REMARK 1 CREATED WITH OPENMM 7.5, 2020-06-04 ATOM 1 N ALA A 1 0.072 -0.034 -0.113 1.00 0.00 N ATOM 2 DN ALA A 1 0.024 -0.103 -0.101 1.00 0.00 EP ATOM 3 H ALA A 1 -0.396 0.850 -0.349 1.00 0.00 H ATOM 4 H2 ALA A 1 -0.547 -0.623 0.444 1.00 0.00 H ATOM 5 H3 ALA A 1 0.343 -0.509 -0.974 1.00 0.00 H ATOM 6 CA ALA A 1 1.286 0.359 0.692 1.00 0.00 C ATOM 7 DCA ALA A 1 1.247 0.375 0.636 1.00 0.00 EP ATOM 8 HA ALA A 1 0.730 0.825 1.494 1.00 0.00 H ATOM 9 C ALA A 1 1.986 1.606 0.031 1.00 0.00 C ATOM 10 DC ALA A 1 1.956 1.579 0.036 1.00 0.00 EP ATOM 11 O ALA A 1 1.230 2.563 -0.208 1.00 0.00 O ATOM 12 DO ALA A 1 1.219 2.525 -0.201 1.00 0.00 EP ATOM 13 LPOA ALA A 1 0.996 2.412 -0.097 1.00 0.00 EP ATOM 14 LPOB ALA A 1 1.458 2.722 -0.321 1.00 0.00 EP ATOM 15 CB ALA A 1 2.135 -0.773 1.297 1.00 0.00 C ATOM 16 DCB ALA A 1 2.057 -0.772 1.289 1.00 0.00 EP ATOM 17 HB1 ALA A 1 2.779 -1.237 0.521 1.00 0.00 H ATOM 18 HB2 ALA A 1 1.483 -1.559 1.736 1.00 0.00 H ATOM 19 HB3 ALA A 1 2.788 -0.373 2.102 1.00 0.00 H ATOM 20 N ALA A 2 3.340 1.626 -0.172 1.00 0.00 N ATOM 21 DN ALA A 2 3.289 1.631 -0.202 1.00 0.00 EP ATOM 22 H ALA A 2 3.913 0.773 -0.267 1.00 0.00 H ATOM 23 CA ALA A 2 3.977 2.932 -0.230 1.00 0.00 C ATOM 24 DCA ALA A 2 3.990 2.909 -0.215 1.00 0.00 EP ATOM 25 HA ALA A 2 3.675 3.404 0.715 1.00 0.00 H ATOM 26 C ALA A 2 5.518 2.682 -0.121 1.00 0.00 C ATOM 27 DC ALA A 2 5.487 2.654 -0.128 1.00 0.00 EP ATOM 28 O ALA A 2 5.947 1.505 -0.133 1.00 0.00 O ATOM 29 DO ALA A 2 5.889 1.489 -0.137 1.00 0.00 EP ATOM 30 LPOA ALA A 2 5.668 1.399 -0.158 1.00 0.00 EP ATOM 31 LPOB ALA A 2 6.229 1.603 -0.108 1.00 0.00 EP ATOM 32 CB ALA A 2 3.712 3.828 -1.442 1.00 0.00 C ATOM 33 DCB ALA A 2 3.662 3.802 -1.434 1.00 0.00 EP ATOM 34 HB1 ALA A 2 2.636 4.055 -1.572 1.00 0.00 H ATOM 35 HB2 ALA A 2 4.080 3.339 -2.370 1.00 0.00 H ATOM 36 HB3 ALA A 2 4.238 4.801 -1.334 1.00 0.00 H ATOM 37 N ALA A 3 6.281 3.795 -0.031 1.00 0.00 N ATOM 38 DN ALA A 3 6.275 3.733 -0.037 1.00 0.00 EP ATOM 39 H ALA A 3 5.825 4.723 0.051 1.00 0.00 H ATOM 40 CA ALA A 3 7.692 3.798 0.060 1.00 0.00 C ATOM 41 DCA ALA A 3 7.707 3.802 0.068 1.00 0.00 EP ATOM 42 HA ALA A 3 8.015 3.302 -0.864 1.00 0.00 H ATOM 43 C ALA A 3 8.044 5.364 0.125 1.00 0.00 C ATOM 44 DC ALA A 3 8.018 5.323 0.136 1.00 0.00 EP ATOM 45 CB ALA A 3 8.274 3.163 1.304 1.00 0.00 C ATOM 46 DCB ALA A 3 8.233 3.093 1.333 1.00 0.00 EP ATOM 47 HB1 ALA A 3 8.009 2.087 1.363 1.00 0.00 H ATOM 48 HB2 ALA A 3 7.899 3.666 2.221 1.00 0.00 H ATOM 49 HB3 ALA A 3 9.384 3.230 1.300 1.00 0.00 H ATOM 50 O ALA A 3 7.074 6.193 0.135 1.00 0.00 O ATOM 51 DOT1 ALA A 3 7.032 6.119 0.127 1.00 0.00 EP ATOM 52 OXT ALA A 3 9.258 5.664 0.187 1.00 0.00 O ATOM 53 DOT2 ALA A 3 9.219 5.692 0.188 1.00 0.00 EP ATOM 54 LPT1 ALA A 3 7.196 6.521 0.158 1.00 0.00 EP ATOM 55 LPT2 ALA A 3 6.769 6.022 0.114 1.00 0.00 EP ATOM 56 LPT3 ALA A 3 9.295 6.011 0.208 1.00 0.00 EP ATOM 57 LPT4 ALA A 3 9.454 5.374 0.178 1.00 0.00 EP TER 58 ALA A 3 END