.000 ! spec=HNH, no=2314, id=2161, vol=1.720000e+07
assign (resid 117 and name HN) (resid 116 and name HA) 2.139 0.572 0.572 weight 1.000 ! spec=HNH, no=2322, id=2169, vol=2.260000e+08
assign (resid 117 and name HN) (resid 117 and name HB2) 2.219 0.615 0.615 weight 1.000 ! spec=HNH, no=2326, id=2172, vol=1.820000e+08
assign (resid 118 and name HN) (resid 118 and name HA) 2.464 0.759 0.759 weight 1.000 ! spec=HNH, no=2334, id=2178, vol=9.670000e+07
assign (resid 118 and name HN) (resid 118 and name HB2) 2.502 0.782 0.782 weight 1.000 ! spec=HNH, no=2335, id=2179, vol=8.840000e+07
assign (resid 118 and name HN) (resid 118 and name HG2) 2.554 0.815 0.815 weight 1.000 ! spec=HNH, no=2337, id=2181, vol=7.810000e+07
assign (resid 118 and name HE21) (resid 120 and name HB2) 3.641 1.657 1.657 weight 1.000 ! spec=HNH, no=2340, id=2184, vol=9.290000e+06
or (resid 118 and name HE21) (resid 120 and name HB1)
assign (resid 118 and name HE22) (resid 140 and name HB2) 3.237 1.310 1.310 weight 1.000 ! spec=HNH, no=2343, id=2186, vol=1.880000e+07
assign (resid 118 and name HE21) (resid 118 and name HA) 3.886 1.887 1.887 weight 1.000 ! spec=HNH, no=2350, id=2193, vol=6.290000e+06
assign (resid 118 and name HE21) (resid 118 and name HB2) 3.234 1.307 1.307 weight 1.000 ! spec=HNH, no=2351, id=2194, vol=1.890000e+07
assign (resid 118 and name HE22) (resid 118 and name HB2) 3.610 1.629 1.629 weight 1.000 ! spec=HNH, no=2352, id=2195, vol=9.780000e+06
assign (resid 118 and name HE21) (resid 118 and name HB1) 3.119 1.216 1.216 weight 1.000 ! spec=HNH, no=2353, id=2196, vol=2.360000e+07
assign (resid 118 and name HE22) (resid 118 and name HB1) 3.553 1.578 1.578 weight 1.000 ! spec=HNH, no=2354, id=2197, vol=1.080000e+07
assign (resid 118 and name HE22) (resid 118 and name HE21) 1.611 0.324 0.324 weight 1.000 ! spec=HNH, no=2357, id=2199, vol=1.240000e+09
assign (resid 118 and name HE21) (resid 118 and name HG2) 2.452 0.752 0.752 weight 1.000 ! spec=HNH, no=2359, id=2200, vol=9.960000e+07
assign (resid 118 and name HE22) (resid 118 and name HG2) 2.777 0.964 0.964 weight 1.000 ! spec=HNH, no=2360, id=2201, vol=4.730000e+07
assign (resid 118 and name HE22) (resid 120 and name HB2) 3.659 1.673 1.673 weight 1.000 ! spec=HNH, no=2363, id=2204, vol=9.030000e+06
assign (resid 118 and name HE22) (resid 139 and name HN) 4.129 2.131 2.131 weight 1.000 ! spec=HNH, no=2364, id=2205, vol=4.370000e+06
assign (resid 118 and name HE21) (resid 139 and name HA) 4.024 2.024 2.024 weight 1.000 ! spec=HNH, no=2365, id=2206, vol=5.100000e+06
assign (resid 118 and name HE22) (resid 139 and name HA) 3.655 1.670 1.670 weight 1.000 ! spec=HNH, no=2366, id=2207, vol=9.080000e+06
assign (resid 118 and name HE21) (resid 140 and name HN) 3.234 1.308 1.308 weight 1.000 ! spec=HNH, no=2367, id=2208, vol=1.890000e+07
assign (resid 118 and name HE22) (resid 140 and name HN) 2.934 1.076 1.076 weight 1.000 ! spec=HNH, no=2368, id=2209, vol=3.390000e+07
assign (resid 118 and name HE21) (resid 140 and name HA) 4.289 2.299 2.299 weight 1.000 ! spec=HNH, no=2369, id=2210, vol=3.480000e+06
assign (resid 118 and name HE21) (resid 140 and name HB1) 3.530 1.558 1.558 weight 1.000 ! spec=HNH, no=2371, id=2212, vol=1.120000e+07
assign (resid 118 and name HE22) (resid 140 and name HB1) 3.327 1.384 1.384 weight 1.000 ! spec=HNH, no=2372, id=2213, vol=1.600000e+07
assign (resid 118 and name HE21) (resid 140 and name HD2) 3.479 1.513 1.513 weight 1.000 ! spec=HNH, no=2373, id=2214, vol=1.220000e+07
assign (resid 118 and name HE22) (resid 140 and name HD2) 3.409 1.452 1.452 weight 1.000 ! spec=HNH, no=2374, id=2215, vol=1.380000e+07
assign (resid 119 and name HN) (resid 118 and name HG2) 2.731 0.932 0.932 weight 1.000 ! spec=HNH, no=2377, id=2218, vol=5.220000e+07
or (resid 119 and name HN) (resid 118 and name HG1)
assign (resid 119 and name HN) (resid 118 and name HB1) 2.709 0.917 0.917 weight 1.000 ! spec=HNH, no=2378, id=2219, vol=5.490000e+07
assign (resid 119 and name HN) (resid 118 and name HA) 2.188 0.598 0.598 weight 1.000 ! spec=HNH, no=2383, id=2224, vol=1.980000e+08
assign (resid 120 and name HN) (resid 119 and name HA) 2.126 0.565 0.565 weight 1.000 ! spec=HNH, no=2393, id=2233, vol=2.350000e+08
assign (resid 121 and name HN) (resid 121 and name HB2) 2.185 0.597 0.597 weight 1.000 ! spec=HNH, no=2398, id=2236, vol=1.990000e+08
assign (resid 121 and name HN) (resid 124 and name HD12) 3.217 1.293 1.293 weight 1.000 ! spec=HNH, no=2399, id=2237, vol=1.960000e+07
or (resid 121 and name HN) (resid 124 and name HD11)
or (resid 121 and name HN) (resid 124 and name HD13)
assign (resid 122 and name HN) (resid 121 and name HB2) 2.797 0.978 0.978 weight 1.000 ! spec=HNH, no=2403, id=2241, vol=4.520000e+07
assign (resid 122 and name HN) (resid 122 and name HA) 2.483 0.771 0.771 weight 1.000 ! spec=HNH, no=2405, id=2242, vol=9.250000e+07
assign (resid 122 and name HN) (resid 122 and name HB2) 2.350 0.690 0.690 weight 1.000 ! spec=HNH, no=2406, id=2243, vol=1.290000e+08
assign (resid 122 and name HN) (resid 122 and name HG2) 2.638 0.870 0.870 weight 1.000 ! spec=HNH, no=2408, id=2245, vol=6.430000e+07
assign (resid 123 and name HN) (resid 122 and name HB1) 2.590 0.839 0.839 weight 1.000 ! spec=HNH, no=2410, id=2247, vol=7.170000e+07
assign (resid 123 and name HN) (resid 122 and name HG2) 2.847 1.013 1.013 weight 1.000 ! spec=HNH, no=2411, id=2248, vol=4.070000e+07
assign (resid 123 and name HN) (resid 123 and name HA) 2.303 0.663 0.663 weight 1.000 ! spec=HNH, no=2413, id=2249, vol=1.450000e+08
assign (resid 124 and name HN) (resid 95 and name HB2) 4.347 2.362 2.362 weight 1.000 ! spec=HNH, no=2417, id=2253, vol=3.210000e+06
assign (resid 124 and name HN) (resid 125 and name HB) 3.688 1.700 1.700 weight 1.000 ! spec=HNH, no=2418, id=2254, vol=8.610000e+06
assign (resid 124 and name HN) (resid 141 and name HA2) 3.690 1.702 1.702 weight 1.000 ! spec=HNH, no=2421, id=2257, vol=8.580000e+06
assign (resid 124 and name HN) (resid 95 and name HD1) 4.255 2.263 2.263 weight 1.000 ! spec=HNH, no=2427, id=2263, vol=3.650000e+06
assign (resid 124 and name HN) (resid 95 and name HE1) 4.337 2.351 2.351 weight 1.000 ! spec=HNH, no=2428, id=2264, vol=3.260000e+06
assign (resid 124 and name HN) (resid 102 and name HZ) 4.276 2.286 2.286 weight 1.000 ! spec=HNH, no=2429, id=2265, vol=3.540000e+06
assign (resid 124 and name HN) (resid 123 and name HA) 2.103 0.553 0.553 weight 1.000 ! spec=HNH, no=2431, id=2267, vol=2.510000e+08
assign (resid 124 and name HN) (resid 123 and name HB2) 2.915 1.062 1.062 weight 1.000 ! spec=HNH, no=2432, id=2268, vol=3.530000e+07
assign (resid 124 and name HN) (resid 124 and name HA) 2.450 0.751 0.751 weight 1.000 ! spec=HNH, no=2434, id=2269, vol=1.000000e+08
assign (resid 124 and name HN) (resid 125 and name HG22) 2.921 1.067 1.067 weight 1.000 ! spec=HNH, no=2439, id=2274, vol=3.490000e+07
or (resid 124 and name HN) (resid 125 and name HG21)
or (resid 124 and name HN) (resid 125 and name HG23)
assign (resid 125 and name HN) (resid 123 and name HB2) 3.714 1.724 1.724 weight 1.000 ! spec=HNH, no=2442, id=2277, vol=8.260000e+06
or (resid 125 and name HN) (resid 123 and name HB1)
assign (resid 125 and name HN) (resid 142 and name HD22) 3.875 1.877 1.877 weight 1.000 ! spec=HNH, no=2443, id=2278, vol=6.390000e+06
assign (resid 125 and name HN) (resid 123 and name HA) 3.099 1.200 1.200 weight 1.000 ! spec=HNH, no=2449, id=2284, vol=2.450000e+07
assign (resid 125 and name HN) (resid 124 and name HA) 2.258 0.637 0.637 weight 1.000 ! spec=HNH, no=2450, id=2285, vol=1.630000e+08
assign (resid 125 and name HN) (resid 124 and name HD22) 2.879 1.036 1.036 weight 1.000 ! spec=HNH, no=2452, id=2287, vol=3.810000e+07
or (resid 125 and name HN) (resid 124 and name HD21)
or (resid 125 and name HN) (resid 124 and name HD23)
assign (resid 125 and name HN) (resid 125 and name HB) 2.305 0.664 0.664 weight 1.000 ! spec=HNH, no=2455, id=2289, vol=1.450000e+08
assign (resid 125 and name HN) (resid 126 and name HN) 2.457 0.754 0.754 weight 1.000 ! spec=HNH, no=2457, id=2291, vol=9.850000e+07
assign (resid 125 and name HN) (resid 126 and name HB2) 3.692 1.704 1.704 weight 1.000 ! spec=HNH, no=2458, id=2292, vol=8.560000e+06
assign (resid 125 and name HN) (resid 126 and name HB1) 3.329 1.385 1.385 weight 1.000 ! spec=HNH, no=2459, id=2293, vol=1.590000e+07
assign (resid 126 and name HN) (resid 124 and name HA) 2.850 1.015 1.015 weight 1.000 ! spec=HNH, no=2463, id=2297, vol=4.040000e+07
assign (resid 126 and name HN) (resid 124 and name HD22) 3.306 1.367 1.367 weight 1.000 ! spec=HNH, no=2464, id=2298, vol=1.660000e+07
or (resid 126 and name HN) (resid 124 and name HD21)
or (resid 126 and name HN) (resid 124 and name HD23)
assign (resid 126 and name HN) (resid 125 and name HB) 2.642 0.873 0.873 weight 1.000 ! spec=HNH, no=2467, id=2301, vol=6.370000e+07
assign (resid 126 and name HN) (resid 126 and name HB2) 2.520 0.794 0.794 weight 1.000 ! spec=HNH, no=2472, id=2305, vol=8.450000e+07
assign (resid 126 and name HN) (resid 126 and name HB1) 2.688 0.903 0.903 weight 1.000 ! spec=HNH, no=2473, id=2306, vol=5.740000e+07
assign (resid 126 and name HN) (resid 127 and name HG21) 2.985 1.114 1.114 weight 1.000 ! spec=HNH, no=2475, id=2308, vol=3.060000e+07
or (resid 126 and name HN) (resid 127 and name HG22)
or (resid 126 and name HN) (resid 127 and name HG23)
assign (resid 127 and name HN) (resid 124 and name HD22) 3.690 1.702 1.702 weight 1.000 ! spec=HNH, no=2488, id=2321, vol=8.590000e+06
or (resid 127 and name HN) (resid 124 and name HD21)
or (resid 127 and name HN) (resid 124 and name HD23)
assign (resid 127 and name HN) (resid 125 and name HN) 3.003 1.127 1.127 weight 1.000 ! spec=HNH, no=2489, id=2322, vol=2.950000e+07
assign (resid 127 and name HN) (resid 125 and name HA) 3.278 1.343 1.343 weight 1.000 ! spec=HNH, no=2490, id=2323, vol=1.750000e+07
assign (resid 127 and name HN) (resid 125 and name HB) 3.953 1.953 1.953 weight 1.000 ! spec=HNH, no=2491, id=2324, vol=5.680000e+06
assign (resid 126 and name HN) (resid 127 and name HN) 2.634 0.867 0.867 weight 1.000 ! spec=HNH, no=2492, id=2325, vol=6.490000e+07
assign (resid 127 and name HN) (resid 126 and name HB2) 3.052 1.164 1.164 weight 1.000 ! spec=HNH, no=2494, id=2327, vol=2.680000e+07
assign (resid 127 and name HN) (resid 127 and name HA) 2.643 0.873 0.873 weight 1.000 ! spec=HNH, no=2497, id=2329, vol=6.350000e+07
assign (resid 127 and name HN) (resid 127 and name HB) 2.484 0.771 0.771 weight 1.000 ! spec=HNH, no=2498, id=2330, vol=9.220000e+07
assign (resid 127 and name HN) (resid 127 and name HG21) 2.636 0.868 0.868 weight 1.000 ! spec=HNH, no=2499, id=2331, vol=6.460000e+07
or (resid 127 and name HN) (resid 127 and name HG22)
or (resid 127 and name HN) (resid 127 and name HG23)
assign (resid 127 and name HN) (resid 142 and name HN) 4.252 2.260 2.260 weight 1.000 ! spec=HNH, no=2505, id=2337, vol=3.660000e+06
assign (resid 128 and name HN) (resid 130 and name HE1) 3.646 1.662 1.662 weight 1.000 ! spec=HNH, no=2510, id=2342, vol=9.220000e+06
or (resid 128 and name HN) (resid 130 and name HE2)
assign (resid 127 and name HN) (resid 128 and name HN) 3.110 1.209 1.209 weight 1.000 ! spec=HNH, no=2513, id=2345, vol=2.390000e+07
assign (resid 128 and name HN) (resid 128 and name HA) 2.724 0.928 0.928 weight 1.000 ! spec=HNH, no=2518, id=2349, vol=5.300000e+07
assign (resid 128 and name HN) (resid 130 and name HD1) 4.129 2.132 2.132 weight 1.000 ! spec=HNH, no=2520, id=2351, vol=4.370000e+06
assign (resid 128 and name HN) (resid 141 and name HA2) 3.827 1.831 1.831 weight 1.000 ! spec=HNH, no=2527, id=2358, vol=6.890000e+06
assign (resid 128 and name HN) (resid 142 and name HN) 3.961 1.961 1.961 weight 1.000 ! spec=HNH, no=2528, id=2359, vol=5.610000e+06
assign (resid 129 and name HN) (resid 90 and name HD12) 3.260 1.328 1.328 weight 1.000 ! spec=HNH, no=2532, id=2363, vol=1.810000e+07
or (resid 129 and name HN) (resid 90 and name HD11)
or (resid 129 and name HN) (resid 90 and name HD13)
assign (resid 129 and name HN) (resid 91 and name HN) 3.814 1.818 1.818 weight 1.000 ! spec=HNH, no=2534, id=2365, vol=7.040000e+06
assign (resid 129 and name HN) (resid 91 and name HD22) 3.978 1.978 1.978 weight 1.000 ! spec=HNH, no=2535, id=2366, vol=5.460000e+06
or (resid 129 and name HN) (resid 91 and name HD21)
or (resid 129 and name HN) (resid 91 and name HD23)
assign (resid 129 and name HN) (resid 128 and name HA) 2.385 0.711 0.711 weight 1.000 ! spec=HNH, no=2539, id=2370, vol=1.180000e+08
assign (resid 129 and name HN) (resid 128 and name HB2) 2.445 0.747 0.747 weight 1.000 ! spec=HNH, no=2540, id=2371, vol=1.010000e+08
assign (resid 129 and name HN) (resid 129 and name HA) 2.926 1.071 1.071 weight 1.000 ! spec=HNH, no=2542, id=2372, vol=3.450000e+07
assign (resid 130 and name HN) (resid 139 and name HG2) 3.338 1.393 1.393 weight 1.000 ! spec=HNH, no=2550, id=2380, vol=1.570000e+07
assign (resid 130 and name HN) (resid 88 and name HB2) 3.517 1.546 1.546 weight 1.000 ! spec=HNH, no=2557, id=2385, vol=1.140000e+07
assign (resid 130 and name HN) (resid 90 and name HA) 3.900 1.901 1.901 weight 1.000 ! spec=HNH, no=2558, id=2386, vol=6.160000e+06
assign (resid 130 and name HN) (resid 90 and name HD22) 3.957 1.957 1.957 weight 1.000 ! spec=HNH, no=2560, id=2388, vol=5.650000e+06
or (resid 130 and name HN) (resid 90 and name HD21)
or (resid 130 and name HN) (resid 90 and name HD23)
assign (resid 130 and name HN) (resid 91 and name HA) 4.396 2.415 2.415 weight 1.000 ! spec=HNH, no=2561, id=2389, vol=3.000000e+06
assign (resid 130 and name HN) (resid 91 and name HD22) 3.457 1.494 1.494 weight 1.000 ! spec=HNH, no=2562, id=2390, vol=1.270000e+07
or (resid 130 and name HN) (resid 91 and name HD21)
or (resid 130 and name HN) (resid 91 and name HD23)
assign (resid 130 and name HN) (resid 115 and name HH2) 3.978 1.978 1.978 weight 1.000 ! spec=HNH, no=2563, id=2391, vol=5.470000e+06
assign (resid 130 and name HN) (resid 115 and name HZ3) 3.939 1.940 1.940 weight 1.000 ! spec=HNH, no=2564, id=2392, vol=5.800000e+06
assign (resid 130 and name HN) (resid 129 and name HA) 2.283 0.651 0.651 weight 1.000 ! spec=HNH, no=2565, id=2393, vol=1.530000e+08
assign (resid 130 and name HN) (resid 130 and name HA) 2.929 1.072 1.072 weight 1.000 ! spec=HNH, no=2568, id=2395, vol=3.430000e+07
assign (resid 130 and name HN) (resid 130 and name HE1) 3.780 1.786 1.786 weight 1.000 ! spec=HNH, no=2570, id=2397, vol=7.430000e+06
assign (resid 130 and name HN) (resid 139 and name HB2) 3.472 1.506 1.506 weight 1.000 ! spec=HNH, no=2574, id=2401, vol=1.240000e+07
assign (resid 89 and name HN) (resid 131 and name HN) 2.972 1.104 1.104 weight 1.000 ! spec=HNH, no=2580, id=2407, vol=3.140000e+07
assign (resid 131 and name HN) (resid 88 and name HA) 3.634 1.651 1.651 weight 1.000 ! spec=HNH, no=2594, id=2419, vol=9.410000e+06
assign (resid 131 and name HN) (resid 88 and name HB2) 3.564 1.588 1.588 weight 1.000 ! spec=HNH, no=2595, id=2420, vol=1.060000e+07
assign (resid 131 and name HN) (resid 89 and name HA) 3.960 1.960 1.960 weight 1.000 ! spec=HNH, no=2596, id=2421, vol=5.620000e+06
assign (resid 131 and name HN) (resid 90 and name HA) 3.393 1.439 1.439 weight 1.000 ! spec=HNH, no=2598, id=2423, vol=1.420000e+07
assign (resid 91 and name HN) (resid 131 and name HN) 3.310 1.369 1.369 weight 1.000 ! spec=HNH, no=2599, id=2424, vol=1.650000e+07
assign (resid 131 and name HN) (resid 91 and name HB1) 3.254 1.324 1.324 weight 1.000 ! spec=HNH, no=2600, id=2425, vol=1.820000e+07
assign (resid 131 and name HN) (resid 91 and name HD22) 3.328 1.384 1.384 weight 1.000 ! spec=HNH, no=2602, id=2427, vol=1.600000e+07
or (resid 131 and name HN) (resid 91 and name HD21)
or (resid 131 and name HN) (resid 91 and name HD23)
assign (resid 131 and name HN) (resid 130 and name HA) 2.423 0.734 0.734 weight 1.000 ! spec=HNH, no=2603, id=2428, vol=1.070000e+08
assign (resid 131 and name HN) (resid 130 and name HB2) 2.803 0.982 0.982 weight 1.000 ! spec=HNH, no=2604, id=2429, vol=4.470000e+07
assign (resid 131 and name HN) (resid 131 and name HA) 3.174 1.259 1.259 weight 1.000 ! spec=HNH, no=2607, id=2431, vol=2.120000e+07
assign (resid 131 and name HN) (resid 131 and name HB2) 2.761 0.953 0.953 weight 1.000 ! spec=HNH, no=2608, id=2432, vol=4.890000e+07
assign (resid 131 and name HN) (resid 131 and name HB1) 2.669 0.890 0.890 weight 1.000 ! spec=HNH, no=2609, id=2433, vol=6.000000e+07
assign (resid 131 and name HN) (resid 132 and name HA) 4.105 2.107 2.107 weight 1.000 ! spec=HNH, no=2611, id=2435, vol=4.530000e+06
assign (resid 131 and name HN) (resid 133 and name HN) 4.249 2.257 2.257 weight 1.000 ! spec=HNH, no=2612, id=2436, vol=3.680000e+06
assign (resid 131 and name HN) (resid 138 and name HA) 4.094 2.095 2.095 weight 1.000 ! spec=HNH, no=2613, id=2437, vol=4.600000e+06
assign (resid 131 and name HN) (resid 138 and name HD1) 3.413 1.456 1.456 weight 1.000 ! spec=HNH, no=2614, id=2438, vol=1.370000e+07
assign (resid 131 and name HN) (resid 138 and name HE1) 4.175 2.179 2.179 weight 1.000 ! spec=HNH, no=2615, id=2439, vol=4.090000e+06
assign (resid 132 and name HN) (resid 136 and name HA1) 4.178 2.182 2.182 weight 1.000 ! spec=HNH, no=2619, id=2443, vol=4.070000e+06
assign (resid 132 and name HN) (resid 131 and name HB1) 3.494 1.526 1.526 weight 1.000 ! spec=HNH, no=2628, id=2452, vol=1.190000e+07
assign (resid 132 and name HN) (resid 137 and name HB2) 3.921 1.922 1.922 weight 1.000 ! spec=HNH, no=2629, id=2453, vol=5.960000e+06
assign (resid 132 and name HN) (resid 88 and name HA) 4.136 2.138 2.138 weight 1.000 ! spec=HNH, no=2630, id=2454, vol=4.330000e+06
assign (resid 132 and name HN) (resid 88 and name HB2) 3.888 1.890 1.890 weight 1.000 ! spec=HNH, no=2631, id=2455, vol=6.270000e+06
assign (resid 132 and name HN) (resid 91 and name HD12) 4.053 2.053 2.053 weight 1.000 ! spec=HNH, no=2632, id=2456, vol=4.890000e+06
or (resid 132 and name HN) (resid 91 and name HD11)
or (resid 132 and name HN) (resid 91 and name HD13)
assign (resid 132 and name HN) (resid 91 and name HD22) 4.052 2.052 2.052 weight 1.000 ! spec=HNH, no=2633, id=2457, vol=4.900000e+06
or (resid 132 and name HN) (resid 91 and name HD21)
or (resid 132 and name HN) (resid 91 and name HD23)
assign (resid 132 and name HN) (resid 131 and name HA) 2.412 0.727 0.727 weight 1.000 ! spec=HNH, no=2634, id=2458, vol=1.100000e+08
assign (resid 132 and name HN) (resid 131 and name HG) 3.041 1.156 1.156 weight 1.000 ! spec=HNH, no=2635, id=2459, vol=2.740000e+07
assign (resid 132 and name HN) (resid 131 and name HD22) 3.321 1.379 1.379 weight 1.000 ! spec=HNH, no=2637, id=2461, vol=1.610000e+07
or (resid 132 and name HN) (resid 131 and name HD21)
or (resid 132 and name HN) (resid 131 and name HD23)
assign (resid 132 and name HN) (resid 132 and name HA) 3.088 1.192 1.192 weight 1.000 ! spec=HNH, no=2639, id=2462, vol=2.500000e+07
assign (resid 132 and name HN) (resid 132 and name HB2) 2.688 0.903 0.903 weight 1.000 ! spec=HNH, no=2640, id=2463, vol=5.740000e+07
assign (resid 132 and name HN) (resid 132 and name HB1) 2.681 0.899 0.899 weight 1.000 ! spec=HNH, no=2641, id=2464, vol=5.830000e+07
assign (resid 132 and name HN) (resid 133 and name HN) 3.610 1.629 1.629 weight 1.000 ! spec=HNH, no=2642, id=2465, vol=9.790000e+06
assign (resid 133 and name HN) (resid 137 and name HB2) 4.493 2.524 2.524 weight 1.000 ! spec=HNH, no=2652, id=2475, vol=2.630000e+06
assign (resid 133 and name HN) (resid 133 and name HD12) 2.954 1.091 1.091 weight 1.000 ! spec=HNH, no=2653, id=2476, vol=3.260000e+07
or (resid 133 and name HN) (resid 133 and name HD11)
or (resid 133 and name HN) (resid 133 and name HD13)
assign (resid 133 and name HN) (resid 134 and name HA) 4.304 2.316 2.316 weight 1.000 ! spec=HNH, no=2654, id=2477, vol=3.410000e+06
assign (resid 133 and name HN) (resid 136 and name HN) 4.106 2.108 2.108 weight 1.000 ! spec=HNH, no=2661, id=2482, vol=4.520000e+06
assign (resid 133 and name HN) (resid 133 and name HG22) 2.765 0.956 0.956 weight 1.000 ! spec=HNH, no=2662, id=2483, vol=4.840000e+07
or (resid 133 and name HN) (resid 133 and name HG21)
or (resid 133 and name HN) (resid 133 and name HG23)
assign (resid 133 and name HN) (resid 135 and name HN) 4.191 2.196 2.196 weight 1.000 ! spec=HNH, no=2664, id=2485, vol=4.000000e+06
assign (resid 133 and name HN) (resid 86 and name HG2) 4.041 2.042 2.042 weight 1.000 ! spec=HNH, no=2666, id=2487, vol=4.970000e+06
assign (resid 133 and name HN) (resid 87 and name HB2) 3.831 1.835 1.835 weight 1.000 ! spec=HNH, no=2667, id=2488, vol=6.850000e+06
assign (resid 133 and name HN) (resid 88 and name HB2) 3.754 1.762 1.762 weight 1.000 ! spec=HNH, no=2669, id=2490, vol=7.740000e+06
assign (resid 133 and name HN) (resid 89 and name HN) 3.632 1.649 1.649 weight 1.000 ! spec=HNH, no=2670, id=2491, vol=9.440000e+06
assign (resid 133 and name HN) (resid 131 and name HA) 3.871 1.873 1.873 weight 1.000 ! spec=HNH, no=2671, id=2492, vol=6.440000e+06
assign (resid 133 and name HN) (resid 131 and name HD12) 3.474 1.508 1.508 weight 1.000 ! spec=HNH, no=2672, id=2493, vol=1.230000e+07
or (resid 133 and name HN) (resid 131 and name HD11)
or (resid 133 and name HN) (resid 131 and name HD13)
assign (resid 133 and name HN) (resid 132 and name HB2) 3.499 1.530 1.530 weight 1.000 ! spec=HNH, no=2675, id=2496, vol=1.180000e+07
assign (resid 133 and name HN) (resid 133 and name HB) 2.599 0.844 0.844 weight 1.000 ! spec=HNH, no=2678, id=2498, vol=7.040000e+07
assign (resid 133 and name HN) (resid 133 and name HG12) 2.809 0.986 0.986 weight 1.000 ! spec=HNH, no=2679, id=2499, vol=4.410000e+07
assign (resid 133 and name HN) (resid 134 and name HN) 3.195 1.276 1.276 weight 1.000 ! spec=HNH, no=2680, id=2500, vol=2.040000e+07
assign (resid 134 and name HN) (resid 132 and name HB2) 3.189 1.272 1.272 weight 1.000 ! spec=HNH, no=2689, id=2509, vol=2.060000e+07
assign (resid 134 and name HN) (resid 76 and name HD22) 4.140 2.143 2.143 weight 1.000 ! spec=HNH, no=2694, id=2513, vol=4.300000e+06
or (resid 134 and name HN) (resid 76 and name HD21)
or (resid 134 and name HN) (resid 76 and name HD23)
assign (resid 134 and name HN) (resid 87 and name HA) 4.395 2.414 2.414 weight 1.000 ! spec=HNH, no=2695, id=2514, vol=3.010000e+06
assign (resid 134 and name HN) (resid 88 and name HA) 4.509 2.541 2.541 weight 1.000 ! spec=HNH, no=2697, id=2516, vol=2.580000e+06
assign (resid 135 and name HN) (resid 76 and name HD12) 3.639 1.656 1.656 weight 1.000 ! spec=HNH, no=2710, id=2528, vol=9.320000e+06
or (resid 135 and name HN) (resid 76 and name HD11)
or (resid 135 and name HN) (resid 76 and name HD13)
assign (resid 135 and name HN) (resid 132 and name HN) 4.117 2.119 2.119 weight 1.000 ! spec=HNH, no=2712, id=2530, vol=4.450000e+06
assign (resid 135 and name HN) (resid 133 and name HB) 4.041 2.041 2.041 weight 1.000 ! spec=HNH, no=2714, id=2532, vol=4.980000e+06
assign (resid 135 and name HN) (resid 133 and name HD12) 3.982 1.982 1.982 weight 1.000 ! spec=HNH, no=2715, id=2533, vol=5.430000e+06
or (resid 135 and name HN) (resid 133 and name HD11)
or (resid 135 and name HN) (resid 133 and name HD13)
assign (resid 134 and name HN) (resid 135 and name HN) 3.021 1.141 1.141 weight 1.000 ! spec=HNH, no=2716, id=2534, vol=2.850000e+07
assign (resid 135 and name HN) (resid 134 and name HA) 3.339 1.393 1.393 weight 1.000 ! spec=HNH, no=2717, id=2535, vol=1.560000e+07
assign (resid 135 and name HN) (resid 134 and name HB2) 2.806 0.984 0.984 weight 1.000 ! spec=HNH, no=2718, id=2536, vol=4.440000e+07
assign (resid 135 and name HN) (resid 135 and name HA) 3.008 1.131 1.131 weight 1.000 ! spec=HNH, no=2720, id=2537, vol=2.930000e+07
assign (resid 135 and name HN) (resid 136 and name HA2) 3.145 1.237 1.237 weight 1.000 ! spec=HNH, no=2723, id=2540, vol=2.240000e+07
assign (resid 135 and name HN) (resid 137 and name HB2) 4.216 2.222 2.222 weight 1.000 ! spec=HNH, no=2726, id=2543, vol=3.860000e+06
assign (resid 136 and name HN) (resid 134 and name HA) 3.665 1.679 1.679 weight 1.000 ! spec=HNH, no=2727, id=2544, vol=8.940000e+06
assign (resid 72 and name HD21) (resid 136 and name HN) 4.202 2.207 2.207 weight 1.000 ! spec=HNH, no=2730, id=2546, vol=3.930000e+06
assign (resid 136 and name HN) (resid 76 and name HD12) 2.797 0.978 0.978 weight 1.000 ! spec=HNH, no=2731, id=2547, vol=4.520000e+07
or (resid 136 and name HN) (resid 76 and name HD11)
or (resid 136 and name HN) (resid 76 and name HD13)
assign (resid 136 and name HN) (resid 76 and name HD22) 2.719 0.924 0.924 weight 1.000 ! spec=HNH, no=2732, id=2548, vol=5.360000e+07
or (resid 136 and name HN) (resid 76 and name HD21)
or (resid 136 and name HN) (resid 76 and name HD23)
assign (resid 136 and name HN) (resid 131 and name HD12) 2.709 0.917 0.917 weight 1.000 ! spec=HNH, no=2733, id=2549, vol=5.480000e+07
or (resid 136 and name HN) (resid 131 and name HD11)
or (resid 136 and name HN) (resid 131 and name HD13)
assign (resid 132 and name HN) (resid 136 and name HN) 4.035 2.035 2.035 weight 1.000 ! spec=HNH, no=2735, id=2551, vol=5.020000e+06
assign (resid 136 and name HN) (resid 132 and name HA) 4.450 2.475 2.475 weight 1.000 ! spec=HNH, no=2736, id=2552, vol=2.790000e+06
assign (resid 136 and name HN) (resid 132 and name HE1) 3.912 1.913 1.913 weight 1.000 ! spec=HNH, no=2738, id=2554, vol=6.040000e+06
assign (resid 136 and name HN) (resid 134 and name HN) 3.556 1.581 1.581 weight 1.000 ! spec=HNH, no=2740, id=2556, vol=1.070000e+07
assign (resid 136 and name HN) (resid 134 and name HB2) 3.371 1.421 1.421 weight 1.000 ! spec=HNH, no=2741, id=2557, vol=1.480000e+07
assign (resid 135 and name HN) (resid 136 and name HN) 2.360 0.696 0.696 weight 1.000 ! spec=HNH, no=2742, id=2558, vol=1.250000e+08
assign (resid 136 and name HN) (resid 135 and name HA) 3.225 1.300 1.300 weight 1.000 ! spec=HNH, no=2743, id=2559, vol=1.930000e+07
assign (resid 136 and name HN) (resid 136 and name HA2) 2.422 0.733 0.733 weight 1.000 ! spec=HNH, no=2746, id=2561, vol=1.070000e+08
assign (resid 136 and name HN) (resid 136 and name HA1) 2.597 0.843 0.843 weight 1.000 ! spec=HNH, no=2747, id=2562, vol=7.060000e+07
assign (resid 136 and name HN) (resid 137 and name HA) 3.472 1.507 1.507 weight 1.000 ! spec=HNH, no=2749, id=2564, vol=1.240000e+07
assign (resid 136 and name HN) (resid 137 and name HB2) 3.557 1.582 1.582 weight 1.000 ! spec=HNH, no=2750, id=2565, vol=1.070000e+07
assign (resid 137 and name HN) (resid 132 and name HA) 4.435 2.458 2.458 weight 1.000 ! spec=HNH, no=2752, id=2567, vol=2.850000e+06
assign (resid 137 and name HN) (resid 135 and name HN) 3.112 1.210 1.210 weight 1.000 ! spec=HNH, no=2754, id=2569, vol=2.390000e+07
assign (resid 137 and name HN) (resid 72 and name HD22) 3.955 1.955 1.955 weight 1.000 ! spec=HNH, no=2755, id=2570, vol=5.660000e+06
assign (resid 137 and name HN) (resid 136 and name HA2) 2.760 0.952 0.952 weight 1.000 ! spec=HNH, no=2757, id=2571, vol=4.900000e+07
assign (resid 137 and name HN) (resid 89 and name HD12) 3.927 1.928 1.928 weight 1.000 ! spec=HNH, no=2760, id=2574, vol=5.910000e+06
or (resid 137 and name HN) (resid 89 and name HD11)
or (resid 137 and name HN) (resid 89 and name HD13)
assign (resid 137 and name HN) (resid 131 and name HD12) 3.080 1.186 1.186 weight 1.000 ! spec=HNH, no=2767, id=2581, vol=2.540000e+07
or (resid 137 and name HN) (resid 131 and name HD11)
or (resid 137 and name HN) (resid 131 and name HD13)
assign (resid 132 and name HN) (resid 137 and name HN) 3.441 1.480 1.480 weight 1.000 ! spec=HNH, no=2770, id=2584, vol=1.300000e+07
assign (resid 136 and name HN) (resid 137 and name HN) 2.547 0.811 0.811 weight 1.000 ! spec=HNH, no=2771, id=2585, vol=7.940000e+07
assign (resid 137 and name HN) (resid 137 and name HA) 2.613 0.853 0.853 weight 1.000 ! spec=HNH, no=2773, id=2586, vol=6.810000e+07
assign (resid 137 and name HN) (resid 137 and name HB2) 2.368 0.701 0.701 weight 1.000 ! spec=HNH, no=2774, id=2587, vol=1.230000e+08
assign (resid 137 and name HN) (resid 138 and name HA) 4.157 2.160 2.160 weight 1.000 ! spec=HNH, no=2776, id=2589, vol=4.200000e+06
assign (resid 138 and name HN) (resid 138 and name HE3) 3.826 1.830 1.830 weight 1.000 ! spec=HNH, no=2777, id=2590, vol=6.910000e+06
assign (resid 138 and name HN) (resid 115 and name HB1) 3.873 1.875 1.875 weight 1.000 ! spec=HNH, no=2779, id=2592, vol=6.420000e+06
assign (resid 138 and name HN) (resid 138 and name HB2) 2.688 0.903 0.903 weight 1.000 ! spec=HNH, no=2781, id=2594, vol=5.750000e+07
assign (resid 138 and name HN) (resid 139 and name HA) 3.841 1.844 1.844 weight 1.000 ! spec=HNH, no=2787, id=2600, vol=6.740000e+06
assign (resid 138 and name HN) (resid 137 and name HN) 3.464 1.500 1.500 weight 1.000 ! spec=HNH, no=2788, id=2601, vol=1.250000e+07
assign (resid 138 and name HN) (resid 115 and name HE3) 3.703 1.714 1.714 weight 1.000 ! spec=HNH, no=2789, id=2602, vol=8.400000e+06
assign (resid 138 and name HN) (resid 114 and name HA) 3.703 1.714 1.714 weight 1.000 ! spec=HNH, no=2791, id=2604, vol=8.400000e+06
assign (resid 138 and name HN) (resid 114 and name HB2) 3.140 1.233 1.233 weight 1.000 ! spec=HNH, no=2792, id=2605, vol=2.260000e+07
assign (resid 138 and name HN) (resid 115 and name HA) 3.127 1.222 1.222 weight 1.000 ! spec=HNH, no=2794, id=2607, vol=2.320000e+07
assign (resid 138 and name HN) (resid 116 and name HB) 3.339 1.394 1.394 weight 1.000 ! spec=HNH, no=2795, id=2608, vol=1.560000e+07
assign (resid 138 and name HN) (resid 116 and name HG21) 3.203 1.282 1.282 weight 1.000 ! spec=HNH, no=2796, id=2609, vol=2.010000e+07
or (resid 138 and name HN) (resid 116 and name HG22)
or (resid 138 and name HN) (resid 116 and name HG23)
assign (resid 138 and name HN) (resid 131 and name HA) 3.446 1.484 1.484 weight 1.000 ! spec=HNH, no=2797, id=2610, vol=1.290000e+07
assign (resid 138 and name HN) (resid 137 and name HB1) 2.890 1.044 1.044 weight 1.000 ! spec=HNH, no=2800, id=2613, vol=3.720000e+07
assign (resid 138 and name HN) (resid 138 and name HA) 3.047 1.160 1.160 weight 1.000 ! spec=HNH, no=2802, id=2614, vol=2.710000e+07
assign (resid 138 and name HN) (resid 138 and name HE1) 3.920 1.921 1.921 weight 1.000 ! spec=HNH, no=2808, id=2620, vol=5.970000e+06
assign (resid 72 and name HD21) (resid 138 and name HE1) 3.551 1.576 1.576 weight 1.000 ! spec=HNH, no=2809, id=2621, vol=1.080000e+07
assign (resid 114 and name HN) (resid 138 and name HE1) 3.843 1.847 1.847 weight 1.000 ! spec=HNH, no=2810, id=2622, vol=6.720000e+06
assign (resid 138 and name HE1) (resid 136 and name HA2) 4.093 2.094 2.094 weight 1.000 ! spec=HNH, no=2811, id=2623, vol=4.610000e+06
assign (resid 138 and name HE1) (resid 137 and name HA) 3.913 1.914 1.914 weight 1.000 ! spec=HNH, no=2818, id=2630, vol=6.030000e+06
assign (resid 138 and name HE1) (resid 138 and name HZ3) 4.115 2.117 2.117 weight 1.000 ! spec=HNH, no=2819, id=2631, vol=4.460000e+06
assign (resid 138 and name HE1) (resid 138 and name HE3) 4.469 2.497 2.497 weight 1.000 ! spec=HNH, no=2823, id=2635, vol=2.720000e+06
assign (resid 138 and name HE1) (resid 139 and name HN) 4.465 2.492 2.492 weight 1.000 ! spec=HNH, no=2825, id=2637, vol=2.740000e+06
assign (resid 138 and name HE1) (resid 66 and name HN) 4.415 2.436 2.436 weight 1.000 ! spec=HNH, no=2827, id=2639, vol=2.930000e+06
assign (resid 138 and name HE1) (resid 66 and name HB) 3.537 1.564 1.564 weight 1.000 ! spec=HNH, no=2828, id=2640, vol=1.110000e+07
assign (resid 138 and name HE1) (resid 66 and name HG22) 3.037 1.153 1.153 weight 1.000 ! spec=HNH, no=2829, id=2641, vol=2.760000e+07
or (resid 138 and name HE1) (resid 66 and name HG21)
or (resid 138 and name HE1) (resid 66 and name HG23)
assign (resid 138 and name HE1) (resid 72 and name HN) 4.385 2.403 2.403 weight 1.000 ! spec=HNH, no=2830, id=2642, vol=3.050000e+06
assign (resid 138 and name HE1) (resid 72 and name HA) 3.938 1.938 1.938 weight 1.000 ! spec=HNH, no=2831, id=2643, vol=5.810000e+06
assign (resid 138 and name HE1) (resid 72 and name HB1) 4.120 2.122 2.122 weight 1.000 ! spec=HNH, no=2832, id=2644, vol=4.430000e+06
assign (resid 138 and name HE1) (resid 114 and name HB2) 3.238 1.311 1.311 weight 1.000 ! spec=HNH, no=2835, id=2647, vol=1.880000e+07
assign (resid 138 and name HE1) (resid 114 and name HB1) 3.083 1.188 1.188 weight 1.000 ! spec=HNH, no=2836, id=2648, vol=2.520000e+07
assign (resid 138 and name HE1) (resid 131 and name HA) 3.848 1.850 1.850 weight 1.000 ! spec=HNH, no=2837, id=2649, vol=6.680000e+06
assign (resid 138 and name HE1) (resid 131 and name HB2) 3.160 1.248 1.248 weight 1.000 ! spec=HNH, no=2838, id=2650, vol=2.170000e+07
assign (resid 138 and name HE1) (resid 131 and name HD22) 3.204 1.283 1.283 weight 1.000 ! spec=HNH, no=2840, id=2652, vol=2.000000e+07
or (resid 138 and name HE1) (resid 131 and name HD21)
or (resid 138 and name HE1) (resid 131 and name HD23)
assign (resid 138 and name HE1) (resid 132 and name HN) 4.265 2.274 2.274 weight 1.000 ! spec=HNH, no=2841, id=2653, vol=3.600000e+06
assign (resid 138 and name HE1) (resid 138 and name HA) 3.724 1.734 1.734 weight 1.000 ! spec=HNH, no=2842, id=2654, vol=8.120000e+06
assign (resid 139 and name HN) (resid 116 and name HG21) 3.177 1.262 1.262 weight 1.000 ! spec=HNH, no=2847, id=2658, vol=2.110000e+07
or (resid 139 and name HN) (resid 116 and name HG22)
or (resid 139 and name HN) (resid 116 and name HG23)
assign (resid 139 and name HN) (resid 139 and name HG2) 3.089 1.193 1.193 weight 1.000 ! spec=HNH, no=2852, id=2662, vol=2.490000e+07
assign (resid 139 and name HN) (resid 115 and name HE3) 4.046 2.046 2.046 weight 1.000 ! spec=HNH, no=2858, id=2668, vol=4.940000e+06
assign (resid 139 and name HN) (resid 115 and name HH2) 4.180 2.184 2.184 weight 1.000 ! spec=HNH, no=2859, id=2669, vol=4.060000e+06
assign (resid 139 and name HN) (resid 115 and name HZ3) 3.696 1.707 1.707 weight 1.000 ! spec=HNH, no=2861, id=2671, vol=8.500000e+06
assign (resid 130 and name HN) (resid 139 and name HN) 2.806 0.984 0.984 weight 1.000 ! spec=HNH, no=2862, id=2672, vol=4.440000e+07
assign (resid 139 and name HN) (resid 131 and name HA) 3.320 1.378 1.378 weight 1.000 ! spec=HNH, no=2865, id=2675, vol=1.620000e+07
assign (resid 138 and name HN) (resid 139 and name HN) 3.656 1.671 1.671 weight 1.000 ! spec=HNH, no=2868, id=2678, vol=9.060000e+06
assign (resid 139 and name HN) (resid 138 and name HA) 2.353 0.692 0.692 weight 1.000 ! spec=HNH, no=2869, id=2679, vol=1.280000e+08
assign (resid 139 and name HN) (resid 138 and name HB2) 2.928 1.072 1.072 weight 1.000 ! spec=HNH, no=2870, id=2680, vol=3.430000e+07
assign (resid 139 and name HN) (resid 138 and name HB1) 2.906 1.056 1.056 weight 1.000 ! spec=HNH, no=2871, id=2681, vol=3.600000e+07
assign (resid 139 and name HN) (resid 139 and name HA) 2.805 0.983 0.983 weight 1.000 ! spec=HNH, no=2874, id=2683, vol=4.450000e+07
assign (resid 139 and name HN) (resid 139 and name HB2) 2.901 1.052 1.052 weight 1.000 ! spec=HNH, no=2875, id=2684, vol=3.630000e+07
assign (resid 139 and name HN) (resid 139 and name HB1) 3.043 1.158 1.158 weight 1.000 ! spec=HNH, no=2876, id=2685, vol=2.730000e+07
assign (resid 139 and name HN) (resid 139 and name HG1) 3.007 1.131 1.131 weight 1.000 ! spec=HNH, no=2877, id=2686, vol=2.930000e+07
assign (resid 139 and name HN) (resid 140 and name HA) 3.504 1.535 1.535 weight 1.000 ! spec=HNH, no=2879, id=2688, vol=1.170000e+07
assign (resid 140 and name HN) (resid 139 and name HG1) 3.052 1.165 1.165 weight 1.000 ! spec=HNH, no=2886, id=2692, vol=2.680000e+07
assign (resid 140 and name HN) (resid 140 and name HG1) 2.700 0.912 0.912 weight 1.000 ! spec=HNH, no=2888, id=2694, vol=5.590000e+07
assign (resid 140 and name HN) (resid 138 and name HA) 4.205 2.211 2.211 weight 1.000 ! spec=HNH, no=2892, id=2697, vol=3.920000e+06
assign (resid 140 and name HN) (resid 140 and name HE2) 3.880 1.882 1.882 weight 1.000 ! spec=HNH, no=2893, id=2698, vol=6.350000e+06
assign (resid 140 and name HN) (resid 115 and name HZ3) 3.583 1.604 1.604 weight 1.000 ! spec=HNH, no=2898, id=2703, vol=1.020000e+07
assign (resid 140 and name HN) (resid 118 and name HG2) 3.846 1.849 1.849 weight 1.000 ! spec=HNH, no=2899, id=2704, vol=6.690000e+06
assign (resid 140 and name HN) (resid 124 and name HD22) 3.754 1.761 1.761 weight 1.000 ! spec=HNH, no=2900, id=2705, vol=7.750000e+06
or (resid 140 and name HN) (resid 124 and name HD21)
or (resid 140 and name HN) (resid 124 and name HD23)
assign (resid 139 and name HN) (resid 140 and name HN) 3.468 1.504 1.504 weight 1.000 ! spec=HNH, no=2901, id=2706, vol=1.240000e+07
assign (resid 140 and name HN) (resid 139 and name HA) 2.203 0.607 0.607 weight 1.000 ! spec=HNH, no=2902, id=2707, vol=1.900000e+08
assign (resid 140 and name HN) (resid 140 and name HA) 2.762 0.953 0.953 weight 1.000 ! spec=HNH, no=2905, id=2709, vol=4.880000e+07
assign (resid 140 and name HN) (resid 140 and name HB2) 2.555 0.816 0.816 weight 1.000 ! spec=HNH, no=2906, id=2710, vol=7.790000e+07
assign (resid 140 and name HN) (resid 140 and name HG2) 3.006 1.130 1.130 weight 1.000 ! spec=HNH, no=2908, id=2712, vol=2.940000e+07
assign (resid 141 and name HN) (resid 124 and name HD22) 3.450 1.488 1.488 weight 1.000 ! spec=HNH, no=2912, id=2716, vol=1.280000e+07
or (resid 141 and name HN) (resid 124 and name HD21)
or (resid 141 and name HN) (resid 124 and name HD23)
assign (resid 141 and name HN) (resid 115 and name HZ3) 4.060 2.061 2.061 weight 1.000 ! spec=HNH, no=2913, id=2717, vol=4.830000e+06
assign (resid 141 and name HN) (resid 127 and name HN) 4.214 2.219 2.219 weight 1.000 ! spec=HNH, no=2920, id=2724, vol=3.870000e+06
assign (resid 141 and name HN) (resid 140 and name HA) 2.192 0.601 0.601 weight 1.000 ! spec=HNH, no=2928, id=2732, vol=1.950000e+08
assign (resid 141 and name HN) (resid 140 and name HB1) 2.768 0.958 0.958 weight 1.000 ! spec=HNH, no=2930, id=2734, vol=4.820000e+07
assign (resid 141 and name HN) (resid 141 and name HA2) 2.679 0.897 0.897 weight 1.000 ! spec=HNH, no=2932, id=2735, vol=5.860000e+07
assign (resid 141 and name HN) (resid 141 and name HA1) 2.706 0.916 0.916 weight 1.000 ! spec=HNH, no=2933, id=2736, vol=5.510000e+07
assign (resid 141 and name HN) (resid 142 and name HA) 3.519 1.548 1.548 weight 1.000 ! spec=HNH, no=2935, id=2738, vol=1.140000e+07
assign (resid 142 and name HN) (resid 141 and name HA2) 2.390 0.714 0.714 weight 1.000 ! spec=HNH, no=2938, id=2741, vol=1.160000e+08
assign (resid 142 and name HN) (resid 141 and name HA1) 2.365 0.699 0.699 weight 1.000 ! spec=HNH, no=2940, id=2743, vol=1.240000e+08
assign (resid 142 and name HN) (resid 144 and name HN) 3.666 1.680 1.680 weight 1.000 ! spec=HNH, no=2943, id=2746, vol=8.930000e+06
assign (resid 142 and name HN) (resid 124 and name HD22) 3.132 1.226 1.226 weight 1.000 ! spec=HNH, no=2944, id=2747, vol=2.290000e+07
or (resid 142 and name HN) (resid 124 and name HD21)
or (resid 142 and name HN) (resid 124 and name HD23)
assign (resid 142 and name HN) (resid 127 and name HG21) 3.511 1.541 1.541 weight 1.000 ! spec=HNH, no=2946, id=2749, vol=1.160000e+07
or (resid 142 and name HN) (resid 127 and name HG22)
or (resid 142 and name HN) (resid 127 and name HG23)
assign (resid 141 and name HN) (resid 142 and name HN) 3.287 1.351 1.351 weight 1.000 ! spec=HNH, no=2948, id=2751, vol=1.720000e+07
assign (resid 142 and name HN) (resid 142 and name HA) 2.648 0.877 0.877 weight 1.000 ! spec=HNH, no=2950, id=2752, vol=6.280000e+07
assign (resid 142 and name HN) (resid 142 and name HD21) 3.375 1.424 1.424 weight 1.000 ! spec=HNH, no=2951, id=2753, vol=1.470000e+07
assign (resid 142 and name HN) (resid 143 and name HN) 3.167 1.253 1.253 weight 1.000 ! spec=HNH, no=2953, id=2755, vol=2.150000e+07
assign (resid 142 and name HD21) (resid 144 and name HG2) 3.487 1.520 1.520 weight 1.000 ! spec=HNH, no=2955, id=2757, vol=1.210000e+07
or (resid 142 and name HD21) (resid 144 and name HG1)
assign (resid 142 and name HD21) (resid 141 and name HA2) 3.950 1.950 1.950 weight 1.000 ! spec=HNH, no=2956, id=2758, vol=5.710000e+06
assign (resid 142 and name HD21) (resid 127 and name HG21) 3.818 1.822 1.822 weight 1.000 ! spec=HNH, no=2962, id=2764, vol=6.990000e+06
or (resid 142 and name HD21) (resid 127 and name HG22)
or (resid 142 and name HD21) (resid 127 and name HG23)
assign (resid 142 and name HD21) (resid 124 and name HD22) 3.560 1.584 1.584 weight 1.000 ! spec=HNH, no=2965, id=2767, vol=1.060000e+07
or (resid 142 and name HD21) (resid 124 and name HD21)
or (resid 142 and name HD21) (resid 124 and name HD23)
assign (resid 142 and name HD22) (resid 144 and name HB1) 3.681 1.693 1.693 weight 1.000 ! spec=HNH, no=2966, id=2768, vol=8.710000e+06
assign (resid 142 and name HD22) (resid 143 and name HN) 3.959 1.959 1.959 weight 1.000 ! spec=HNH, no=2967, id=2769, vol=5.630000e+06
assign (resid 142 and name HD22) (resid 124 and name HD22) 3.615 1.634 1.634 weight 1.000 ! spec=HNH, no=2968, id=2770, vol=9.710000e+06
or (resid 142 and name HD22) (resid 124 and name HD21)
or (resid 142 and name HD22) (resid 124 and name HD23)
assign (resid 142 and name HD22) (resid 144 and name HB2) 3.493 1.525 1.525 weight 1.000 ! spec=HNH, no=2969, id=2771, vol=1.190000e+07
assign (resid 142 and name HD22) (resid 141 and name HA2) 4.167 2.171 2.171 weight 1.000 ! spec=HNH, no=2974, id=2776, vol=4.140000e+06
assign (resid 142 and name HD22) (resid 144 and name HG2) 3.654 1.669 1.669 weight 1.000 ! spec=HNH, no=2975, id=2777, vol=9.100000e+06
or (resid 142 and name HD22) (resid 144 and name HG1)
assign (resid 142 and name HD22) (resid 142 and name HN) 3.752 1.759 1.759 weight 1.000 ! spec=HNH, no=2979, id=2781, vol=7.770000e+06
assign (resid 142 and name HD21) (resid 142 and name HA) 3.244 1.315 1.315 weight 1.000 ! spec=HNH, no=2980, id=2782, vol=1.860000e+07
assign (resid 142 and name HD22) (resid 142 and name HA) 3.498 1.530 1.530 weight 1.000 ! spec=HNH, no=2981, id=2783, vol=1.180000e+07
assign (resid 142 and name HD22) (resid 142 and name HD21) 1.672 0.349 0.349 weight 1.000 ! spec=HNH, no=2984, id=2785, vol=9.920000e+08
assign (resid 142 and name HD21) (resid 142 and name HB2) 2.418 0.731 0.731 weight 1.000 ! spec=HNH, no=2986, id=2786, vol=1.080000e+08
assign (resid 142 and name HD21) (resid 143 and name HN) 3.600 1.620 1.620 weight 1.000 ! spec=HNH, no=2988, id=2788, vol=9.950000e+06
assign (resid 143 and name HN) (resid 49 and name HB) 3.727 1.736 1.736 weight 1.000 ! spec=HNH, no=2989, id=2789, vol=8.090000e+06
assign (resid 143 and name HN) (resid 144 and name HB2) 3.907 1.908 1.908 weight 1.000 ! spec=HNH, no=2992, id=2792, vol=6.090000e+06
assign (resid 143 and name HN) (resid 128 and name HB2) 3.118 1.215 1.215 weight 1.000 ! spec=HNH, no=2996, id=2796, vol=2.360000e+07
assign (resid 143 and name HN) (resid 142 and name HA) 2.156 0.581 0.581 weight 1.000 ! spec=HNH, no=2997, id=2797, vol=2.160000e+08
assign (resid 143 and name HN) (resid 142 and name HB2) 2.448 0.749 0.749 weight 1.000 ! spec=HNH, no=3000, id=2800, vol=1.010000e+08
assign (resid 143 and name HN) (resid 143 and name HB2) 2.469 0.762 0.762 weight 1.000 ! spec=HNH, no=3003, id=2802, vol=9.560000e+07
assign (resid 143 and name HN) (resid 143 and name HB1) 2.659 0.884 0.884 weight 1.000 ! spec=HNH, no=3004, id=2803, vol=6.130000e+07
assign (resid 143 and name HN) (resid 144 and name HG2) 3.589 1.610 1.610 weight 1.000 ! spec=HNH, no=3005, id=2804, vol=1.010000e+07
assign (resid 143 and name HN) (resid 145 and name HN) 3.906 1.907 1.907 weight 1.000 ! spec=HNH, no=3006, id=2805, vol=6.100000e+06
assign (resid 144 and name HN) (resid 142 and name HD22) 3.089 1.193 1.193 weight 1.000 ! spec=HNH, no=3014, id=2813, vol=2.490000e+07
assign (resid 143 and name HN) (resid 144 and name HN) 2.619 0.857 0.857 weight 1.000 ! spec=HNH, no=3015, id=2814, vol=6.720000e+07
assign (resid 144 and name HN) (resid 143 and name HA) 2.519 0.793 0.793 weight 1.000 ! spec=HNH, no=3016, id=2815, vol=8.470000e+07
assign (resid 144 and name HN) (resid 144 and name HA) 2.357 0.694 0.694 weight 1.000 ! spec=HNH, no=3019, id=2817, vol=1.260000e+08
assign (resid 144 and name HN) (resid 144 and name HB2) 2.287 0.654 0.654 weight 1.000 ! spec=HNH, no=3020, id=2818, vol=1.510000e+08
assign (resid 144 and name HN) (resid 144 and name HG2) 2.495 0.778 0.778 weight 1.000 ! spec=HNH, no=3021, id=2819, vol=8.990000e+07
assign (resid 145 and name HN) (resid 49 and name HA) 3.566 1.590 1.590 weight 1.000 ! spec=HNH, no=3027, id=2825, vol=1.050000e+07
assign (resid 145 and name HN) (resid 143 and name HB1) 3.922 1.922 1.922 weight 1.000 ! spec=HNH, no=3028, id=2826, vol=5.960000e+06
assign (resid 145 and name HN) (resid 143 and name HB2) 3.811 1.816 1.816 weight 1.000 ! spec=HNH, no=3029, id=2827, vol=7.070000e+06
assign (resid 145 and name HN) (resid 144 and name HB2) 3.226 1.301 1.301 weight 1.000 ! spec=HNH, no=3031, id=2829, vol=1.920000e+07
assign (resid 145 and name HN) (resid 145 and name HA) 2.533 0.802 0.802 weight 1.000 ! spec=HNH, no=3034, id=2831, vol=8.190000e+07
assign (resid 146 and name HN) (resid 147 and name HN) 2.682 0.899 0.899 weight 1.000 ! spec=HNH, no=3039, id=2836, vol=5.820000e+07
assign (resid 146 and name HN) (resid 46 and name HB) 3.564 1.588 1.588 weight 1.000 ! spec=HNH, no=3044, id=2840, vol=1.060000e+07
assign (resid 146 and name HN) (resid 145 and name HA) 2.405 0.723 0.723 weight 1.000 ! spec=HNH, no=3047, id=2843, vol=1.120000e+08
assign (resid 146 and name HN) (resid 145 and name HG12) 2.746 0.943 0.943 weight 1.000 ! spec=HNH, no=3048, id=2844, vol=5.050000e+07
or (resid 146 and name HN) (resid 145 and name HG11)
or (resid 146 and name HN) (resid 145 and name HG13)
assign (resid 146 and name HN) (resid 145 and name HG22) 3.025 1.144 1.144 weight 1.000 ! spec=HNH, no=3049, id=2845, vol=2.830000e+07
or (resid 146 and name HN) (resid 145 and name HG21)
or (resid 146 and name HN) (resid 145 and name HG23)
assign (resid 146 and name HN) (resid 146 and name HA) 2.485 0.772 0.772 weight 1.000 ! spec=HNH, no=3051, id=2846, vol=9.200000e+07
assign (resid 146 and name HN) (resid 146 and name HB2) 2.616 0.855 0.855 weight 1.000 ! spec=HNH, no=3052, id=2847, vol=6.770000e+07
assign (resid 146 and name HN) (resid 146 and name HB1) 2.713 0.920 0.920 weight 1.000 ! spec=HNH, no=3053, id=2848, vol=5.430000e+07
assign (resid 146 and name HN) (resid 147 and name HA) 3.605 1.624 1.624 weight 1.000 ! spec=HNH, no=3054, id=2849, vol=9.880000e+06
assign (resid 148 and name HN) (resid 148 and name HB) 2.486 0.772 0.772 weight 1.000 ! spec=HNH, no=3072, id=2864, vol=9.190000e+07
assign (resid 148 and name HN) (resid 149 and name HN) 3.184 1.267 1.267 weight 1.000 ! spec=HNH, no=3074, id=2866, vol=2.080000e+07
assign (resid 149 and name HN) (resid 43 and name HB2) 3.829 1.833 1.833 weight 1.000 ! spec=HNH, no=3075, id=2867, vol=6.870000e+06
or (resid 149 and name HN) (resid 43 and name HB1)
or (resid 149 and name HN) (resid 43 and name HB3)
assign (resid 149 and name HN) (resid 148 and name HA) 2.148 0.577 0.577 weight 1.000 ! spec=HNH, no=3078, id=2870, vol=2.210000e+08
assign (resid 149 and name HN) (resid 43 and name HA) 3.778 1.785 1.785 weight 1.000 ! spec=HNH, no=3082, id=2874, vol=7.440000e+06
assign (resid 149 and name HN) (resid 149 and name HG1) 2.478 0.767 0.767 weight 1.000 ! spec=HNH, no=3084, id=2876, vol=9.360000e+07
assign (resid 149 and name HN) (resid 46 and name HG22) 3.795 1.800 1.800 weight 1.000 ! spec=HNH, no=3085, id=2877, vol=7.260000e+06
or (resid 149 and name HN) (resid 46 and name HG21)
or (resid 149 and name HN) (resid 46 and name HG23)
assign (resid 149 and name HN) (resid 149 and name HB2) 2.615 0.855 0.855 weight 1.000 ! spec=HNH, no=3088, id=2879, vol=6.770000e+07
assign (resid 149 and name HN) (resid 150 and name HA1) 3.507 1.538 1.538 weight 1.000 ! spec=HNH, no=3091, id=2882, vol=1.160000e+07
assign (resid 150 and name HN) (resid 151 and name HB) 3.667 1.681 1.681 weight 1.000 ! spec=HNH, no=3099, id=2890, vol=8.910000e+06
assign (resid 149 and name HN) (resid 150 and name HN) 2.421 0.733 0.733 weight 1.000 ! spec=HNH, no=3110, id=2901, vol=1.080000e+08
assign (resid 150 and name HN) (resid 149 and name HA) 2.382 0.709 0.709 weight 1.000 ! spec=HNH, no=3111, id=2902, vol=1.180000e+08
assign (resid 150 and name HN) (resid 150 and name HA2) 2.407 0.724 0.724 weight 1.000 ! spec=HNH, no=3113, id=2903, vol=1.110000e+08
assign (resid 150 and name HN) (resid 150 and name HA1) 2.425 0.735 0.735 weight 1.000 ! spec=HNH, no=3114, id=2904, vol=1.060000e+08
assign (resid 150 and name HN) (resid 151 and name HN) 3.008 1.131 1.131 weight 1.000 ! spec=HNH, no=3115, id=2905, vol=2.930000e+07
assign (resid 151 and name HN) (resid 151 and name HA) 2.960 1.095 1.095 weight 1.000 ! spec=HNH, no=3118, id=2908, vol=3.220000e+07
assign (resid 151 and name HN) (resid 39 and name HZ) 3.358 1.409 1.409 weight 1.000 ! spec=HNH, no=3121, id=2911, vol=1.510000e+07
assign (resid 42 and name HN) (resid 151 and name HN) 3.143 1.235 1.235 weight 1.000 ! spec=HNH, no=3122, id=2912, vol=2.250000e+07
assign (resid 151 and name HN) (resid 39 and name HD1) 3.731 1.740 1.740 weight 1.000 ! spec=HNH, no=3123, id=2913, vol=8.030000e+06
assign (resid 40 and name HN) (resid 151 and name HN) 2.830 1.001 1.001 weight 1.000 ! spec=HNH, no=3124, id=2914, vol=4.220000e+07
assign (resid 151 and name HN) (resid 40 and name HD22) 3.619 1.637 1.637 weight 1.000 ! spec=HNH, no=3126, id=2916, vol=9.640000e+06
or (resid 151 and name HN) (resid 40 and name HD21)
or (resid 151 and name HN) (resid 40 and name HD23)
assign (resid 151 and name HN) (resid 150 and name HA2) 2.421 0.733 0.733 weight 1.000 ! spec=HNH, no=3128, id=2918, vol=1.080000e+08
assign (resid 151 and name HN) (resid 150 and name HA1) 2.430 0.738 0.738 weight 1.000 ! spec=HNH, no=3129, id=2919, vol=1.050000e+08
assign (resid 151 and name HN) (resid 151 and name HB) 2.764 0.955 0.955 weight 1.000 ! spec=HNH, no=3131, id=2920, vol=4.860000e+07
assign (resid 151 and name HN) (resid 152 and name HA) 4.007 2.007 2.007 weight 1.000 ! spec=HNH, no=3132, id=2921, vol=5.230000e+06
assign (resid 152 and name HN) (resid 39 and name HZ) 3.988 1.988 1.988 weight 1.000 ! spec=HNH, no=3137, id=2925, vol=5.380000e+06
assign (resid 152 and name HN) (resid 39 and name HA) 4.427 2.450 2.450 weight 1.000 ! spec=HNH, no=3145, id=2933, vol=2.880000e+06
assign (resid 152 and name HN) (resid 39 and name HD1) 3.557 1.582 1.582 weight 1.000 ! spec=HNH, no=3146, id=2934, vol=1.070000e+07
assign (resid 152 and name HN) (resid 63 and name HB1) 4.116 2.117 2.117 weight 1.000 ! spec=HNH, no=3148, id=2936, vol=4.460000e+06
assign (resid 152 and name HN) (resid 63 and name HE2) 3.711 1.721 1.721 weight 1.000 ! spec=HNH, no=3149, id=2937, vol=8.300000e+06
or (resid 152 and name HN) (resid 63 and name HE1)
or (resid 152 and name HN) (resid 63 and name HE3)
assign (resid 152 and name HN) (resid 152 and name HA) 2.909 1.058 1.058 weight 1.000 ! spec=HNH, no=3153, id=2940, vol=3.580000e+07
assign (resid 152 and name HN) (resid 152 and name HB2) 2.711 0.918 0.918 weight 1.000 ! spec=HNH, no=3154, id=2941, vol=5.460000e+07
assign (resid 152 and name HN) (resid 152 and name HB1) 2.769 0.958 0.958 weight 1.000 ! spec=HNH, no=3155, id=2942, vol=4.810000e+07
assign (resid 153 and name HN) (resid 75 and name HG22) 4.050 2.050 2.050 weight 1.000 ! spec=HNH, no=3159, id=2945, vol=4.910000e+06
or (resid 153 and name HN) (resid 75 and name HG21)
or (resid 153 and name HN) (resid 75 and name HG23)
assign (resid 153 and name HN) (resid 151 and name HG21) 3.383 1.431 1.431 weight 1.000 ! spec=HNH, no=3162, id=2948, vol=1.440000e+07
or (resid 153 and name HN) (resid 151 and name HG22)
or (resid 153 and name HN) (resid 151 and name HG23)
assign (resid 153 and name HN) (resid 29 and name HZ3) 4.257 2.265 2.265 weight 1.000 ! spec=HNH, no=3164, id=2950, vol=3.640000e+06
assign (resid 153 and name HN) (resid 38 and name HA) 4.087 2.088 2.088 weight 1.000 ! spec=HNH, no=3168, id=2954, vol=4.650000e+06
assign (resid 153 and name HN) (resid 38 and name HB) 4.228 2.235 2.235 weight 1.000 ! spec=HNH, no=3169, id=2955, vol=3.790000e+06
assign (resid 153 and name HN) (resid 38 and name HD12) 4.126 2.127 2.127 weight 1.000 ! spec=HNH, no=3170, id=2956, vol=4.390000e+06
or (resid 153 and name HN) (resid 38 and name HD11)
or (resid 153 and name HN) (resid 38 and name HD13)
assign (resid 153 and name HN) (resid 38 and name HG22) 3.037 1.153 1.153 weight 1.000 ! spec=HNH, no=3171, id=2957, vol=2.760000e+07
or (resid 153 and name HN) (resid 38 and name HG21)
or (resid 153 and name HN) (resid 38 and name HG23)
assign (resid 153 and name HN) (resid 39 and name HD1) 3.805 1.809 1.809 weight 1.000 ! spec=HNH, no=3172, id=2958, vol=7.140000e+06
assign (resid 153 and name HN) (resid 40 and name HD22) 3.989 1.989 1.989 weight 1.000 ! spec=HNH, no=3173, id=2959, vol=5.370000e+06
or (resid 153 and name HN) (resid 40 and name HD21)
or (resid 153 and name HN) (resid 40 and name HD23)
assign (resid 153 and name HN) (resid 152 and name HB2) 3.236 1.309 1.309 weight 1.000 ! spec=HNH, no=3175, id=2961, vol=1.890000e+07
assign (resid 153 and name HN) (resid 152 and name HB1) 3.333 1.388 1.388 weight 1.000 ! spec=HNH, no=3176, id=2962, vol=1.580000e+07
assign (resid 153 and name HN) (resid 153 and name HA) 3.164 1.252 1.252 weight 1.000 ! spec=HNH, no=3180, id=2965, vol=2.160000e+07
assign (resid 153 and name HN) (resid 153 and name HB2) 3.012 1.134 1.134 weight 1.000 ! spec=HNH, no=3181, id=2966, vol=2.900000e+07
assign (resid 153 and name HN) (resid 153 and name HB1) 3.305 1.365 1.365 weight 1.000 ! spec=HNH, no=3182, id=2967, vol=1.660000e+07
assign (resid 154 and name HN) (resid 64 and name HA) 3.406 1.450 1.450 weight 1.000 ! spec=HNH, no=3189, id=2974, vol=1.390000e+07
assign (resid 154 and name HN) (resid 56 and name HB2) 3.334 1.389 1.389 weight 1.000 ! spec=HNH, no=3190, id=2975, vol=1.580000e+07
assign (resid 154 and name HN) (resid 37 and name HA) 3.757 1.765 1.765 weight 1.000 ! spec=HNH, no=3192, id=2977, vol=7.700000e+06
assign (resid 154 and name HN) (resid 38 and name HG22) 3.686 1.698 1.698 weight 1.000 ! spec=HNH, no=3194, id=2979, vol=8.640000e+06
or (resid 154 and name HN) (resid 38 and name HG21)
or (resid 154 and name HN) (resid 38 and name HG23)
assign (resid 154 and name HN) (resid 61 and name HB2) 2.619 0.857 0.857 weight 1.000 ! spec=HNH, no=3195, id=2980, vol=6.720000e+07
or (resid 154 and name HN) (resid 61 and name HB1)
or (resid 154 and name HN) (resid 61 and name HB3)
assign (resid 62 and name HN) (resid 154 and name HN) 2.773 0.961 0.961 weight 1.000 ! spec=HNH, no=3196, id=2981, vol=4.760000e+07
assign (resid 154 and name HN) (resid 63 and name HN) 4.125 2.127 2.127 weight 1.000 ! spec=HNH, no=3197, id=2982, vol=4.400000e+06
assign (resid 64 and name HN) (resid 154 and name HN) 3.491 1.524 1.524 weight 1.000 ! spec=HNH, no=3198, id=2983, vol=1.200000e+07
assign (resid 65 and name HN) (resid 154 and name HN) 4.202 2.207 2.207 weight 1.000 ! spec=HNH, no=3199, id=2984, vol=3.930000e+06
assign (resid 153 and name HN) (resid 154 and name HN) 3.590 1.611 1.611 weight 1.000 ! spec=HNH, no=3200, id=2985, vol=1.010000e+07
assign (resid 154 and name HN) (resid 153 and name HA) 2.419 0.732 0.732 weight 1.000 ! spec=HNH, no=3201, id=2986, vol=1.080000e+08
assign (resid 154 and name HN) (resid 153 and name HB2) 2.769 0.958 0.958 weight 1.000 ! spec=HNH, no=3202, id=2987, vol=4.810000e+07
assign (resid 154 and name HN) (resid 153 and name HB1) 2.571 0.826 0.826 weight 1.000 ! spec=HNH, no=3203, id=2988, vol=7.510000e+07
assign (resid 154 and name HN) (resid 154 and name HA) 3.069 1.178 1.178 weight 1.000 ! spec=HNH, no=3204, id=2989, vol=2.590000e+07
assign (resid 154 and name HN) (resid 154 and name HB1) 2.745 0.942 0.942 weight 1.000 ! spec=HNH, no=3205, id=2990, vol=5.060000e+07
assign (resid 154 and name HN) (resid 154 and name HG2) 3.195 1.276 1.276 weight 1.000 ! spec=HNH, no=3206, id=2991, vol=2.040000e+07
assign (resid 154 and name HN) (resid 155 and name HA) 3.335 1.390 1.390 weight 1.000 ! spec=HNH, no=3207, id=2992, vol=1.570000e+07
assign (resid 155 and name HN) (resid 29 and name HZ3) 4.257 2.265 2.265 weight 1.000 ! spec=HNH, no=3222, id=3001, vol=3.640000e+06
assign (resid 155 and name HN) (resid 35 and name HA) 3.692 1.704 1.704 weight 1.000 ! spec=HNH, no=3223, id=3002, vol=8.560000e+06
assign (resid 155 and name HN) (resid 35 and name HB2) 3.546 1.572 1.572 weight 1.000 ! spec=HNH, no=3224, id=3003, vol=1.090000e+07
assign (resid 155 and name HN) (resid 35 and name HB1) 3.885 1.887 1.887 weight 1.000 ! spec=HNH, no=3225, id=3004, vol=6.300000e+06
assign (resid 36 and name HN) (resid 155 and name HN) 2.958 1.094 1.094 weight 1.000 ! spec=HNH, no=3226, id=3005, vol=3.230000e+07
assign (resid 155 and name HN) (resid 36 and name HB2) 3.417 1.459 1.459 weight 1.000 ! spec=HNH, no=3227, id=3006, vol=1.360000e+07
assign (resid 155 and name HN) (resid 36 and name HB1) 3.455 1.492 1.492 weight 1.000 ! spec=HNH, no=3228, id=3007, vol=1.270000e+07
assign (resid 155 and name HN) (resid 37 and name HN) 4.226 2.233 2.233 weight 1.000 ! spec=HNH, no=3229, id=3008, vol=3.800000e+06
assign (resid 155 and name HN) (resid 37 and name HA) 3.063 1.172 1.172 weight 1.000 ! spec=HNH, no=3230, id=3009, vol=2.630000e+07
assign (resid 155 and name HN) (resid 37 and name HB1) 4.121 2.122 2.122 weight 1.000 ! spec=HNH, no=3231, id=3010, vol=4.420000e+06
assign (resid 155 and name HN) (resid 37 and name HD1) 3.965 1.966 1.966 weight 1.000 ! spec=HNH, no=3232, id=3011, vol=5.570000e+06
assign (resid 155 and name HN) (resid 61 and name HA) 4.036 2.036 2.036 weight 1.000 ! spec=HNH, no=3233, id=3012, vol=5.010000e+06
assign (resid 155 and name HN) (resid 61 and name HB2) 3.128 1.223 1.223 weight 1.000 ! spec=HNH, no=3234, id=3013, vol=2.310000e+07
or (resid 155 and name HN) (resid 61 and name HB1)
or (resid 155 and name HN) (resid 61 and name HB3)
assign (resid 155 and name HN) (resid 154 and name HN) 3.180 1.264 1.264 weight 1.000 ! spec=HNH, no=3235, id=3014, vol=2.100000e+07
assign (resid 155 and name HN) (resid 154 and name HA) 2.419 0.731 0.731 weight 1.000 ! spec=HNH, no=3236, id=3015, vol=1.080000e+08
assign (resid 155 and name HN) (resid 154 and name HB2) 3.123 1.219 1.219 weight 1.000 ! spec=HNH, no=3237, id=3016, vol=2.340000e+07
assign (resid 155 and name HN) (resid 154 and name HB1) 3.267 1.334 1.334 weight 1.000 ! spec=HNH, no=3238, id=3017, vol=1.780000e+07
assign (resid 155 and name HN) (resid 154 and name HG2) 2.493 0.777 0.777 weight 1.000 ! spec=HNH, no=3239, id=3018, vol=9.030000e+07
assign (resid 155 and name HN) (resid 154 and name HG1) 2.941 1.081 1.081 weight 1.000 ! spec=HNH, no=3240, id=3019, vol=3.340000e+07
assign (resid 155 and name HN) (resid 155 and name HA) 3.032 1.149 1.149 weight 1.000 ! spec=HNH, no=3242, id=3020, vol=2.790000e+07
assign (resid 156 and name HN) (resid 154 and name HG1) 3.799 1.804 1.804 weight 1.000 ! spec=HNH, no=3248, id=3026, vol=7.200000e+06
assign (resid 156 and name HN) (resid 156 and name HB2) 2.188 0.598 0.598 weight 1.000 ! spec=HNH, no=3249, id=3027, vol=1.970000e+08
or (resid 156 and name HN) (resid 156 and name HB1)
or (resid 156 and name HN) (resid 156 and name HB3)
assign (resid 156 and name HN) (resid 154 and name HE2) 4.088 2.089 2.089 weight 1.000 ! spec=HNH, no=3253, id=3031, vol=4.640000e+06
or (resid 156 and name HN) (resid 154 and name HE1)
assign (resid 156 and name HN) (resid 35 and name HA) 3.769 1.776 1.776 weight 1.000 ! spec=HNH, no=3260, id=3038, vol=7.560000e+06
assign (resid 156 and name HN) (resid 35 and name HB2) 4.439 2.463 2.463 weight 1.000 ! spec=HNH, no=3261, id=3039, vol=2.830000e+06
assign (resid 156 and name HN) (resid 35 and name HB1) 4.262 2.270 2.270 weight 1.000 ! spec=HNH, no=3262, id=3040, vol=3.620000e+06
assign (resid 156 and name HN) (resid 154 and name HA) 4.211 2.217 2.217 weight 1.000 ! spec=HNH, no=3266, id=3044, vol=3.880000e+06
assign (resid 155 and name HN) (resid 156 and name HN) 3.595 1.615 1.615 weight 1.000 ! spec=HNH, no=3267, id=3045, vol=1.000000e+07
assign (resid 156 and name HN) (resid 155 and name HA) 2.259 0.638 0.638 weight 1.000 ! spec=HNH, no=3268, id=3046, vol=1.630000e+08
assign (resid 156 and name HN) (resid 155 and name HG21) 2.934 1.076 1.076 weight 1.000 ! spec=HNH, no=3270, id=3048, vol=3.400000e+07
or (resid 156 and name HN) (resid 155 and name HG22)
or (resid 156 and name HN) (resid 155 and name HG23)
assign (resid 156 and name HN) (resid 156 and name HA) 2.300 0.661 0.661 weight 1.000 ! spec=HNH, no=3272, id=3049, vol=1.460000e+08
assign (resid 36 and name HN) (resid 157 and name HN) 3.656 1.670 1.670 weight 1.000 ! spec=HNH, no=3273, id=3050, vol=9.080000e+06
assign (resid 157 and name HN) (resid 34 and name HB2) 3.542 1.568 1.568 weight 1.000 ! spec=HNH, no=3283, id=3060, vol=1.100000e+07
assign (resid 157 and name HN) (resid 35 and name HA) 2.829 1.000 1.000 weight 1.000 ! spec=HNH, no=3284, id=3061, vol=4.220000e+07
assign (resid 157 and name HN) (resid 35 and name HB2) 3.887 1.889 1.889 weight 1.000 ! spec=HNH, no=3285, id=3062, vol=6.280000e+06
assign (resid 157 and name HN) (resid 35 and name HB1) 3.412 1.455 1.455 weight 1.000 ! spec=HNH, no=3286, id=3063, vol=1.370000e+07
assign (resid 157 and name HN) (resid 156 and name HA) 2.307 0.665 0.665 weight 1.000 ! spec=HNH, no=3287, id=3064, vol=1.440000e+08
assign (resid 157 and name HN) (resid 156 and name HB2) 2.341 0.685 0.685 weight 1.000 ! spec=HNH, no=3288, id=3065, vol=1.320000e+08
or (resid 157 and name HN) (resid 156 and name HB1)
or (resid 157 and name HN) (resid 156 and name HB3)
assign (resid 157 and name HN) (resid 157 and name HA) 2.821 0.995 0.995 weight 1.000 ! spec=HNH, no=3290, id=3066, vol=4.300000e+07
assign (resid 157 and name HN) (resid 157 and name HG12) 2.864 1.025 1.025 weight 1.000 ! spec=HNH, no=3292, id=3068, vol=3.920000e+07
assign (resid 157 and name HN) (resid 157 and name HD12) 2.618 0.856 0.856 weight 1.000 ! spec=HNH, no=3293, id=3069, vol=6.730000e+07
or (resid 157 and name HN) (resid 157 and name HD11)
or (resid 157 and name HN) (resid 157 and name HD13)
assign (resid 157 and name HN) (resid 158 and name HD2) 3.651 1.666 1.666 weight 1.000 ! spec=HNH, no=3294, id=3070, vol=9.140000e+06
assign (resid 159 and name HN) (resid 159 and name HE1) 4.033 2.033 2.033 weight 1.000 ! spec=HNH, no=3297, id=3073, vol=5.040000e+06
or (resid 159 and name HN) (resid 159 and name HE2)
assign (resid 159 and name HN) (resid 157 and name HA) 2.924 1.069 1.069 weight 1.000 ! spec=HNH, no=3300, id=3076, vol=3.470000e+07
assign (resid 159 and name HN) (resid 157 and name HG22) 2.946 1.085 1.085 weight 1.000 ! spec=HNH, no=3301, id=3077, vol=3.310000e+07
or (resid 159 and name HN) (resid 157 and name HG21)
or (resid 159 and name HN) (resid 157 and name HG23)
assign (resid 159 and name HN) (resid 158 and name HB1) 3.058 1.169 1.169 weight 1.000 ! spec=HNH, no=3304, id=3080, vol=2.650000e+07
assign (resid 159 and name HN) (resid 158 and name HD2) 3.634 1.651 1.651 weight 1.000 ! spec=HNH, no=3305, id=3081, vol=9.400000e+06
assign (resid 159 and name HN) (resid 158 and name HD1) 3.591 1.612 1.612 weight 1.000 ! spec=HNH, no=3306, id=3082, vol=1.010000e+07
assign (resid 159 and name HN) (resid 159 and name HA) 2.547 0.811 0.811 weight 1.000 ! spec=HNH, no=3308, id=3083, vol=7.940000e+07
assign (resid 159 and name HN) (resid 159 and name HB2) 2.341 0.685 0.685 weight 1.000 ! spec=HNH, no=3309, id=3084, vol=1.320000e+08
assign (resid 159 and name HN) (resid 160 and name HB2) 3.310 1.370 1.370 weight 1.000 ! spec=HNH, no=3311, id=3086, vol=1.650000e+07
assign (resid 160 and name HN) (resid 161 and name HN) 2.666 0.889 0.889 weight 1.000 ! spec=HNH, no=3314, id=3089, vol=6.030000e+07
assign (resid 160 and name HN) (resid 159 and name HB2) 2.882 1.038 1.038 weight 1.000 ! spec=HNH, no=3317, id=3092, vol=3.780000e+07
assign (resid 160 and name HN) (resid 160 and name HA) 2.864 1.026 1.026 weight 1.000 ! spec=HNH, no=3320, id=3094, vol=3.920000e+07
assign (resid 160 and name HN) (resid 160 and name HB2) 2.782 0.967 0.967 weight 1.000 ! spec=HNH, no=3321, id=3095, vol=4.680000e+07
assign (resid 160 and name HN) (resid 160 and name HB1) 3.046 1.160 1.160 weight 1.000 ! spec=HNH, no=3322, id=3096, vol=2.710000e+07
assign (resid 160 and name HN) (resid 160 and name HG2) 3.302 1.363 1.363 weight 1.000 ! spec=HNH, no=3324, id=3098, vol=1.670000e+07
assign (resid 161 and name HN) (resid 159 and name HB2) 4.172 2.176 2.176 weight 1.000 ! spec=HNH, no=3326, id=3100, vol=4.110000e+06
or (resid 161 and name HN) (resid 159 and name HB1)
assign (resid 161 and name HN) (resid 160 and name HA) 2.383 0.710 0.710 weight 1.000 ! spec=HNH, no=3328, id=3102, vol=1.180000e+08
assign (resid 161 and name HN) (resid 160 and name HG2) 3.728 1.737 1.737 weight 1.000 ! spec=HNH, no=3329, id=3103, vol=8.070000e+06
assign (resid 161 and name HN) (resid 161 and name HB2) 2.977 1.108 1.108 weight 1.000 ! spec=HNH, no=3332, id=3105, vol=3.110000e+07
assign (resid 161 and name HN) (resid 161 and name HG2) 3.334 1.389 1.389 weight 1.000 ! spec=HNH, no=3334, id=3107, vol=1.580000e+07
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