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 |
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644474 |
6ccw   |
30402 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
# Restraints file 1: Restraints.txt assi (resi 3 and name H1') (resi 3 and name H2) 4.40 0.88 0.88 !!1.63e+08 2525566 7.00 assi (resi 3 and name H1') (resi 3 and name H2') 3.13 0.63 0.63 !!2.04e+10 20716770 assi (resi 3 and name H1') (resi 3 and name H2'') 2.40 0.48 0.48 !!3.51e+10 39601868 2.86 assi (resi 3 and name H1') (resi 3 and name H8) 3.87 0.77 0.77 !!3.46e+10 15053107 assi (resi 3 and name H2) (resi 3 and name H2') 5.94 1.19 1.19 !!4.36e+08 12234697 assi (resi 3 and name H2') (resi 3 and name H8) 2.35 0.47 0.47 !!-2.36e+09 54724084 4.99 2.30 assi (resi 3 and name H2'') (resi 3 and name H8) 3.85 0.77 0.77 !!5.30e+08 21870068 assi (resi 2 and name H1') (resi 2 and name H2') 2.96 0.59 0.59 !!1.88e+09 59002160 assi (resi 2 and name H1') (resi 2 and name H2'') 2.45 0.49 0.49 !!3.92e+08 40999516 assi (resi 2 and name H1') (resi 2 and name H6) 3.65 0.73 0.73 !!1.95e+10 31177590 assi (resi 2 and name H1') (resi 2 and name H5#) 5.54 1.11 1.11 !!3.59e+08 14425125 assi (resi 2 and name H2') (resi 2 and name H6) 2.44 0.49 0.49 !!1.92e+09 109258880 assi (resi 2 and name H2') (resi 2 and name H5#) 5.23 1.05 1.05 !!9.43e+08 30132618 assi (resi 2 and name H2'') (resi 2 and name H6) 3.89 0.77 0.77 !!2.69e+09 124827008 assi (resi 2 and name H2'') (resi 2 and name H5#) 5.43 1.09 1.09 !!6.13e+08 28165972 5.02 assi (resi 2 and name H3') (resi 2 and name H6) 2.49 0.50 0.50 !!3.36e+07 3036195 3.01 2.96 assi (resi 2 and name H4') (resi 2 and name H1') 3.53 0.71 0.71 !!2.48e+08 14542139 assi (resi 2 and name H4') (resi 2 and name H6) 4.18 0.82 0.82 !!9.96e+08 20191028 assi (resi 2 and name H5') (resi 2 and name H6) 4.40 0.88 0.88 !!2.80e+08 10069837 assi (resi 2 and name H5'') (resi 2 and name H6) 2.60 0.52 0.52 !!2.69e+07 7931930 3.26 3.16 3.00 assi (resi 2 and name H6) (resi 2 and name H5#) 3.02 0.60 0.60 !!2.57e+09 90178504 assi (resi 13 and name H1') (resi 13 and name H2') 3.05 0.61 0.61 !!7.44e+08 9615505 3.44 assi (resi 13 and name H1') (resi 13 and name H2'') 2.56 0.51 0.51 !!3.90e+08 30671125 assi (resi 13 and name H1') (resi 13 and name H5#) 5.55 1.11 1.11 !!2.44e+08 11069811 assi (resi 13 and name H2') (resi 13 and name H3) 4.68 0.93 0.93 !!2.16e+08 4406812 assi (resi 13 and name H2'') (resi 13 and name H3) 5.00 1.00 1.00 !!4.18e+07 1900817 4.79 assi (resi 13 and name H2'') (resi 13 and name H6) 4.99 1.00 1.00 !!7.42e+07 382616 assi (resi 13 and name H5#) (resi 13 and name H3) 5.00 1.00 1.00 !!1.90e+08 6446292 6.83 assi (resi 13 and name H6) (resi 13 and name H3) 4.88 0.98 0.98 !!8.03e+07 2901988 assi (resi 13 and name H6) (resi 13 and name H5#) 3.00 0.60 0.60 !!4.80e+09 134720896 3.99 assi (resi 15 and name H1') (resi 15 and name H2) 4.81 0.96 0.96 !!5.56e+08 18357284 assi (resi 15 and name H1') (resi 15 and name H2'') 2.54 0.41 0.41 !!2.21e+09 35161248 assi (resi 15 and name H1') (resi 15 and name H8) 3.74 0.76 0.76 !!5.98e+08 22292282 assi (resi 15 and name H2') (resi 15 and name H8) 2.97 0.60 0.60 !!4.23e+08 14120713 assi (resi 15 and name H2'') (resi 15 and name H8) 3.71 0.74 0.74 !!7.26e+08 19618564 assi (resi 15 and name H4') (resi 15 and name H8) 4.23 0.85 0.85 !!2.27e+08 8512190 assi (resi 14 and name H1') (resi 14 and name H2') 2.74 0.55 0.55 !!4.57e+10 28493618 assi (resi 14 and name H1') (resi 14 and name H2'') 2.25 0.45 0.45 !!1.34e+09 28718724 2.93 assi (resi 14 and name H1') (resi 14 and name H6) 3.06 0.61 0.61 !!1.14e+09 34699532 assi (resi 14 and name H4') (resi 14 and name H6) 4.56 0.91 0.91 !!2.14e+09 33945604 assi (resi 14 and name H5'*) (resi 14 and name H6) 3.38 0.67 0.67 !!1.62e+09 17643758 3.08 assi (resi 14 and name H6) (resi 14 and name H2'') 4.89 0.98 0.98 !!1.80e+08 3744450 assi (resi 14 and name H6) (resi 14 and name H5#) 3.08 0.62 0.62 !!4.06e+09 326303264 4.10 assi (resi 1 and name H1') (resi 1 and name H2') 3.29 0.66 0.66 !!3.10e+09 41671680 assi (resi 1 and name H1') (resi 1 and name H2'') 2.30 0.46 0.46 !!4.75e+08 49980800 2.86 assi (resi 1 and name H1') (resi 1 and name H6) 2.56 0.52 0.52 !!1.15e+09 69663400 4.06 assi (resi 1 and name H1') (resi 1 and name H5#) 5.08 1.02 1.02 !!4.92e+07 26392926 4.55 assi (resi 1 and name H2') (resi 1 and name H2'') 1.96 0.39 0.39 !!5.02e+09 61790048 assi (resi 1 and name H2') (resi 1 and name H6) 3.95 0.79 0.79 !!2.14e+10 43685204 3.11 assi (resi 1 and name H2'') (resi 1 and name H6) 4.37 0.87 0.87 !!1.44e+09 42603448 4.47 assi (resi 1 and name H4') (resi 1 and name H6) 5.01 1.00 1.00 !!4.09e+08 11595790 assi (resi 1 and name H5'*) (resi 1 and name H6) 6.00 1.20 1.20 !!3.70e+07 21505964 4.47 4.57 5.00 5.50 assi (resi 1 and name H6) (resi 1 and name H5#) 3.00 0.60 0.60 !!4.65e+09 380618848 4.01 assi (resi 19 and name H1') (resi 19 and name H2') 2.80 0.56 0.56 !!1.60e+10 20852470 2.26 assi (resi 19 and name H1') (resi 19 and name H2'') 2.36 0.47 0.47 !!1.34e+10 30584978 assi (resi 19 and name H1') (resi 19 and name H4') 3.60 0.74 0.74 !!5.26e+08 28681152 3.76 assi (resi 19 and name H6) (resi 19 and name H1') 2.38 0.48 0.48 !!9.55e+08 47525288 3.22 assi (resi 19 and name H6) (resi 19 and name H2') 4.48 0.89 0.89 !!6.22e+10 66021048 3.60 assi (resi 19 and name H6) (resi 19 and name H2'') 4.05 0.81 0.81 !!1.23e+09 109500208 4.50 assi (resi 19 and name H6) (resi 19 and name H4') 4.80 0.96 0.96 !!-1.07e+08 10223241 4.00 assi (resi 19 and name H6) (resi 19 and name H5') 5.50 1.50 1.50 !!1.79e+07 14391742 5.42 5.50 assi (resi 19 and name H6) (resi 19 and name H5#) 2.53 0.51 0.51 !!9.96e+09 74440200 3.53 assi (resi 20 and name H1') (resi 20 and name H2') 2.90 0.58 0.58 !!7.44e+08 42767204 2.44 assi (resi 20 and name H1') (resi 20 and name H2'') 2.23 0.45 0.45 !!7.48e+08 22504640 2.33 assi (resi 20 and name H1') (resi 20 and name H4') 3.67 0.73 0.73 !!3.83e+08 24439066 3.60 3.12 assi (resi 20 and name H6) (resi 20 and name H1') 3.90 0.78 0.78 !!7.24e+08 52096936 assi (resi 20 and name H6) (resi 20 and name H2'') 4.00 0.80 0.80 !!1.79e+08 98272384 3.90 assi (resi 20 and name H6) (resi 20 and name H4') 4.86 0.97 0.97 !!3.51e+10 31489880 assi (resi 20 and name H6) (resi 20 and name H5') 4.24 0.85 0.85 !!-3.89e+07 24910114 4.50 4.40 assi (resi 20 and name H6) (resi 20 and name H5#) 3.00 1.00 1.00 !!3.43e+09 233671120 3.22 2.82 3.94 assi (resi 21 and name H1') (resi 21 and name H2) 4.94 0.99 0.99 !!2.05e+08 7155756 assi (resi 21 and name H1') (resi 21 and name H2') 2.85 0.57 0.57 !!1.90e+09 45760120 assi (resi 21 and name H1') (resi 21 and name H2'') 2.14 0.43 0.43 !!1.04e+09 28024852 assi (resi 21 and name H1') (resi 21 and name H4') 3.06 0.61 0.61 !!6.23e+08 32580896 3.60 assi (resi 21 and name H1') (resi 21 and name H5') 4.97 0.99 0.99 !!2.13e+08 8290049 assi (resi 21 and name H1') (resi 21 and name H5'') 5.12 1.02 1.02 !!1.48e+08 9886822 assi (resi 21 and name H1') (resi 21 and name H8) 4.00 0.80 0.80 !!8.97e+08 65975000 4.27 4.00 3.90 3.70 3.60 assi (resi 21 and name H2') (resi 21 and name H8) 2.80 0.80 0.80 !!1.16e+09 42288668 3.02 2.80 assi (resi 21 and name H2'') (resi 21 and name H8) 3.82 0.76 0.76 !!1.61e+09 88700528 3.78 3.72 3.72 assi (resi 21 and name H3') (resi 21 and name H8) 3.97 0.79 0.79 !!8.97e+08 65975000 4.00 2.53 4.00 assi (resi 21 and name H4') (resi 21 and name H8) 5.00 1.00 1.00 !!6.99e+08 10271440 4.20 assi (resi 21 and name H5') (resi 21 and name H8) 4.13 0.83 0.83 !!2.08e+08 9060403 3.73 4.50 3.05 4.00 4.30 4.23 assi (resi 21 and name H5'') (resi 21 and name H8) 4.00 1.00 1.00 !!6.99e+08 10271440 3.55 4.00 4.30 4.00 3.94 assi (resi 24 and name H2') (resi 24 and name H1') 2.95 0.59 0.59 !!2.93e+10 25354280 assi (resi 23 and name H2') (resi 23 and name H1') 3.10 0.62 0.62 !!2.17e+08 8534188 6.68 assi (resi 18 and name H2') (resi 18 and name H1') 3.11 0.62 0.62 !!5.96e+08 8376184 assi (resi 17 and name H2') (resi 17 and name H1') 3.36 0.67 0.67 !!1.34e+10 4247206 assi (resi 12 and name H2') (resi 12 and name H1') 3.13 0.62 0.62 !!4.89e+08 8233122 assi (resi 6 and name H2') (resi 6 and name H1') 3.00 0.60 0.60 !!5.75e+08 12033400 assi (resi 5 and name H2') (resi 5 and name H1') 3.10 0.62 0.62 !!2.42e+08 6988412 3.56 assi (resi 22 and name H2') (resi 22 and name H1') 3.10 0.62 0.62 !!3.08e+08 6333788 6.30 assi (resi 16 and name H2') (resi 16 and name H1') 3.36 0.67 0.67 !!2.81e+09 3776721 assi (resi 11 and name H2') (resi 11 and name H1') 3.20 0.64 0.64 !!5.03e+08 13245611 assi (resi 10 and name H2') (resi 10 and name H1') 3.29 0.65 0.65 !!5.11e+08 6723800 assi (resi 4 and name H1') (resi 4 and name H2') 3.21 0.64 0.64 !!5.52e+08 27785932 assi (resi 24 and name H2'') (resi 24 and name H1') 2.40 0.48 0.48 !!1.13e+09 33225574 5.07 assi (resi 23 and name H2'') (resi 23 and name H1') 2.50 0.50 0.50 !!6.65e+08 16509108 5.54 assi (resi 18 and name H2'') (resi 18 and name H1') 2.49 0.50 0.50 !!-6.07e+07 9446446 assi (resi 17 and name H2'') (resi 17 and name H1') 2.59 0.52 0.52 !!-1.87e+09 3805841 assi (resi 12 and name H2'') (resi 12 and name H1') 2.59 0.72 0.72 !!3.78e+08 10492836 assi (resi 6 and name H2'') (resi 6 and name H1') 2.63 0.53 0.53 !!1.74e+08 8963792 assi (resi 5 and name H2'') (resi 5 and name H1') 2.28 0.46 0.46 !!3.14e+08 8048721 assi (resi 16 and name H2'') (resi 16 and name H1') 2.27 0.44 0.44 !!2.32e+10 4574962 assi (resi 11 and name H2'') (resi 11 and name H1') 2.30 0.46 0.46 !!2.02e+08 2632029 2.76 assi (resi 10 and name H2'') (resi 10 and name H1') 2.35 0.47 0.47 !!6.70e+07 4604419 2.72 assi (resi 4 and name H1') (resi 4 and name H2'') 2.08 0.42 0.42 !!3.82e+08 17400314 assi (resi 22 and name H1') (resi 22 and name H2'') 2.50 0.50 0.50 !!1.92e+07 536887 3.16 assi (resi 18 and name H1') (resi 18 and name H3') 3.90 0.78 0.78 !!4.21e+07 516158 2.78 assi (resi 12 and name H1') (resi 12 and name H3') 3.59 0.72 0.72 !!1.75e+07 523822 3.21 assi (resi 6 and name H1') (resi 6 and name H3') 3.84 0.77 0.77 !!-9.99e-09 1917758 3.29 assi (resi 16 and name H1') (resi 16 and name H3') 3.82 0.76 0.76 !!-9.99e-09 1914175 3.29 assi (resi 23 and name H1') (resi 23 and name H3') 3.85 0.77 0.77 !!-9.99e-09 1648554 3.37 assi (resi 5 and name H1') (resi 5 and name H3') 3.73 0.75 0.75 !!-9.99e-09 1536564 3.41 assi (resi 4 and name H1') (resi 4 and name H3') 3.58 0.72 0.72 !!9.16e+06 695112 assi (resi 24 and name H1') (resi 24 and name H3') 3.60 0.72 0.72 !!8.92e+06 763772 assi (resi 11 and name H1') (resi 11 and name H3') 3.73 0.75 0.75 !!-9.99e-09 910105 assi (resi 17 and name H1') (resi 17 and name H3') 3.94 0.79 0.79 !!5.14e+06 529036 assi (resi 10 and name H3') (resi 10 and name H1') 4.13 0.83 0.83 !!-9.99e-09 487617 assi (resi 22 and name H3') (resi 22 and name H1') 4.50 0.90 0.90 !!4.84e+05 186524 0.00 5.84 assi (resi 24 and name H4') (resi 24 and name H1') 3.60 0.72 0.72 !!8.38e+07 17172764 7.83 assi (resi 23 and name H4') (resi 23 and name H1') 3.40 0.68 0.68 !!2.23e+08 12917325 6.65 assi (resi 12 and name H4') (resi 12 and name H1') 3.43 0.69 0.69 !!1.14e+08 8019041 assi (resi 6 and name H4') (resi 6 and name H1') 3.42 0.68 0.68 !!1.90e+07 11908606 assi (resi 5 and name H4') (resi 5 and name H1') 3.27 0.65 0.65 !!5.24e+08 9171402 assi (resi 22 and name H4') (resi 22 and name H1') 2.99 0.60 0.60 !!2.72e+10 16903324 assi (resi 10 and name H4') (resi 10 and name H1') 3.32 0.66 0.66 !!2.66e+10 13120944 assi (resi 4 and name H4') (resi 4 and name H1') 3.62 0.72 0.72 !!4.70e+07 13229181 assi (resi 11 and name H1') (resi 11 and name H4') 2.83 0.57 0.57 !!3.75e+07 2257583 assi (resi 16 and name H1') (resi 16 and name H4') 3.40 0.68 0.68 !!-9.99e-09 1454848 0.00 2.45 2.60 2.80 assi (resi 17 and name H1') (resi 17 and name H4') 2.97 0.59 0.59 !!-9.99e-09 3552905 0.00 assi (resi 18 and name H1') (resi 18 and name H4') 3.48 0.70 0.70 !!5.34e+07 1102623 0.00 2.97 assi (resi 24 and name H1') (resi 24 and name H8) 3.70 0.74 0.74 !!4.92e+08 25016952 5.83 assi (resi 23 and name H1') (resi 23 and name H8) 3.90 0.78 0.78 !!3.02e+08 17316748 6.32 assi (resi 18 and name H1') (resi 18 and name H8) 4.07 0.81 0.81 !!5.81e+08 3399931 assi (resi 17 and name H1') (resi 17 and name H8) 3.84 0.77 0.77 !!3.70e+10 20211838 assi (resi 12 and name H1') (resi 12 and name H8) 4.03 0.81 0.81 !!2.48e+08 31493128 assi (resi 6 and name H1') (resi 6 and name H8) 3.82 0.76 0.76 !!4.96e+08 44682388 assi (resi 5 and name H1') (resi 5 and name H8) 3.79 0.76 0.76 !!2.07e+09 17660126 4.59 assi (resi 22 and name H1') (resi 22 and name H8) 2.70 0.54 0.54 !!5.77e+09 73102056 3.87 assi (resi 16 and name H1') (resi 16 and name H8) 2.69 0.53 0.53 !!-1.10e+08 25497608 2.89 assi (resi 11 and name H1') (resi 11 and name H8) 2.76 0.55 0.55 !!1.66e+09 86509992 assi (resi 10 and name H1') (resi 10 and name H8) 2.63 0.53 0.53 !!3.90e+09 61292484 assi (resi 4 and name H1') (resi 4 and name H8) 2.62 0.52 0.52 !!1.98e+09 191070304 assi (resi 24 and name H1') (resi 24 and name H1) 5.20 1.30 1.30 !!-9.99e-09 17001 0.00 4.83 assi (resi 6 and name H1') (resi 6 and name H5'*) 4.30 0.86 0.86 !!-9.99e-09 2628281 3.12 assi (resi 18 and name H1') (resi 18 and name H5') 4.78 0.96 0.96 !!1.62e+06 271953 assi (resi 24 and name H2') (resi 24 and name H8) 3.16 0.63 0.63 !!3.51e+09 155756016 3.00 3.90 2.50 2.55 2.60 2.65 assi (resi 23 and name H2') (resi 23 and name H8) 2.46 0.49 0.49 !!4.26e+09 66327444 4.07 2.40 2.95 3.06 3.86 assi (resi 17 and name H2') (resi 17 and name H8) 2.56 0.51 0.51 !!1.16e+09 36118912 2.95 3.60 3.76 4.46 assi (resi 12 and name H8) (resi 12 and name H2') 2.52 0.50 0.50 !!1.01e+10 86443408 3.52 3.92 2.42 2.46 assi (resi 6 and name H2') (resi 6 and name H8) 3.08 0.62 0.62 !!1.38e+09 43530108 3.00 3.80 assi (resi 22 and name H2') (resi 22 and name H8) 4.40 0.88 0.88 !!2.20e+08 11652951 6.66 assi (resi 16 and name H2') (resi 16 and name H8) 4.58 0.92 0.92 !!1.26e+09 9184806 assi (resi 11 and name H2') (resi 11 and name H8) 4.12 0.82 0.82 !!6.81e+08 31856308 assi (resi 10 and name H2') (resi 10 and name H8) 4.44 0.89 0.89 !!2.71e+08 5241160 assi (resi 4 and name H2') (resi 4 and name H8) 4.38 0.84 0.84 !!2.86e+08 12670160 assi (resi 5 and name H2') (resi 5 and name H8) 2.77 0.55 0.55 !!4.22e+07 1632963 0.00 assi (resi 18 and name H2') (resi 18 and name H8) 2.94 0.59 0.59 !!2.98e+07 2291078 0.00 assi (resi 24 and name H2'') (resi 24 and name H8) 4.60 0.92 0.92 !!-1.81e+07 120245704 4.99 assi (resi 23 and name H2'') (resi 23 and name H8) 3.76 0.75 0.75 !!1.49e+09 55469580 3.74 assi (resi 17 and name H2'') (resi 17 and name H8) 3.66 0.73 0.73 !!9.06e+08 56114452 assi (resi 6 and name H2'') (resi 6 and name H8) 4.47 0.89 0.89 !!1.63e+09 39896552 4.77 assi (resi 22 and name H2'') (resi 22 and name H8) 4.24 0.85 0.85 !!1.79e+08 7092590 6.90 4.40 3.74 assi (resi 16 and name H2'') (resi 16 and name H8) 4.50 0.90 0.90 !!6.92e+08 15085615 assi (resi 10 and name H2'') (resi 10 and name H8) 4.48 0.89 0.89 !!2.61e+08 8092482 assi (resi 4 and name H2'') (resi 4 and name H8) 4.28 0.85 0.85 !!1.94e+08 9256825 3.80 assi (resi 5 and name H2'') (resi 5 and name H8) 3.80 0.76 0.76 !!2.54e+07 1008368 0.00 3.02 assi (resi 11 and name H2'') (resi 11 and name H8) 3.32 0.66 0.66 !!1.44e+07 236424 0.00 assi (resi 12 and name H2'') (resi 12 and name H8) 3.70 0.74 0.74 !!-9.99e-09 3163942 0.00 3.03 assi (resi 18 and name H2'') (resi 18 and name H8) 4.00 0.80 0.80 !!3.18e+07 1740902 0.00 2.91 3.60 assi (resi 24 and name H3') (resi 24 and name H8) 4.36 0.87 0.87 !!1.26e+07 1542815 3.60 assi (resi 23 and name H3') (resi 23 and name H8) 4.23 0.85 0.85 !!9.90e+06 1035998 3.53 4.33 assi (resi 18 and name H3') (resi 18 and name H8) 4.37 0.87 0.87 !!1.84e+07 2093228 3.70 assi (resi 17 and name H3') (resi 17 and name H8) 3.70 0.74 0.74 !!1.35e+07 1558717 3.90 4.20 assi (resi 12 and name H3') (resi 12 and name H8) 4.32 0.86 0.86 !!-9.99e-09 910502 3.73 assi (resi 6 and name H3') (resi 6 and name H8) 4.08 0.82 0.82 !!-9.99e-09 1900671 3.80 assi (resi 5 and name H3') (resi 5 and name H8) 4.04 0.81 0.81 !!1.38e+07 872299 3.34 assi (resi 4 and name H3') (resi 4 and name H8) 5.50 1.10 1.10 !!4.41e+06 232206 4.04 5.10 assi (resi 11 and name H3') (resi 11 and name H8) 5.20 1.04 1.04 !!1.64e+06 300791 4.77 assi (resi 16 and name H3') (resi 16 and name H8) 5.08 1.02 1.02 !!1.12e+06 121199 assi (resi 10 and name H3') (resi 10 and name H8) 5.31 1.06 1.06 !!8.64e+05 128260 assi (resi 22 and name H3') (resi 22 and name H8) 5.76 1.15 1.15 !!5.28e+05 107894 assi (resi 24 and name H4') (resi 24 and name H8) 4.90 0.98 0.98 !!8.72e+06 507393211 assi (resi 23 and name H4') (resi 23 and name H8) 4.59 0.92 0.92 !!2.05e+09 35770888 assi (resi 17 and name H4') (resi 17 and name H8) 4.40 0.88 0.88 !!1.13e+11 10371706 assi (resi 12 and name H4') (resi 12 and name H8) 4.99 1.00 1.00 !!-8.80e+06 13793619 assi (resi 6 and name H4') (resi 6 and name H8) 4.78 0.96 0.96 !!1.62e+09 42355496 assi (resi 22 and name H4') (resi 22 and name H8) 5.52 1.10 1.10 !!6.77e+08 27605448 assi (resi 11 and name H4') (resi 11 and name H8) 5.40 1.08 1.08 !!7.76e+08 24863398 assi (resi 4 and name H4') (resi 4 and name H8) 5.53 1.11 1.11 !!6.73e+08 24068930 assi (resi 5 and name H4') (resi 5 and name H8) 4.80 0.96 0.96 !!1.23e+07 411916 0.00 3.41 4.80 5.00 assi (resi 10 and name H4') (resi 10 and name H8) 4.92 0.98 0.98 !!-9.99e-09 284325 0.00 4.52 4.62 assi (resi 16 and name H4') (resi 16 and name H8) 4.65 0.93 0.93 !!8.68e+06 253635 0.00 3.61 4.50 assi (resi 23 and name H5') (resi 23 and name H8) 4.60 0.92 0.92 !!2.96e+08 4083614 6.34 assi (resi 17 and name H5') (resi 17 and name H8) 4.50 0.90 0.90 !!3.08e+08 4450324 assi (resi 12 and name H5') (resi 12 and name H8) 4.99 1.00 1.00 !!-3.92e+09 4639895 assi (resi 5 and name H5') (resi 5 and name H8) 4.80 0.96 0.96 !!1.94e+08 4198876 assi (resi 22 and name H5') (resi 22 and name H8) 6.00 1.20 1.20 !!-2.26e+08 10952665 5.50 assi (resi 4 and name H5') (resi 4 and name H8) 6.04 1.21 1.21 !!3.97e+08 22894828 assi (resi 24 and name H5') (resi 24 and name H8) 4.00 0.80 0.80 !!-9.99e-09 2066143 0.00 3.25 assi (resi 23 and name H5'') (resi 23 and name H8) 4.60 0.92 0.92 !!2.75e+08 6377726 6.42 assi (resi 17 and name H5'') (resi 17 and name H8) 4.84 0.97 0.97 !!-5.12e+08 2477505 assi (resi 12 and name H5'') (resi 12 and name H8) 4.55 0.91 0.91 !!3.23e+10 21472998 3.30 assi (resi 5 and name H5'') (resi 5 and name H8) 5.00 1.00 1.00 !!2.35e+08 7976654 3.99 assi (resi 22 and name H5'') (resi 22 and name H8) 6.07 1.21 1.21 !!3.85e+08 18921606 assi (resi 11 and name H5'') (resi 11 and name H8) 6.32 1.26 1.26 !!3.02e+08 7575185 assi (resi 4 and name H5'') (resi 4 and name H8) 5.80 1.16 1.16 !!9.04e+08 24381962 5.26 assi (resi 18 and name H5'') (resi 18 and name H8) 3.00 1.00 1.00 !!-9.99e-09 955986 0.00 3.70 3.07 assi (resi 6 and name H5'*) (resi 6 and name H8) 3.80 0.76 0.76 !!1.35e+08 43633420 4.03 assi (resi 23 and name H1) (resi 23 and name H21) 2.30 0.46 0.46 !!-1.12e+09 -30223852 assi (resi 22 and name H1) (resi 22 and name H21) 2.30 0.46 0.46 !!-8.18e+08 -11690460 assi (resi 17 and name H1) (resi 17 and name H21) 2.30 0.46 0.46 !!-7.53e+08 -20732348 assi (resi 16 and name H1) (resi 16 and name H21) 2.30 0.46 0.46 !!-1.02e+09 -21270218 assi (resi 11 and name H1) (resi 11 and name H21) 2.30 0.46 0.46 !!-5.52e+08 -9081044 assi (resi 5 and name H1) (resi 5 and name H21) 2.30 0.46 0.46 !!-1.13e+09 -25419834 assi (resi 4 and name H22) (resi 4 and name H1) 3.58 0.71 0.71 !!1.29e+09 26646898 assi (resi 4 and name H1) (resi 4 and name H21) 2.30 0.46 0.46 !!-9.65e+08 -27921794 assi (resi 12 and name H2') (resi 12 and name H3') 2.60 0.52 0.52 !!3.79e+07 834657 0.00 2.83 assi (resi 16 and name H2') (resi 16 and name H3') 2.49 0.50 0.50 !!3.34e+07 1319423 0.00 assi (resi 24 and name H2') (resi 24 and name H3') 2.32 0.46 0.46 !!-9.99e-09 3935631 0.00 assi (resi 17 and name H2') (resi 17 and name H3') 2.52 0.50 0.50 !!-9.99e-09 3207884 0.00 assi (resi 6 and name H2') (resi 6 and name H3') 2.43 0.49 0.49 !!-9.99e-09 3151714 0.00 assi (resi 4 and name H2') (resi 4 and name H3') 2.39 0.48 0.48 !!2.20e+07 1184627 0.00 assi (resi 22 and name H2') (resi 22 and name H3') 2.50 0.50 0.50 !!1.24e+07 252711 0.00 3.40 assi (resi 10 and name H2') (resi 10 and name H3') 2.70 0.54 0.54 !!4.56e+06 54220 0.00 4.02 2.80 assi (resi 23 and name H2'') (resi 23 and name H3') 2.89 0.58 0.58 !!-9.99e-09 4198605 0.00 assi (resi 24 and name H2'') (resi 24 and name H3') 2.94 0.59 0.59 !!-9.99e-09 3803965 0.00 assi (resi 17 and name H2'') (resi 17 and name H3') 2.95 0.59 0.59 !!-9.99e-09 3699086 0.00 assi (resi 16 and name H2'') (resi 16 and name H3') 2.99 0.60 0.60 !!2.71e+07 1445532 0.00 assi (resi 12 and name H2'') (resi 12 and name H3') 2.60 0.52 0.52 !!-9.99e-09 3352571 0.00 assi (resi 6 and name H2'') (resi 6 and name H3') 3.04 0.61 0.61 !!-9.99e-09 3078596 0.00 assi (resi 4 and name H2'') (resi 4 and name H3') 3.08 0.62 0.62 !!2.24e+07 1102262 0.00 assi (resi 5 and name H2'') (resi 5 and name H3') 3.19 0.64 0.64 !!-9.99e-09 2296265 0.00 assi (resi 10 and name H2'') (resi 10 and name H3') 3.13 0.62 0.62 !!9.98e+06 -55681 0.00 assi (resi 22 and name H2'') (resi 22 and name H3') 2.90 0.58 0.58 !!1.55e+06 -6354 0.00 4.81 assi (resi 16 and name H3') (resi 16 and name H4') 2.87 0.49 0.57 !!8.45e+07 2682933 0.00 assi (resi 17 and name H3') (resi 17 and name H4') 2.53 0.51 0.51 !!-9.99e-09 9375035 0.00 assi (resi 5 and name H3') (resi 5 and name H4') 2.59 0.52 0.52 !!6.39e+07 2783794 0.00 assi (resi 6 and name H3') (resi 6 and name H4') 2.60 0.52 0.52 !!6.27e+07 3500600 0.00 assi (resi 12 and name H3') (resi 12 and name H4') 3.23 0.65 0.65 !!5.84e+07 2317062 0.00 2.63 assi (resi 4 and name H3') (resi 4 and name H4') 2.68 0.54 0.54 !!5.26e+07 2775294 0.00 assi (resi 11 and name H3') (resi 11 and name H4') 2.68 0.54 0.54 !!-9.99e-09 6613431 0.00 assi (resi 18 and name H3') (resi 18 and name H4') 2.80 0.56 0.56 !!-9.99e-09 5063306 0.00 assi (resi 24 and name H3') (resi 24 and name H4') 2.85 0.57 0.57 !!3.62e+07 3216273 0.00 assi (resi 23 and name H3') (resi 23 and name H4') 2.92 0.58 0.58 !!3.10e+07 3156804 0.00 assi (resi 4 and name H3') (resi 4 and name H5') 2.60 0.52 0.52 !!5.83e+07 2227970 0.00 2.63 2.83 assi (resi 24 and name H3') (resi 24 and name H5') 2.50 0.50 0.50 !!-9.99e-09 7211471 0.00 2.64 2.90 2.85 2.77 3.07 assi (resi 6 and name H3') (resi 6 and name H5'*) 2.65 0.53 0.53 !!-9.99e-09 7053272 0.00 assi (resi 12 and name H3') (resi 12 and name H5'*) 3.52 0.70 0.70 !!-9.99e-09 4809644 0.00 3.82 assi (resi 16 and name H3') (resi 16 and name H5'*) 2.58 0.52 0.52 !!3.36e+07 2446651 0.00 2.88 assi (resi 17 and name H3') (resi 17 and name H5'*) 2.90 0.58 0.58 !!-9.99e-09 3562648 0.00 2.97 assi (resi 18 and name H3') (resi 18 and name H5'') 2.78 0.55 0.55 !!-9.99e-09 3466460 0.00 assi (resi 10 and name H3') (resi 10 and name H5') 2.80 0.56 0.56 !!-9.99e-09 3316607 0.00 3.00 assi (resi 18 and name H3') (resi 18 and name H5') 2.53 0.51 0.51 !!2.05e+07 1818518 0.00 assi (resi 10 and name H3') (resi 10 and name H5'') 2.89 0.57 0.57 !!-9.99e-09 1924618 0.00 assi (resi 4 and name H3') (resi 4 and name H5'') 2.62 0.52 0.52 !!1.21e+07 3987560 0.00 assi (resi 22 and name H3') (resi 22 and name H5'') 3.00 0.60 0.60 !!-9.99e-09 1322467 0.00 assi (resi 5 and name H4') (resi 5 and name H5') 2.35 0.47 0.47 !!-9.99e-09 14304935 0.00 assi (resi 24 and name H4') (resi 24 and name H5') 2.35 0.47 0.47 !!-9.99e-09 14606853 0.00 assi (resi 22 and name H4') (resi 22 and name H5'') 2.83 0.57 0.57 !!-9.99e-09 11952627 0.00 assi (resi 24 and name H4') (resi 24 and name H5'') 2.69 0.53 0.53 !!-9.99e-09 10230775 0.00 assi (resi 5 and name H4') (resi 5 and name H5'') 2.62 0.52 0.52 !!-9.99e-09 7458031 0.00 assi (resi 16 and name H4') (resi 16 and name H5'*) 2.68 0.54 0.54 !!-9.99e-09 6542679 0.00 assi (resi 7 and name H1') (resi 7 and name H6) 4.30 0.86 0.86 !!3.04e+09 4812222 assi (resi 7 and name H1') (resi 7 and name H2') 2.87 0.57 0.75 !!-9.99e-09 -999 assi (resi 7 and name H1') (resi 7 and name H2'') 2.38 0.47 0.47 !!-9.99e-09 -999 assi (resi 7 and name H1') (resi 7 and name H4') 3.23 0.65 0.65 !!-9.99e-09 -999 assi (resi 7 and name H2') (resi 7 and name H6) 3.70 0.74 0.74 !!5.63e+08 7574368 2.40 assi (resi 7 and name H2'') (resi 7 and name H6) 3.95 0.79 0.79 !!6.84e+10 20827902 3.06 3.85 assi (resi 7 and name H6) (resi 7 and name H5#) 2.94 0.59 0.59 !!2.96e+10 36663828 assi (resi 7 and name H4') (resi 7 and name H5') 2.64 0.53 0.53 !!-9.99e-09 7162259 0.00 assi (resi 7 and name H3') (resi 7 and name H5') 2.90 0.58 0.58 !!-9.99e-09 2885675 0.00 3.07 assi (resi 7 and name H2'') (resi 7 and name H3') 3.11 0.62 0.62 !!-9.99e-09 2669786 0.00 assi (resi 7 and name H3') (resi 7 and name H4') 3.19 0.64 0.64 !!1.82e+07 2126740 0.00 assi (resi 7 and name H3') (resi 7 and name H5'') 2.50 0.50 0.50 !!-9.99e-09 1900558 0.00 3.30 assi (resi 7 and name H2') (resi 7 and name H3') 2.60 0.52 0.52 !!1.38e+07 1182643 0.00 3.34 assi (resi 7 and name H1') (resi 7 and name H3') 4.10 0.82 0.82 !!1.08e+07 392234 0.00 3.48 assi (resi 7 and name H5'') (resi 7 and name H6) 2.88 0.59 0.59 !!-9.99e-09 1016467 0.00 3.66 4.50 3.65 3.36 assi (resi 7 and name H3') (resi 7 and name H6) 3.48 0.69 0.69 !!5.57e+06 507501 0.00 3.28 assi (resi 7 and name H4') (resi 7 and name H6) 4.94 0.99 0.99 !!-9.99e-09 688676 0.00 3.90 assi (resi 7 and name H5') (resi 7 and name H6) 3.74 0.75 0.75 !!-9.99e-09 382249 0.00 4.30 5.00 3.44 assi (resi 8 and name H1') (resi 8 and name H2') 2.98 0.60 0.60 !!2.37e+09 27596082 assi (resi 8 and name H1') (resi 8 and name H2'') 2.48 0.50 0.50 !!2.37e+09 27596082 assi (resi 8 and name H1') (resi 8 and name H6) 4.20 0.84 0.84 !!2.12e+08 33243018 assi (resi 8 and name H2') (resi 8 and name H6) 2.92 0.58 0.58 !!7.85e+08 40490032 assi (resi 8 and name H2'') (resi 8 and name H6) 3.77 0.74 0.74 !!6.18e+09 48240312 3.72 assi (resi 8 and name H4') (resi 8 and name H1') 3.05 0.61 0.61 !!4.32e+08 -2615350 assi (resi 8 and name H5') (resi 8 and name H6) 3.43 0.69 0.69 !!2.27e+10 13192822 4.08 assi (resi 8 and name H5'') (resi 8 and name H6) 4.35 0.87 0.87 !!8.25e+08 13546641 assi (resi 8 and name H6) (resi 8 and name H5#) 3.00 0.60 0.60 !!2.64e+10 100106112 assi (resi 8 and name H2'') (resi 8 and name H3') 2.81 0.56 0.56 !!3.94e+07 1135417 0.00 assi (resi 8 and name H3') (resi 8 and name H5'') 2.92 0.58 0.58 !!3.08e+07 1061452 0.00 assi (resi 8 and name H3') (resi 8 and name H4') 3.01 0.60 0.60 !!2.58e+07 2040606 0.00 assi (resi 8 and name H3') (resi 8 and name H5') 3.18 0.64 0.64 !!1.86e+07 1136395 0.00 assi (resi 8 and name H1') (resi 8 and name H3') 3.60 0.72 0.72 !!1.84e+07 502586 0.00 3.19 assi (resi 8 and name H2') (resi 8 and name H3') 2.70 0.54 0.54 !!1.54e+07 1096347 0.00 3.28 assi (resi 8 and name H3') (resi 8 and name H6) 3.57 0.71 0.71 !!9.35e+06 1142670 0.00 assi (resi 8 and name H4') (resi 8 and name H6) 4.40 0.88 0.88 !!2.64e+06 427328 0.00 assi (resi 9 and name H1') (resi 9 and name H2) 5.45 1.09 1.09 !!4.33e+08 10487526 5.95 assi (resi 9 and name H1') (resi 9 and name H8) 3.36 0.67 0.67 !!8.14e+08 22873710 assi (resi 9 and name H2') (resi 9 and name H1') 3.52 0.72 0.72 !!2.09e+10 28495722 assi (resi 9 and name H2') (resi 9 and name H8) 3.75 0.75 0.75 !!7.01e+10 105832664 assi (resi 9 and name H2'') (resi 9 and name H1') 2.38 0.56 0.56 !!2.83e+07 27876774 assi (resi 9 and name H2'') (resi 9 and name H8) 4.29 0.86 0.86 !!-3.64e+06 86667376 assi (resi 9 and name H4') (resi 9 and name H8) 4.49 0.90 0.90 !!3.19e+07 7504012 assi (resi 9 and name H5') (resi 9 and name H8) 4.29 0.85 0.85 !!3.28e+10 12730213 assi (resi 9 and name H3') (resi 9 and name H4') 2.57 0.51 0.51 !!6.62e+07 1760205 0.00 assi (resi 9 and name H2'') (resi 9 and name H3') 2.72 0.54 0.54 !!4.80e+07 1314777 0.00 assi (resi 9 and name H3') (resi 9 and name H5'') 2.88 0.58 0.58 !!3.37e+07 816562 0.00 assi (resi 9 and name H2') (resi 9 and name H3') 2.67 0.53 0.53 !!2.32e+07 1295601 0.00 assi (resi 9 and name H4') (resi 9 and name H5'') 2.47 0.49 0.49 !!1.90e+07 1353936 0.00 assi (resi 9 and name H4') (resi 9 and name H5') 2.80 0.56 0.56 !!1.22e+07 1921093 0.00 3.41 assi (resi 9 and name H1') (resi 9 and name H3') 3.90 0.78 0.78 !!1.00e+07 487194 0.00 3.53 assi (resi 9 and name H1') (resi 9 and name H4') 3.68 0.74 0.74 !!-9.99e-09 974672 0.00 assi (resi 9 and name H3') (resi 9 and name H8) 4.70 0.94 0.94 !!4.36e+06 511918 0.00 4.05 4.80 assi (resi 9 and name H1') (resi 9 and name H5'') 5.04 1.01 1.01 !!4.85e+05 398440 0.00 assi (resi 9 and name H8) (resi 9 and name H5'') 4.00 0.80 0.80 !!-9.99e-09 56444 0.00 5.92 assi (resi 25 and name H1') (resi 25 and name H6) 3.50 0.70 0.70 !!-3.30e+08 17360796 assi (resi 25 and name H2') (resi 25 and name H1') 3.21 0.64 0.64 !!1.62e+08 19471218 assi (resi 25 and name H2') (resi 25 and name H6) 3.47 0.69 0.69 !!1.68e+09 36202220 3.75 assi (resi 25 and name H2'') (resi 25 and name H1') 2.77 0.55 0.55 !!1.64e+09 7753212 assi (resi 25 and name H4') (resi 25 and name H1') 3.65 0.73 0.73 !!5.89e+08 22494026 assi (resi 25 and name H5') (resi 25 and name H6) 3.99 0.80 0.80 !!-1.38e+08 9439599 assi (resi 25 and name H5'') (resi 25 and name H6) 2.83 0.57 0.57 !!3.81e+09 14307460 3.54 3.00 assi (resi 25 and name H6) (resi 25 and name H5#) 3.06 0.61 0.61 !!1.02e+09 32005772 assi (resi 25 and name H2') (resi 25 and name H3') 2.40 0.48 0.48 !!3.28e+02 4017722 2.81 assi (resi 25 and name H2'') (resi 25 and name H3') 2.93 0.59 0.59 !!-9.99e-09 3873967 0.00 assi (resi 25 and name H3') (resi 25 and name H4') 2.99 0.60 0.60 !!-9.99e-09 3408272 0.00 assi (resi 25 and name H3') (resi 25 and name H5'') 2.80 0.56 0.56 !!-9.99e-09 2434571 0.00 3.16 assi (resi 25 and name H3') (resi 25 and name H5') 3.01 0.60 0.60 !!-9.99e-09 2258601 0.00 3.20 2.80 assi (resi 25 and name H3') (resi 25 and name H6) 3.29 0.66 0.66 !!1.52e+07 1758387 0.00 assi (resi 25 and name H1') (resi 25 and name H5') 5.00 1.00 1.00 !!-9.99e-09 1134786 0.00 3.59 assi (resi 25 and name H1') (resi 25 and name H3') 3.67 0.73 0.73 !!7.95e+06 868130 0.00 assi (resi 25 and name H3') (resi 25 and name H5#) 5.48 1.10 1.10 !!1.06e+06 76214 0.00 assi (resi 25 and name H2') (resi 25 and name H5#) 5.49 1.09 1.09 !!-3.33e-09 114299 0.00 4.99 4.80 assi (resi 26 and name H1') (resi 26 and name H2'*) 2.56 0.51 0.51 !!2.80e+09 61324436 assi (resi 26 and name H1') (resi 26 and name H6) 3.52 0.70 0.70 !!6.84e+08 36625520 assi (resi 26 and name H2'*) (resi 26 and name H6) 3.60 0.72 0.72 !!2.91e+09 141753648 3.03 assi (resi 26 and name H2'*) (resi 26 and name H5#) 5.27 1.05 1.05 !!9.00e+08 27186718 assi (resi 26 and name H3') (resi 26 and name H6) 3.57 0.71 0.71 !!2.93e+10 35131380 2.25 3.70 assi (resi 26 and name H6) (resi 26 and name H5#) 3.00 0.60 0.60 !!3.44e+09 239231072 4.21 assi (resi 26 and name H4') (resi 26 and name H5') 2.63 0.53 0.53 !!-9.99e-09 7338386 0.00 assi (resi 26 and name H2'*) (resi 26 and name H3') 2.75 0.55 0.55 !!4.48e+07 3401807 0.00 assi (resi 26 and name H4') (resi 26 and name H5'') 2.77 0.55 0.55 !!-9.99e-09 5406703 0.00 assi (resi 26 and name H3') (resi 26 and name H5') 2.92 0.59 0.59 !!3.86e+07 3153708 0.00 assi (resi 26 and name H3') (resi 26 and name H5'') 2.50 0.50 0.50 !!-9.99e-09 4735392 0.00 2.93 assi (resi 26 and name H1') (resi 26 and name H3') 4.00 0.80 0.80 !!3.24e+07 479480 0.00 2.90 assi (resi 26 and name H3') (resi 26 and name H4') 2.94 0.59 0.59 !!-9.99e-09 3801878 0.00 assi (resi 26 and name H1') (resi 26 and name H4') 3.05 0.61 0.61 !!2.42e+07 1364484 0.00 assi (resi 26 and name H5') (resi 26 and name H6) 3.98 0.80 0.80 !!7.82e+06 484966 0.00 assi (resi 26 and name H5'') (resi 26 and name H6) 2.81 0.56 0.56 !!3.47e+06 422842 0.00 4.21 assi (resi 26 and name H4') (resi 26 and name H6) 4.55 0.91 0.91 !!2.16e+06 472005 0.00 assi (resi 23 and name H1) (resi 24 and name H1) 3.60 0.70 0.70 !!-5.93e+08 -21217932 assi (resi 17 and name H1) (resi 22 and name H1) 3.63 0.73 0.73 !!-6.18e+08 -15109669 4.50 4.60 assi (resi 23 and name H1) (resi 4 and name H1) 3.60 0.72 0.74 !!-6.18e+08 -15109669 4.50 4.60 assi (resi 16 and name H1) (resi 11 and name H1) 3.60 0.70 0.70 !!-6.18e+08 -15109669 4.50 4.60 3.50 assi (resi 17 and name H1) (resi 18 and name H1) 4.00 0.80 0.80 !!-2.46e+08 -9919355 4.40 4.70 3.55 assi (resi 5 and name H1) (resi 12 and name H1) 3.62 0.72 0.72 !!-6.18e+08 -15109669 4.50 4.60 3.57 assi (resi 5 and name H1) (resi 6 and name H1) 3.60 0.66 0.66 !!-2.44e+08 -8877311 4.50 assi (resi 16 and name H1) (resi 17 and name H1) 5.00 1.20 1.20 !!-3.20e+08 -11352299 4.90 assi (resi 12 and name H1) (resi 16 and name H1) 4.42 0.88 0.88 !!-6.13e+07 -3453226 assi (resi 10 and name H1) (resi 11 and name H1) 3.61 0.68 0.68 !!-6.18e+08 -15109669 4.50 4.60 assi (resi 11 and name H8) (resi 6 and name H1) 5.35 1.07 1.07 !!1.13e+08 3424076 7.45 5.45 assi (resi 17 and name H8) (resi 10 and name H1) 5.37 1.07 1.07 !!1.42e+08 1482353 7.17 5.37 assi (resi 5 and name H8) (resi 24 and name H1) 5.39 1.08 1.08 !!1.42e+08 1482353 7.17 5.37 assi (resi 16 and name H1) (resi 22 and name H1) 4.30 0.86 0.86 !!-1.76e+08 -6512719 assi (resi 4 and name H8) (resi 12 and name H1) 5.34 1.07 1.07 !!7.14e+07 8101650 8.04 assi (resi 5 and name H8) (resi 23 and name H1) 5.43 1.09 1.09 !!2.26e+08 10425914 6.63 assi (resi 6 and name H8) (resi 24 and name H1) 5.44 1.09 1.09 !!3.59e+08 11801120 6.14 assi (resi 10 and name H8) (resi 6 and name H1) 5.42 1.08 1.08 !!1.06e+08 3004230 7.52 assi (resi 11 and name H8) (resi 5 and name H1) 5.37 1.07 1.07 !!2.18e+08 8155095 6.67 assi (resi 12 and name H8) (resi 16 and name H1) 5.37 1.08 1.08 !!2.19e+08 10606344 6.67 assi (resi 16 and name H8) (resi 22 and name H1) 5.34 1.07 1.07 !!8.98e+07 5811946 7.74 assi (resi 17 and name H8) (resi 11 and name H1) 5.43 1.09 1.09 !!2.72e+08 7959491 6.43 assi (resi 18 and name H8) (resi 10 and name H1) 5.44 1.09 1.09 !!1.72e+08 3719556 6.94 assi (resi 22 and name H8) (resi 4 and name H1) 5.36 1.07 1.07 !!1.55e+08 11510522 7.06 assi (resi 23 and name H8) (resi 17 and name H1) 5.48 1.10 1.10 !!7.14e+08 11985857 assi (resi 24 and name H8) (resi 18 and name H1) 5.44 1.09 1.09 !!4.40e+08 6689570 5.94 assi (resi 5 and name H8) (resi 23 and name H21) 3.03 0.61 0.61 !!3.28e+08 8234720 2.63 assi (resi 11 and name H8) (resi 5 and name H21) 3.19 0.62 0.62 !!9.90e+08 10914757 assi (resi 22 and name H8) (resi 4 and name H21) 3.18 0.64 0.64 !!3.44e+08 9349016 assi (resi 23 and name H8) (resi 17 and name H21) 3.02 0.60 0.60 !!5.48e+08 6785340 assi (resi 5 and name H1') (resi 4 and name H8) 4.02 0.80 0.80 !!3.92e+09 18939226 3.52 assi (resi 11 and name H8) (resi 12 and name H1') 4.50 0.90 0.90 !!1.20e+08 4126976 7.37 3.50 3.95 assi (resi 11 and name H1') (resi 10 and name H8) 4.60 0.92 0.92 !!3.92e+09 18939226 4.40 4.48 4.03 assi (resi 17 and name H1') (resi 16 and name H8) 3.83 0.77 0.77 !!-2.58e+08 4703122 4.99 3.30 3.83 assi (resi 22 and name H8) (resi 23 and name H1') 4.00 0.80 0.80 !!2.24e+08 3516756 6.64 3.80 assi (resi 4 and name H1') (resi 5 and name H8) 4.17 0.83 0.83 !!4.72e+08 18650112 5.87 4.20 3.72 assi (resi 16 and name H1') (resi 17 and name H8) 3.89 0.80 0.80 !!2.11e+08 7854666 6.71 3.40 3.90 3.69 assi (resi 22 and name H1') (resi 23 and name H8) 4.17 0.83 0.83 !!4.18e+08 16102239 5.99 3.70 assi (resi 5 and name H1') (resi 6 and name H8) 4.15 0.83 0.83 !!3.18e+08 51103840 6.26 2.80 3.84 4.24 assi (resi 11 and name H1') (resi 12 and name H8) 4.50 0.90 0.90 !!3.92e+09 18939226 4.12 4.40 3.90 3.69 4.05 assi (resi 17 and name H1') (resi 18 and name H8) 3.04 0.61 0.61 !!1.34e+09 2703419 3.80 3.60 3.90 assi (resi 23 and name H1') (resi 24 and name H8) 4.14 0.84 0.84 !!6.14e+08 58619692 5.62 3.82 assi (resi 4 and name H2') (resi 5 and name H8) 2.75 0.55 0.55 !!2.64e+09 63679628 assi (resi 5 and name H2') (resi 6 and name H8) 2.98 0.60 0.60 !!2.64e+09 63679628 assi (resi 11 and name H2') (resi 12 and name H8) 2.88 0.80 0.80 !!2.95e+10 111824104 2.68 2.88 assi (resi 16 and name H2') (resi 17 and name H8) 3.25 0.63 0.63 !!1.44e+08 12054099 7.15 4.30 3.50 4.20 assi (resi 17 and name H2') (resi 18 and name H8) 2.88 0.57 0.57 !!1.44e+08 12054099 assi (resi 22 and name H2') (resi 23 and name H8) 2.90 0.58 0.58 !!6.77e+08 35505160 5.52 3.77 assi (resi 23 and name H2') (resi 24 and name H8) 2.80 0.56 0.56 !!8.91e+10 50621120 2.45 3.70 assi (resi 4 and name H2'') (resi 5 and name H8) 2.34 0.47 0.47 !!2.70e+01 32610678 5.22 3.80 3.00 assi (resi 5 and name H2'') (resi 6 and name H8) 2.32 0.46 0.46 !!2.05e+09 79126856 4.59 assi (resi 11 and name H2'') (resi 12 and name H8) 3.00 0.80 0.80 !!2.95e+10 111824104 2.21 3.00 3.00 assi (resi 16 and name H2'') (resi 17 and name H8) 2.38 0.47 0.47 !!-2.95e+08 8279974 4.99 2.80 assi (resi 17 and name H2'') (resi 18 and name H8) 2.40 0.48 0.48 !!-2.95e+08 8279974 2.30 2.18 assi (resi 22 and name H2'') (resi 23 and name H8) 2.45 0.49 0.49 !!8.16e+08 26420776 5.36 2.80 3.00 assi (resi 23 and name H2'') (resi 24 and name H8) 2.34 0.47 0.47 !!5.63e+09 178293888 3.88 2.40 assi (resi 5 and name H3') (resi 4 and name H8) 5.11 1.02 1.02 !!2.87e+05 95451 assi (resi 23 and name H3') (resi 22 and name H8) 5.48 1.10 1.10 !!2.87e+05 95451 assi (resi 4 and name H3') (resi 5 and name H8) 4.50 0.90 0.90 !!8.92e+06 740384 assi (resi 5 and name H3') (resi 6 and name H8) 4.58 0.92 0.92 !!-9.99e-09 1172724 assi (resi 11 and name H3') (resi 12 and name H8) 4.45 0.89 0.89 !!-9.99e-09 715655 assi (resi 16 and name H3') (resi 17 and name H8) 4.70 0.94 0.94 !!-9.99e-09 715655 4.54 assi (resi 17 and name H3') (resi 18 and name H8) 4.40 0.89 0.88 !!-9.99e-09 715655 assi (resi 22 and name H3') (resi 23 and name H8) 4.50 0.90 0.90 !!3.57e+06 481071 assi (resi 23 and name H3') (resi 24 and name H8) 4.48 0.89 0.89 !!-9.99e-09 1246626 assi (resi 4 and name H8) (resi 5 and name H8) 4.30 0.86 0.86 !!3.26e+08 6742808 6.24 4.70 assi (resi 11 and name H8) (resi 12 and name H8) 4.50 0.90 0.90 !!1.20e+08 4126976 7.37 4.00 4.20 3.62 assi (resi 17 and name H8) (resi 16 and name H8) 4.33 0.87 0.87 !!1.78e+07 170222610 4.30 assi (resi 22 and name H8) (resi 23 and name H8) 4.49 0.89 0.89 !!1.41e+08 7646512 7.18 3.90 4.19 4.29 assi (resi 11 and name H8) (resi 10 and name H8) 4.50 0.90 0.90 !!3.92e+09 18939226 4.40 4.08 4.48 5.00 assi (resi 5 and name H8) (resi 6 and name H8) 4.54 0.91 0.91 !!9.93e+08 14174460 5.18 4.28 4.58 4.88 4.44 assi (resi 17 and name H8) (resi 18 and name H8) 4.42 0.92 0.92 !!1.22e+09 14670153 assi (resi 23 and name H8) (resi 24 and name H8) 4.40 0.88 0.88 !!1.22e+09 14670153 4.41 4.91 4.46 assi (resi 23 and name H1) (resi 5 and name H1) 3.98 0.99 0.99 !!1.24e+06 78818 0.00 assi (resi 6 and name H1) (resi 24 and name H1) 4.68 1.17 1.17 !!4.68e+05 108055 0.00 assi (resi 10 and name H1) (resi 18 and name H1) 4.94 1.24 1.24 !!3.42e+05 43624 0.00 assi (resi 5 and name H8) (resi 24 and name H1) 5.08 1.27 1.27 !!9.67e+05 115521 0.00 4.50 assi (resi 11 and name H8) (resi 6 and name H1) 5.04 1.26 1.26 !!4.89e+05 95252 0.00 assi (resi 5 and name H8) (resi 4 and name H1) 5.50 1.38 1.38 !!-9.99e-09 31716 0.00 4.36 4.90 5.50 assi (resi 22 and name H1) (resi 23 and name H8) 5.50 1.38 1.38 !!-9.99e-09 27326 0.00 4.47 assi (resi 18 and name H1) (resi 23 and name H8) 4.52 1.13 1.13 !!5.83e+05 50211 0.00 assi (resi 11 and name H3') (resi 10 and name H8) 6.50 1.30 1.30 !!-9.99e-09 99227 0.00 5.39 assi (resi 17 and name H4') (resi 18 and name H8) 5.00 1.50 1.50 !!-9.99e-09 1074145 0.00 3.62 4.80 assi (resi 5 and name H4') (resi 6 and name H8) 4.90 0.98 0.98 !!6.97e+06 365291 0.00 3.75 assi (resi 17 and name H4') (resi 16 and name H8) 4.70 0.94 0.94 !!-9.99e-09 660414 0.00 3.93 assi (resi 5 and name H4') (resi 4 and name H8) 4.10 0.82 0.82 !!4.87e+06 603100 0.00 3.98 assi (resi 11 and name H4') (resi 10 and name H8) 4.72 0.94 0.94 !!4.80e+06 657728 0.00 3.99 4.20 4.60 4.40 assi (resi 23 and name H4') (resi 24 and name H8) 5.00 1.00 1.00 !!-9.99e-09 587626 0.00 4.01 assi (resi 12 and name H4') (resi 11 and name H8) 4.60 1.00 1.00 !!-9.99e-09 510381 0.00 4.20 4.60 assi (resi 16 and name H4') (resi 17 and name H8) 5.80 1.16 1.16 !!-9.99e-09 453659 0.00 5.00 5.50 assi (resi 23 and name H4') (resi 22 and name H8) 4.70 0.94 0.94 !!2.81e+06 433079 0.00 4.36 assi (resi 22 and name H1') (resi 23 and name H4') 4.30 0.86 0.86 !!1.14e+07 735939 0.00 3.45 4.00 assi (resi 17 and name H1') (resi 18 and name H4') 5.30 1.06 1.06 !!-9.99e-09 856488 0.00 3.76 assi (resi 23 and name H1') (resi 24 and name H4') 4.93 0.98 0.98 !!2.24e+06 536485 0.00 assi (resi 4 and name H1') (resi 5 and name H5') 2.70 0.60 0.60 !!-9.99e-09 3259322 0.00 3.01 2.80 assi (resi 4 and name H1') (resi 5 and name H5'') 3.30 0.66 0.66 !!-9.99e-09 3067628 0.00 3.04 assi (resi 10 and name H1') (resi 11 and name H5'') 3.50 0.70 0.70 !!-9.99e-09 2953691 0.00 3.06 4.00 3.30 assi (resi 10 and name H1') (resi 11 and name H5') 4.80 0.96 0.96 !!-9.99e-09 2644265 0.00 3.12 3.80 3.30 assi (resi 16 and name H1') (resi 17 and name H5'*) 3.50 0.70 0.70 !!-9.99e-09 2471658 0.00 3.15 assi (resi 22 and name H1') (resi 23 and name H5'') 3.75 0.75 0.75 !!-9.99e-09 1952804 0.00 3.28 assi (resi 4 and name H1') (resi 5 and name H3') 4.90 0.98 0.98 !!1.53e+07 333035 0.00 3.29 3.84 assi (resi 22 and name H1') (resi 23 and name H5') 2.54 0.51 0.51 !!-9.99e-09 1784873 0.00 3.03 assi (resi 17 and name H1') (resi 18 and name H5') 4.50 1.20 1.20 !!-9.99e-09 1020196 0.00 3.66 3.68 4.00 assi (resi 17 and name H1') (resi 18 and name H5'') 4.30 1.26 1.26 !!-9.99e-09 681228 0.00 3.91 4.30 assi (resi 10 and name H2'') (resi 11 and name H1) 5.32 1.06 1.06 !!2.00e+06 104925 0.00 3.99 assi (resi 10 and name H2') (resi 11 and name H1) 4.90 1.23 1.23 !!1.14e+06 105687 0.00 4.38 assi (resi 5 and name H2'') (resi 24 and name H1) 5.68 1.37 1.37 !!1.83e+05 33930 0.00 assi (resi 11 and name H5'') (resi 10 and name H8) 5.00 0.88 0.88 !!-9.99e-09 1409626 0.00 3.46 4.40 assi (resi 5 and name H5'') (resi 4 and name H8) 4.80 1.00 1.00 !!8.14e+06 631923 0.00 3.65 4.20 assi (resi 5 and name H5') (resi 4 and name H8) 3.73 0.75 0.75 !!7.21e+06 479597 0.00 assi (resi 17 and name H5'*) (resi 16 and name H8) 5.07 1.01 1.01 !!6.67e+06 349989 0.00 4.70 assi (resi 23 and name H5'') (resi 22 and name H8) 4.94 0.99 0.99 !!6.10e+06 501272 0.00 3.83 4.50 4.84 assi (resi 23 and name H5') (resi 22 and name H8) 4.50 0.90 0.90 !!3.76e+06 392487 0.00 4.15 4.90 4.80 assi (resi 8 and name H1') (resi 6 and name H1) 4.50 1.35 1.35 !!5.00e+09 -999 4.58 4.50 5.50 5.50 4.50 assi (resi 8 and name H5#) (resi 6 and name H1') 5.70 1.00 1.00 !!3.42e+08 6861619 4.90 5.15 5.50 assi (resi 8 and name H5#) (resi 6 and name H2'') 3.80 1.14 1.14 !!3.42e+08 6861619 3.90 3.20 3.00 4.50 4.30 assi (resi 8 and name H5#) (resi 6 and name H2') 4.30 1.32 1.32 !!2.09e+08 6287018 3.50 3.20 4.00 3.60 3.80 assi (resi 8 and name H5#) (resi 6 and name H3') 4.00 1.20 1.20 !!2.09e+08 6287018 3.60 5.00 4.00 3.50 assi (resi 8 and name H5#) (resi 6 and name H8) 6.00 1.50 1.50 !!2.09e+08 6287018 5.50 5.50 assi (resi 8 and name H6) (resi 6 and name H1') 5.00 1.50 1.50 !!-1.00e+09 -999 5.30 5.00 5.50 assi (resi 6 and name H3') (resi 8 and name H6) 5.30 1.00 1.00 !!-9.99e-09 109001 5.31 5.80 5.70 5.00 4.50 assi (resi 7 and name H1') (resi 8 and name H6) 5.50 1.65 1.65 !!-1.00e+09 -999 5.00 5.50 assi (resi 7 and name H3') (resi 8 and name H6) 5.00 1.50 1.50 !!-1.00e+09 -999 3.50 4.50 4.50 assi (resi 7 and name H1') (resi 8 and name H5#) 5.50 1.65 1.65 !!-1.00e+09 -999 5.30 5.50 assi (resi 7 and name H3') (resi 8 and name H5#) 4.80 1.44 1.44 !!-1.00e+09 -999 3.90 assi (resi 7 and name H4') (resi 8 and name H5#) 4.00 1.20 1.20 !!-1.00e+09 -999 4.30 assi (resi 7 and name H5') (resi 8 and name H5#) 4.00 1.20 1.20 !!-1.00e+09 -999 5.12 4.00 3.80 assi (resi 7 and name H5'') (resi 8 and name H5#) 4.30 1.29 1.29 !!-1.00e+09 -999 4.30 4.50 4.80 assi (resi 7 and name H6) (resi 8 and name H5#) 6.00 2.00 2.00 !!-1.00e+09 -999 5.45 6.00 assi (resi 9 and name H2) (resi 10 and name H1) 5.00 1.50 1.50 !!9.90e+09 999 5.50 assi (resi 9 and name H8) (resi 10 and name H1) 5.60 1.50 1.50 !!1.36e+08 3748838 5.00 assi (resi 9 and name H4') (resi 10 and name H8) 4.30 1.29 1.29 !!-9.99e-09 474976 4.15 4.60 assi (resi 9 and name H2) (resi 18 and name H1) 5.35 1.07 1.07 !!3.93e+09 12009923 4.40 assi (resi 9 and name H2) (resi 18 and name H1') 5.20 1.56 1.56 !!1.28e+07 503926 5.00 5.30 assi (resi 9 and name H2) (resi 18 and name H2') 4.00 1.20 1.20 !!3.90e+07 676749 assi (resi 9 and name H2) (resi 18 and name H2'') 4.50 1.20 1.20 !!4.03e+07 887485 4.00 assi (resi 9 and name H2) (resi 18 and name H3') 5.50 1.65 1.65 !!9.78e+06 639168 assi (resi 9 and name H2) (resi 18 and name H8) 5.00 1.10 1.10 !!3.93e+09 12009923 5.50 assi (resi 9 and name H8) (resi 6 and name H1) 5.50 1.25 1.25 !!1.30e+06 138372 0.00 4.28 4.40 5.00 assi (resi 8 and name H1') (resi 9 and name H8) 4.10 1.20 1.20 !!-9.99e-09 1582960 5.00 4.50 assi (resi 25 and name H5#) (resi 24 and name H8) 4.50 1.35 1.35 !!2.24e+08 2530070 5.04 4.60 2.55 2.70 4.50 assi (resi 25 and name H5#) (resi 24 and name H2'') 4.20 1.00 1.00 !!2.24e+08 2530070 5.04 3.70 assi (resi 25 and name H5#) (resi 24 and name H2') 3.80 1.00 1.00 !!9.79e+08 4262330 4.20 3.50 4.00 assi (resi 25 and name H5#) (resi 24 and name H1') 5.00 1.00 1.00 !!4.20e+08 13246653 4.78 4.10 4.80 assi (resi 25 and name H5#) (resi 18 and name H1) 5.30 1.06 1.06 !!2.42e+08 3463750 assi (resi 25 and name H6) (resi 24 and name H1') 4.21 0.84 0.84 !!4.20e+08 13246653 4.78 4.10 4.10 assi (resi 25 and name H6) (resi 24 and name H2') 3.30 1.00 1.00 !!5.23e+08 26524736 2.77 3.30 assi (resi 25 and name H6) (resi 24 and name H2'') 2.70 1.00 1.00 !!6.58e+08 27860108 2.95 3.00 2.70 assi (resi 25 and name H6) (resi 24 and name H8) 5.50 1.20 1.20 !!2.36e+08 4764386 5.39 5.01 assi (resi 25 and name H1') (resi 26 and name H5#) 4.90 0.98 0.98 !!5.23e+05 53146 assi (resi 25 and name H2') (resi 26 and name H5#) 3.80 1.00 1.00 !!1.66e+06 297946 3.80 3.80 assi (resi 25 and name H2'') (resi 26 and name H5#) 4.30 1.20 1.20 !!1.93e+06 272587 4.10 4.00 assi (resi 25 and name H3') (resi 26 and name H5#) 4.50 0.90 0.90 !!4.25e+06 52196 assi (resi 25 and name H6) (resi 26 and name H5#) 4.00 1.00 1.00 !!3.68e+06 564210 3.95 4.50 assi (resi 25 and name H1') (resi 26 and name H6) 4.18 0.84 0.84 !!4.64e+06 692435 3.80 assi (resi 25 and name H2') (resi 26 and name H6) 3.00 1.00 1.00 !!1.82e+07 543433 3.20 2.92 assi (resi 25 and name H2'') (resi 26 and name H6) 3.00 1.00 1.00 !!2.72e+07 1429013 2.80 2.48 assi (resi 25 and name H3') (resi 26 and name H6) 4.70 0.94 0.94 !!6.79e+06 466448 4.10 assi (resi 26 and name H6) (resi 25 and name H6) 5.10 1.02 1.02 !!-9.99e-09 1074160 assi (resi 26 and name H6) (resi 25 and name H5#) 6.50 1.50 1.50 !!-9.99e-09 1074160 5.40 6.00 assi (resi 3 and name H2) (resi 12 and name H1) 4.80 1.00 1.00 !!1.11e+08 3288338 5.07 5.10 5.10 5.20 5.20 assi (resi 3 and name H2) (resi 4 and name H1) 3.90 0.60 0.60 !!2.58e+08 4142422 6.49 3.80 4.00 4.10 assi (resi 3 and name H1') (resi 4 and name H1) 5.20 1.50 1.50 !!2.58e+08 4142422 6.49 2.70 4.00 5.00 assi (resi 3 and name H1') (resi 4 and name H22) 4.30 1.20 1.20 !!2.58e+08 4142422 6.49 2.70 3.71 4.30 assi (resi 3 and name H2'') (resi 4 and name H1) 5.50 1.50 1.50 !!2.58e+08 4142422 6.49 2.70 5.80 5.50 assi (resi 3 and name H2'') (resi 4 and name H22) 4.00 1.20 1.20 !!2.58e+08 4142422 5.00 4.80 4.00 3.80 assi (resi 3 and name H2) (resi 13 and name H5#) 6.00 2.00 2.00 !!1.22e+09 40182284 3.01 4.50 5.00 5.70 5.80 assi (resi 3 and name H2) (resi 2 and name H1') 5.80 2.00 2.00 !!3.08e+08 15223617 4.30 5.50 5.80 assi (resi 3 and name H8) (resi 2 and name H6) 4.10 1.00 1.00 !!3.72e+08 17753454 5.10 5.00 4.80 4.55 4.30 assi (resi 3 and name H8) (resi 2 and name H2'') 4.00 1.20 1.20 !!8.17e+08 32008430 3.85 4.00 3.70 3.80 assi (resi 3 and name H8) (resi 2 and name H2') 3.10 1.00 1.00 !!6.16e+08 49371616 3.61 4.00 4.00 2.97 assi (resi 3 and name H8) (resi 2 and name H1') 5.71 1.50 1.50 !!3.08e+08 15223617 4.30 5.00 5.50 5.00 5.71 assi (resi 3 and name H62) (resi 2 and name H5#) 4.12 1.00 1.00 !!8.17e+08 32008430 3.85 4.80 5.00 assi (resi 3 and name H61) (resi 2 and name H6) 4.50 1.00 1.00 !!3.72e+08 17753454 5.10 3.86 4.00 4.20 assi (resi 3 and name H61) (resi 2 and name H5#) 4.20 1.00 1.00 !!8.17e+08 32008430 3.85 5.00 4.80 4.30 assi (resi 13 and name H3) (resi 15 and name H2) 2.80 0.50 0.50 !!1.52e+08 5450718 2.28 3.00 2.50 2.70 assi (resi 27 and name H4) (resi 3 and name H2) 4.80 1.00 1.00 !!4.03e+08 16401635 5.52 5.00 assi (resi 27 and name H8) (resi 3 and name H62) 3.10 1.00 1.00 !!3.88e+08 16401635 2.52 4.00 3.50 3.30 3.20 assi (resi 27 and name HC1) (resi 3 and name H62) 3.60 1.20 1.20 !!3.88e+08 16401635 2.52 4.00 3.80 3.90 3.70 assi (resi 27 and name HC2) (resi 3 and name H62) 3.70 1.20 1.20 !!3.88e+08 16401635 2.52 4.00 3.90 3.80 assi (resi 27 and name H1) (resi 12 and name H8) 5.00 1.50 1.50 !!1.46e+08 5207048 7.13 4.40 5.00 4.00 4.50 assi (resi 27 and name H4) (resi 12 and name H1) 4.00 1.00 1.00 !!2.76e+08 19068608 4.02 4.00 assi (resi 27 and name H62) (resi 12 and name H1) 3.50 1.00 1.00 !!4.06e+08 9595061 6.02 3.00 4.60 4.20 4.00 assi (resi 27 and name H61) (resi 12 and name H1) 4.90 1.04 1.04 !!4.06e+08 9595061 6.02 3.84 assi (resi 27 and name H8) (resi 12 and name H1) 5.00 1.50 1.50 !!2.93e+09 4894356 4.33 5.30 5.20 5.00 assi (resi 27 and name HA#) (resi 12 and name H1') 6.00 1.80 1.80 !!3.19e+08 9565512 assi (resi 27 and name HA#) (resi 12 and name H2') 3.80 1.20 1.20 !!5.29e+08 30790686 5.06 4.70 4.00 assi (resi 27 and name HA#) (resi 12 and name H2'') 4.30 1.20 1.20 !!5.29e+08 30790686 5.06 4.00 assi (resi 27 and name HA#) (resi 12 and name H3') 4.50 1.35 1.35 !!5.82e+08 27888466 5.57 5.00 assi (resi 27 and name HA#) (resi 12 and name H8) 3.50 1.05 1.05 !!1.08e+09 20186202 assi (resi 27 and name HB#) (resi 12 and name H1') 4.60 1.44 1.44 !!5.82e+08 27888466 5.67 3.90 assi (resi 27 and name HB#) (resi 12 and name H2') 5.00 2.00 2.00 !!5.29e+08 30790686 5.06 4.70 assi (resi 27 and name HB#) (resi 12 and name H2'') 5.00 2.00 2.00 !!5.29e+08 30790686 5.06 5.40 assi (resi 27 and name HB#) (resi 12 and name H3') 5.50 1.65 1.65 !!5.82e+08 27888466 5.57 5.00 assi (resi 27 and name HB#) (resi 12 and name H8) 6.00 1.20 1.20 !!5.82e+08 27888466 5.67 5.40 5.50 assi (resi 27 and name HA#) (resi 16 and name H1) 4.50 1.20 1.20 !!5.29e+08 30790686 5.76 4.70 5.00 4.00 4.30 assi (resi 27 and name H1) (resi 16 and name H1) 3.80 1.14 1.14 !!4.36e+08 21304288 5.94 3.77 assi (resi 27 and name H13) (resi 16 and name H1) 4.00 1.20 1.20 !!2.92e+08 19716726 6.36 4.00 4.00 assi (resi 27 and name H12) (resi 16 and name H1) 5.50 1.00 1.00 !!6.64e+07 2449362 8.14 5.00 4.80 5.00 assi (resi 27 and name H12) (resi 16 and name H8) 5.00 1.50 1.50 !!1.99e+08 7282172 4.28 4.50 4.20 4.50 assi (resi 27 and name HC1) (resi 22 and name H1) 4.50 1.35 1.35 !!1.17e+09 7252016 assi (resi 27 and name H8) (resi 22 and name H1) 3.60 1.05 1.05 !!2.52e+09 15613098 4.44 3.30 3.50 assi (resi 27 and name H4) (resi 4 and name H1) 6.00 1.80 1.80 !!2.41e+08 8667180 6.56 4.10 6.00 6.00 assi (resi 27 and name H8) (resi 4 and name H1) 4.50 1.50 1.50 !!2.41e+08 8667180 6.56 4.10 4.50 5.00 assi (resi 27 and name H62) (resi 4 and name H1) 4.20 1.20 1.20 !!2.77e+08 5415654 6.41 3.90 4.50 assi (resi 27 and name H61) (resi 4 and name H1) 4.80 1.20 1.20 !!2.77e+08 5415654 6.41 3.90 4.20 5.00 4.90 assi (resi 27 and name HC2) (resi 2 and name H5#) 4.00 1.00 1.00 !!1.42e+09 68045712 5.00 6.00 4.00 3.50 3.80 assi (resi 27 and name H12) (resi 15 and name H2) 5.05 1.00 1.00 !!2.10e+09 42788608 5.07 5.00 5.00 4.94 5.96 assi (resi 27 and name H11) (resi 15 and name H8) 4.20 1.20 1.20 !!2.10e+09 42788608 5.07 4.30 3.72 3.90 4.00 assi (resi 27 and name H12) (resi 15 and name H8) 4.45 1.00 1.00 !!5.40e+08 21102896 4.50 4.50 4.60 assi (resi 27 and name H12) (resi 15 and name H1') 4.80 1.50 1.50 !!2.10e+09 42788608 4.80 5.60 5.40 5.20 5.20 5.20 5.20 assi (resi 27 and name H12) (resi 15 and name H2') 3.10 1.60 1.60 !!2.10e+09 42788608 4.00 4.60 4.30 4.10 3.10 3.10 assi (resi 27 and name H12) (resi 15 and name H2'') 4.90 1.50 1.50 !!2.10e+09 42788608 4.50 5.80 5.50 5.30 5.30 5.30 5.30 assi (resi 27 and name H13) (resi 15 and name H8) 6.00 1.20 1.20 !!2.11e+08 6995133 4.31 6.00 6.53 6.50 6.30 assi (resi 27 and name H13) (resi 13 and name H3) 3.70 0.60 0.60 !!-7.31e+08 32981104 4.00 4.00 3.84 3.70 assi (resi 27 and name H1) (resi 13 and name H3) 3.70 0.80 0.80 !!3.09e+08 9013856 4.00 4.00 4.19 4.17 4.00 assi (resi 27 and name HA#) (resi 13 and name H3) 5.00 1.00 1.00 !!5.09e+08 11055606 4.39 4.77 5.88 5.20 assi (resi 27 and name H4) (resi 13 and name H5#) 4.50 1.00 1.00 !!1.42e+09 68045712 3.59 3.77 4.20 3.80 4.20 assi (resi 27 and name HB#) (resi 13 and name H5#) 5.50 1.00 1.00 !!1.22e+09 40182284 3.01 4.50 5.00 5.32 assi (resi 27 and name H61) (resi 13 and name H5#) 5.00 1.50 1.50 !!7.58e+07 3850690 5.00 4.60 5.00 assi (resi 27 and name H4) (resi 13 and name H6) 3.60 0.70 0.70 !!1.52e+08 5450718 4.60 3.80 3.40 3.80 assi (resi 27 and name HB#) (resi 13 and name H6) 3.80 1.00 1.00 !!9.12e+08 22494752 4.00 3.50 3.80 assi (resi 27 and name HA#) (resi 13 and name H5'*) 4.50 1.30 1.30 !!4.06e+08 3973072 4.51 5.20 4.50 assi (resi 27 and name HB#) (resi 13 and name H5'*) 5.00 1.50 1.50 !!9.12e+08 22494752 5.50 4.50 4.50 assi (resi 3 and name H2) (resi 2 and name H5#) 7.00 2.00 2.00 !!6.00e+08 999 7.00 6.50 7.00 assi (resi 3 and name H2) (resi 2 and name H2'') 6.00 2.00 2.00 !!-9.99e+02 -999 5.00 5.81 5.40 5.60 5.80 assi (resi 3 and name H2) (resi 2 and name H2') 5.80 2.00 2.00 !!9.99e+02 -999 5.00 5.81 5.40 5.60 assi (resi 1 and name H6) (resi 2 and name H6) 6.00 1.00 1.00 !!9.00e+07 -999 4.50 5.45 assi (resi 14 and name H6) (resi 13 and name H6) 6.78 1.50 1.50 !!9.00e+09 -999 5.00 assi (resi 14 and name H2') (resi 15 and name H1') 5.48 1.00 1.00 !!9.00e+09 -999 4.00 assi (resi 1 and name H6) (resi 2 and name H5#) 6.90 2.00 2.00 !!4.30e+08 33827880 5.50 4.50 5.50 assi (resi 1 and name H2') (resi 2 and name H5#) 4.50 1.50 1.50 !!1.56e+08 10700765 4.80 5.50 assi (resi 1 and name H2'') (resi 2 and name H5#) 4.80 1.44 1.44 !!1.56e+08 10700765 assi (resi 1 and name H1') (resi 2 and name H6) 5.00 1.00 1.00 !!1.56e+08 10700765 5.00 4.50 assi (resi 14 and name H5#) (resi 13 and name H6) 5.20 1.00 1.00 !!8.79e+08 17897712 4.50 4.70 5.37 5.30 assi (resi 14 and name H5#) (resi 13 and name H5#) 6.19 1.50 1.50 !!8.79e+08 17897712 5.50 5.00 assi (resi 14 and name H5#) (resi 13 and name H3) 5.00 1.10 1.10 !!8.79e+08 17897712 6.50 5.02 assi (resi 14 and name H2'') (resi 15 and name H2) 5.45 1.30 1.30 !!3.79e+08 16429922 4.70 4.50 5.45 5.45 assi (resi 14 and name H2') (resi 15 and name H2) 5.09 1.20 1.20 !!3.79e+08 16429922 4.20 5.09 assi (resi 14 and name H1') (resi 15 and name H2) 6.50 1.30 1.30 !!3.79e+08 16429922 5.00 4.70 5.92 6.50 6.50 assi (resi 1 and name H2') (resi 2 and name H6) 4.00 1.00 1.00 !!9.00e+09 -999 3.80 4.50 assi (resi 1 and name H2'') (resi 2 and name H6) 3.50 1.00 1.00 !!9.00e+09 -999 3.20 4.00 assi (resi 27 and name H8) (resi 13 and name H3) 5.40 1.00 1.00 !!9.00e+09 -999 5.94 5.59 assi (resi 3 and name H2) (resi 22 and name H1) 6.50 1.30 1.30 !!9.00e+09 -999 6.20 assi (resi 21 and name H2) (resi 27 and name HC2) 5.50 1.00 1.00 !!4.50e+08 15407867 5.50 6.00 assi (resi 21 and name H8) (resi 27 and name HC1) 4.00 1.00 1.00 !!4.50e+08 15407867 5.00 4.50 assi (resi 21 and name H8) (resi 27 and name HC2) 3.60 1.00 1.00 !!4.50e+08 15407867 3.50 assi (resi 21 and name H8) (resi 27 and name H11) 6.50 1.00 1.00 !!9.00e+09 -999 6.50 assi (resi 21 and name H1') (resi 27 and name HC2) 5.00 1.00 1.00 !!4.50e+08 999 assi (resi 3 and name H8) (resi 2 and name H5#) 6.00 1.00 1.00 !!9.00e+09 -999 assi (resi 1 and name H5#) (resi 13 and name H5#) 5.50 1.50 1.50 !!9.00e+09 -999 6.00 5.50 assi (resi 20 and name H1') (resi 21 and name H8) 4.00 1.00 1.00 !!5.34e+08 22105770 4.00 3.90 3.80 4.00 3.80 assi (resi 20 and name H2') (resi 21 and name H8) 5.50 1.20 1.20 !!3.85e+08 10384594 4.60 3.20 5.00 5.00 5.30 assi (resi 20 and name H2'') (resi 21 and name H8) 5.20 1.00 1.00 !!4.50e+08 15407867 4.90 4.90 assi (resi 20 and name H3') (resi 21 and name H8) 6.00 1.56 1.56 !!4.50e+08 15407867 4.62 5.20 5.50 assi (resi 20 and name H4') (resi 21 and name H8) 4.50 1.00 1.00 !!4.50e+08 15407867 4.51 3.90 4.50 5.00 4.00 assi (resi 19 and name H1') (resi 20 and name H5#) 6.50 1.50 1.50 !!1.02e+08 6228836 4.57 4.87 6.50 assi (resi 19 and name H3') (resi 20 and name H5#) 6.50 1.50 1.50 !!1.02e+08 6228836 4.92 5.00 6.00 6.20 assi (resi 19 and name H6) (resi 20 and name H5#) 6.50 1.50 1.50 !!2.37e+06 382230 4.48 5.10 5.00 6.50 assi (resi 19 and name H1') (resi 20 and name H6) 6.00 1.00 1.00 !!2.08e+08 3333411 5.00 assi (resi 19 and name H3') (resi 20 and name H6) 6.00 1.00 1.00 !!1.02e+08 6228836 4.80 assi (resi 19 and name H2') (resi 20 and name H6) 5.50 1.00 1.00 !!9.00e+09 999 assi (resi 19 and name H2'') (resi 20 and name H6) 5.50 1.00 1.00 !!9.00e+09 999 assi (resi 19 and name H2') (resi 20 and name H5#) 6.00 1.50 1.50 !!9.00e+09 999 6.00 assi (resi 7 and name H4') (resi 8 and name H6) 5.00 1.50 1.50 !!9.00e+09 -999 4.00 4.00 assi (resi 6 and name H2') (resi 8 and name H6) 4.80 1.00 1.00 !!9.00e+09 999 4.00 assi (resi 7 and name H2'') (resi 8 and name H6) 6.00 1.50 1.50 !!9.00e+09 999 assi (resi 7 and name H2') (resi 8 and name H6) 6.00 1.50 1.50 !!9.00e+09 999 assi (resi 27 and name HA#) (resi 16 and name H21) 4.20 1.26 1.26 !!9.00e+09 999 assi (resi 12 and name H5') (resi 11 and name H1') 3.80 1.00 1.00 !!9.00e+09 999 4.00 assi (resi 12 and name H5') (resi 11 and name H8) 3.60 0.80 0.80 !!9.00e+09 999 5.00 3.60 assi (resi 27 and name H62) (resi 3 and name H2) 2.90 1.00 1.00 !!4.03e+08 16401635 3.02 2.40 3.40 3.20 3.10 assi (resi 27 and name H61) (resi 3 and name H2) 2.60 1.00 1.00 !!1.10e+09 30587916 2.16 1.90 2.80 2.90 2.70 assi (resi 27 and name H8) (resi 3 and name H2) 3.70 1.00 1.00 !!3.88e+08 16401635 2.52 3.00 3.20 3.50 assi (resi 27 and name HC1) (resi 22 and name H21) 3.30 1.00 1.00 !!9.00e+09 999 3.50 assi (resi 15 and name H2) (resi 27 and name H8) 3.90 0.78 0.78 !!9.00e+09 -999 4.00 3.50 3.50 3.50 3.50 3.70 3.80 assi (resi 3 and name H8) (resi 22 and name H8) 4.00 1.20 1.20 !!9.00e+09 -999 4.50 4.00 assi (resi 15 and name H1') (resi 27 and name HC2) 4.30 1.20 1.20 !!9.00e+09 -999 4.30 4.30 4.30 assi (resi 15 and name H1') (resi 27 and name H11) 3.60 1.00 1.00 !!9.00e+09 -999
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