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REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-05 |
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ATOM 1 N ALA A 1 3.326 1.548 0.000 1.00 0.00 N |
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ATOM 2 H2 ALA A 1 2.495 1.314 0.839 1.00 0.00 H |
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ATOM 3 H3 ALA A 1 2.647 1.446 -0.991 1.00 0.00 H |
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ATOM 4 H ALA A 1 3.909 0.724 0.000 1.00 0.00 H |
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ATOM 5 CA ALA A 1 3.970 2.846 0.000 1.00 0.00 C |
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ATOM 6 HA ALA A 1 3.672 3.400 -0.890 1.00 0.00 H |
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ATOM 7 CB ALA A 1 3.577 3.654 1.232 1.00 0.00 C |
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ATOM 8 HB1 ALA A 1 3.877 3.116 2.131 1.00 0.00 H |
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ATOM 9 HB2 ALA A 1 4.075 4.623 1.206 1.00 0.00 H |
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ATOM 10 HB3 ALA A 1 2.497 3.801 1.241 1.00 0.00 H |
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ATOM 11 C ALA A 1 5.486 2.705 0.000 1.00 0.00 C |
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ATOM 12 O ALA A 1 6.009 1.593 0.000 1.00 0.00 O |
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ATOM 13 N PHE A 2 6.191 3.839 0.000 1.00 0.00 N |
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ATOM 14 H PHE A 2 5.715 4.730 0.000 1.00 0.00 H |
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ATOM 15 CA PHE A 2 7.640 3.839 0.000 1.00 0.00 C |
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ATOM 16 HA PHE A 2 8.004 3.325 0.890 1.00 0.00 H |
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ATOM 17 CB PHE A 2 8.189 3.127 -1.232 1.00 0.00 C |
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ATOM 18 HB2 PHE A 2 7.841 2.094 -1.241 1.00 0.00 H |
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ATOM 19 HB3 PHE A 2 7.841 3.636 -2.131 1.00 0.00 H |
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ATOM 20 CG PHE A 2 9.696 3.076 -1.321 1.00 0.00 C |
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ATOM 21 CD1 PHE A 2 10.311 2.447 -2.410 1.00 0.00 C |
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ATOM 22 HD1 PHE A 2 9.703 1.995 -3.193 1.00 0.00 H |
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ATOM 23 CE1 PHE A 2 11.708 2.400 -2.492 1.00 0.00 C |
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ATOM 24 HE1 PHE A 2 12.188 1.910 -3.340 1.00 0.00 H |
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ATOM 25 CZ PHE A 2 12.489 2.981 -1.486 1.00 0.00 C |
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ATOM 26 HZ PHE A 2 13.576 2.944 -1.550 1.00 0.00 H |
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ATOM 27 CE2 PHE A 2 11.873 3.609 -0.397 1.00 0.00 C |
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ATOM 28 HE2 PHE A 2 12.481 4.062 0.386 1.00 0.00 H |
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ATOM 29 CD2 PHE A 2 10.476 3.657 -0.315 1.00 0.00 C |
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ATOM 30 HD2 PHE A 2 9.997 4.146 0.533 1.00 0.00 H |
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ATOM 31 C PHE A 2 8.188 5.259 0.000 1.00 0.00 C |
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ATOM 32 O PHE A 2 7.425 6.222 0.000 1.00 0.00 O |
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ATOM 33 OXT PHE A 2 9.436 5.328 0.092 1.00 0.00 O |
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TER 34 PHE A 2 |
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END |
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