START VERSION 2 val v 45 4 N U -1 29 6 4 0 0 0 1.335000 116.600000 180.000000 0.000 - 5 H U -2 4 29 6 0 6 0 1.010000 119.800000 0.000000 0.000 - 6 CA U -3 4 29 6 0 0 0 1.449000 121.900000 180.000000 0.000 - 7 HA U -4 6 4 29 0 0 0 1.090000 109.500000 300.000000 0.000 - 8 CB U -5 6 4 29 0 0 0 1.525000 111.100000 60.000000 0.000 - 9 U1 U 0 8 6 4 0 0 0 36.087668 91.591158 176.897205 0.000 - 10 U2 U 1 9 8 6 0 0 0 1.000000 33.587081 358.073807 0.000 - 11 U3 U 2 10 9 8 0 0 0 1.000000 90.000000 174.019771 0.000 - 12 U4 U 3 11 10 9 0 0 0 1.000000 90.000000 90.000000 0.000 - 13 CA1 CT 4 12 11 10 0 0 0 3.819100 44.693112 314.605942 -0.050 - 14 N1 N 5 13 12 11 0 0 0 1.472629 37.153087 199.228383 -0.140 - 15 C1 CN 6 14 13 12 0 0 0 1.537341 113.846883 124.188557 0.500 - 16 O1 O 7 15 14 13 0 0 0 1.274386 116.052472 -135.022882 -0.500 A2 17 CB1 CH 8 14 13 12 0 0 0 1.550939 107.930389 1.102319 0.010 - 18 H1A HC 9 13 12 11 0 0 0 1.009890 81.061454 14.416307 0.060 - 19 H2A HC 10 13 12 11 0 0 0 1.009975 125.555879 269.454658 0.060 - 20 HB HC 11 17 14 13 0 0 0 1.089990 109.476087 59.981892 0.060 - 21 CG1 CH3 12 17 14 13 0 0 0 1.525231 109.488493 -179.995352 -0.180 - 22 1HG1 HC 13 21 17 14 0 0 0 1.089990 109.471137 59.983510 0.060 - 23 2HG1 HC 14 21 17 14 0 0 0 1.088924 109.525776 179.981470 0.060 - 24 3HG1 HC 15 21 17 14 0 0 0 1.090091 109.461732 300.016530 0.060 - 25 CG2 CH3 16 17 14 13 0 0 0 1.524839 109.485077 300.003729 -0.180 - 26 1HG2 HC 17 25 17 14 0 0 0 1.089768 109.490244 59.988127 0.060 - 27 2HG2 HC 18 25 17 14 0 0 0 1.089532 109.527189 179.991261 0.060 - 28 3HG2 HC 19 25 17 14 0 0 0 1.090824 109.504054 299.998441 0.060 - 29 C U -20 6 4 29 0 8 0 1.522000 111.100000 180.000000 0.000 - 30 O U -21 29 6 4 0 0 0 1.229000 120.500000 0.000000 0.000 - STOP START VERSION 2 val 14 0.8855895932153 0.2955759004499 -0.3582819552559 7.0572985630312 -0.1783011794814 0.9286219361686 0.3253766879512 -19.0238838762766 0.4288819905105 -0.2242681135154 0.8750794543788 -11.3254598335941 -22.1 -60.0 1l # for position 1l 0.6042340925287 0.7058548443523 0.3696891939595 -28.7286213743170 -0.0288920203467 0.4830667883688 -0.8751066958579 37.2082538192735 -0.7962828722171 0.5180882325237 0.3122789950257 27.8872050093472 -47.0 -60.0 2l # for position 2l 0.8800945230775 0.0773434276646 -0.4684566411592 10.9117684598416 0.0900811142818 0.9415229728391 0.3246842842917 -31.8607096410740 0.4661748848863 -0.3279519565627 0.8216620296009 -5.7906754826884 -25.0 -60.0 4l # for position 4l 0.6517800250865 0.4787867488026 0.5881717844892 -39.4154900021001 0.0271386617716 0.7603140317656 -0.6489884946111 13.5423433382915 -0.7579223521809 0.4389599324213 0.4825638670614 23.6043304411970 -84.5 -60.0 5l # for position 5l 0.8855895932153 0.2955759004499 -0.3582819552559 7.0572985630312 -0.1783011794814 0.9286219361686 0.3253766879512 -19.0238838762766 0.4288819905105 -0.2242681135154 0.8750794543788 -11.3254598335941 -22.1 60.0 1l # for position 1l 0.6042340925287 0.7058548443523 0.3696891939595 -28.7286213743170 -0.0288920203467 0.4830667883688 -0.8751066958579 37.2082538192735 -0.7962828722171 0.5180882325237 0.3122789950257 27.8872050093472 -47.0 60.0 2l # for position 2l 0.8800945230775 0.0773434276646 -0.4684566411592 10.9117684598416 0.0900811142818 0.9415229728391 0.3246842842917 -31.8607096410740 0.4661748848863 -0.3279519565627 0.8216620296009 -5.7906754826884 -25.0 60.0 4l # for position 4l 0.6517800250865 0.4787867488026 0.5881717844892 -39.4154900021001 0.0271386617716 0.7603140317656 -0.6489884946111 13.5423433382915 -0.7579223521809 0.4389599324213 0.4825638670614 23.6043304411970 -84.5 60.0 5l # for position 5l 0.8855895932153 0.2955759004499 -0.3582819552559 7.0572985630312 -0.1783011794814 0.9286219361686 0.3253766879512 -19.0238838762766 0.4288819905105 -0.2242681135154 0.8750794543788 -11.3254598335941 -22.1 180.0 1l # for position 1l 0.6042340925287 0.7058548443523 0.3696891939595 -28.7286213743170 -0.0288920203467 0.4830667883688 -0.8751066958579 37.2082538192735 -0.7962828722171 0.5180882325237 0.3122789950257 27.8872050093472 -47.0 180.0 2l # for position 2l 0.8800945230775 0.0773434276646 -0.4684566411592 10.9117684598416 0.0900811142818 0.9415229728391 0.3246842842917 -31.8607096410740 0.4661748848863 -0.3279519565627 0.8216620296009 -5.7906754826884 -25.0 180.0 4l # for position 4l 0.6517800250865 0.4787867488026 0.5881717844892 -39.4154900021001 0.0271386617716 0.7603140317656 -0.6489884946111 13.5423433382915 -0.7579223521809 0.4389599324213 0.4825638670614 23.6043304411970 -84.5 180.0 5l # for position 5l STOP START ATOM 1 CA1 val 360 29.610 27.138 40.378 52.25 1.75 8.906583 ATOM 2 N1 val 360 28.185 26.769 40.421 0.00 1.85 1.492571 ATOM 3 C1 val 360 27.774 26.025 41.702 29.60 1.82 3.116316 ATOM 4 O1 val 360 26.691 26.412 42.251 39.24 1.51 3.808465 ATOM 5 CB1 val 360 27.877 25.907 39.169 0.00 1.87 0.154497 ATOM 6 H1A val 360 30.178 26.755 39.636 0.00 1.22 2.795343 ATOM 7 H2A val 360 30.022 26.847 41.253 0.00 0.00 ATOM 8 HB val 360 28.499 25.012 39.182 16.27 1.45 1.548099 ATOM 9 CG1 val 360 26.406 25.504 39.178 4.89 1.79 -1.169769 ATOM 10 1HG1 val 360 25.784 26.399 39.165 16.61 1.51 0.785038 ATOM 11 2HG1 val 360 26.189 24.899 38.299 20.42 1.44 0.971103 ATOM 12 3HG1 val 360 26.193 24.927 40.078 14.88 1.47 1.655279 ATOM 13 CG2 val 360 28.175 26.714 37.910 9.78 1.76 0.375640 ATOM 14 1HG2 val 360 29.226 27.002 37.903 16.96 1.43 1.277435 ATOM 15 2HG2 val 360 27.959 26.109 37.030 25.96 1.44 1.262194 ATOM 16 3HG2 val 360 27.553 27.610 37.896 19.03 1.49 0.945255 @ 7.804770 27.721613 144.790954 276.950900 END STOP