0 0 2 This is a remark line molecule.res LYR INT 0 CORRECT OMIT DU BEG 0.0000 1 DUMM DU M 0 -1 -2 0.000 .0 .0 .00000 2 DUMM DU M 1 0 -1 1.449 .0 .0 .00000 3 DUMM DU M 2 1 0 1.523 111.21 .0 .00000 4 N NL M 3 2 1 1.540 111.208 -180.000 -0.36614 5 H H E 4 3 2 1.029 107.350 96.134 0.31147 6 CA LA M 4 3 2 1.464 61.082 -23.645 -0.49105 7 CB LB 3 6 4 3 1.526 110.515 95.900 -0.00916 8 CG LG 3 7 6 4 1.497 113.292 -59.855 -0.04536 9 CD LD 3 8 7 6 1.505 110.073 -179.099 -0.09801 10 CE LE 3 9 8 7 1.524 111.228 -159.391 -0.07200 11 NZ NZ B 10 9 8 1.491 113.262 -71.294 -0.38057 12 HZ H E 11 10 9 1.005 107.740 -58.539 0.36780 13 C15 RF B 11 10 9 1.310 111.994 111.067 0.18613 14 H15 HA E 13 11 10 1.000 111.332 7.165 0.20444 15 C14 RE B 13 11 10 1.436 126.858 -172.845 -0.37658 16 C13 RD B 15 13 11 1.349 117.269 166.255 0.21187 17 C12 RC B 16 15 13 1.442 120.019 178.778 -0.24967 18 C11 RB B 17 16 15 1.334 124.816 174.183 0.02969 19 C10 RA B 18 17 16 1.412 124.411 179.924 -0.29936 20 C9 R9 B 19 18 17 1.352 127.042 177.423 0.14528 21 C8 R8 B 20 19 18 1.451 119.971 -46.747 -0.14165 22 C7 R7 B 21 20 19 1.331 123.701 176.647 -0.07415 23 C6 R6 S 22 21 20 1.433 132.665 -176.194 -0.15338 24 C1 R1 3 23 22 21 1.531 112.168 137.430 0.14685 25 C2 R2 3 24 23 22 1.534 111.664 -161.829 -0.07221 26 C3 R3 3 25 24 23 1.515 113.511 -41.209 -0.11664 27 C4 R4 3 26 25 24 1.505 110.730 57.044 -0.07797 28 C5 R5 S 27 26 25 1.501 113.293 -48.023 0.10712 29 C18 RI 3 28 27 26 1.507 113.472 -153.187 -0.20865 30 H183 HC E 29 28 27 1.091 109.494 -60.022 0.06730 31 H182 HC E 29 28 27 1.091 109.449 59.865 0.06730 32 H181 HC E 29 28 27 1.089 109.613 179.935 0.06730 33 H42 HC E 27 26 25 1.090 109.075 73.675 0.05304 34 H41 HC E 27 26 25 1.089 109.104 -169.857 0.05304 35 H32 HC E 26 25 24 1.089 109.759 178.351 0.05765 36 H31 HC E 26 25 24 1.089 109.770 -64.218 0.05765 37 H22 HC E 25 24 23 1.090 109.032 80.597 0.04505 38 H21 HC E 25 24 23 1.090 109.003 -162.965 0.04505 39 C16 RG 3 24 23 22 1.531 109.980 76.820 -0.18130 40 H163 HC E 39 24 23 1.089 109.494 62.944 0.05579 41 H162 HC E 39 24 23 1.090 109.529 -177.129 0.05579 42 H161 HC E 39 24 23 1.090 109.490 -57.093 0.05579 43 C17 RH 3 24 23 22 1.530 109.849 -42.508 -0.25375 44 H173 HC E 43 24 23 1.090 109.477 178.226 0.07002 45 H172 HC E 43 24 23 1.090 109.467 -61.763 0.07002 46 H171 HC E 43 24 23 1.090 109.570 58.246 0.07002 47 H7 HA E 22 21 20 1.090 113.663 3.766 0.14887 48 H8 HA E 21 20 19 1.090 118.168 -3.275 0.10223 49 C19 RJ 3 20 19 18 1.494 122.557 130.190 -0.20919 50 H193 HC E 49 20 19 1.090 109.515 123.032 0.08810 51 H192 HC E 49 20 19 1.091 109.498 -116.976 0.08810 52 H191 HC E 49 20 19 1.091 109.581 2.948 0.08810 53 H10 HA E 19 18 17 1.090 116.521 -2.663 0.16413 54 H11 HA E 18 17 16 1.089 117.799 -0.180 0.16543 55 H12 HA E 17 16 15 1.090 117.536 -5.823 0.14525 56 C20 RK 3 16 15 13 1.500 122.639 -0.960 -0.17592 57 H203 HC E 56 16 15 1.090 109.519 119.697 0.08629 58 H202 HC E 56 16 15 1.090 109.568 -120.225 0.08629 59 H201 HC E 56 16 15 1.090 109.474 -0.289 0.08629 60 H14 HA E 15 13 11 1.090 121.377 -13.798 0.16671 61 HE2 HP E 10 9 8 1.009 108.746 50.086 0.12092 62 HE3 HP E 10 9 8 1.010 108.753 167.385 0.12092 63 HD3 HC E 9 8 7 0.995 109.501 81.076 0.06082 64 HD2 HC E 9 8 7 0.994 109.327 -39.895 0.06082 65 HG2 HC E 8 7 6 0.999 109.528 -59.333 0.05144 66 HG3 HC E 8 7 6 0.999 109.566 61.016 0.05144 67 HB3 HC E 7 6 4 0.998 107.950 179.306 0.06801 68 HB2 HC E 7 6 4 0.999 107.896 60.765 0.06801 69 HA H1 E 6 4 3 1.012 108.585 -21.878 0.22465 70 C L M 6 4 3 1.517 112.077 -142.144 0.80991 71 O OL E 70 6 4 1.236 119.905 147.549 -0.60148 LOOP C5 C6 IMPROPER C14 H14 C15 NZ C15 C13 C14 H14 C20 C14 C13 C12 C11 C13 C12 H12 C10 C12 C11 H11 C11 C9 C10 H10 C19 C10 C9 C8 C7 C9 C8 H8 C6 C8 C7 H7 C5 C1 C6 C7 C4 C18 C5 C6 +M CA C O DONE STOP