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Peter Kerpedjiev committed May 2, 2014
1 parent 35b2b64 commit 6255206
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Showing 40 changed files with 34,859 additions and 0 deletions.
425 changes: 425 additions & 0 deletions forgi/threedee/data/ideal_1_10_11_20.pdb

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468 changes: 468 additions & 0 deletions forgi/threedee/data/ideal_1_11_12_22.pdb

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639 changes: 639 additions & 0 deletions forgi/threedee/data/ideal_1_15_16_30.pdb

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724 changes: 724 additions & 0 deletions forgi/threedee/data/ideal_1_17_18_34.pdb

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761 changes: 761 additions & 0 deletions forgi/threedee/data/ideal_1_18_19_36.pdb

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809 changes: 809 additions & 0 deletions forgi/threedee/data/ideal_1_19_20_38.pdb

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42 changes: 42 additions & 0 deletions forgi/threedee/data/ideal_1_1_2_2.pdb
Original file line number Diff line number Diff line change
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ATOM 1 P A A 1 3.063 8.025 -4.135 1.00 1.00 P
ATOM 2 O1P A A 1 3.223 8.856 -5.350 1.00 1.00 O
ATOM 3 O2P A A 1 1.891 7.121 -4.118 1.00 1.00 O
ATOM 4 O5' A A 1 4.396 7.181 -3.881 1.00 1.00 O
ATOM 5 C5' A A 1 5.621 7.881 -3.587 1.00 1.00 C
ATOM 6 C4' A A 1 6.719 6.889 -3.258 1.00 1.00 C
ATOM 7 O4' A A 1 6.486 6.364 -1.919 1.00 1.00 O
ATOM 8 C3' A A 1 6.776 5.642 -4.140 1.00 1.00 C
ATOM 9 O3' A A 1 7.397 5.908 -5.390 1.00 1.00 O
ATOM 10 C2' A A 1 7.567 4.725 -3.208 1.00 1.00 C
ATOM 11 O2' A A 1 8.962 4.911 -3.068 1.00 1.00 O
ATOM 12 C1' A A 1 6.874 4.999 -1.877 1.00 1.00 C
ATOM 13 N9 A A 1 5.666 4.158 -1.647 1.00 1.00 N
ATOM 14 C8 A A 1 4.345 4.449 -1.900 1.00 1.00 C
ATOM 15 N7 A A 1 3.524 3.496 -1.584 1.00 1.00 N
ATOM 16 C5 A A 1 4.348 2.496 -1.086 1.00 1.00 C
ATOM 17 C6 A A 1 4.082 1.215 -0.578 1.00 1.00 C
ATOM 18 N6 A A 1 2.849 0.697 -0.485 1.00 1.00 N
ATOM 19 N1 A A 1 5.134 0.481 -0.167 1.00 1.00 N
ATOM 20 C2 A A 1 6.356 1.001 -0.262 1.00 1.00 C
ATOM 21 N3 A A 1 6.725 2.179 -0.716 1.00 1.00 N
ATOM 22 C4 A A 1 5.655 2.893 -1.121 1.00 1.00 C
ATOM 23 P U A 2 3.063 -8.025 4.135 1.00 1.00 P
ATOM 24 O1P U A 2 3.223 -8.856 5.350 1.00 1.00 O
ATOM 25 O2P U A 2 1.891 -7.121 4.118 1.00 1.00 O
ATOM 26 O5' U A 2 4.397 -7.181 3.881 1.00 1.00 O
ATOM 27 C5' U A 2 5.621 -7.881 3.587 1.00 1.00 C
ATOM 28 C4' U A 2 6.719 -6.889 3.258 1.00 1.00 C
ATOM 29 O4' U A 2 6.486 -6.364 1.919 1.00 1.00 O
ATOM 30 C3' U A 2 6.776 -5.642 4.140 1.00 1.00 C
ATOM 31 O3' U A 2 7.397 -5.908 5.390 1.00 1.00 O
ATOM 32 C2' U A 2 7.567 -4.725 3.208 1.00 1.00 C
ATOM 33 O2' U A 2 8.962 -4.910 3.068 1.00 1.00 O
ATOM 34 C1' U A 2 6.874 -4.999 1.877 1.00 1.00 C
ATOM 35 N1 U A 2 5.666 -4.158 1.647 1.00 1.00 N
ATOM 36 C2 U A 2 5.867 -2.911 1.107 1.00 1.00 C
ATOM 37 O2 U A 2 6.971 -2.482 0.819 1.00 1.00 O
ATOM 38 N3 U A 2 4.725 -2.160 0.908 1.00 1.00 N
ATOM 39 C4 U A 2 3.431 -2.543 1.197 1.00 1.00 C
ATOM 40 O4 U A 2 2.487 -1.783 0.974 1.00 1.00 O
ATOM 41 C5 U A 2 3.322 -3.869 1.760 1.00 1.00 C
ATOM 42 C6 U A 2 4.416 -4.621 1.964 1.00 1.00 C
847 changes: 847 additions & 0 deletions forgi/threedee/data/ideal_1_20_21_40.pdb

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897 changes: 897 additions & 0 deletions forgi/threedee/data/ideal_1_21_22_42.pdb

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85 changes: 85 additions & 0 deletions forgi/threedee/data/ideal_1_2_3_4.pdb
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ATOM 1 P C A 1 3.063 8.025 -4.135 1.00 1.00 P
ATOM 2 O1P C A 1 3.223 8.856 -5.350 1.00 1.00 O
ATOM 3 O2P C A 1 1.891 7.121 -4.118 1.00 1.00 O
ATOM 4 O5' C A 1 4.397 7.181 -3.881 1.00 1.00 O
ATOM 5 C5' C A 1 5.620 7.882 -3.587 1.00 1.00 C
ATOM 6 C4' C A 1 6.719 6.889 -3.258 1.00 1.00 C
ATOM 7 O4' C A 1 6.486 6.363 -1.919 1.00 1.00 O
ATOM 8 C3' C A 1 6.776 5.642 -4.140 1.00 1.00 C
ATOM 9 O3' C A 1 7.398 5.908 -5.390 1.00 1.00 O
ATOM 10 C2' C A 1 7.567 4.725 -3.208 1.00 1.00 C
ATOM 11 O2' C A 1 8.962 4.910 -3.069 1.00 1.00 O
ATOM 12 C1' C A 1 6.874 5.000 -1.877 1.00 1.00 C
ATOM 13 N1 C A 1 5.666 4.158 -1.647 1.00 1.00 N
ATOM 14 C2 C A 1 5.853 2.891 -1.100 1.00 1.00 C
ATOM 15 O2 C A 1 7.001 2.521 -0.831 1.00 1.00 O
ATOM 16 N3 C A 1 4.764 2.108 -0.883 1.00 1.00 N
ATOM 17 C4 C A 1 3.536 2.547 -1.188 1.00 1.00 C
ATOM 18 N4 C A 1 2.508 1.746 -0.956 1.00 1.00 N
ATOM 19 C5 C A 1 3.323 3.847 -1.751 1.00 1.00 C
ATOM 20 C6 C A 1 4.423 4.613 -1.961 1.00 1.00 C
ATOM 21 P U A 2 6.913 5.099 -6.683 1.00 1.00 P
ATOM 22 O1P U A 2 7.496 5.711 -7.898 1.00 1.00 O
ATOM 23 O2P U A 2 5.439 4.971 -6.666 1.00 1.00 O
ATOM 24 O5' U A 2 7.579 3.667 -6.429 1.00 1.00 O
ATOM 25 C5' U A 2 8.988 3.595 -6.135 1.00 1.00 C
ATOM 26 C4' U A 2 9.376 2.167 -5.806 1.00 1.00 C
ATOM 27 O4' U A 2 8.896 1.851 -4.467 1.00 1.00 O
ATOM 28 C3' U A 2 8.750 1.087 -6.688 1.00 1.00 C
ATOM 29 O3' U A 2 9.417 0.975 -7.938 1.00 1.00 O
ATOM 30 C2' U A 2 8.920 -0.112 -5.756 1.00 1.00 C
ATOM 31 O2' U A 2 10.194 -0.710 -5.616 1.00 1.00 O
ATOM 32 C1' U A 2 8.486 0.493 -4.425 1.00 1.00 C
ATOM 33 N1 U A 2 7.014 0.438 -4.195 1.00 1.00 N
ATOM 34 C2 U A 2 6.509 -0.720 -3.655 1.00 1.00 C
ATOM 35 O2 U A 2 7.207 -1.677 -3.367 1.00 1.00 O
ATOM 36 N3 U A 2 5.143 -0.735 -3.456 1.00 1.00 N
ATOM 37 C4 U A 2 4.261 0.286 -3.745 1.00 1.00 C
ATOM 38 O4 U A 2 3.056 0.157 -3.522 1.00 1.00 O
ATOM 39 C5 U A 2 4.885 1.461 -4.308 1.00 1.00 C
ATOM 40 C6 U A 2 6.213 1.503 -4.512 1.00 1.00 C
ATOM 41 P A A 3 -1.758 -8.408 1.587 1.00 1.00 P
ATOM 42 O1P A A 3 -2.072 -9.193 2.802 1.00 1.00 O
ATOM 43 O2P A A 3 -2.256 -7.014 1.570 1.00 1.00 O
ATOM 44 O5' A A 3 -0.180 -8.418 1.333 1.00 1.00 O
ATOM 45 C5' A A 3 0.473 -9.668 1.039 1.00 1.00 C
ATOM 46 C4' A A 3 1.932 -9.427 0.710 1.00 1.00 C
ATOM 47 O4' A A 3 2.020 -8.860 -0.629 1.00 1.00 O
ATOM 48 C3' A A 3 2.654 -8.408 1.592 1.00 1.00 C
ATOM 49 O3' A A 3 3.033 -8.968 2.842 1.00 1.00 O
ATOM 50 C2' A A 3 3.815 -8.064 0.660 1.00 1.00 C
ATOM 51 O2' A A 3 4.888 -8.974 0.520 1.00 1.00 O
ATOM 52 C1' A A 3 3.084 -7.921 -0.671 1.00 1.00 C
ATOM 53 N9 A A 3 2.522 -6.560 -0.901 1.00 1.00 N
ATOM 54 C8 A A 3 1.253 -6.091 -0.648 1.00 1.00 C
ATOM 55 N7 A A 3 1.077 -4.846 -0.964 1.00 1.00 N
ATOM 56 C5 A A 3 2.310 -4.449 -1.462 1.00 1.00 C
ATOM 57 C6 A A 3 2.779 -3.228 -1.970 1.00 1.00 C
ATOM 58 N6 A A 3 2.021 -2.126 -2.063 1.00 1.00 N
ATOM 59 N1 A A 3 4.060 -3.178 -2.381 1.00 1.00 N
ATOM 60 C2 A A 3 4.808 -4.276 -2.286 1.00 1.00 C
ATOM 61 N3 A A 3 4.482 -5.467 -1.832 1.00 1.00 N
ATOM 62 C4 A A 3 3.196 -5.489 -1.427 1.00 1.00 C
ATOM 63 P G A 4 3.063 -8.025 4.135 1.00 1.00 P
ATOM 64 O1P G A 4 3.223 -8.856 5.350 1.00 1.00 O
ATOM 65 O2P G A 4 1.891 -7.121 4.118 1.00 1.00 O
ATOM 66 O5' G A 4 4.397 -7.181 3.881 1.00 1.00 O
ATOM 67 C5' G A 4 5.621 -7.881 3.587 1.00 1.00 C
ATOM 68 C4' G A 4 6.719 -6.889 3.258 1.00 1.00 C
ATOM 69 O4' G A 4 6.486 -6.363 1.919 1.00 1.00 O
ATOM 70 C3' G A 4 6.775 -5.642 4.140 1.00 1.00 C
ATOM 71 O3' G A 4 7.398 -5.908 5.390 1.00 1.00 O
ATOM 72 C2' G A 4 7.567 -4.726 3.208 1.00 1.00 C
ATOM 73 O2' G A 4 8.961 -4.911 3.068 1.00 1.00 O
ATOM 74 C1' G A 4 6.874 -4.999 1.877 1.00 1.00 C
ATOM 75 N9 G A 4 5.666 -4.158 1.647 1.00 1.00 N
ATOM 76 C8 G A 4 4.342 -4.447 1.899 1.00 1.00 C
ATOM 77 N7 G A 4 3.516 -3.480 1.579 1.00 1.00 N
ATOM 78 C5 G A 4 4.351 -2.483 1.079 1.00 1.00 C
ATOM 79 C6 G A 4 4.033 -1.195 0.574 1.00 1.00 C
ATOM 80 O6 G A 4 2.932 -0.661 0.462 1.00 1.00 O
ATOM 81 N1 G A 4 5.185 -0.505 0.172 1.00 1.00 N
ATOM 82 C2 G A 4 6.474 -0.995 0.248 1.00 1.00 C
ATOM 83 N2 G A 4 7.438 -0.180 -0.188 1.00 1.00 N
ATOM 84 N3 G A 4 6.771 -2.203 0.722 1.00 1.00 N
ATOM 85 C4 G A 4 5.664 -2.886 1.117 1.00 1.00 C
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